A0A5K4FBF6_SCHMA Loading...

Ig-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FBF6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 956 aa.

						>A0A5K4FBF6_SCHMA|A0A5K4FBF6
MEFCDLKYGCHIINKTQTSVIFDHSFYTGQLIEFIQINDMPSGIQLFKTWSILSLTFHRIQMNQIPIMCSLDNQQDYMLRNNDNNNVNVMQPNRTSHLKHHIHLNDTFGYIPFRSNIITMNLLYIDKVYIEIYSNPKSIFTSSIKHSTVVIENQPVQLGCFYEKTNVPINANYEYTFFIQLSDTTTNHNDTLFNISSLSTIHSMNNHYHNITSLSMTSSKRIILHRQLKYHIIEFIPYRKFHKGRIYCQISIKIKKPIVNTMDPIVSLSSQTSLRSWSNQISNVDNHLEDDSTDDPVLISSMGYIDLNIYYGPHIDNRENQFYILYPCSIFGKKLKMLCWTKSTDKLYITQEITLQCQTDFNPSGRIQWFLWKSNNTQTYLTNGSNLQLTLDQLQSSLEMITVNSKNLWIMDKEVFNDHGNYLPTDDPIKLDDVNFQIHLWKFTCIASSLGFDSQSANRFIIQAEKPFVHSHSHVNGILGKSIHLICNVVSYPEPNFTYPIWLHNGEYIEIEDSYGNDISPMNSTIEDSKFPISLTHHFVPKYKIIHRKYAFGWIITLKINNLDLNDEGIYQCSFTNLMGSSSYEINLYLNHTLSMNQFIIIIVSCFIILLIILLFSISLYYTHKQCQYFEWLHHYLCIKCKFTLNRKPYHKNDRRYNQKPVGYYTAVDLSEVIQNSLIDDDYFDVINNKKINQSFHQPYLIDPVISLNQSNDYVTCNPILNDQQSTLQEKCLCEFKNNCEHQLNSFNIPSKSNCSTCSHIKPLIQTKNNNDNDHDCCELKQYPLPSKTLSGYYINHPSSTVKVLHNQFRYKTVLRDDKNVNNDDVPLGFNQTPLFNHIYSNNVCLNELTSNSMINDQYSTYCQCNIKSNQTQGQYFTLPPYHHCMLYSNIMNKNIYTFNNQQDQCIHCTLKPRTSNLAPKLNETFSYCDNKVSLKNNVTTIIDTTNGMYNHNNNF
					

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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	32.3	Very low	27.6	Very low	233 Å²	233	154.1 Å²	154.1	100%	1.148	80%	0.799	S	S	*	*				0	82.6	0	-80.6	173.7	166.6	0	0	105.8
2	E	28	Very low	27.3	Very low	167 Å²	167	154.8 Å²	154.8	78%	0.78	80%	0.802	S	S	*	*				64.4	120.5	83	-75.6	-166.6	164.1	0	0	110.2
3	F	28.6	Very low	27.5	Very low	173 Å²	173	154.2 Å²	154.2	76%	0.759	80%	0.798	S	S	*	*			cis	-159.4	155.7	8.8	-119.3	-84.8	0	0	0	107.7
4	C	26.1	Very low	27.6	Very low	110 Å²	110	152 Å²	152	74%	0.743	79%	0.788	S	S	*	*			trans	-16.9	165.2	153.1	-66	0	0	0	0	118.4
5	D	28.5	Very low	27.5	Very low	135 Å²	135	153 Å²	153	72%	0.722	78%	0.784	S	S	*	*			cis	174.9	168.3	-10.8	-171.7	7.1	0	0	0	104.8
6	L	28.9	Very low	27.4	Very low	121 Å²	121	150.9 Å²	150.9	63%	0.634	78%	0.781	S	S	*	*			trans	87	112.2	158.4	-61.6	155.1	0	0	0	121.6
7	K	26.7	Very low	27.3	Very low	157 Å²	157	153.4 Å²	153.4	68%	0.683	79%	0.788	S	S	*	*				74.9	130.3	121.2	-74	-178.7	-179.1	173.2	0	121.2
8	Y	28.6	Very low	27.4	Very low	218 Å²	218	152.4 Å²	152.4	86%	0.855	79%	0.791	S	S	*	*			trans	86.5	125	160.8	-59.5	-75.8	0	0	0	117.9
9	G	26.6	Very low	27.3	Very low	78 Å²	78	150.8 Å²	150.8	80%	0.804	79%	0.794	S	S	*	*			trans	120	110.1	149.4	0	0	0	0	0	116.1
10	C	23.3	Very low	27.3	Very low	122 Å²	122	148.3 Å²	148.3	82%	0.824	79%	0.785	S	S	*	*			trans	-55.9	146.3	173.4	-66	0	0	0	0	114.4
11	H	26.5	Very low	27.3	Very low	181 Å²	181	148.8 Å²	148.8	84%	0.838	79%	0.786	S	S	*	*			trans	-153.8	111.3	132.2	-102.7	-71.8	0	0	0	110
12	I	24.1	Very low	27.1	Very low	162 Å²	162	146.8 Å²	146.8	83%	0.831	77%	0.771	S	S	*	*			trans	-110.9	125.3	163	-67.5	174.9	0	0	0	106.7
13	I	29.6	Very low	27.1	Very low	148 Å²	148	146.3 Å²	146.3	76%	0.759	77%	0.774	S	S	*	*			trans	-129.5	105.5	159.4	-64	179.8	0	0	0	106.8
14	N	28	Very low	27.1	Very low	123 Å²	123	146.8 Å²	146.8	66%	0.658	78%	0.779	S	S	*	*			trans	38.2	142.2	138.9	-101.3	-9.8	0	0	0	119.2
15	K	26.9	Very low	27.4	Very low	167 Å²	167	146.5 Å²	146.5	73%	0.726	78%	0.777	S	S	*	*			cis	178.3	128	8.8	-140.8	172.8	-165.8	-179.3	0	101.5
16	T	25.9	Very low	27.5	Very low	119 Å²	119	149.2 Å²	149.2	73%	0.73	78%	0.783	S	S	*	*				172	118.3	72	36.3	0	0	0	0	105.9
17	Q	26.3	Very low	27.5	Very low	193 Å²	193	153 Å²	153	90%	0.902	79%	0.79	S	S	*	*			trans	149.9	109.3	159.6	-90.7	175.6	0.9	0	0	108.9
18	T	27.5	Very low	27.7	Very low	137 Å²	137	151.9 Å²	151.9	84%	0.84	80%	0.797	S	S	*	*			trans	-155.5	101.7	160.6	48.7	0	0	0	0	110.1
19	S	27.2	Very low	27.5	Very low	122 Å²	122	144.9 Å²	144.9	85%	0.853	79%	0.792	S	S	*	*			trans	-114.1	127.4	133.1	51.5	0	0	0	0	106.3
20	V	26.6	Very low	27.6	Very low	100 Å²	100	150.5 Å²	150.5	61%	0.606	80%	0.797	S	S	*	*			trans	-121.1	122.9	178.1	-179.9	0	0	0	0	106.2	F22	V20-F22 HydrophobicContact CB-CE2 4.47Å; V20-F22 HydrophobicContact CG1-CD2 3.78Å; V20-F22 HydrophobicContact CG1-CE2 3.35Å; V20-F22 HydrophobicContact CG1-CZ 3.93Å
21	I	26.5	Very low	27.7	Very low	159 Å²	159	152.7 Å²	152.7	82%	0.815	80%	0.8	S	S	*	*			trans	-100.9	127.7	175.4	-62.3	172.1	0	0	0	106.6
22	F	27.8	Very low	27.7	Very low	190 Å²	190	150.3 Å²	150.3	83%	0.833	79%	0.792	S	S	*	*			trans	-112.9	126.3	172	-81.3	-78.1	0	0	0	110.2	V20	V20-F22 HydrophobicContact CB-CE2 4.47Å; V20-F22 HydrophobicContact CG1-CD2 3.78Å; V20-F22 HydrophobicContact CG1-CE2 3.35Å; V20-F22 HydrophobicContact CG1-CZ 3.93Å
23	D	29.3	Very low	27.7	Very low	158 Å²	158	150.3 Å²	150.3	85%	0.845	79%	0.788	S	S	*	*			trans	-94.5	151.3	178.4	-153.8	-6.2	0	0	0	110.9
24	H	29.1	Very low	27.5	Very low	183 Å²	183	152.3 Å²	152.3	85%	0.847	79%	0.791	S	S	*	*			trans	-67.5	134.9	-165.1	-90.5	-61.3	0	0	0	115.3
25	S	31.8	Very low	27.3	Very low	103 Å²	103	151.9 Å²	151.9	72%	0.72	79%	0.788	S	S	*	*			trans	-167.9	121.2	142.3	16.6	0	0	0	0	114.4
26	F	31.3	Very low	27.2	Very low	192 Å²	192	150.8 Å²	150.8	84%	0.842	79%	0.785	S	S	*	*			trans	63.7	104	147.7	-69.3	-83.8	0	0	0	123.4
27	Y	27.9	Very low	27.3	Very low	200 Å²	200	150.5 Å²	150.5	78%	0.784	78%	0.778	S	S	*	*				36.5	123.2	126.7	-86.5	-90.3	0	0	0	121.1
28	T	31.2	Very low	27.2	Very low	134 Å²	134	146.9 Å²	146.9	82%	0.822	77%	0.765	S	S	*	*				179.8	127.9	84.6	42.9	0	0	0	0	112.9
29	G	24.9	Very low	27.2	Very low	72 Å²	72	147.7 Å²	147.7	74%	0.742	77%	0.765	S	S	*	*			trans	96.2	82.7	139.8	0	0	0	0	0	121.1
30	Q	28.1	Very low	27.1	Very low	195 Å²	195	150.6 Å²	150.6	91%	0.911	77%	0.767	S	S	*	*	S	Bend	trans	169.8	125	132.8	-94	170.4	1.2	0	0	112
31	L	26.1	Very low	27.2	Very low	169 Å²	169	150 Å²	150	89%	0.885	77%	0.765	S	S	*	*			trans	44.4	111.5	176.8	-97.6	94.9	0	0	0	120.6
32	I	25	Very low	27.5	Very low	131 Å²	131	144.8 Å²	144.8	67%	0.672	74%	0.742	S	S	*	*			trans	-116.6	124.1	165.5	-64.9	169.7	0	0	0	107.1	I35	I32-I35 HydrophobicContact CG2-CD1 3.8Å; I32-I35 HydrophobicContact CG2-CG1 4.07Å
33	E	25.1	Very low	27.6	Very low	162 Å²	162	138.6 Å²	138.6	76%	0.757	73%	0.733	S	S	*	*			trans	-129.5	108.3	158.2	-110.7	-179.3	169.4	0	0	108.9
34	F	24.9	Very low	27.7	Very low	189 Å²	189	135 Å²	135	83%	0.829	71%	0.713	S	S	*	*			trans	71.5	72.8	165.7	-65.1	-80.7	0	0	0	122.6
35	I	24.4	Very low	27.7	Very low	115 Å²	115	132.4 Å²	132.4	59%	0.59	70%	0.701	S	S	*	*				-18.8	153.2	120	-72.3	169.9	0	0	0	115.6	I32	I32-I35 HydrophobicContact CG2-CD1 3.8Å; I32-I35 HydrophobicContact CG2-CG1 4.07Å
36	Q	23.8	Very low	27.6	Very low	143 Å²	143	132.2 Å²	132.2	67%	0.668	69%	0.691	S	S	*	*			cis	169.1	177.6	-4.6	-166.2	-163.9	-31.7	0	0	105.9
37	I	28.7	Very low	27.6	Very low	113 Å²	113	129.6 Å²	129.6	58%	0.579	68%	0.68	S	S	*	*			trans	82.6	138.3	142.7	-77.1	152	0	0	0	119.1
38	N	24.8	Very low	27.6	Very low	118 Å²	118	126.2 Å²	126.2	63%	0.631	67%	0.669	S	S	*	*			cis	-166.5	132.1	-3.9	-88.5	-21.8	0	0	0	110.8
39	D	25.8	Very low	27.5	Very low	154 Å²	154	123.8 Å²	123.8	82%	0.824	65%	0.654	S	S	*	*				166.6	95.6	118.4	-91.6	-13.9	0	0	0	109.1
40	M	26.9	Very low	27.8	Very low	183 Å²	183	132.5 Å²	132.5	90%	0.901	67%	0.665	S	S	*	*			trans	28.8	155.1	154	-79.7	-154	-177.8	0	0	123.5
41	P	27.9	Very low	28	Very low	86 Å²	86	127 Å²	127	56%	0.558	65%	0.648	S	S	*	*	S	Bend	cis	-143.1	85.2	-11	34.1	-10.1	0	0	0	113.1
42	S	32.9	Very low	28.2	Very low	50 Å²	50	122.4 Å²	122.4	35%	0.35	62%	0.623	S	S	.	*			trans	-172.5	119.1	161.7	21.5	0	0	0	0	112.3	H58 R59	S42-H58 WeakPolarHBondContact CB-O 3.35Å; S42-H58 PolarHBondContact OG-O 3.41Å; S42-R59 PolarHBondContact OG-O 3.31Å
43	G	29.6	Very low	28.7	Very low	61 Å²	61	117.1 Å²	117.1	63%	0.629	60%	0.596	S	S	*	*			trans	-75.1	154.8	-174.1	0	0	0	0	0	115.1
44	I	30.8	Very low	29.1	Very low	82 Å²	82	110.9 Å²	110.9	42%	0.421	57%	0.571	S	S	.	*			trans	-88.9	125.4	168.3	-62.9	170.5	0	0	0	107.9	L46 F57	I44-L46 HydrophobicContact CG2-CG 4.28Å; I44-F57 HydrophobicContact CD1-CE1 4.19Å; I44-F57 HydrophobicContact CG1-CD1 4.43Å; I44-F57 HydrophobicContact CG1-CE1 4.42Å
45	Q	30.4	Very low	30	Very low	128 Å²	128	102.2 Å²	102.2	60%	0.598	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.3	165.8	-79.9	-176.7	-12.4	0	0	109.7	F47	Q45-F47 HydrophobicContact CB-CE2 4.14Å
46	L	29.4	Very low	30.5	Very low	100 Å²	100	98.3 Å²	98.3	52%	0.524	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	120.5	175.2	-80.1	159.9	0	0	0	109.2	I44 L53 L55	I44-L46 HydrophobicContact CG2-CG 4.28Å; L46-L53 HydrophobicContact CD2-CD1 3.84Å; L46-L55 HydrophobicContact CD2-CD2 3.47Å; L46-L55 VanDerWaalsContact CD2-CD2 3.47Å; L46-L55 HydrophobicContact CG-CD2 4.42Å
47	F	30.8	Very low	31.4	Very low	137 Å²	137	92.3 Å²	92.3	60%	0.601	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.2	116.4	166.5	-68.5	-85.8	0	0	0	108.6	Q45	Q45-F47 HydrophobicContact CB-CE2 4.14Å
48	K	27.1	Very low	31.7	Very low	129 Å²	129	91.5 Å²	91.5	56%	0.561	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	111.5	171.7	-171.1	176.4	-178.9	-179.9	0	108.7	N105	K48-N105 PolarHBondContact NZ-O 3.06Å
49	T	29.4	Very low	32.1	Very low	83 Å²	83	93.5 Å²	93.5	51%	0.509	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	157.3	154.1	60.1	0	0	0	0	107.8	S51 I52	T49-S51 PolarHBondContact O-N 3.42Å; T49-I52 PolarHBondContact N-O 2.89Å; T49-I52 PolarHBondContact O-N 3.39Å
50	W	31.5	Very low	32.6	Very low	255 Å²	255	88.6 Å²	88.6	97%	0.966	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	7.3	-165.9	-71.6	29.7	0	0	0	115.7
51	S	33	Very low	32.7	Very low	80 Å²	80	89.2 Å²	89.2	56%	0.559	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-150.5	-1.5	-179.9	38	0	0	0	0	114.5	T49	T49-S51 PolarHBondContact O-N 3.42Å
52	I	29.8	Very low	32.7	Very low	71 Å²	71	91.7 Å²	91.7	36%	0.364	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	122.3	-177	-54.4	175.4	0	0	0	109.5	T49	T49-I52 PolarHBondContact N-O 2.89Å; T49-I52 PolarHBondContact O-N 3.39Å
53	L	35.8	Very low	32.5	Very low	20 Å²	20	96.4 Å²	96.4	11%	0.105	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	117.6	165.4	-177.9	71.2	0	0	0	108.2	L46 L55 I102 T119	L46-L53 HydrophobicContact CD2-CD1 3.84Å; L53-L55 HydrophobicContact CD2-CD1 4.43Å; L53-L55 HydrophobicContact CG-CG 4.5Å; L53-I102 HydrophobicContact CD2-CD1 4.31Å; L53-I102 HydrophobicContact CD2-CG2 3.92Å; L53-T119 PolarHBondContact O-N 2.94Å; L53-T119 VanDerWaalsContact O-N 3.1Å
54	S	34.5	Very low	32.4	Very low	31 Å²	31	100.1 Å²	100.1	22%	0.217	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	122.9	174.2	-170.9	0	0	0	0	110.2
55	L	42.8	Very low	32.5	Very low	7 Å²	7	98.4 Å²	98.4	4%	0.037	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	123.1	173.9	-68.5	166.2	0	0	0	108.4	L46 L53 F57 I102 T119 N121	L46-L55 HydrophobicContact CD2-CD2 3.47Å; L46-L55 VanDerWaalsContact CD2-CD2 3.47Å; L46-L55 HydrophobicContact CG-CD2 4.42Å; L53-L55 HydrophobicContact CD2-CD1 4.43Å; L53-L55 HydrophobicContact CG-CG 4.5Å; L55-F57 HydrophobicContact CB-CE2 3.96Å; L55-F57 HydrophobicContact CB-CZ 4.44Å; L55-I102 HydrophobicContact CD1-CD1 4.07Å; L55-I102 HydrophobicContact CD2-CD1 4.03Å; L55-T119 PolarHBondContact N-O 3.46Å; L55-T119 VanDerWaalsContact N-O 3.12Å; L55-N121 PolarHBondContact O-N 2.9Å
56	T	35.8	Very low	32.5	Very low	33 Å²	33	94.9 Å²	94.9	20%	0.202	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	120.6	175.3	-55.2	0	0	0	0	109.5	N121 L123	T56-N121 HydrophobicContact CG2-CB 4.04Å; T56-N121 PolarHBondContact OG1-ND2 3.09Å; T56-L123 HydrophobicContact CG2-CD1 4.49Å
57	F	42.5	Very low	32.6	Very low	17 Å²	17	91.2 Å²	91.2	8%	0.075	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118.4	178.6	-61.7	-85.5	0	0	0	109.2	I44 L55 I60 I65 I67 N121 L122 L123	I44-F57 HydrophobicContact CD1-CE1 4.19Å; I44-F57 HydrophobicContact CG1-CD1 4.43Å; I44-F57 HydrophobicContact CG1-CE1 4.42Å; L55-F57 HydrophobicContact CB-CE2 3.96Å; L55-F57 HydrophobicContact CB-CZ 4.44Å; F57-I60 HydrophobicContact CB-CD1 3.98Å; F57-I60 HydrophobicContact CD1-CD1 3.69Å; F57-I60 HydrophobicContact CG-CD1 4.25Å; F57-I65 HydrophobicContact CD1-CD1 4.43Å; F57-I65 HydrophobicContact CE1-CG2 4.41Å; F57-I67 HydrophobicContact CE2-CD1 4.3Å; F57-I67 HydrophobicContact CZ-CD1 4.24Å; F57-N121 PolarHBondContact N-O 3.49Å; F57-L122 HydrophobicContact CD2-CD2 3.93Å; F57-L122 HydrophobicContact CE2-CD2 4.44Å; F57-L123 WeakPolarHBondContact O-CB 3.31Å; F57-L123 WeakPolarHBondContact O-CD1 3.23Å
58	H	34.3	Very low	32.4	Very low	96 Å²	96	86.8 Å²	86.8	44%	0.444	42%	0.422	S	S	.	.			trans	-99.5	139.4	174.3	-73.6	-87	0	0	0	110	S42 I60 L123	S42-H58 WeakPolarHBondContact CB-O 3.35Å; S42-H58 PolarHBondContact OG-O 3.41Å; H58-I60 WeakPolarHBondContact O-CG1 3.42Å; H58-I60 PolarHBondContact O-N 3.19Å; H58-L123 HydrophobicContact CB-CD1 4.46Å; H58-L123 VanDerWaalsContact ND1-CD1 3.26Å; H58-L123 WeakPolarHBondContact ND1-CD1 3.34Å
59	R	34	Very low	32.4	Very low	161 Å²	161	82.7 Å²	82.7	61%	0.608	41%	0.409	S	S	*	.	S	Bend	trans	43.6	59.6	167	-70.6	-177.1	172.3	169.1	-0.3	116.2	S42	S42-R59 PolarHBondContact OG-O 3.31Å
60	I	34.5	Very low	32.3	Very low	51 Å²	51	79.8 Å²	79.8	26%	0.262	39%	0.392	S	S	.	.			trans	-109	101.6	174.3	-53.6	-178.1	0	0	0	110	F57 H58 M62 I65	F57-I60 HydrophobicContact CB-CD1 3.98Å; F57-I60 HydrophobicContact CD1-CD1 3.69Å; F57-I60 HydrophobicContact CG-CD1 4.25Å; H58-I60 WeakPolarHBondContact O-CG1 3.42Å; H58-I60 PolarHBondContact O-N 3.19Å; I60-M62 HydrophobicContact CG2-CB 3.82Å; I60-M62 HydrophobicContact CG2-CG 3.86Å; I60-M62 PolarHBondContact O-N 2.9Å; I60-I65 HydrophobicContact CD1-CD1 3.93Å; I60-I65 HydrophobicContact CG2-CD1 4.19Å
61	Q	29.6	Very low	32	Very low	196 Å²	196	72.4 Å²	72.4	92%	0.916	37%	0.371	S	S	*	.			trans	-85.8	84.5	163.9	-83.6	-171.7	-39.8	0	0	109.2
62	M	28.6	Very low	31.8	Very low	138 Å²	138	72.4 Å²	72.4	68%	0.68	37%	0.365	S	S	*	.			trans	-147.3	139.9	174.9	-70	-79.3	175.4	0	0	110.1	I60 Q64	I60-M62 HydrophobicContact CG2-CB 3.82Å; I60-M62 HydrophobicContact CG2-CG 3.86Å; I60-M62 PolarHBondContact O-N 2.9Å; M62-Q64 VanDerWaalsContact C-N 3.27Å; M62-Q64 PolarHBondContact O-N 3.46Å
63	N	28	Very low	31.7	Very low	148 Å²	148	74.3 Å²	74.3	79%	0.791	38%	0.376	S	S	*	.	S	Bend	trans	-68.4	-14.8	-173.6	-74.7	-20.9	0	0	0	115
64	Q	28.5	Very low	31.3	Very low	139 Å²	139	82.8 Å²	82.8	65%	0.65	42%	0.415	S	S	*	.			trans	-153.2	134.3	-176.7	-65.3	-176.9	-34.2	0	0	111.7	M62 Y129	M62-Q64 VanDerWaalsContact C-N 3.27Å; M62-Q64 PolarHBondContact O-N 3.46Å; Q64-Y129 HydrophobicContact CB-CD2 4.33Å; Q64-Y129 HydrophobicContact CG-CD2 3.84Å; Q64-Y129 HydrophobicContact CG-CE2 3.81Å
65	I	32.9	Very low	31	Very low	47 Å²	47	89.7 Å²	89.7	24%	0.241	44%	0.444	C	S	.	.			trans	-125.2	106.3	166.5	-60.1	174.9	0	0	0	107.6	F57 I60 I67	F57-I65 HydrophobicContact CD1-CD1 4.43Å; F57-I65 HydrophobicContact CE1-CG2 4.41Å; I60-I65 HydrophobicContact CD1-CD1 3.93Å; I60-I65 HydrophobicContact CG2-CD1 4.19Å; I65-I67 HydrophobicContact CG2-CG1 4.21Å
66	P	29.6	Very low	30.2	Very low	54 Å²	54	95.4 Å²	95.4	35%	0.351	48%	0.475	S	S	.	.			trans	-79.1	126.9	169.2	29.7	-30.3	0	0	0	110.1
67	I	32.5	Very low	29.7	Very low	22 Å²	22	102.7 Å²	102.7	11%	0.113	50%	0.5	C	S	.	.			trans	-106	107.6	171.9	-59	175.5	0	0	0	107.7	F57 I65 M120	F57-I67 HydrophobicContact CE2-CD1 4.3Å; F57-I67 HydrophobicContact CZ-CD1 4.24Å; I65-I67 HydrophobicContact CG2-CG1 4.21Å; I67-M120 HydrophobicContact CD1-CE 3.57Å; I67-M120 HydrophobicContact CD1-SD 3.74Å; I67-M120 HydrophobicContact CG2-CE 4.47Å
68	M	26	Very low	28.9	Very low	44 Å²	44	108.4 Å²	108.4	22%	0.217	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	118.6	174.4	-86.7	-173.7	78.6	0	0	111.3	H100 I102 Y133	M68-H100 WeakPolarHBondContact CB-O 3.15Å; M68-I102 PolarHBondContact O-N 2.86Å; M68-Y133 HydrophobicContact CG-CD2 4.17Å; M68-Y133 HydrophobicContact CG-CE2 3.6Å
69	C	27	Very low	28.5	Very low	43 Å²	43	109.9 Å²	109.9	29%	0.291	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	118.6	164.7	-68	0	0	0	0	109.3
70	S	26.8	Very low	28.1	Very low	22 Å²	22	112.4 Å²	112.4	15%	0.154	55%	0.548	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	134.7	175.5	-168.4	0	0	0	0	110.6	I102 H103	S70-I102 PolarHBondContact N-O 3.37Å; S70-I102 VanDerWaalsContact N-O 3.16Å; S70-H103 WeakPolarHBondContact O-CA 3.44Å
71	L	25.4	Very low	27.8	Very low	100 Å²	100	115.9 Å²	115.9	52%	0.524	57%	0.568	S	S	.	*			trans	-104.4	93.3	175.3	-86.3	150.3	0	0	0	108.1	L104 S138	L71-L104 HydrophobicContact CD2-CB 4.4Å; L71-L104 WeakPolarHBondContact CD2-O 3.46Å; L71-S138 WeakPolarHBondContact O-CB 3.39Å; L71-S138 PolarHBondContact O-OG 2.97Å
72	D	28	Very low	27.8	Very low	81 Å²	81	113 Å²	113	43%	0.433	56%	0.559	S	S	.	*			trans	-134.6	144.2	170.1	-90.9	-35.2	0	0	0	111.3	H103	D72-H103 PolarHBondContact O-CE1 3.49Å; D72-H103 PolarHBondContact O-ND1 3.05Å
73	N	27.9	Very low	27.9	Very low	111 Å²	111	112.7 Å²	112.7	59%	0.594	56%	0.56	S	S	*	*			trans	-142.5	99.2	179.9	-142	13.4	0	0	0	105.9
74	Q	29.1	Very low	28.1	Very low	198 Å²	198	111.8 Å²	111.8	93%	0.925	55%	0.554	S	S	*	*			trans	-145.7	136.6	160.6	-85.7	-144.6	-33.9	0	0	112.3
75	Q	27.1	Very low	28.2	Very low	175 Å²	175	111.5 Å²	111.5	82%	0.818	56%	0.558	S	S	*	*			trans	-75.4	133.5	178	-78.9	171.9	-54.3	0	0	111.7
76	D	25.5	Very low	27.9	Very low	128 Å²	128	116 Å²	116	68%	0.684	58%	0.582	S	S	*	*				81.2	121.2	125.8	-78.4	-17.3	0	0	0	123.1
77	Y	26.3	Very low	27.8	Very low	186 Å²	186	119.7 Å²	119.7	73%	0.729	60%	0.604	S	S	*	*			trans	100.1	99	140.9	-84.2	-118.5	0	0	0	121
78	M	24.8	Very low	27.4	Very low	136 Å²	136	125.6 Å²	125.6	67%	0.67	64%	0.635	S	S	*	*				87.6	125.4	110.2	-78	-119.1	-71	0	0	123.2
79	L	27	Very low	27.2	Very low	127 Å²	127	129.5 Å²	129.5	67%	0.665	66%	0.661	S	S	*	*			trans	97.5	97.3	134.9	-71.2	161.9	0	0	0	121.9
80	R	25.5	Very low	27.1	Very low	215 Å²	215	136 Å²	136	81%	0.811	69%	0.69	S	S	*	*				61.4	142.7	112.8	-109	-173.4	-167.7	-172.3	2.2	124.4
81	N	28.5	Very low	27	Very low	124 Å²	124	143.6 Å²	143.6	66%	0.663	72%	0.723	S	S	*	*			trans	90.9	106.9	152.5	-73.9	1.7	0	0	0	116.8
82	N	28.9	Very low	27	Very low	136 Å²	136	144.2 Å²	144.2	73%	0.727	73%	0.733	S	S	*	*				85.6	110.2	74.5	-95.8	17.2	0	0	0	111.9
83	D	31.7	Very low	26.8	Very low	131 Å²	131	146.5 Å²	146.5	70%	0.701	75%	0.745	S	S	*	*				162.9	120.8	112.7	-81.8	-26.6	0	0	0	113.1
84	N	30.5	Very low	26.6	Very low	128 Å²	128	153.5 Å²	153.5	68%	0.684	76%	0.763	S	S	*	*				44.9	115.9	128.2	-59.7	-25.5	0	0	0	121.5
85	N	32	Very low	26.4	Very low	134 Å²	134	149.7 Å²	149.7	72%	0.717	75%	0.753	S	S	*	*				153.3	129.6	101.2	-86.4	-33.2	0	0	0	114.6
86	N	25.9	Very low	26.2	Very low	140 Å²	140	146.3 Å²	146.3	75%	0.749	75%	0.749	S	S	*	*			trans	55.6	128.5	140.8	-59.2	-19.6	0	0	0	121.7
87	V	27.5	Very low	26.2	Very low	133 Å²	133	148.5 Å²	148.5	81%	0.806	76%	0.755	S	S	*	*				164.3	113.2	109.8	166.7	0	0	0	0	111.6
88	N	23.3	Very low	26.1	Very low	145 Å²	145	145.8 Å²	145.8	78%	0.775	75%	0.752	S	S	*	*			trans	33.5	128.4	139.8	-70.8	-10.4	0	0	0	125.4
89	V	23.2	Very low	26.1	Very low	126 Å²	126	146.9 Å²	146.9	76%	0.764	75%	0.753	S	S	*	*				93.6	132.9	127.7	173.8	0	0	0	0	120.5
90	M	24.2	Very low	26.1	Very low	180 Å²	180	145.8 Å²	145.8	89%	0.887	74%	0.744	S	S	*	*			trans	99	122.2	164.9	-83.2	-179.2	175.5	0	0	120
91	Q	24.6	Very low	26.1	Very low	182 Å²	182	140.5 Å²	140.5	85%	0.85	73%	0.729	S	S	*	*			trans	-61	143.7	179.5	-71.7	175.3	-44.3	0	0	113.5
92	P	24.6	Very low	26.2	Very low	113 Å²	113	135.8 Å²	135.8	73%	0.734	70%	0.703	S	S	*	*				-146.6	162.2	123.6	32.8	-14.3	0	0	0	114.9
93	N	25.1	Very low	26.2	Very low	128 Å²	128	133.6 Å²	133.6	68%	0.684	69%	0.689	S	S	*	*			trans	9.3	116.2	160.2	-69.4	-19	0	0	0	118.2	T95	N93-T95 PolarHBondContact O-N 3.47Å
94	R	23.8	Very low	26.2	Very low	258 Å²	258	129.8 Å²	129.8	97%	0.974	67%	0.668	S	S	*	*			trans	-66.8	88	174	-72.5	-178.2	175	-178.1	-2.8	111.5
95	T	23.5	Very low	26	Very low	118 Å²	118	126.9 Å²	126.9	72%	0.724	65%	0.653	S	S	*	*			trans	-100.1	107	151.1	37.7	0	0	0	0	107.7	N93	N93-T95 PolarHBondContact O-N 3.47Å
96	S	24.3	Very low	25.9	Very low	105 Å²	105	127 Å²	127	73%	0.734	65%	0.653	S	S	*	*			trans	-100.6	103.8	168.4	52.4	0	0	0	0	108.6	L98	S96-L98 PolarHBondContact O-N 2.87Å
97	H	24.5	Very low	26	Very low	173 Å²	173	125.5 Å²	125.5	80%	0.801	65%	0.649	S	S	*	*			trans	-73	111.6	168	-76.1	-80.7	0	0	0	109
98	L	23.8	Very low	25.8	Very low	130 Å²	130	128 Å²	128	68%	0.681	65%	0.649	S	S	*	*			trans	-102.1	107.4	166.7	-148	93.4	0	0	0	108.2	S96	S96-L98 PolarHBondContact O-N 2.87Å
99	K	24.8	Very low	26	Very low	159 Å²	159	123.6 Å²	123.6	69%	0.691	64%	0.639	S	S	*	*			trans	-78.7	127.2	170.7	-84.6	-179.3	175.1	178	0	108.9
100	H	27.6	Very low	26.2	Very low	103 Å²	103	124.8 Å²	124.8	48%	0.477	63%	0.631	S	S	.	*			trans	-123.5	119	168.1	-120.2	60.5	0	0	0	109.1	M68	M68-H100 WeakPolarHBondContact CB-O 3.15Å
101	H	26.6	Very low	26.3	Very low	104 Å²	104	121.3 Å²	121.3	48%	0.481	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.9	118.6	176.9	-72.3	-75.3	0	0	0	109.5
102	I	29.7	Very low	26.4	Very low	25 Å²	25	118 Å²	118	13%	0.128	61%	0.609	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.3	117.6	166.8	-58.5	177.2	0	0	0	108.5	L53 L55 M68 S70	L53-I102 HydrophobicContact CD2-CD1 4.31Å; L53-I102 HydrophobicContact CD2-CG2 3.92Å; L55-I102 HydrophobicContact CD1-CD1 4.07Å; L55-I102 HydrophobicContact CD2-CD1 4.03Å; M68-I102 PolarHBondContact O-N 2.86Å; S70-I102 PolarHBondContact N-O 3.37Å; S70-I102 VanDerWaalsContact N-O 3.16Å
103	H	29.5	Very low	26.7	Very low	90 Å²	90	119.8 Å²	119.8	42%	0.417	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.4	117.1	173.9	-86.8	-101.1	0	0	0	111.4	S70 D72 N105	S70-H103 WeakPolarHBondContact O-CA 3.44Å; D72-H103 PolarHBondContact O-CE1 3.49Å; D72-H103 PolarHBondContact O-ND1 3.05Å; H103-N105 PolarHBondContact O-N 3.32Å
104	L	30.1	Very low	27.2	Very low	51 Å²	51	122.6 Å²	122.6	27%	0.267	61%	0.606	S	S	.	*			trans	-91.3	84.6	169.9	-68.3	170.8	0	0	0	109.4	L71 D106	L71-L104 HydrophobicContact CD2-CB 4.4Å; L71-L104 WeakPolarHBondContact CD2-O 3.46Å; L104-D106 PolarHBondContact O-N 2.94Å
105	N	27.2	Very low	28.1	Very low	68 Å²	68	113.7 Å²	113.7	36%	0.364	58%	0.584	S	S	.	*			trans	-74.1	112.5	171.3	-96.4	-0.7	0	0	0	110.9	K48 H103	K48-N105 PolarHBondContact NZ-O 3.06Å; H103-N105 PolarHBondContact O-N 3.32Å
106	D	29.9	Very low	29.4	Very low	135 Å²	135	111.8 Å²	111.8	72%	0.722	57%	0.569	S	S	*	*			trans	-111.9	108.1	153.1	-86.1	-17	0	0	0	108.3	L104	L104-D106 PolarHBondContact O-N 2.94Å
107	T	27.5	Very low	30.5	Very low	109 Å²	109	108.7 Å²	108.7	67%	0.669	54%	0.544	S	S	*	.			trans	-84.1	120.6	176.7	40.3	0	0	0	0	110.7
108	F	24.8	Very low	31.8	Very low	185 Å²	185	101.9 Å²	101.9	81%	0.811	51%	0.513	S	S	*	.	S	Bend	trans	28	104.7	153.3	-85.9	-93.2	0	0	0	118
109	G	25.7	Very low	33.1	Very low	54 Å²	54	96.8 Å²	96.8	56%	0.557	49%	0.487	S	S	*	.	S	Bend	trans	151.6	103.3	157.6	0	0	0	0	0	114.6	I111	G109-I111 PolarHBondContact O-N 2.94Å
110	Y	27.8	Very low	34.6	Very low	150 Å²	150	89.4 Å²	89.4	59%	0.588	46%	0.455	S	S	*	.			trans	36.3	66.1	148.9	-65.9	-89.1	0	0	0	118.9	S269	Y110-S269 PolarHBondContact OH-O 2.78Å; Y110-S269 PolarHBondContact OH-OG 2.95Å
111	I	26.2	Very low	36	Very low	107 Å²	107	85.6 Å²	85.6	55%	0.549	44%	0.438	S	S	.	.			trans	-144.3	130.4	164.7	-52.9	177.9	0	0	0	109	G109 F113 R114	G109-I111 PolarHBondContact O-N 2.94Å; I111-F113 PolarHBondContact O-N 2.92Å; I111-R114 HydrophobicContact CG2-CG 3.88Å
112	P	26.9	Very low	37.4	Very low	112 Å²	112	80.8 Å²	80.8	73%	0.727	42%	0.416	S	S	*	.			trans	-53.1	138.6	173.2	24.5	-34.7	0	0	0	109.1	R114	P112-R114 PolarHBondContact O-N 3.17Å
113	F	32	Very low	38.7	Very low	152 Å²	152	80.9 Å²	80.9	67%	0.667	42%	0.417	S	S	*	.			trans	-36.4	94.6	-180	-74.5	-87.4	0	0	0	111.2	I111 S115 I299 S301	I111-F113 PolarHBondContact O-N 2.92Å; F113-S115 PolarHBondContact O-N 3.21Å; F113-I299 HydrophobicContact CE2-CG2 4.13Å; F113-S301 WeakPolarHBondContact CB-OG 2.79Å
114	R	35	Very low	39.8	Very low	187 Å²	187	82.4 Å²	82.4	71%	0.706	42%	0.42	S	S	*	.			trans	-71.6	134.7	178.6	-83.5	-174.1	173.9	-177.1	-0.3	106.9	I111 P112 N116	I111-R114 HydrophobicContact CG2-CG 3.88Å; P112-R114 PolarHBondContact O-N 3.17Å; R114-N116 PolarHBondContact O-N 3.38Å
115	S	42.6	Very low	40.9	Very low	71 Å²	71	81.3 Å²	81.3	50%	0.497	41%	0.414	S	S	.	.			trans	-55.1	108.2	175.5	36.3	0	0	0	0	109.7	F113 I117 M302	F113-S115 PolarHBondContact O-N 3.21Å; S115-I117 PolarHBondContact O-N 2.96Å; S115-M302 WeakPolarHBondContact CA-O 3.37Å; S115-M302 WeakPolarHBondContact CB-O 3.42Å
116	N	50.2	Low	41.5	Very low	77 Å²	77	85 Å²	85	41%	0.412	43%	0.434	S	S	.	.			trans	-74.1	127.1	174.8	-74.7	-25.9	0	0	0	108.9	R114 Y304	R114-N116 PolarHBondContact O-N 3.38Å; N116-Y304 PolarHBondContact O-N 3.27Å
117	I	48.7	Very low	42.3	Very low	41 Å²	41	83 Å²	83	21%	0.21	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	117.6	176.3	-49.7	175	0	0	0	107.4	S115 Y304	S115-I117 PolarHBondContact O-N 2.96Å; I117-Y304 HydrophobicContact CB-CE2 4.23Å; I117-Y304 HydrophobicContact CD1-CE1 4.3Å; I117-Y304 HydrophobicContact CD1-CE2 4.31Å; I117-Y304 WeakPolarHBondContact CD1-OH 3.49Å; I117-Y304 HydrophobicContact CG1-CE1 3.78Å; I117-Y304 HydrophobicContact CG1-CE2 3.92Å; I117-Y304 VanDerWaalsContact CG1-CZ 3.41Å; I117-Y304 WeakPolarHBondContact CG1-OH 3.38Å; I117-Y304 HydrophobicContact CG2-CD2 4.18Å; I117-Y304 HydrophobicContact CG2-CE2 3.56Å
118	I	52	Low	43.3	Very low	29 Å²	29	78.5 Å²	78.5	15%	0.149	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	117.6	170.3	-58.3	175.5	0	0	0	107.2	M120 Y304 I305 D306	I118-M120 HydrophobicContact CG2-CE 3.84Å; I118-M120 HydrophobicContact CG2-CG 4.1Å; I118-Y304 PolarHBondContact N-O 2.97Å; I118-Y304 VanDerWaalsContact N-O 3.12Å; I118-I305 HydrophobicContact CB-CG1 4.38Å; I118-I305 HydrophobicContact CB-CG2 4.49Å; I118-I305 CarbonylContact O-C 3.47Å; I118-I305 VanDerWaalsContact O-CA 3.29Å; I118-I305 WeakPolarHBondContact O-CA 3.38Å; I118-D306 PolarHBondContact O-N 3.33Å
119	T	50.4	Low	44.5	Very low	23 Å²	23	72 Å²	72	14%	0.141	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	117.7	175	-52.5	0	0	0	0	109.3	L53 L55 D306 N308	L53-T119 PolarHBondContact O-N 2.94Å; L53-T119 VanDerWaalsContact O-N 3.1Å; L55-T119 PolarHBondContact N-O 3.46Å; L55-T119 VanDerWaalsContact N-O 3.12Å; T119-D306 WeakPolarHBondContact CA-O 3.4Å; T119-D306 HydrophobicContact CG2-CB 4.36Å; T119-N308 WeakPolarHBondContact CG2-ND2 3.48Å
120	M	56	Low	45.7	Very low	5 Å²	5	69.6 Å²	69.6	3%	0.025	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	120.2	176.2	-61.1	-176.4	-177.3	0	0	110	I67 I118 L122 I305 D306 L307 N308	I67-M120 HydrophobicContact CD1-CE 3.57Å; I67-M120 HydrophobicContact CD1-SD 3.74Å; I67-M120 HydrophobicContact CG2-CE 4.47Å; I118-M120 HydrophobicContact CG2-CE 3.84Å; I118-M120 HydrophobicContact CG2-CG 4.1Å; M120-L122 HydrophobicContact CB-CD2 4.5Å; M120-I305 HydrophobicContact CE-CG2 4.09Å; M120-I305 HydrophobicContact CG-CG2 4.16Å; M120-I305 HydrophobicContact SD-CG2 4.03Å; M120-D306 PolarHBondContact N-O 2.83Å; M120-L307 HydrophobicContact CB-CD2 4.08Å; M120-L307 HydrophobicContact SD-CD2 4.12Å; M120-N308 PolarHBondContact O-N 3.36Å
121	N	57.2	Low	46.5	Very low	22 Å²	22	65.3 Å²	65.3	12%	0.118	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	111.8	174.6	-66.9	-29.5	0	0	0	108.7	L55 T56 F57 N308 Y310	L55-N121 PolarHBondContact O-N 2.9Å; T56-N121 HydrophobicContact CG2-CB 4.04Å; T56-N121 PolarHBondContact OG1-ND2 3.09Å; F57-N121 PolarHBondContact N-O 3.49Å; N121-N308 CarbonylContact C-O 3.52Å; N121-N308 WeakPolarHBondContact CA-O 3.16Å; N121-N308 VanDerWaalsContact OD1-CB 3.29Å; N121-N308 WeakPolarHBondContact OD1-CB 3.25Å; N121-N308 PolarHBondContact OD1-ND2 3.36Å; N121-N308 VanDerWaalsContact OD1-ND2 3.09Å; N121-Y310 HydrophobicContact CB-CD2 4.4Å; N121-Y310 HydrophobicContact CB-CE2 3.82Å
122	L	56.6	Low	47.4	Very low	4 Å²	4	62 Å²	62	2%	0.021	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	120.6	-173.7	-59.1	178	0	0	0	109.7	F57 M120 I125 V128 L307 N308 I309 Y310	F57-L122 HydrophobicContact CD2-CD2 3.93Å; F57-L122 HydrophobicContact CE2-CD2 4.44Å; M120-L122 HydrophobicContact CB-CD2 4.5Å; L122-I125 HydrophobicContact CB-CD1 3.64Å; L122-I125 HydrophobicContact CB-CG1 4.29Å; L122-I125 HydrophobicContact CD1-CD1 4.17Å; L122-I125 HydrophobicContact CD2-CD1 3.54Å; L122-I125 HydrophobicContact CG-CD1 3.95Å; L122-V128 HydrophobicContact CD1-CG1 4.22Å; L122-V128 HydrophobicContact CD1-CG2 3.6Å; L122-L307 HydrophobicContact CD1-CD2 4.25Å; L122-N308 PolarHBondContact N-O 2.89Å; L122-I309 CarbonylContact O-C 3.52Å; L122-I309 WeakPolarHBondContact O-CA 3.48Å; L122-Y310 PolarHBondContact O-N 2.89Å
123	L	56	Low	48.2	Very low	27 Å²	27	61.3 Å²	61.3	14%	0.141	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	121.7	177	-73.9	147.6	0	0	0	109	T56 F57 H58 Y310 F452	T56-L123 HydrophobicContact CG2-CD1 4.49Å; F57-L123 WeakPolarHBondContact O-CB 3.31Å; F57-L123 WeakPolarHBondContact O-CD1 3.23Å; H58-L123 HydrophobicContact CB-CD1 4.46Å; H58-L123 VanDerWaalsContact ND1-CD1 3.26Å; H58-L123 WeakPolarHBondContact ND1-CD1 3.34Å; L123-Y310 HydrophobicContact CD2-CG 4.37Å; L123-Y310 HydrophobicContact CG-CD2 4.43Å; L123-F452 HydrophobicContact CD2-CE1 4.09Å; L123-F452 HydrophobicContact CD2-CE2 4.3Å; L123-F452 HydrophobicContact CD2-CZ 3.5Å
124	Y	53.7	Low	48.6	Very low	121 Å²	121	55.6 Å²	55.6	48%	0.475	27%	0.267	S	S	.	.	S	Bend	trans	53.6	74.1	176.7	-74.2	-87.8	0	0	0	114.5	Y310 F452	Y124-Y310 PolarHBondContact N-O 2.83Å; Y124-F452 HydrophobicContact CD2-CD1 4.23Å; Y124-F452 AromaticContact CD2-CE1 3.82Å; Y124-F452 HydrophobicContact CD2-CE1 3.82Å; Y124-F452 AromaticContact CE2-CD1 3.25Å; Y124-F452 HydrophobicContact CE2-CD1 3.25Å; Y124-F452 AromaticContact CE2-CE1 3.3Å; Y124-F452 HydrophobicContact CE2-CE1 3.3Å; Y124-F452 AromaticContact CZ-CD1 3.59Å; Y124-F452 AromaticContact CZ-CE1 3.97Å; Y124-F452 WeakPolarHBondContact OH-CD1 3.23Å
125	I	51.8	Low	48.8	Very low	29 Å²	29	49.3 Å²	49.3	15%	0.149	25%	0.247	C	C	.	.			trans	-127.5	133.2	177	-54.4	-171.8	0	0	0	109.1	L122 K127 V128 P237	L122-I125 HydrophobicContact CB-CD1 3.64Å; L122-I125 HydrophobicContact CB-CG1 4.29Å; L122-I125 HydrophobicContact CD1-CD1 4.17Å; L122-I125 HydrophobicContact CD2-CD1 3.54Å; L122-I125 HydrophobicContact CG-CD1 3.95Å; I125-K127 WeakPolarHBondContact CG2-O 3.29Å; I125-V128 HydrophobicContact CB-CG2 4.37Å; I125-V128 HydrophobicContact CD1-CG2 4.43Å; I125-V128 HydrophobicContact CG2-CG2 3.71Å; I125-P237 WeakPolarHBondContact O-CG 3.5Å
126	D	41.5	Very low	48.5	Very low	145 Å²	145	48.9 Å²	48.9	78%	0.775	24%	0.242	S	C	*	.	S	Bend	trans	-87.5	-29.4	175.6	-67.7	-33.2	0	0	0	112.1	P237	D126-P237 WeakPolarHBondContact O-CD 3.21Å
127	K	45.5	Very low	47.8	Very low	93 Å²	93	52.6 Å²	52.6	40%	0.404	26%	0.255	S	S	.	.			trans	-150.2	138.6	178.1	-64.1	-168.9	178.5	-167.9	0	112	I125 Y129 E234	I125-K127 WeakPolarHBondContact CG2-O 3.29Å; K127-Y129 HydrophobicContact CB-CE2 4.16Å; K127-E234 IonicContact NZ-OE1 2.67Å
128	V	48.9	Very low	47.1	Very low	15 Å²	15	52.2 Å²	52.2	9%	0.091	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	130.2	176.2	-172.2	0	0	0	0	109	L122 I125 I130 F235	L122-V128 HydrophobicContact CD1-CG1 4.22Å; L122-V128 HydrophobicContact CD1-CG2 3.6Å; I125-V128 HydrophobicContact CB-CG2 4.37Å; I125-V128 HydrophobicContact CD1-CG2 4.43Å; I125-V128 HydrophobicContact CG2-CG2 3.71Å; V128-I130 HydrophobicContact CG1-CG1 4.08Å; V128-F235 HydrophobicContact CB-CB 4.35Å; V128-F235 HydrophobicContact CB-CD1 3.89Å; V128-F235 HydrophobicContact CG2-CD1 3.77Å; V128-F235 HydrophobicContact CG2-CE1 4.28Å; V128-F235 PolarHBondContact N-O 3.32Å; V128-F235 PolarHBondContact O-N 2.96Å
129	Y	50	Low	46.3	Very low	47 Å²	47	54.9 Å²	54.9	18%	0.184	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	126.1	172.3	-64.4	-82.7	0	0	0	108.7	Q64 K127 E234	Q64-Y129 HydrophobicContact CB-CD2 4.33Å; Q64-Y129 HydrophobicContact CG-CD2 3.84Å; Q64-Y129 HydrophobicContact CG-CE2 3.81Å; K127-Y129 HydrophobicContact CB-CE2 4.16Å; Y129-E234 HydrophobicContact CD1-CB 4.26Å; Y129-E234 HydrophobicContact CD1-CG 4.2Å; Y129-E234 HydrophobicContact CE1-CB 4.02Å; Y129-E234 HydrophobicContact CE1-CG 3.59Å; Y129-E234 PolarHBondContact OH-OE1 2.89Å
130	I	50.8	Low	45.5	Very low	5 Å²	5	59 Å²	59	3%	0.026	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	119.8	176.1	-54.9	175.6	0	0	0	108.3	V128 I132 I233 I246 I305 L307	V128-I130 HydrophobicContact CG1-CG1 4.08Å; I130-I132 HydrophobicContact CG2-CD1 4.46Å; I130-I132 HydrophobicContact CG2-CG1 4.13Å; I130-I233 HydrophobicContact CB-CB 4.45Å; I130-I233 PolarHBondContact N-O 2.87Å; I130-I233 VanDerWaalsContact N-O 3.08Å; I130-I233 PolarHBondContact O-N 3.32Å; I130-I233 VanDerWaalsContact O-N 3.12Å; I130-I246 HydrophobicContact CD1-CD1 3.77Å; I130-I305 HydrophobicContact CD1-CD1 4.49Å; I130-I305 HydrophobicContact CG2-CD1 4.16Å; I130-L307 HydrophobicContact CD1-CD2 4.28Å
131	E	44.9	Very low	44.4	Very low	59 Å²	59	64.1 Å²	64.1	28%	0.276	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	124.4	177.4	-65	-179.7	148.7	0	0	109.5	Y133	E131-Y133 HydrophobicContact CB-CE2 3.71Å; E131-Y133 PolarHBondContact OE2-OH 3.26Å
132	I	45.5	Very low	43.2	Very low	37 Å²	37	66.6 Å²	66.6	19%	0.19	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	122.6	-179.7	-56.1	170.6	0	0	0	109.2	I130 L158 C160 I233 C248	I130-I132 HydrophobicContact CG2-CD1 4.46Å; I130-I132 HydrophobicContact CG2-CG1 4.13Å; I132-L158 HydrophobicContact CB-CD2 3.97Å; I132-L158 HydrophobicContact CG2-CD1 4.33Å; I132-L158 HydrophobicContact CG2-CD2 3.62Å; I132-C160 WeakPolarHBondContact CD1-SG 3.33Å; I132-I233 HydrophobicContact CD1-CD1 4.28Å; I132-C248 WeakPolarHBondContact CD1-SG 3.17Å
133	Y	42.8	Very low	42.1	Very low	99 Å²	99	71.2 Å²	71.2	39%	0.388	37%	0.369	S	S	.	.			trans	-111.6	145.7	179.4	-54.1	-86.9	0	0	0	110.5	M68 E131	M68-Y133 HydrophobicContact CG-CD2 4.17Å; M68-Y133 HydrophobicContact CG-CE2 3.6Å; E131-Y133 HydrophobicContact CB-CE2 3.71Å; E131-Y133 PolarHBondContact OE2-OH 3.26Å
134	S	39.9	Very low	41.2	Very low	32 Å²	32	73.7 Å²	73.7	22%	0.224	38%	0.381	C	S	.	.			trans	-114.7	129	162.9	59.2	0	0	0	0	108.4	L228	S134-L228 WeakPolarHBondContact O-CD1 3.46Å; S134-L228 WeakPolarHBondContact OG-CD2 3.28Å
135	N	39.5	Very low	40.2	Very low	55 Å²	55	76.9 Å²	76.9	29%	0.294	40%	0.398	S	S	.	.			trans	-98.8	109.9	172.3	-173.4	-4.1	0	0	0	108.2	K137 S138	N135-K137 PolarHBondContact O-N 2.89Å; N135-K137 PolarHBondContact OD1-N 3.45Å; N135-K137 VanDerWaalsContact OD1-N 3.16Å; N135-S138 PolarHBondContact O-OG 3.49Å
136	P	37.6	Very low	39.3	Very low	61 Å²	61	84.4 Å²	84.4	40%	0.396	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-20	-176.6	29.7	-31.1	0	0	0	111.8	S138 L228	P136-S138 PolarHBondContact O-N 2.9Å; P136-L228 HydrophobicContact CB-CD1 4.1Å; P136-L228 HydrophobicContact CG-CD1 3.53Å
137	K	34.1	Very low	38.6	Very low	156 Å²	156	80 Å²	80	68%	0.678	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-28.6	-179	-83.8	-176.7	173.2	179.6	0	113.2	N135	N135-K137 PolarHBondContact O-N 2.89Å; N135-K137 PolarHBondContact OD1-N 3.45Å; N135-K137 VanDerWaalsContact OD1-N 3.16Å
138	S	35.1	Very low	37.8	Very low	33 Å²	33	81.7 Å²	81.7	23%	0.231	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-16.8	-177.7	55.1	0	0	0	0	114.3	L71 N135 P136 F140	L71-S138 WeakPolarHBondContact O-CB 3.39Å; L71-S138 PolarHBondContact O-OG 2.97Å; N135-S138 PolarHBondContact O-OG 3.49Å; P136-S138 PolarHBondContact O-N 2.9Å; S138-F140 PolarHBondContact O-N 3.47Å
139	I	33.9	Very low	36.8	Very low	85 Å²	85	84.4 Å²	84.4	44%	0.436	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-19.7	178.6	-60.7	174.2	0	0	0	112.1
140	F	34.8	Very low	35.8	Very low	110 Å²	110	87.5 Å²	87.5	48%	0.482	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.6	19.9	-167	-62.9	-70	0	0	0	115.9	S138 S142 I151	S138-F140 PolarHBondContact O-N 3.47Å; F140-S142 VanDerWaalsContact C-N 3.29Å; F140-S142 PolarHBondContact O-N 2.85Å; F140-I151 HydrophobicContact CD1-CD1 3.71Å; F140-I151 HydrophobicContact CE1-CD1 3.24Å; F140-I151 HydrophobicContact CZ-CD1 3.79Å
141	T	32.4	Very low	35	Very low	112 Å²	112	89.9 Å²	89.9	69%	0.687	48%	0.483	S	S	*	.			trans	-84.2	70.5	174.3	51.4	0	0	0	0	111.3
142	S	32.9	Very low	34.3	Very low	73 Å²	73	92.1 Å²	92.1	51%	0.51	49%	0.494	S	S	.	.			trans	-70.4	132.5	164.6	76.5	0	0	0	0	109	F140 I144	F140-S142 VanDerWaalsContact C-N 3.29Å; F140-S142 PolarHBondContact O-N 2.85Å; S142-I144 PolarHBondContact O-N 3.49Å
143	S	32.9	Very low	34	Very low	101 Å²	101	95 Å²	95	71%	0.706	51%	0.509	S	S	*	.	S	Bend	trans	-71.4	28.4	-174.9	55.2	0	0	0	0	114.1
144	I	36	Very low	33.9	Very low	79 Å²	79	92.5 Å²	92.5	41%	0.405	50%	0.501	S	S	.	.			trans	-103.8	97.7	-176.3	-51.3	177.4	0	0	0	108.5	S142 H146 S147 I265	S142-I144 PolarHBondContact O-N 3.49Å; I144-H146 PolarHBondContact O-N 2.85Å; I144-S147 WeakPolarHBondContact CG2-OG 3.43Å; I144-I265 HydrophobicContact CD1-CG2 3.79Å
145	K	33.9	Very low	34.2	Very low	189 Å²	189	94 Å²	94	82%	0.822	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	116.6	159.6	-74.7	179.2	175.5	178.1	0	107.2
146	H	32.1	Very low	34.6	Very low	186 Å²	186	93 Å²	93	86%	0.861	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	101	10	172.7	-52.6	-65.2	0	0	0	120.5	I144	I144-H146 PolarHBondContact O-N 2.85Å
147	S	27.5	Very low	35.2	Very low	52 Å²	52	95.2 Å²	95.2	36%	0.364	51%	0.511	S	S	.	.			trans	-115	97.8	176.1	-50.9	0	0	0	0	113	I144 V149	I144-S147 WeakPolarHBondContact CG2-OG 3.43Å; S147-V149 PolarHBondContact O-N 2.98Å; S147-V149 VanDerWaalsContact O-N 3.12Å
148	T	28	Very low	35.9	Very low	129 Å²	129	88.6 Å²	88.6	79%	0.791	48%	0.483	S	S	*	.			trans	-68.9	98.9	163.3	27.8	0	0	0	0	109.6	V150	T148-V150 PolarHBondContact O-N 3.33Å
149	V	27.9	Very low	36.8	Very low	73 Å²	73	88.5 Å²	88.5	44%	0.442	49%	0.487	S	S	.	.			trans	-83.9	104.8	165.3	-174.3	0	0	0	0	107.5	S147 I151	S147-V149 PolarHBondContact O-N 2.98Å; S147-V149 VanDerWaalsContact O-N 3.12Å; V149-I151 HydrophobicContact CG1-CD1 4.27Å; V149-I151 HydrophobicContact CG1-CG1 3.79Å; V149-I151 PolarHBondContact O-N 2.87Å
150	V	28.4	Very low	37.9	Very low	112 Å²	112	85 Å²	85	68%	0.679	47%	0.47	S	S	*	.			trans	-82.1	99.4	173.5	179.7	0	0	0	0	107.6	T148 E152	T148-V150 PolarHBondContact O-N 3.33Å; V150-E152 HydrophobicContact CG1-CG 4.49Å
151	I	34.1	Very low	39.3	Very low	54 Å²	54	84.1 Å²	84.1	28%	0.277	47%	0.466	S	S	.	.			trans	-93.3	100.6	169.2	-55.1	-178.4	0	0	0	107.5	F140 V149 N153 I258	F140-I151 HydrophobicContact CD1-CD1 3.71Å; F140-I151 HydrophobicContact CE1-CD1 3.24Å; F140-I151 HydrophobicContact CZ-CD1 3.79Å; V149-I151 HydrophobicContact CG1-CD1 4.27Å; V149-I151 HydrophobicContact CG1-CG1 3.79Å; V149-I151 PolarHBondContact O-N 2.87Å; I151-N153 PolarHBondContact O-N 2.86Å; I151-I258 HydrophobicContact CB-CD1 4.36Å; I151-I258 HydrophobicContact CG1-CD1 4.49Å; I151-I258 HydrophobicContact CG1-CG2 4.33Å; I151-I258 HydrophobicContact CG2-CD1 4Å
152	E	31	Very low	40.9	Very low	107 Å²	107	79.7 Å²	79.7	50%	0.5	44%	0.437	S	S	.	.			trans	-62.9	119.8	172.4	-74.5	-173.2	153.1	0	0	111.6	V150 Q154 K255	V150-E152 HydrophobicContact CG1-CG 4.49Å; E152-Q154 WeakPolarHBondContact O-CG 3.4Å; E152-Q154 PolarHBondContact O-N 3.38Å; E152-K255 IonicContact OE2-NZ 3.02Å; E152-K255 PolarHBondContact OE2-NZ 2.78Å
153	N	39	Very low	42.5	Very low	97 Å²	97	79.5 Å²	79.5	52%	0.519	43%	0.428	S	S	.	.			trans	50.2	37.3	140.4	-73.7	-17.8	0	0	0	120.1	I151 R226	I151-N153 PolarHBondContact O-N 2.86Å; N153-R226 PolarHBondContact O-NH1 3.24Å
154	Q	41.8	Very low	43.5	Very low	46 Å²	46	84.2 Å²	84.2	22%	0.215	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-100.2	127.5	176.5	-66.9	-95.1	8.6	0	0	112.5	E152 K253 K255	E152-Q154 WeakPolarHBondContact O-CG 3.4Å; E152-Q154 PolarHBondContact O-N 3.38Å; Q154-K253 WeakPolarHBondContact CB-O 3.13Å; Q154-K253 WeakPolarHBondContact CG-O 3.2Å; Q154-K253 PolarHBondContact OE1-O 2.99Å; Q154-K255 VanDerWaalsContact NE2-CG 3.27Å; Q154-K255 VanDerWaalsContact NE2-N 3.2Å
155	P	45.7	Very low	44.4	Very low	63 Å²	63	85.9 Å²	85.9	41%	0.409	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-74.3	127.9	178.1	28.8	-31.4	0	0	0	111.6
156	V	46.8	Very low	45.4	Very low	35 Å²	35	79.5 Å²	79.5	21%	0.212	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	121.9	164.7	-177.7	0	0	0	0	107.8	L228 I250 I252	V156-L228 HydrophobicContact CB-CD2 3.94Å; V156-L228 HydrophobicContact CG2-CD2 4.42Å; V156-I250 HydrophobicContact CG1-CG2 3.81Å; V156-I252 HydrophobicContact CG1-CG1 4.19Å; V156-I252 HydrophobicContact CG2-CD1 4.42Å; V156-I252 HydrophobicContact CG2-CG1 4.15Å
157	Q	50.4	Low	46.3	Very low	108 Å²	108	74.1 Å²	74.1	51%	0.505	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	123.3	172.1	-60	-179	-20.6	0	0	108.6	I250 S251	Q157-I250 CarbonylContact O-C 3.54Å; Q157-I250 WeakPolarHBondContact O-CA 3.36Å; Q157-S251 WeakPolarHBondContact CB-OG 3.35Å; Q157-S251 PolarHBondContact N-O 3.49Å; Q157-S251 PolarHBondContact O-N 3.38Å
158	L	49.1	Very low	47.4	Very low	16 Å²	16	72.3 Å²	72.3	8%	0.084	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	137.4	163.7	-179.1	69.9	0	0	0	107.2	I132 H231 Q249 I250	I132-L158 HydrophobicContact CB-CD2 3.97Å; I132-L158 HydrophobicContact CG2-CD1 4.33Å; I132-L158 HydrophobicContact CG2-CD2 3.62Å; L158-H231 HydrophobicContact CD2-CB 4.44Å; L158-H231 PolarHBondContact O-CE1 3.43Å; L158-H231 VanDerWaalsContact O-CE1 3.29Å; L158-H231 PolarHBondContact O-NE2 3.26Å; L158-Q249 CarbonylContact C-O 3.55Å; L158-Q249 WeakPolarHBondContact CA-O 3.4Å; L158-I250 HydrophobicContact CD1-CD1 4.29Å; L158-I250 HydrophobicContact CD1-CG1 3.47Å; L158-I250 VanDerWaalsContact CD1-CG1 3.47Å
159	G	53.4	Low	48.3	Very low	31 Å²	31	74 Å²	74	32%	0.32	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	122.5	174.5	0	0	0	0	0	109.7	Q249	G159-Q249 PolarHBondContact N-O 3.28Å; G159-Q249 PolarHBondContact O-N 2.87Å
160	C	58	Low	49.4	Very low	13 Å²	13	73.8 Å²	73.8	9%	0.088	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	141.1	172.9	-61	0	0	0	0	110.4	I132 I233 I246 Y247 C248	I132-C160 WeakPolarHBondContact CD1-SG 3.33Å; C160-I233 HydrophobicContact CB-CD1 3.54Å; C160-I246 HydrophobicContact CB-CG2 4.17Å; C160-Y247 CarbonylContact C-O 3.48Å; C160-Y247 WeakPolarHBondContact CA-O 3.39Å; C160-Y247 WeakPolarHBondContact CB-O 3.3Å; C160-C248 HydrophobicContact CB-CB 4.17Å; C160-C248 WeakPolarHBondContact CB-SG 3.45Å; C160-C248 WeakPolarHBondContact SG-CB 3.44Å; C160-C248 CovalentContact SG-SG 2.05Å; C160-C248 PolarHBondContact SG-SG 3.28Å
161	F	64.7	Low	50.2	Low	90 Å²	90	69.8 Å²	69.8	40%	0.395	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	148	179.2	57.9	-88.8	0	0	0	110	Y247 M302	F161-Y247 HydrophobicContact CD2-CD2 4.11Å; F161-Y247 HydrophobicContact CD2-CG 4.35Å; F161-Y247 VanDerWaalsContact CE2-CB 3.49Å; F161-Y247 AromaticContact CE2-CD2 3.8Å; F161-Y247 HydrophobicContact CE2-CD2 3.8Å; F161-Y247 AromaticContact CE2-CG 3.82Å; F161-Y247 HydrophobicContact CE2-CG 3.82Å; F161-Y247 HydrophobicContact CZ-CG 4.19Å; F161-Y247 PolarHBondContact N-O 2.84Å; F161-Y247 PolarHBondContact O-N 2.91Å; F161-M302 HydrophobicContact CE1-CE 4.39Å; F161-M302 HydrophobicContact CE2-CE 4.22Å; F161-M302 HydrophobicContact CZ-CE 3.54Å
162	Y	64.6	Low	50.6	Low	20 Å²	20	71.8 Å²	71.8	8%	0.078	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	151.6	178.9	-66.8	-90.3	0	0	0	111	K164 A171 I233 I246	Y162-K164 PolarHBondContact O-N 2.87Å; Y162-A171 HydrophobicContact CD2-CB 4.5Å; Y162-A171 HydrophobicContact CE2-CB 3.81Å; Y162-I233 HydrophobicContact CE2-CG2 4.15Å; Y162-I233 WeakPolarHBondContact OH-CG2 3.28Å; Y162-I246 HydrophobicContact CD1-CD1 4.28Å; Y162-I246 HydrophobicContact CD1-CG1 3.72Å; Y162-I246 HydrophobicContact CE1-CD1 3.54Å; Y162-I246 HydrophobicContact CE1-CG1 3.5Å
163	E	66.3	Low	51	Low	68 Å²	68	71.2 Å²	71.2	32%	0.318	38%	0.375	S	S	.	.			trans	-63.7	121.1	165.7	-159	158.7	-159.8	0	0	110	T165 N166 R245 Y247	E163-T165 PolarHBondContact O-N 3.34Å; E163-N166 PolarHBondContact O-N 3.49Å; E163-R245 HydrophobicContact CB-CB 4.43Å; E163-R245 PolarHBondContact N-O 3.48Å; E163-R245 VanDerWaalsContact N-O 3.09Å; E163-Y247 HydrophobicContact CB-CD2 4.49Å; E163-Y247 HydrophobicContact CB-CE2 3.83Å; E163-Y247 HydrophobicContact CG-CE2 4.04Å; E163-Y247 PolarHBondContact OE1-OH 3.04Å
164	K	55.1	Low	50.7	Low	201 Å²	201	72.5 Å²	72.5	87%	0.874	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-52.7	-23.8	-171.1	-100.2	-176.6	177.3	-179.9	0	114.7	Y162 N166	Y162-K164 PolarHBondContact O-N 2.87Å; K164-N166 VanDerWaalsContact C-N 3.28Å; K164-N166 PolarHBondContact O-N 2.91Å
165	T	55.5	Low	50.1	Low	114 Å²	114	76 Å²	76	70%	0.699	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-73.1	-18.3	-178.8	48.9	0	0	0	0	113.6	E163	E163-T165 PolarHBondContact O-N 3.34Å
166	N	54.2	Low	49.3	Very low	54 Å²	54	76 Å²	76	29%	0.289	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-121	8.6	-170	-72.4	-20.3	0	0	0	114.1	E163 K164 P168 F241 K243	E163-N166 PolarHBondContact O-N 3.49Å; K164-N166 VanDerWaalsContact C-N 3.28Å; K164-N166 PolarHBondContact O-N 2.91Å; N166-P168 WeakPolarHBondContact O-CD 3.4Å; N166-F241 HydrophobicContact CB-CD2 4.31Å; N166-F241 HydrophobicContact CB-CE2 3.96Å; N166-F241 WeakPolarHBondContact O-CD2 3.1Å; N166-F241 WeakPolarHBondContact O-CE2 3.33Å; N166-K243 PolarHBondContact ND2-O 3.35Å; N166-K243 VanDerWaalsContact ND2-O 3.07Å
167	V	50.4	Low	48.2	Very low	74 Å²	74	79.1 Å²	79.1	45%	0.448	40%	0.399	S	S	.	.			trans	-69.8	116.3	-168.4	-172.6	0	0	0	0	112.2
168	P	50.7	Low	47	Very low	14 Å²	14	82.6 Å²	82.6	9%	0.091	41%	0.413	C	S	.	.			trans	-68.8	142.9	164.9	29.6	-32.7	0	0	0	109.4	N166 N170 F235 Y238	N166-P168 WeakPolarHBondContact O-CD 3.4Å; P168-N170 PolarHBondContact O-N 2.88Å; P168-F235 HydrophobicContact CG-CD2 4.03Å; P168-F235 HydrophobicContact CG-CE2 3.94Å; P168-Y238 HydrophobicContact CB-CD2 3.84Å; P168-Y238 HydrophobicContact CB-CE2 4.15Å
169	I	48.2	Very low	45.8	Very low	164 Å²	164	87.1 Å²	87.1	84%	0.841	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-11.4	-175.4	-64.1	167	0	0	0	113.2
170	N	50.4	Low	44.5	Very low	69 Å²	69	94.1 Å²	94.1	37%	0.369	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	30.5	-168.1	-65.3	-16.6	0	0	0	115.3	P168 N172 I236 Y238	P168-N170 PolarHBondContact O-N 2.88Å; N170-N172 PolarHBondContact O-N 3.43Å; N170-I236 HydrophobicContact CB-CD1 4.47Å; N170-Y238 PolarHBondContact ND2-OH 2.85Å
171	A	45.1	Very low	43	Very low	28 Å²	28	99.6 Å²	99.6	23%	0.231	49%	0.488	C	S	.	.			trans	-72.7	112.8	172.5	0	0	0	0	0	110.7	Y162	Y162-A171 HydrophobicContact CD2-CB 4.5Å; Y162-A171 HydrophobicContact CE2-CB 3.81Å
172	N	43.1	Very low	41.3	Very low	96 Å²	96	99.1 Å²	99.1	51%	0.513	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	138.7	175.5	-71.2	-25.8	0	0	0	110.6	N170 E234	N170-N172 PolarHBondContact O-N 3.43Å; N172-E234 PolarHBondContact O-N 3.48Å
173	Y	38.2	Very low	39.5	Very low	94 Å²	94	104.6 Å²	104.6	37%	0.369	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	123.8	173.2	-60.8	-86.6	0	0	0	109.5	I232 I233	Y173-I232 WeakPolarHBondContact CA-O 3.29Å; Y173-I233 HydrophobicContact CD1-CG1 4.39Å; Y173-I233 HydrophobicContact CE1-CG1 4.31Å
174	E	33	Very low	37.8	Very low	124 Å²	124	107.3 Å²	107.3	58%	0.579	55%	0.549	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	146.6	175.6	-83.2	-167.5	163.1	0	0	113.2	I232	E174-I232 HydrophobicContact CB-CB 4.08Å; E174-I232 HydrophobicContact CB-CD1 4.14Å; E174-I232 PolarHBondContact N-O 2.89Å; E174-I232 PolarHBondContact O-N 3.32Å
175	Y	30.1	Very low	36.8	Very low	120 Å²	120	102 Å²	102	47%	0.471	53%	0.533	S	S	.	.			trans	-122.6	90.9	-178.8	-59.3	-83.6	0	0	0	111.8	Y230 H231	Y175-Y230 WeakPolarHBondContact CA-OH 3.32Å; Y175-Y230 WeakPolarHBondContact CB-OH 3.46Å; Y175-Y230 PolarHBondContact O-OH 3.25Å; Y175-H231 AromaticContact CE1-CE1 3.43Å; Y175-H231 VanDerWaalsContact CE1-CE1 3.43Å; Y175-H231 WeakPolarHBondContact CE1-CE1 3.32Å; Y175-H231 AromaticContact CE1-ND1 3.63Å; Y175-H231 AromaticContact CE1-NE2 3.97Å; Y175-H231 AromaticContact CZ-CE1 3.92Å
176	T	27.6	Very low	35.8	Very low	62 Å²	62	103.1 Å²	103.1	38%	0.38	54%	0.54	S	S	.	.			trans	-88.2	98.8	159.1	-30	0	0	0	0	121.8	F178 Y230	T176-F178 HydrophobicContact CG2-CD2 4.43Å; T176-F178 HydrophobicContact CG2-CE2 3.52Å; T176-F178 HydrophobicContact CG2-CZ 3.74Å; T176-Y230 VanDerWaalsContact C-CE2 3.44Å; T176-Y230 WeakPolarHBondContact CA-OH 3.3Å; T176-Y230 PolarHBondContact N-OH 3.47Å; T176-Y230 WeakPolarHBondContact O-CD1 3.47Å; T176-Y230 WeakPolarHBondContact O-CE1 3.46Å; T176-Y230 VanDerWaalsContact O-CE2 3.26Å; T176-Y230 WeakPolarHBondContact O-CE2 3.4Å; T176-Y230 PolarHBondContact O-OH 3.47Å
177	F	24.6	Very low	34.7	Very low	101 Å²	101	108 Å²	108	44%	0.443	57%	0.566	S	S	.	*			trans	-77.2	140.5	-179.7	-58.9	-95.2	0	0	0	114.9	Q227 Y230	F177-Q227 HydrophobicContact CD1-CB 4.1Å; F177-Q227 HydrophobicContact CD1-CG 4.19Å; F177-Q227 HydrophobicContact CE1-CB 4.25Å; F177-Y230 HydrophobicContact CB-CE1 4.47Å; F177-Y230 HydrophobicContact CD1-CE1 4.25Å; F177-Y230 WeakPolarHBondContact CD2-OH 3.31Å; F177-Y230 HydrophobicContact CG-CE1 4.27Å; F177-Y230 PolarHBondContact N-OH 2.93Å; F177-Y230 VanDerWaalsContact N-OH 3.13Å
178	F	24.7	Very low	34	Very low	181 Å²	181	113.4 Å²	113.4	79%	0.794	59%	0.586	S	S	*	*			trans	-128	139.3	171.2	-67.4	-83.7	0	0	0	112.8	T176	T176-F178 HydrophobicContact CG2-CD2 4.43Å; T176-F178 HydrophobicContact CG2-CE2 3.52Å; T176-F178 HydrophobicContact CG2-CZ 3.74Å
179	I	24.2	Very low	33	Very low	111 Å²	111	119.9 Å²	119.9	57%	0.569	62%	0.62	S	S	*	*			trans	-120.3	119.3	173.8	-64.1	178.4	0	0	0	107.9	L181 H225	I179-L181 HydrophobicContact CG2-CG 4.43Å; I179-H225 WeakPolarHBondContact CG2-CE1 3.3Å; I179-H225 WeakPolarHBondContact CG2-NE2 3.23Å
180	Q	26.3	Very low	32.2	Very low	178 Å²	178	119 Å²	119	83%	0.832	62%	0.617	S	S	*	*			trans	-126.2	114.3	170.6	-171.1	173.1	-0.9	0	0	109.1
181	L	26.1	Very low	31.3	Very low	128 Å²	128	121 Å²	121	67%	0.67	63%	0.632	S	S	*	*			trans	-96.9	118.9	174.1	-73	160	0	0	0	108.3	I179	I179-L181 HydrophobicContact CG2-CG 4.43Å
182	S	28.2	Very low	30.3	Very low	81 Å²	81	127.7 Å²	127.7	57%	0.566	66%	0.663	S	S	*	*			trans	-133.2	108.3	164.8	62	0	0	0	0	108	T184	S182-T184 PolarHBondContact O-N 3.43Å
183	D	28.1	Very low	29.5	Very low	134 Å²	134	131.9 Å²	131.9	72%	0.717	68%	0.677	S	S	*	*			trans	-78.3	113.6	171.1	-154.8	-23.8	0	0	0	107.6	T185	D183-T185 PolarHBondContact O-N 2.91Å; D183-T185 PolarHBondContact OD1-N 3.23Å; D183-T185 PolarHBondContact OD1-OG1 2.89Å; D183-T185 VanDerWaalsContact OD1-OG1 3.1Å
184	T	31	Very low	28.8	Very low	126 Å²	126	134.5 Å²	134.5	77%	0.773	70%	0.697	S	S	*	*			trans	-89.6	20.3	-179.7	52.4	0	0	0	0	112.2	S182	S182-T184 PolarHBondContact O-N 3.43Å
185	T	32.8	Very low	28.7	Very low	90 Å²	90	135.1 Å²	135.1	55%	0.552	70%	0.703	S	S	*	*	S	Bend	trans	-122.8	120	172.8	60.8	0	0	0	0	109.6	D183	D183-T185 PolarHBondContact O-N 2.91Å; D183-T185 PolarHBondContact OD1-N 3.23Å; D183-T185 PolarHBondContact OD1-OG1 2.89Å; D183-T185 VanDerWaalsContact OD1-OG1 3.1Å
186	T	35	Very low	28.4	Very low	137 Å²	137	134 Å²	134	84%	0.84	71%	0.713	S	S	*	*			trans	86	103.6	178.1	73.5	0	0	0	0	115.7	H188	T186-H188 PolarHBondContact O-N 2.91Å; T186-H188 VanDerWaalsContact O-N 3.12Å
187	N	31.4	Very low	28.5	Very low	157 Å²	157	136.2 Å²	136.2	84%	0.84	73%	0.731	S	S	*	*			trans	-49.5	109.7	158.6	-71.5	-26.9	0	0	0	109.1
188	H	35.9	Very low	28.7	Very low	187 Å²	187	139.5 Å²	139.5	87%	0.866	75%	0.752	S	S	*	*			trans	-170.6	131.7	139.2	-93	-54.7	0	0	0	109	T186 D190	T186-H188 PolarHBondContact O-N 2.91Å; T186-H188 VanDerWaalsContact O-N 3.12Å; H188-D190 PolarHBondContact O-N 3.38Å
189	N	29.3	Very low	28.9	Very low	150 Å²	150	135.9 Å²	135.9	80%	0.802	75%	0.749	S	S	*	*			trans	-44.9	127.2	165.5	-66.7	-26.2	0	0	0	109.3
190	D	30.8	Very low	29.1	Very low	144 Å²	144	136.8 Å²	136.8	77%	0.77	76%	0.76	S	S	*	*			trans	-177.2	116.7	131.4	-86.2	-21.3	0	0	0	112.4	H188	H188-D190 PolarHBondContact O-N 3.38Å
191	T	30.7	Very low	29.5	Very low	112 Å²	112	134.8 Å²	134.8	69%	0.687	75%	0.754	S	S	*	*			trans	55.5	111.8	140	60.9	0	0	0	0	121.2
192	L	24.3	Very low	29.8	Very low	169 Å²	169	138.1 Å²	138.1	89%	0.885	77%	0.765	S	S	*	*			trans	-16.3	129.7	146.7	-82.3	125.1	0	0	0	116
193	F	27.8	Very low	30.1	Very low	183 Å²	183	139.4 Å²	139.4	80%	0.803	77%	0.774	S	S	*	*			trans	-129.7	119.6	150.8	-98.3	-84.5	0	0	0	111.7	I195	F193-I195 HydrophobicContact CD1-CD1 4.44Å; F193-I195 HydrophobicContact CD1-CG1 4.47Å
194	N	23.5	Very low	30.3	Very low	149 Å²	149	141.1 Å²	141.1	80%	0.797	78%	0.78	S	S	*	*			trans	-93.7	116	172.3	-171.5	10.9	0	0	0	107
195	I	30.1	Very low	30.4	Very low	137 Å²	137	142.3 Å²	142.3	70%	0.703	78%	0.782	S	S	*	*			trans	-135.2	102.4	173.2	-57.5	-179.7	0	0	0	110	F193	F193-I195 HydrophobicContact CD1-CD1 4.44Å; F193-I195 HydrophobicContact CD1-CG1 4.47Å
196	S	24.8	Very low	30.3	Very low	98 Å²	98	145.1 Å²	145.1	69%	0.685	79%	0.793	S	S	*	*			trans	-66.1	140.7	159.5	47	0	0	0	0	111.6
197	S	29	Very low	30.2	Very low	107 Å²	107	147.2 Å²	147.2	75%	0.748	79%	0.793	S	S	*	*			trans	81.5	119.4	168.4	77.6	0	0	0	0	118.1
198	L	29.6	Very low	30.2	Very low	171 Å²	171	149.5 Å²	149.5	90%	0.895	79%	0.792	S	S	*	*			trans	-118.6	89.2	-178	-155.8	98.1	0	0	0	108.9
199	S	27.8	Very low	30.1	Very low	104 Å²	104	149.5 Å²	149.5	73%	0.727	79%	0.791	S	S	*	*			trans	-125.9	11	-180	59.7	0	0	0	0	115.4
200	T	29.4	Very low	30.2	Very low	130 Å²	130	149.1 Å²	149.1	80%	0.798	79%	0.789	S	S	*	*			trans	-144.6	45	-164.4	21.6	0	0	0	0	116.9
201	I	34.6	Very low	30.2	Very low	137 Å²	137	149.8 Å²	149.8	70%	0.703	79%	0.791	S	S	*	*			trans	-128.7	73.9	168.8	-49.8	178.9	0	0	0	110.6
202	H	32.3	Very low	30.2	Very low	198 Å²	198	150.7 Å²	150.7	92%	0.917	80%	0.797	S	S	*	*			trans	-117.6	17.9	173.1	-126.9	56.9	0	0	0	112.7
203	S	33.8	Very low	30.5	Very low	107 Å²	107	147.4 Å²	147.4	75%	0.748	79%	0.788	S	S	*	*			trans	-128.8	13.1	-167	91.4	0	0	0	0	118.4
204	M	32.2	Very low	30.5	Very low	170 Å²	170	146.1 Å²	146.1	84%	0.837	79%	0.788	S	S	*	*			trans	-108.8	21.6	-177	-66.2	-158.7	-165	0	0	115.5	N206	M204-N206 PolarHBondContact O-N 3.46Å
205	N	32.7	Very low	30.6	Very low	152 Å²	152	143.7 Å²	143.7	81%	0.813	78%	0.784	S	S	*	*			trans	-93.1	19.3	-169.2	-139.1	20.1	0	0	0	116.7
206	N	31.7	Very low	30.4	Very low	149 Å²	149	145.2 Å²	145.2	80%	0.797	79%	0.789	S	S	*	*			trans	-150	90.9	-179.7	-83.5	-33.7	0	0	0	111.5	M204	M204-N206 PolarHBondContact O-N 3.46Å
207	H	32.2	Very low	30.5	Very low	181 Å²	181	146.1 Å²	146.1	84%	0.838	79%	0.791	S	S	*	*			trans	171.2	144.9	145	-93.2	2.5	0	0	0	111.5
208	Y	31.4	Very low	30.3	Very low	205 Å²	205	146.7 Å²	146.7	80%	0.804	80%	0.795	S	S	*	*			trans	96.3	67.1	174.3	-67	-83.3	0	0	0	118.1
209	H	33.3	Very low	30.2	Very low	186 Å²	186	143.6 Å²	143.6	86%	0.861	79%	0.788	S	S	*	*			trans	-74.9	151.4	134.7	-97	-74.7	0	0	0	109.8
210	N	32.2	Very low	30	Very low	142 Å²	142	148.3 Å²	148.3	76%	0.759	80%	0.795	S	S	*	*			trans	74.4	110.9	176.4	-65.4	-14.9	0	0	0	116.9
211	I	31	Very low	29.9	Very low	159 Å²	159	153.2 Å²	153.2	82%	0.815	80%	0.799	S	S	*	*			trans	177.7	117.3	130.8	-85.3	148.9	0	0	0	108.5
212	T	31.3	Very low	29.5	Very low	131 Å²	131	153.5 Å²	153.5	80%	0.804	80%	0.8	S	S	*	*			trans	-91.3	138.9	170.2	27.9	0	0	0	0	110.4
213	S	29.4	Very low	29.1	Very low	99 Å²	99	150.2 Å²	150.2	69%	0.692	79%	0.788	S	S	*	*			trans	69.1	145.2	163.7	74.9	0	0	0	0	119.2
214	L	28.1	Very low	28.8	Very low	156 Å²	156	151.2 Å²	151.2	82%	0.817	79%	0.785	S	S	*	*			trans	88	104.6	175.4	-70.7	119.1	0	0	0	118.3
215	S	26.5	Very low	28.5	Very low	99 Å²	99	147.4 Å²	147.4	69%	0.692	76%	0.764	S	S	*	*			trans	14.6	141.2	134.3	61.7	0	0	0	0	119.8
216	M	26.1	Very low	28.6	Very low	168 Å²	168	148.1 Å²	148.1	83%	0.828	76%	0.756	S	S	*	*			trans	104	109.5	164.9	-64.4	-161.2	139.1	0	0	115.1
217	T	26	Very low	28.7	Very low	118 Å²	118	147.2 Å²	147.2	72%	0.724	75%	0.747	S	S	*	*	S	Bend	trans	71.9	126.1	135.6	58	0	0	0	0	118.6
218	S	25.3	Very low	29.1	Very low	118 Å²	118	141 Å²	141	83%	0.825	72%	0.72	S	S	*	*			trans	61.4	90.8	158.8	65.7	0	0	0	0	117.1
219	S	26.3	Very low	29.4	Very low	106 Å²	106	136.8 Å²	136.8	74%	0.741	71%	0.706	S	S	*	*			trans	-153.1	85.4	163.1	37.5	0	0	0	0	111.9	R221	S219-R221 PolarHBondContact O-N 2.89Å
220	K	24.4	Very low	29.8	Very low	204 Å²	204	129.3 Å²	129.3	89%	0.887	67%	0.67	S	S	*	*			trans	27.1	87.7	137.2	-64.3	177	178.3	177.5	0	115.3	I222	K220-I222 PolarHBondContact O-N 3.4Å
221	R	26.8	Very low	30.3	Very low	233 Å²	233	123.2 Å²	123.2	88%	0.879	64%	0.637	S	S	*	*			trans	-85.2	105.1	158.2	-81.2	-173.4	178	-172.2	-0.4	108.7	S219 I223	S219-R221 PolarHBondContact O-N 2.89Å; R221-I223 PolarHBondContact O-N 3.27Å
222	I	25.8	Very low	31	Very low	142 Å²	142	116.8 Å²	116.8	73%	0.728	60%	0.604	S	S	*	*			trans	-58.9	117.3	176.8	-68.6	168.1	0	0	0	108.9	K220 L224	K220-I222 PolarHBondContact O-N 3.4Å; I222-L224 HydrophobicContact CG2-CD1 4.21Å; I222-L224 HydrophobicContact CG2-CG 4.46Å; I222-L224 PolarHBondContact O-N 2.91Å
223	I	25.3	Very low	31.8	Very low	129 Å²	129	110.7 Å²	110.7	66%	0.662	57%	0.566	S	S	*	*			trans	-71.6	110.7	173.3	-62.4	167.8	0	0	0	107.1	R221	R221-I223 PolarHBondContact O-N 3.27Å
224	L	26.7	Very low	32.5	Very low	129 Å²	129	107.6 Å²	107.6	68%	0.675	54%	0.541	S	S	*	.			trans	-109.3	97.5	171.1	-103.7	150.3	0	0	0	109.3	I222	I222-L224 HydrophobicContact CG2-CD1 4.21Å; I222-L224 HydrophobicContact CG2-CG 4.46Å; I222-L224 PolarHBondContact O-N 2.91Å
225	H	26.9	Very low	33.7	Very low	89 Å²	89	100.2 Å²	100.2	41%	0.412	50%	0.502	S	S	.	.			trans	-69	131.5	174.5	-136.9	-79.8	0	0	0	109.9	I179	I179-H225 WeakPolarHBondContact CG2-CE1 3.3Å; I179-H225 WeakPolarHBondContact CG2-NE2 3.23Å
226	R	33.8	Very low	35.1	Very low	168 Å²	168	97.9 Å²	97.9	63%	0.634	48%	0.482	S	S	*	.			trans	-140.6	127.3	163.1	-128.3	179.2	-177.4	-175.7	2	112.6	N153	N153-R226 PolarHBondContact O-NH1 3.24Å
227	Q	34.8	Very low	36.3	Very low	129 Å²	129	91 Å²	91	60%	0.603	45%	0.449	S	S	*	.			trans	-64.1	126.5	-173.6	-65.4	165.7	-32.8	0	0	111.5	F177	F177-Q227 HydrophobicContact CD1-CB 4.1Å; F177-Q227 HydrophobicContact CD1-CG 4.19Å; F177-Q227 HydrophobicContact CE1-CB 4.25Å
228	L	39.3	Very low	37.8	Very low	52 Å²	52	90.9 Å²	90.9	27%	0.272	44%	0.436	S	S	.	.			trans	-85.5	130	160.3	-79.3	167	0	0	0	109.2	S134 P136 V156 Y230	S134-L228 WeakPolarHBondContact O-CD1 3.46Å; S134-L228 WeakPolarHBondContact OG-CD2 3.28Å; P136-L228 HydrophobicContact CB-CD1 4.1Å; P136-L228 HydrophobicContact CG-CD1 3.53Å; V156-L228 HydrophobicContact CB-CD2 3.94Å; V156-L228 HydrophobicContact CG2-CD2 4.42Å; L228-Y230 PolarHBondContact O-N 2.9Å
229	K	38.2	Very low	39.4	Very low	116 Å²	116	90.6 Å²	90.6	50%	0.504	42%	0.417	S	S	.	.			trans	-75	115.5	169.9	-66.5	-179.4	178.6	-176.2	0	107.8
230	Y	41.5	Very low	40.9	Very low	29 Å²	29	95 Å²	95	11%	0.114	42%	0.423	C	S	.	.			trans	-81.3	151.7	158.9	52.1	-74.7	0	0	0	106.3	Y175 T176 F177 L228 I232	Y175-Y230 WeakPolarHBondContact CA-OH 3.32Å; Y175-Y230 WeakPolarHBondContact CB-OH 3.46Å; Y175-Y230 PolarHBondContact O-OH 3.25Å; T176-Y230 VanDerWaalsContact C-CE2 3.44Å; T176-Y230 WeakPolarHBondContact CA-OH 3.3Å; T176-Y230 PolarHBondContact N-OH 3.47Å; T176-Y230 WeakPolarHBondContact O-CD1 3.47Å; T176-Y230 WeakPolarHBondContact O-CE1 3.46Å; T176-Y230 VanDerWaalsContact O-CE2 3.26Å; T176-Y230 WeakPolarHBondContact O-CE2 3.4Å; T176-Y230 PolarHBondContact O-OH 3.47Å; F177-Y230 HydrophobicContact CB-CE1 4.47Å; F177-Y230 HydrophobicContact CD1-CE1 4.25Å; F177-Y230 WeakPolarHBondContact CD2-OH 3.31Å; F177-Y230 HydrophobicContact CG-CE1 4.27Å; F177-Y230 PolarHBondContact N-OH 2.93Å; F177-Y230 VanDerWaalsContact N-OH 3.13Å; L228-Y230 PolarHBondContact O-N 2.9Å; Y230-I232 HydrophobicContact CD2-CG1 4.36Å
231	H	42.7	Very low	42.5	Very low	13 Å²	13	85.8 Å²	85.8	6%	0.06	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	114.8	177.1	-74	-100.6	0	0	0	107	L158 Y175	L158-H231 HydrophobicContact CD2-CB 4.44Å; L158-H231 PolarHBondContact O-CE1 3.43Å; L158-H231 VanDerWaalsContact O-CE1 3.29Å; L158-H231 PolarHBondContact O-NE2 3.26Å; Y175-H231 AromaticContact CE1-CE1 3.43Å; Y175-H231 VanDerWaalsContact CE1-CE1 3.43Å; Y175-H231 WeakPolarHBondContact CE1-CE1 3.32Å; Y175-H231 AromaticContact CE1-ND1 3.63Å; Y175-H231 AromaticContact CE1-NE2 3.97Å; Y175-H231 AromaticContact CZ-CE1 3.92Å
232	I	45.5	Very low	44.2	Very low	25 Å²	25	77.5 Å²	77.5	13%	0.128	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	123.6	168.3	-60.9	174.1	0	0	0	106.8	Y173 E174 Y230	Y173-I232 WeakPolarHBondContact CA-O 3.29Å; E174-I232 HydrophobicContact CB-CB 4.08Å; E174-I232 HydrophobicContact CB-CD1 4.14Å; E174-I232 PolarHBondContact N-O 2.89Å; E174-I232 PolarHBondContact O-N 3.32Å; Y230-I232 HydrophobicContact CD2-CG1 4.36Å
233	I	48.4	Very low	46	Very low	2 Å²	2	77.3 Å²	77.3	1%	0.01	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	108.5	173.4	-56.7	177.6	0	0	0	107.3	I130 I132 C160 Y162 Y173 I246	I130-I233 HydrophobicContact CB-CB 4.45Å; I130-I233 PolarHBondContact N-O 2.87Å; I130-I233 VanDerWaalsContact N-O 3.08Å; I130-I233 PolarHBondContact O-N 3.32Å; I130-I233 VanDerWaalsContact O-N 3.12Å; I132-I233 HydrophobicContact CD1-CD1 4.28Å; C160-I233 HydrophobicContact CB-CD1 3.54Å; Y162-I233 HydrophobicContact CE2-CG2 4.15Å; Y162-I233 WeakPolarHBondContact OH-CG2 3.28Å; Y173-I233 HydrophobicContact CD1-CG1 4.39Å; Y173-I233 HydrophobicContact CE1-CG1 4.31Å; I233-I246 HydrophobicContact CD1-CG2 4.22Å
234	E	44.5	Very low	47.8	Very low	34 Å²	34	71.2 Å²	71.2	16%	0.159	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	127.5	170.8	-177	175.5	-153.7	0	0	109.6	K127 Y129 N172	K127-E234 IonicContact NZ-OE1 2.67Å; Y129-E234 HydrophobicContact CD1-CB 4.26Å; Y129-E234 HydrophobicContact CD1-CG 4.2Å; Y129-E234 HydrophobicContact CE1-CB 4.02Å; Y129-E234 HydrophobicContact CE1-CG 3.59Å; Y129-E234 PolarHBondContact OH-OE1 2.89Å; N172-E234 PolarHBondContact O-N 3.48Å
235	F	53.8	Low	49.8	Very low	1 Å²	1	68.4 Å²	68.4	0%	0.004	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	125.9	176.8	169.5	-95.4	0	0	0	110.6	V128 P168 P237 F241 I309	V128-F235 HydrophobicContact CB-CB 4.35Å; V128-F235 HydrophobicContact CB-CD1 3.89Å; V128-F235 HydrophobicContact CG2-CD1 3.77Å; V128-F235 HydrophobicContact CG2-CE1 4.28Å; V128-F235 PolarHBondContact N-O 3.32Å; V128-F235 PolarHBondContact O-N 2.96Å; P168-F235 HydrophobicContact CG-CD2 4.03Å; P168-F235 HydrophobicContact CG-CE2 3.94Å; F235-P237 HydrophobicContact CD1-CB 4.36Å; F235-P237 HydrophobicContact CD1-CG 4.37Å; F235-P237 HydrophobicContact CE1-CB 3.46Å; F235-P237 VanDerWaalsContact CE1-CB 3.46Å; F235-P237 VanDerWaalsContact CE1-CD 3.44Å; F235-P237 HydrophobicContact CE1-CG 3.9Å; F235-P237 VanDerWaalsContact CE1-N 3.3Å; F235-P237 HydrophobicContact CZ-CB 3.94Å; F235-P237 VanDerWaalsContact O-CD 3.3Å; F235-P237 WeakPolarHBondContact O-CD 3.36Å; F235-F241 HydrophobicContact CD2-CE1 4.4Å; F235-F241 HydrophobicContact CD2-CZ 4.24Å; F235-F241 HydrophobicContact CE1-CD1 4.32Å; F235-F241 HydrophobicContact CE1-CE1 4.37Å; F235-F241 AromaticContact CE2-CD1 3.59Å; F235-F241 HydrophobicContact CE2-CD1 3.59Å; F235-F241 AromaticContact CE2-CD2 3.8Å; F235-F241 HydrophobicContact CE2-CD2 3.8Å; F235-F241 AromaticContact CE2-CE1 3.43Å; F235-F241 HydrophobicContact CE2-CE1 3.43Å; F235-F241 VanDerWaalsContact CE2-CE1 3.43Å; F235-F241 AromaticContact CE2-CE2 3.68Å; F235-F241 HydrophobicContact CE2-CE2 3.68Å; F235-F241 AromaticContact CE2-CG 3.73Å; F235-F241 HydrophobicContact CE2-CG 3.73Å; F235-F241 AromaticContact CE2-CZ 3.47Å; F235-F241 HydrophobicContact CE2-CZ 3.47Å; F235-F241 VanDerWaalsContact CE2-CZ 3.47Å; F235-F241 HydrophobicContact CZ-CB 4.14Å; F235-F241 AromaticContact CZ-CD1 3.24Å; F235-F241 HydrophobicContact CZ-CD1 3.24Å; F235-F241 HydrophobicContact CZ-CD2 4.19Å; F235-F241 AromaticContact CZ-CE1 3.42Å; F235-F241 HydrophobicContact CZ-CE1 3.42Å; F235-F241 VanDerWaalsContact CZ-CE1 3.42Å; F235-F241 HydrophobicContact CZ-CE2 4.35Å; F235-F241 AromaticContact CZ-CG 3.63Å; F235-F241 HydrophobicContact CZ-CG 3.63Å; F235-F241 AromaticContact CZ-CZ 3.98Å; F235-F241 HydrophobicContact CZ-CZ 3.98Å; F235-I309 HydrophobicContact CE1-CD1 3.28Å; F235-I309 HydrophobicContact CZ-CD1 3.41Å; F235-I309 VanDerWaalsContact CZ-CD1 3.41Å
236	I	54	Low	51.6	Low	51 Å²	51	64.2 Å²	64.2	26%	0.262	28%	0.277	S	S	.	.			trans	-101.7	102.9	171.3	-57.3	175.9	0	0	0	107.3	N170 Y238	N170-I236 HydrophobicContact CB-CD1 4.47Å; I236-Y238 WeakPolarHBondContact O-CD2 3.36Å; I236-Y238 PolarHBondContact O-N 3.38Å
237	P	51.9	Low	53	Low	22 Å²	22	58 Å²	58	14%	0.143	25%	0.254	C	S	.	.			trans	-56.2	105.5	174.7	15.1	-26.1	0	0	0	112.1	I125 D126 F235 I309	I125-P237 WeakPolarHBondContact O-CG 3.5Å; D126-P237 WeakPolarHBondContact O-CD 3.21Å; F235-P237 HydrophobicContact CD1-CB 4.36Å; F235-P237 HydrophobicContact CD1-CG 4.37Å; F235-P237 HydrophobicContact CE1-CB 3.46Å; F235-P237 VanDerWaalsContact CE1-CB 3.46Å; F235-P237 VanDerWaalsContact CE1-CD 3.44Å; F235-P237 HydrophobicContact CE1-CG 3.9Å; F235-P237 VanDerWaalsContact CE1-N 3.3Å; F235-P237 HydrophobicContact CZ-CB 3.94Å; F235-P237 VanDerWaalsContact O-CD 3.3Å; F235-P237 WeakPolarHBondContact O-CD 3.36Å; P237-I309 HydrophobicContact CB-CD1 3.77Å; P237-I309 HydrophobicContact CB-CG2 4.4Å
238	Y	57.1	Low	54.1	Low	116 Å²	116	52.7 Å²	52.7	46%	0.455	23%	0.231	S	C	.	.			trans	-75.3	139	156.1	-75.6	-89.4	0	0	0	108.1	P168 N170 I236 K240 F241	P168-Y238 HydrophobicContact CB-CD2 3.84Å; P168-Y238 HydrophobicContact CB-CE2 4.15Å; N170-Y238 PolarHBondContact ND2-OH 2.85Å; I236-Y238 WeakPolarHBondContact O-CD2 3.36Å; I236-Y238 PolarHBondContact O-N 3.38Å; Y238-K240 PolarHBondContact O-N 3.43Å; Y238-F241 WeakPolarHBondContact O-CB 3.33Å; Y238-F241 PolarHBondContact O-N 2.82Å
239	R	60.7	Low	54.9	Low	112 Å²	112	53.5 Å²	53.5	42%	0.423	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-27.2	176.4	-68	-173.7	178.3	158.9	-0.4	112.9	F241 Y311 H314 D360	R239-F241 PolarHBondContact O-N 3.31Å; R239-Y311 HydrophobicContact CB-CD2 4.33Å; R239-Y311 HydrophobicContact CB-CE1 4.3Å; R239-Y311 HydrophobicContact CB-CE2 4.09Å; R239-Y311 HydrophobicContact CG-CD2 4.32Å; R239-Y311 HydrophobicContact CG-CG 4.37Å; R239-Y311 WeakPolarHBondContact O-CE1 3.41Å; R239-Y311 PolarHBondContact O-OH 2.72Å; R239-H314 PolarHBondContact NH1-CD2 2.78Å; R239-H314 PolarHBondContact NH1-ND1 3.45Å; R239-D360 VanDerWaalsContact CB-OD2 3.22Å; R239-D360 WeakPolarHBondContact CB-OD2 3.49Å; R239-D360 VanDerWaalsContact CD-OD2 3.31Å; R239-D360 WeakPolarHBondContact CD-OD2 3.24Å
240	K	57.2	Low	55.6	Low	199 Å²	199	50.9 Å²	50.9	87%	0.865	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-14.5	174.1	-62.6	-176.6	178.6	180	0	114.4	Y238 H242	Y238-K240 PolarHBondContact O-N 3.43Å; K240-H242 PolarHBondContact O-N 3.45Å
241	F	58	Low	56.1	Low	11 Å²	11	50.1 Å²	50.1	5%	0.048	22%	0.223	C	C	.	.			trans	-86.4	93.7	-177	-167.8	-88.9	0	0	0	110.5	N166 F235 Y238 R239 G244 L307 I309	N166-F241 HydrophobicContact CB-CD2 4.31Å; N166-F241 HydrophobicContact CB-CE2 3.96Å; N166-F241 WeakPolarHBondContact O-CD2 3.1Å; N166-F241 WeakPolarHBondContact O-CE2 3.33Å; F235-F241 HydrophobicContact CD2-CE1 4.4Å; F235-F241 HydrophobicContact CD2-CZ 4.24Å; F235-F241 HydrophobicContact CE1-CD1 4.32Å; F235-F241 HydrophobicContact CE1-CE1 4.37Å; F235-F241 AromaticContact CE2-CD1 3.59Å; F235-F241 HydrophobicContact CE2-CD1 3.59Å; F235-F241 AromaticContact CE2-CD2 3.8Å; F235-F241 HydrophobicContact CE2-CD2 3.8Å; F235-F241 AromaticContact CE2-CE1 3.43Å; F235-F241 HydrophobicContact CE2-CE1 3.43Å; F235-F241 VanDerWaalsContact CE2-CE1 3.43Å; F235-F241 AromaticContact CE2-CE2 3.68Å; F235-F241 HydrophobicContact CE2-CE2 3.68Å; F235-F241 AromaticContact CE2-CG 3.73Å; F235-F241 HydrophobicContact CE2-CG 3.73Å; F235-F241 AromaticContact CE2-CZ 3.47Å; F235-F241 HydrophobicContact CE2-CZ 3.47Å; F235-F241 VanDerWaalsContact CE2-CZ 3.47Å; F235-F241 HydrophobicContact CZ-CB 4.14Å; F235-F241 AromaticContact CZ-CD1 3.24Å; F235-F241 HydrophobicContact CZ-CD1 3.24Å; F235-F241 HydrophobicContact CZ-CD2 4.19Å; F235-F241 AromaticContact CZ-CE1 3.42Å; F235-F241 HydrophobicContact CZ-CE1 3.42Å; F235-F241 VanDerWaalsContact CZ-CE1 3.42Å; F235-F241 HydrophobicContact CZ-CE2 4.35Å; F235-F241 AromaticContact CZ-CG 3.63Å; F235-F241 HydrophobicContact CZ-CG 3.63Å; F235-F241 AromaticContact CZ-CZ 3.98Å; F235-F241 HydrophobicContact CZ-CZ 3.98Å; Y238-F241 WeakPolarHBondContact O-CB 3.33Å; Y238-F241 PolarHBondContact O-N 2.82Å; R239-F241 PolarHBondContact O-N 3.31Å; F241-G244 VanDerWaalsContact CZ-CA 3.43Å; F241-L307 HydrophobicContact CE1-CB 4.08Å; F241-L307 HydrophobicContact CE1-CD1 3.99Å; F241-L307 HydrophobicContact CZ-CD1 4.31Å; F241-I309 HydrophobicContact CD1-CD1 3.59Å; F241-I309 HydrophobicContact CD1-CG1 4.22Å; F241-I309 HydrophobicContact CE1-CD1 4.2Å
242	H	61.1	Low	56.4	Low	58 Å²	58	50.8 Å²	50.8	27%	0.269	23%	0.227	S	C	.	.			trans	-119.7	139	168.4	-177.3	47.5	0	0	0	109.8	K240 N362	K240-H242 PolarHBondContact O-N 3.45Å; H242-N362 PolarHBondContact CE1-ND2 2.92Å; H242-N362 PolarHBondContact ND1-ND2 3.24Å
243	K	63.8	Low	56.8	Low	139 Å²	139	54.1 Å²	54.1	60%	0.604	24%	0.241	S	C	*	.	S	Bend	trans	60.4	45.7	-178	-57.4	175.3	179.7	178.5	0	112.9	N166 L307	N166-K243 PolarHBondContact ND2-O 3.35Å; N166-K243 VanDerWaalsContact ND2-O 3.07Å; K243-L307 WeakPolarHBondContact CA-O 3.25Å; K243-L307 PolarHBondContact N-O 2.91Å
244	G	64.8	Low	57	Low	0 Å²	0	55.2 Å²	55.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	132.8	171.5	0	0	0	0	0	110.6	F241 L307	F241-G244 VanDerWaalsContact CZ-CA 3.43Å; G244-L307 PolarHBondContact N-O 3.28Å; G244-L307 VanDerWaalsContact N-O 3.08Å; G244-L307 WeakPolarHBondContact O-CB 3.39Å; G244-L307 PolarHBondContact O-N 3.25Å
245	R	66.8	Low	57.3	Low	71 Å²	71	57.4 Å²	57.4	27%	0.268	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	123.2	173.8	-172.2	172.1	-76.9	166.5	-3.4	110.3	E163 Y247 Y304 I305 D306	E163-R245 HydrophobicContact CB-CB 4.43Å; E163-R245 PolarHBondContact N-O 3.48Å; E163-R245 VanDerWaalsContact N-O 3.09Å; R245-Y247 HydrophobicContact CB-CE2 4.4Å; R245-Y247 WeakPolarHBondContact CD-OH 3.49Å; R245-Y247 HydrophobicContact CG-CD1 4.48Å; R245-Y247 HydrophobicContact CG-CD2 4.37Å; R245-Y247 HydrophobicContact CG-CE1 4.11Å; R245-Y247 HydrophobicContact CG-CE2 3.97Å; R245-Y304 HydrophobicContact CG-CD2 3.87Å; R245-Y304 HydrophobicContact CG-CG 4.15Å; R245-I305 WeakPolarHBondContact CA-O 3.12Å; R245-D306 IonicContact CZ-OD1 3.31Å; R245-D306 IonicContact NE-OD1 3.5Å; R245-D306 PolarHBondContact NE-OD1 2.92Å; R245-D306 IonicContact NH2-OD1 2.94Å; R245-D306 PolarHBondContact NH2-OD1 3.43Å; R245-D306 IonicContact NH2-OD2 2.77Å
246	I	64.9	Low	57.2	Low	0 Å²	0	62.5 Å²	62.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	115.7	171.8	-52.6	-175.4	0	0	0	107.1	I130 C160 Y162 I233 Y304 I305 L307	I130-I246 HydrophobicContact CD1-CD1 3.77Å; C160-I246 HydrophobicContact CB-CG2 4.17Å; Y162-I246 HydrophobicContact CD1-CD1 4.28Å; Y162-I246 HydrophobicContact CD1-CG1 3.72Å; Y162-I246 HydrophobicContact CE1-CD1 3.54Å; Y162-I246 HydrophobicContact CE1-CG1 3.5Å; I233-I246 HydrophobicContact CD1-CG2 4.22Å; I246-Y304 CarbonylContact O-C 3.52Å; I246-Y304 WeakPolarHBondContact O-CA 3.32Å; I246-Y304 WeakPolarHBondContact O-CB 3.45Å; I246-I305 HydrophobicContact CB-CB 4.22Å; I246-I305 PolarHBondContact N-O 2.8Å; I246-I305 PolarHBondContact O-N 3.18Å; I246-L307 HydrophobicContact CD1-CD1 3.56Å; I246-L307 HydrophobicContact CD1-CG 4.37Å; I246-L307 HydrophobicContact CG1-CD1 3.94Å
247	Y	64	Low	57	Low	39 Å²	39	63.6 Å²	63.6	15%	0.153	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	135.1	171.8	-65	-79	0	0	0	109.5	C160 F161 E163 R245 M302 Y304	C160-Y247 CarbonylContact C-O 3.48Å; C160-Y247 WeakPolarHBondContact CA-O 3.39Å; C160-Y247 WeakPolarHBondContact CB-O 3.3Å; F161-Y247 HydrophobicContact CD2-CD2 4.11Å; F161-Y247 HydrophobicContact CD2-CG 4.35Å; F161-Y247 VanDerWaalsContact CE2-CB 3.49Å; F161-Y247 AromaticContact CE2-CD2 3.8Å; F161-Y247 HydrophobicContact CE2-CD2 3.8Å; F161-Y247 AromaticContact CE2-CG 3.82Å; F161-Y247 HydrophobicContact CE2-CG 3.82Å; F161-Y247 HydrophobicContact CZ-CG 4.19Å; F161-Y247 PolarHBondContact N-O 2.84Å; F161-Y247 PolarHBondContact O-N 2.91Å; E163-Y247 HydrophobicContact CB-CD2 4.49Å; E163-Y247 HydrophobicContact CB-CE2 3.83Å; E163-Y247 HydrophobicContact CG-CE2 4.04Å; E163-Y247 PolarHBondContact OE1-OH 3.04Å; R245-Y247 HydrophobicContact CB-CE2 4.4Å; R245-Y247 WeakPolarHBondContact CD-OH 3.49Å; R245-Y247 HydrophobicContact CG-CD1 4.48Å; R245-Y247 HydrophobicContact CG-CD2 4.37Å; R245-Y247 HydrophobicContact CG-CE1 4.11Å; R245-Y247 HydrophobicContact CG-CE2 3.97Å; Y247-M302 HydrophobicContact CD1-CE 3.29Å; Y247-M302 HydrophobicContact CE1-CE 4.01Å; Y247-M302 HydrophobicContact CG-CE 3.69Å; Y247-Y304 HydrophobicContact CE1-CG 4.47Å
248	C	57.3	Low	56.9	Low	17 Å²	17	63.5 Å²	63.5	12%	0.115	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	123.8	175.6	-71.8	0	0	0	0	109.2	I132 C160 M302 G303	I132-C248 WeakPolarHBondContact CD1-SG 3.17Å; C160-C248 HydrophobicContact CB-CB 4.17Å; C160-C248 WeakPolarHBondContact CB-SG 3.45Å; C160-C248 WeakPolarHBondContact SG-CB 3.44Å; C160-C248 CovalentContact SG-SG 2.05Å; C160-C248 PolarHBondContact SG-SG 3.28Å; C248-M302 CarbonylContact O-C 3.55Å; C248-M302 WeakPolarHBondContact O-CA 3.35Å; C248-G303 PolarHBondContact N-O 3.04Å; C248-G303 PolarHBondContact O-N 2.91Å
249	Q	56	Low	56.5	Low	68 Å²	68	59.4 Å²	59.4	32%	0.318	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	129.8	177.9	-175.6	179.3	-8.9	0	0	109.7	L158 G159 S301	L158-Q249 CarbonylContact C-O 3.55Å; L158-Q249 WeakPolarHBondContact CA-O 3.4Å; G159-Q249 PolarHBondContact N-O 3.28Å; G159-Q249 PolarHBondContact O-N 2.87Å; Q249-S301 CarbonylContact C-O 3.53Å; Q249-S301 WeakPolarHBondContact CA-O 3.32Å
250	I	53.2	Low	55.7	Low	62 Å²	62	58.7 Å²	58.7	32%	0.318	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	130.8	165.9	-62.4	168.4	0	0	0	106.5	V156 Q157 L158 I252 S300 S301	V156-I250 HydrophobicContact CG1-CG2 3.81Å; Q157-I250 CarbonylContact O-C 3.54Å; Q157-I250 WeakPolarHBondContact O-CA 3.36Å; L158-I250 HydrophobicContact CD1-CD1 4.29Å; L158-I250 HydrophobicContact CD1-CG1 3.47Å; L158-I250 VanDerWaalsContact CD1-CG1 3.47Å; I250-I252 HydrophobicContact CG2-CG1 4.42Å; I250-S300 CarbonylContact O-C 3.58Å; I250-S300 WeakPolarHBondContact O-CA 3.42Å; I250-S301 PolarHBondContact N-O 3Å; I250-S301 PolarHBondContact O-N 2.86Å
251	S	51.5	Low	55.1	Low	13 Å²	13	53.4 Å²	53.4	9%	0.091	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	136.2	172	67.1	0	0	0	0	111.4	Q157 I299	Q157-S251 WeakPolarHBondContact CB-OG 3.35Å; Q157-S251 PolarHBondContact N-O 3.49Å; Q157-S251 PolarHBondContact O-N 3.38Å; S251-I299 CarbonylContact C-O 3.57Å; S251-I299 WeakPolarHBondContact CA-O 3.31Å
252	I	50.5	Low	54.3	Low	27 Å²	27	57.3 Å²	57.3	14%	0.138	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	123.3	-179.8	-51.9	-179.8	0	0	0	106.2	V156 I250 I254 L298 I299	V156-I252 HydrophobicContact CG1-CG1 4.19Å; V156-I252 HydrophobicContact CG2-CD1 4.42Å; V156-I252 HydrophobicContact CG2-CG1 4.15Å; I250-I252 HydrophobicContact CG2-CG1 4.42Å; I252-I254 HydrophobicContact CG2-CD1 4.5Å; I252-I254 HydrophobicContact CG2-CG1 3.99Å; I252-L298 CarbonylContact O-C 3.53Å; I252-L298 WeakPolarHBondContact O-CA 3.25Å; I252-I299 HydrophobicContact CB-CB 4.48Å; I252-I299 PolarHBondContact N-O 3.21Å; I252-I299 PolarHBondContact O-N 3.43Å
253	K	53.4	Low	53.2	Low	95 Å²	95	59 Å²	59	41%	0.413	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	135.7	168.9	-73.4	-177.3	-178.4	-171	0	107.9	Q154 P296 V297 L298	Q154-K253 WeakPolarHBondContact CB-O 3.13Å; Q154-K253 WeakPolarHBondContact CG-O 3.2Å; Q154-K253 PolarHBondContact OE1-O 2.99Å; K253-P296 HydrophobicContact CB-CB 4.11Å; K253-P296 HydrophobicContact CD-CG 4.33Å; K253-V297 CarbonylContact C-O 3.52Å; K253-L298 HydrophobicContact CD-CD1 4.41Å; K253-L298 HydrophobicContact CG-CD1 3.48Å; K253-L298 VanDerWaalsContact CG-CD1 3.48Å
254	I	51.8	Low	51.8	Low	24 Å²	24	56.6 Å²	56.6	12%	0.123	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	130.2	178.5	-58.1	-172.6	0	0	0	108.4	I252 K256 I258 V259 P296 V297 I299	I252-I254 HydrophobicContact CG2-CD1 4.5Å; I252-I254 HydrophobicContact CG2-CG1 3.99Å; I254-K256 PolarHBondContact O-N 3.19Å; I254-I258 HydrophobicContact CG2-CB 3.97Å; I254-I258 HydrophobicContact CG2-CD1 4.47Å; I254-I258 HydrophobicContact CG2-CG2 4.11Å; I254-V259 HydrophobicContact CG2-CG2 4.15Å; I254-P296 CarbonylContact O-C 3.33Å; I254-P296 WeakPolarHBondContact O-CA 3.41Å; I254-P296 WeakPolarHBondContact O-CB 3.5Å; I254-V297 PolarHBondContact N-O 3.46Å; I254-V297 PolarHBondContact O-N 3.4Å; I254-I299 HydrophobicContact CD1-CD1 3.4Å; I254-I299 HydrophobicContact CD1-CG1 4.05Å; I254-I299 HydrophobicContact CG1-CD1 4.38Å
255	K	52.2	Low	50.6	Low	80 Å²	80	61.1 Å²	61.1	35%	0.348	31%	0.314	S	S	.	.			trans	-66.3	133.2	176.5	-66.5	-168.4	-176.8	169.1	0	109.7	E152 Q154 P257 I258	E152-K255 IonicContact OE2-NZ 3.02Å; E152-K255 PolarHBondContact OE2-NZ 2.78Å; Q154-K255 VanDerWaalsContact NE2-CG 3.27Å; Q154-K255 VanDerWaalsContact NE2-N 3.2Å; K255-P257 VanDerWaalsContact C-N 3.33Å; K255-P257 HydrophobicContact CB-CG 4.07Å; K255-P257 VanDerWaalsContact O-N 3.16Å; K255-I258 HydrophobicContact CB-CD1 4.47Å; K255-I258 WeakPolarHBondContact O-CB 2.95Å; K255-I258 PolarHBondContact O-N 3.26Å
256	K	51.2	Low	49.1	Very low	108 Å²	108	61.6 Å²	61.6	47%	0.47	33%	0.325	S	S	.	.	H	α-helix	trans	-44.3	-39.9	177.3	-151.8	169.2	-175.7	173.9	0	115.6	I254 I258 V259 N260	I254-K256 PolarHBondContact O-N 3.19Å; K256-I258 PolarHBondContact O-N 2.84Å; K256-V259 WeakPolarHBondContact O-CB 3.43Å; K256-V259 PolarHBondContact O-N 2.71Å; K256-N260 PolarHBondContact O-N 2.97Å
257	P	49.2	Very low	47.5	Very low	74 Å²	74	66.5 Å²	66.5	48%	0.481	36%	0.359	S	S	.	.	H	α-helix	trans	-61.8	-23.7	176.6	18.5	-32.9	0	0	0	115.5	K255 T261	K255-P257 VanDerWaalsContact C-N 3.33Å; K255-P257 HydrophobicContact CB-CG 4.07Å; K255-P257 VanDerWaalsContact O-N 3.16Å; P257-T261 PolarHBondContact O-N 2.92Å; P257-T261 PolarHBondContact O-OG1 2.85Å
258	I	50.1	Low	46.1	Very low	20 Å²	20	72.7 Å²	72.7	10%	0.103	39%	0.394	C	S	.	.	H	α-helix	trans	-76.5	-29.1	175.4	-60.7	171	0	0	0	110.6	I151 I254 K255 K256 T261	I151-I258 HydrophobicContact CB-CD1 4.36Å; I151-I258 HydrophobicContact CG1-CD1 4.49Å; I151-I258 HydrophobicContact CG1-CG2 4.33Å; I151-I258 HydrophobicContact CG2-CD1 4Å; I254-I258 HydrophobicContact CG2-CB 3.97Å; I254-I258 HydrophobicContact CG2-CD1 4.47Å; I254-I258 HydrophobicContact CG2-CG2 4.11Å; K255-I258 HydrophobicContact CB-CD1 4.47Å; K255-I258 WeakPolarHBondContact O-CB 2.95Å; K255-I258 PolarHBondContact O-N 3.26Å; K256-I258 PolarHBondContact O-N 2.84Å; I258-T261 WeakPolarHBondContact CA-OG1 3.37Å; I258-T261 PolarHBondContact O-OG1 3.33Å; I258-T261 VanDerWaalsContact O-OG1 3.04Å
259	V	49.4	Very low	44.8	Very low	30 Å²	30	74.9 Å²	74.9	18%	0.182	41%	0.41	C	S	.	.	H	α-helix	trans	-70.3	-45.5	178.4	-176	0	0	0	0	110	I254 K256 T261 M262 V297	I254-V259 HydrophobicContact CG2-CG2 4.15Å; K256-V259 WeakPolarHBondContact O-CB 3.43Å; K256-V259 PolarHBondContact O-N 2.71Å; V259-T261 VanDerWaalsContact C-N 3.26Å; V259-T261 PolarHBondContact O-N 3.38Å; V259-M262 PolarHBondContact O-N 2.83Å; V259-M262 VanDerWaalsContact O-N 3.12Å; V259-V297 HydrophobicContact CG2-CB 4.35Å; V259-V297 HydrophobicContact CG2-CG2 3.96Å
260	N	42.9	Very low	43.7	Very low	98 Å²	98	74.5 Å²	74.5	52%	0.524	41%	0.414	S	S	.	.	H	α-helix	trans	-69.5	-20.1	-179.3	-63.4	0.8	0	0	0	113.7	K256	K256-N260 PolarHBondContact O-N 2.97Å
261	T	45.6	Very low	42.9	Very low	87 Å²	87	80.4 Å²	80.4	53%	0.534	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-10.6	175.4	40.5	0	0	0	0	113.2	P257 I258 V259	P257-T261 PolarHBondContact O-N 2.92Å; P257-T261 PolarHBondContact O-OG1 2.85Å; I258-T261 WeakPolarHBondContact CA-OG1 3.37Å; I258-T261 PolarHBondContact O-OG1 3.33Å; I258-T261 VanDerWaalsContact O-OG1 3.04Å; V259-T261 VanDerWaalsContact C-N 3.26Å; V259-T261 PolarHBondContact O-N 3.38Å
262	M	39.9	Very low	42.1	Very low	93 Å²	93	85.8 Å²	85.8	46%	0.458	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-24.2	170.6	-71.5	-166	170.2	0	0	113	V259 I265	V259-M262 PolarHBondContact O-N 2.83Å; V259-M262 VanDerWaalsContact O-N 3.12Å; M262-I265 PolarHBondContact O-N 2.95Å
263	D	37.9	Very low	41.5	Very low	94 Å²	94	86.2 Å²	86.2	50%	0.503	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-32	-176	-77.1	-32.1	0	0	0	116.4
264	P	35.5	Very low	40.7	Very low	89 Å²	89	86.9 Å²	86.9	58%	0.578	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-8.7	177.1	30	-28.8	0	0	0	114.6
265	I	38.2	Very low	39.8	Very low	94 Å²	94	95.3 Å²	95.3	48%	0.482	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-8	-171.9	-60.1	177	0	0	0	112.4	I144 M262	I144-I265 HydrophobicContact CD1-CG2 3.79Å; M262-I265 PolarHBondContact O-N 2.95Å
266	V	36	Very low	39.2	Very low	81 Å²	81	95 Å²	95	49%	0.491	52%	0.524	S	S	.	.			trans	-110.5	35.5	-176.6	-165.9	0	0	0	0	112.3	L268	V266-L268 VanDerWaalsContact C-N 3.29Å; V266-L268 PolarHBondContact O-N 2.85Å
267	S	31.2	Very low	38.4	Very low	103 Å²	103	96 Å²	96	72%	0.72	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	7.1	-178.2	50.9	0	0	0	0	115.4
268	L	35	Very low	37.8	Very low	170 Å²	170	95.9 Å²	95.9	89%	0.89	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.5	6.9	-173.4	-118.3	86.2	0	0	0	117.7	V266	V266-L268 VanDerWaalsContact C-N 3.29Å; V266-L268 PolarHBondContact O-N 2.85Å
269	S	29.3	Very low	37.4	Very low	63 Å²	63	99.6 Å²	99.6	44%	0.441	55%	0.546	S	S	.	.	S	Bend	trans	-141.5	114.5	174.4	56.2	0	0	0	0	113.3	Y110	Y110-S269 PolarHBondContact OH-O 2.78Å; Y110-S269 PolarHBondContact OH-OG 2.95Å
270	S	34	Very low	37	Very low	59 Å²	59	104.8 Å²	104.8	41%	0.413	57%	0.568	S	S	.	*			trans	56.3	99.9	171.4	60.2	0	0	0	0	118.4	T272 S273	S270-T272 PolarHBondContact O-N 3.37Å; S270-S273 PolarHBondContact O-N 3.4Å; S270-S273 PolarHBondContact O-OG 3.49Å; S270-S273 PolarHBondContact OG-OG 3.17Å; S270-S273 VanDerWaalsContact OG-OG 3.12Å
271	Q	36.4	Very low	37	Very low	187 Å²	187	104.5 Å²	104.5	87%	0.874	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-6.7	169.5	-76.3	-179.6	-17.1	0	0	115
272	T	35	Very low	36.8	Very low	126 Å²	126	102.8 Å²	102.8	77%	0.773	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-18.8	178.6	34.5	0	0	0	0	114	S270	S270-T272 PolarHBondContact O-N 3.37Å
273	S	37.6	Very low	37	Very low	35 Å²	35	105 Å²	105	25%	0.245	57%	0.571	C	S	.	*	S	Bend	trans	-87.9	-12.7	-178.6	46.9	0	0	0	0	114.7	S270	S270-S273 PolarHBondContact O-N 3.4Å; S270-S273 PolarHBondContact O-OG 3.49Å; S270-S273 PolarHBondContact OG-OG 3.17Å; S270-S273 VanDerWaalsContact OG-OG 3.12Å
274	L	35.1	Very low	37.4	Very low	110 Å²	110	106.2 Å²	106.2	58%	0.576	58%	0.581	S	S	*	*	H	α-helix	trans	-79.5	-23	-178.6	-95.6	147.5	0	0	0	114.1	S278	L274-S278 WeakPolarHBondContact O-CB 3.47Å; L274-S278 PolarHBondContact O-N 2.88Å
275	R	34.1	Very low	37.7	Very low	201 Å²	201	107.2 Å²	107.2	76%	0.758	58%	0.582	S	S	*	*	H	α-helix	trans	-73.5	-24.7	178.7	-78.2	-175.6	-179.7	179.6	0.2	113.7	N279	R275-N279 VanDerWaalsContact O-CB 3.26Å; R275-N279 WeakPolarHBondContact O-CB 3.45Å; R275-N279 PolarHBondContact O-N 2.07Å; R275-N279 PolarHBondContact O-ND2 3.3Å
276	S	39.7	Very low	38	Very low	72 Å²	72	109 Å²	109	50%	0.503	59%	0.592	S	S	.	*	H	α-helix	trans	-83.6	-29	179.3	93.2	0	0	0	0	113	Q280	S276-Q280 WeakPolarHBondContact O-CG 3.42Å; S276-Q280 PolarHBondContact O-N 3.26Å
277	W	33.6	Very low	38.7	Very low	130 Å²	130	113.8 Å²	113.8	49%	0.492	61%	0.609	S	S	.	*	H	α-helix	trans	-75.3	-44.2	174.6	-120.5	48.5	0	0	0	111.3	N279 Q280 I281	W277-N279 VanDerWaalsContact C-N 3.3Å; W277-N279 PolarHBondContact O-N 3.04Å; W277-Q280 PolarHBondContact O-N 3.43Å; W277-I281 HydrophobicContact CD2-CD1 4.24Å; W277-I281 HydrophobicContact CE3-CD1 4.02Å; W277-I281 HydrophobicContact CZ3-CD1 4.46Å; W277-I281 WeakPolarHBondContact O-CB 3.41Å; W277-I281 WeakPolarHBondContact O-CG1 3.23Å; W277-I281 PolarHBondContact O-N 3.07Å; W277-I281 VanDerWaalsContact O-N 3.09Å
278	S	37.4	Very low	39.3	Very low	72 Å²	72	117.1 Å²	117.1	50%	0.503	62%	0.618	S	S	.	*	H	α-helix	trans	-59.4	-40.1	172.5	-174.7	0	0	0	0	111.9	L274 S282	L274-S278 WeakPolarHBondContact O-CB 3.47Å; L274-S278 PolarHBondContact O-N 2.88Å; S278-S282 WeakPolarHBondContact O-CB 3.19Å; S278-S282 PolarHBondContact O-N 3.16Å; S278-S282 PolarHBondContact O-OG 2.88Å
279	N	42	Very low	39.6	Very low	97 Å²	97	117.8 Å²	117.8	52%	0.519	62%	0.617	S	S	.	*	H	α-helix	trans	-77.8	-20.7	-177.8	-74	-5.6	0	0	0	114.6	R275 W277 N283	R275-N279 VanDerWaalsContact O-CB 3.26Å; R275-N279 WeakPolarHBondContact O-CB 3.45Å; R275-N279 PolarHBondContact O-N 2.07Å; R275-N279 PolarHBondContact O-ND2 3.3Å; W277-N279 VanDerWaalsContact C-N 3.3Å; W277-N279 PolarHBondContact O-N 3.04Å; N279-N283 WeakPolarHBondContact O-CB 3.46Å
280	Q	40.9	Very low	40.4	Very low	140 Å²	140	121.9 Å²	121.9	65%	0.654	63%	0.633	S	S	*	*	H	α-helix	trans	-87.5	-27.7	174.3	-77.6	-176.3	-10.9	0	0	112.3	S276 W277	S276-Q280 WeakPolarHBondContact O-CG 3.42Å; S276-Q280 PolarHBondContact O-N 3.26Å; W277-Q280 PolarHBondContact O-N 3.43Å
281	I	43.3	Very low	40.9	Very low	91 Å²	91	126.5 Å²	126.5	47%	0.467	65%	0.653	S	S	.	*	H	α-helix	trans	-84.6	-37.4	175	-62.9	169.7	0	0	0	110.4	W277 N283 V284	W277-I281 HydrophobicContact CD2-CD1 4.24Å; W277-I281 HydrophobicContact CE3-CD1 4.02Å; W277-I281 HydrophobicContact CZ3-CD1 4.46Å; W277-I281 WeakPolarHBondContact O-CB 3.41Å; W277-I281 WeakPolarHBondContact O-CG1 3.23Å; W277-I281 PolarHBondContact O-N 3.07Å; W277-I281 VanDerWaalsContact O-N 3.09Å; I281-N283 VanDerWaalsContact C-N 3.3Å; I281-N283 PolarHBondContact O-N 2.91Å; I281-V284 PolarHBondContact O-N 3.26Å
282	S	40.1	Very low	41.5	Very low	52 Å²	52	121.8 Å²	121.8	36%	0.364	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75	-13.2	179.3	73.2	0	0	0	0	114.8	S278 V284	S278-S282 WeakPolarHBondContact O-CB 3.19Å; S278-S282 PolarHBondContact O-N 3.16Å; S278-S282 PolarHBondContact O-OG 2.88Å; S282-V284 VanDerWaalsContact C-N 3.34Å
283	N	44	Very low	42.2	Very low	140 Å²	140	122.4 Å²	122.4	75%	0.749	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	0.6	178.8	-98.8	-8.5	0	0	0	113.7	N279 I281	N279-N283 WeakPolarHBondContact O-CB 3.46Å; I281-N283 VanDerWaalsContact C-N 3.3Å; I281-N283 PolarHBondContact O-N 2.91Å
284	V	46.3	Very low	43	Very low	118 Å²	118	126.4 Å²	126.4	72%	0.715	66%	0.664	S	S	*	*	S	Bend	trans	-103.5	-10.1	176.9	-177.7	0	0	0	0	112.1	I281 S282	I281-V284 PolarHBondContact O-N 3.26Å; S282-V284 VanDerWaalsContact C-N 3.34Å
285	D	41.8	Very low	43.9	Very low	111 Å²	111	126.7 Å²	126.7	59%	0.594	67%	0.666	S	S	*	*			trans	-111.2	21	-163	-85	-16.4	0	0	0	116.5
286	N	45.6	Very low	44.9	Very low	130 Å²	130	119.7 Å²	119.7	70%	0.695	65%	0.646	S	S	*	*	S	Bend	trans	-101	6.1	-177.4	-78.4	-16.7	0	0	0	116.5
287	H	49.9	Very low	45.4	Very low	183 Å²	183	119.2 Å²	119.2	85%	0.847	64%	0.64	S	S	*	*	S	Bend	trans	-142.9	17.4	-175	-78.4	-49.3	0	0	0	118
288	L	43.4	Very low	46.4	Very low	173 Å²	173	117.4 Å²	117.4	91%	0.906	64%	0.64	S	S	*	*			trans	-130.8	95.7	175.1	-80.6	158.2	0	0	0	110.9
289	E	42.5	Very low	47	Very low	184 Å²	184	117.1 Å²	117.1	86%	0.86	63%	0.632	S	S	*	*			trans	-65.8	144.6	160.4	-68.7	177.8	154.3	0	0	109.9
290	D	46	Very low	47.4	Very low	148 Å²	148	115.6 Å²	115.6	79%	0.791	63%	0.629	S	S	*	*	S	Bend	trans	72.2	118.7	163.1	-77.9	-18.5	0	0	0	121.6
291	D	44.7	Very low	47.7	Very low	156 Å²	156	110.3 Å²	110.3	83%	0.834	61%	0.607	S	S	*	*			trans	61.2	73	142.1	-73.3	-14	0	0	0	120.6
292	S	47.7	Very low	48.2	Very low	89 Å²	89	109.9 Å²	109.9	62%	0.622	60%	0.604	S	S	*	*			trans	-158.4	93	140.5	53.9	0	0	0	0	113	D294	S292-D294 PolarHBondContact O-N 2.9Å
293	T	50.9	Low	49	Very low	138 Å²	138	108.3 Å²	108.3	85%	0.847	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	76.3	172	51	0	0	0	0	110.7
294	D	54.7	Low	49.7	Very low	120 Å²	120	104 Å²	104	64%	0.642	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-174.2	8	161.4	-101.4	-22.1	0	0	0	117.4	S292 P296	S292-D294 PolarHBondContact O-N 2.9Å; D294-P296 WeakPolarHBondContact O-CD 3.47Å
295	D	53	Low	50.4	Low	115 Å²	115	99 Å²	99	62%	0.615	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-64.9	125.2	-174.4	-85	-16.7	0	0	0	113.4
296	P	55.8	Low	51.5	Low	54 Å²	54	95.1 Å²	95.1	35%	0.351	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-74.2	132.2	179.7	28.6	-32.9	0	0	0	111.6	K253 I254 D294 L298	K253-P296 HydrophobicContact CB-CB 4.11Å; K253-P296 HydrophobicContact CD-CG 4.33Å; I254-P296 CarbonylContact O-C 3.33Å; I254-P296 WeakPolarHBondContact O-CA 3.41Å; I254-P296 WeakPolarHBondContact O-CB 3.5Å; D294-P296 WeakPolarHBondContact O-CD 3.47Å; P296-L298 PolarHBondContact O-N 3.48Å
297	V	50.7	Low	52.3	Low	62 Å²	62	89 Å²	89	38%	0.376	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	117.8	170.3	179	0	0	0	0	109.2	K253 I254 V259	K253-V297 CarbonylContact C-O 3.52Å; I254-V297 PolarHBondContact N-O 3.46Å; I254-V297 PolarHBondContact O-N 3.4Å; V259-V297 HydrophobicContact CG2-CB 4.35Å; V259-V297 HydrophobicContact CG2-CG2 3.96Å
298	L	53.3	Low	53	Low	93 Å²	93	81.5 Å²	81.5	49%	0.487	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	111.2	174.5	-170.6	79	0	0	0	109.6	I252 K253 P296	I252-L298 CarbonylContact O-C 3.53Å; I252-L298 WeakPolarHBondContact O-CA 3.25Å; K253-L298 HydrophobicContact CD-CD1 4.41Å; K253-L298 HydrophobicContact CG-CD1 3.48Å; K253-L298 VanDerWaalsContact CG-CD1 3.48Å; P296-L298 PolarHBondContact O-N 3.48Å
299	I	50.6	Low	54	Low	66 Å²	66	73.6 Å²	73.6	34%	0.338	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	115	166	-56.4	-171.3	0	0	0	107.5	F113 S251 I252 I254	F113-I299 HydrophobicContact CE2-CG2 4.13Å; S251-I299 CarbonylContact C-O 3.57Å; S251-I299 WeakPolarHBondContact CA-O 3.31Å; I252-I299 HydrophobicContact CB-CB 4.48Å; I252-I299 PolarHBondContact N-O 3.21Å; I252-I299 PolarHBondContact O-N 3.43Å; I254-I299 HydrophobicContact CD1-CD1 3.4Å; I254-I299 HydrophobicContact CD1-CG1 4.05Å; I254-I299 HydrophobicContact CG1-CD1 4.38Å
300	S	50.1	Low	55.2	Low	64 Å²	64	67.8 Å²	67.8	45%	0.448	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	145.3	171.4	62.3	0	0	0	0	111.8	I250	I250-S300 CarbonylContact O-C 3.58Å; I250-S300 WeakPolarHBondContact O-CA 3.42Å
301	S	48.4	Very low	56.3	Low	29 Å²	29	62.2 Å²	62.2	20%	0.203	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	140.6	169.7	179.7	0	0	0	0	108.4	F113 Q249 I250	F113-S301 WeakPolarHBondContact CB-OG 2.79Å; Q249-S301 CarbonylContact C-O 3.53Å; Q249-S301 WeakPolarHBondContact CA-O 3.32Å; I250-S301 PolarHBondContact N-O 3Å; I250-S301 PolarHBondContact O-N 2.86Å
302	M	53.3	Low	57.7	Low	82 Å²	82	55.2 Å²	55.2	40%	0.404	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	124.4	-178.5	-171.7	173.8	173.1	0	0	109.1	S115 F161 Y247 C248	S115-M302 WeakPolarHBondContact CA-O 3.37Å; S115-M302 WeakPolarHBondContact CB-O 3.42Å; F161-M302 HydrophobicContact CE1-CE 4.39Å; F161-M302 HydrophobicContact CE2-CE 4.22Å; F161-M302 HydrophobicContact CZ-CE 3.54Å; Y247-M302 HydrophobicContact CD1-CE 3.29Å; Y247-M302 HydrophobicContact CE1-CE 4.01Å; Y247-M302 HydrophobicContact CG-CE 3.69Å; C248-M302 CarbonylContact O-C 3.55Å; C248-M302 WeakPolarHBondContact O-CA 3.35Å
303	G	55.8	Low	59.3	Low	20 Å²	20	51 Å²	51	21%	0.206	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	168.8	169.3	0	0	0	0	0	110.2	C248	C248-G303 PolarHBondContact N-O 3.04Å; C248-G303 PolarHBondContact O-N 2.91Å
304	Y	60	Low	60.8	Low	49 Å²	49	47.4 Å²	47.4	19%	0.192	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	149.8	170.1	62.6	-89.9	0	0	0	112.6	N116 I117 I118 R245 I246 Y247 D306	N116-Y304 PolarHBondContact O-N 3.27Å; I117-Y304 HydrophobicContact CB-CE2 4.23Å; I117-Y304 HydrophobicContact CD1-CE1 4.3Å; I117-Y304 HydrophobicContact CD1-CE2 4.31Å; I117-Y304 WeakPolarHBondContact CD1-OH 3.49Å; I117-Y304 HydrophobicContact CG1-CE1 3.78Å; I117-Y304 HydrophobicContact CG1-CE2 3.92Å; I117-Y304 VanDerWaalsContact CG1-CZ 3.41Å; I117-Y304 WeakPolarHBondContact CG1-OH 3.38Å; I117-Y304 HydrophobicContact CG2-CD2 4.18Å; I117-Y304 HydrophobicContact CG2-CE2 3.56Å; I118-Y304 PolarHBondContact N-O 2.97Å; I118-Y304 VanDerWaalsContact N-O 3.12Å; R245-Y304 HydrophobicContact CG-CD2 3.87Å; R245-Y304 HydrophobicContact CG-CG 4.15Å; I246-Y304 CarbonylContact O-C 3.52Å; I246-Y304 WeakPolarHBondContact O-CA 3.32Å; I246-Y304 WeakPolarHBondContact O-CB 3.45Å; Y247-Y304 HydrophobicContact CE1-CG 4.47Å; Y304-D306 WeakPolarHBondContact CD2-OD1 3.33Å; Y304-D306 WeakPolarHBondContact CE2-OD1 3.45Å
305	I	61	Low	62.1	Low	12 Å²	12	41.7 Å²	41.7	6%	0.062	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	117.2	175.2	-52.5	173.8	0	0	0	107.1	I118 M120 I130 R245 I246 L307	I118-I305 HydrophobicContact CB-CG1 4.38Å; I118-I305 HydrophobicContact CB-CG2 4.49Å; I118-I305 CarbonylContact O-C 3.47Å; I118-I305 VanDerWaalsContact O-CA 3.29Å; I118-I305 WeakPolarHBondContact O-CA 3.38Å; M120-I305 HydrophobicContact CE-CG2 4.09Å; M120-I305 HydrophobicContact CG-CG2 4.16Å; M120-I305 HydrophobicContact SD-CG2 4.03Å; I130-I305 HydrophobicContact CD1-CD1 4.49Å; I130-I305 HydrophobicContact CG2-CD1 4.16Å; R245-I305 WeakPolarHBondContact CA-O 3.12Å; I246-I305 HydrophobicContact CB-CB 4.22Å; I246-I305 PolarHBondContact N-O 2.8Å; I246-I305 PolarHBondContact O-N 3.18Å; I305-L307 HydrophobicContact CG2-CD2 4.03Å; I305-L307 HydrophobicContact CG2-CG 4.31Å
306	D	63.4	Low	63.2	Low	31 Å²	31	39.6 Å²	39.6	17%	0.166	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	113.8	169.7	-76.3	-17.9	0	0	0	108.7	I118 T119 M120 R245 Y304	I118-D306 PolarHBondContact O-N 3.33Å; T119-D306 WeakPolarHBondContact CA-O 3.4Å; T119-D306 HydrophobicContact CG2-CB 4.36Å; M120-D306 PolarHBondContact N-O 2.83Å; R245-D306 IonicContact CZ-OD1 3.31Å; R245-D306 IonicContact NE-OD1 3.5Å; R245-D306 PolarHBondContact NE-OD1 2.92Å; R245-D306 IonicContact NH2-OD1 2.94Å; R245-D306 PolarHBondContact NH2-OD1 3.43Å; R245-D306 IonicContact NH2-OD2 2.77Å; Y304-D306 WeakPolarHBondContact CD2-OD1 3.33Å; Y304-D306 WeakPolarHBondContact CE2-OD1 3.45Å
307	L	62.8	Low	63.9	Low	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	109.1	176.8	-66.3	175.6	0	0	0	110.4	M120 L122 I130 F241 K243 G244 I246 I305	M120-L307 HydrophobicContact CB-CD2 4.08Å; M120-L307 HydrophobicContact SD-CD2 4.12Å; L122-L307 HydrophobicContact CD1-CD2 4.25Å; I130-L307 HydrophobicContact CD1-CD2 4.28Å; F241-L307 HydrophobicContact CE1-CB 4.08Å; F241-L307 HydrophobicContact CE1-CD1 3.99Å; F241-L307 HydrophobicContact CZ-CD1 4.31Å; K243-L307 WeakPolarHBondContact CA-O 3.25Å; K243-L307 PolarHBondContact N-O 2.91Å; G244-L307 PolarHBondContact N-O 3.28Å; G244-L307 VanDerWaalsContact N-O 3.08Å; G244-L307 WeakPolarHBondContact O-CB 3.39Å; G244-L307 PolarHBondContact O-N 3.25Å; I246-L307 HydrophobicContact CD1-CD1 3.56Å; I246-L307 HydrophobicContact CD1-CG 4.37Å; I246-L307 HydrophobicContact CG1-CD1 3.94Å; I305-L307 HydrophobicContact CG2-CD2 4.03Å; I305-L307 HydrophobicContact CG2-CG 4.31Å
308	N	65.1	Low	64.7	Low	27 Å²	27	46.4 Å²	46.4	14%	0.144	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	105.1	173.7	-66.9	-36.9	0	0	0	109.9	T119 M120 N121 L122 Y310	T119-N308 WeakPolarHBondContact CG2-ND2 3.48Å; M120-N308 PolarHBondContact O-N 3.36Å; N121-N308 CarbonylContact C-O 3.52Å; N121-N308 WeakPolarHBondContact CA-O 3.16Å; N121-N308 VanDerWaalsContact OD1-CB 3.29Å; N121-N308 WeakPolarHBondContact OD1-CB 3.25Å; N121-N308 PolarHBondContact OD1-ND2 3.36Å; N121-N308 VanDerWaalsContact OD1-ND2 3.09Å; L122-N308 PolarHBondContact N-O 2.89Å; N308-Y310 HydrophobicContact CB-CE2 4.03Å
309	I	64.1	Low	65.5	Low	7 Å²	7	49.8 Å²	49.8	4%	0.036	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	116.3	-179.3	-46.7	-166.4	0	0	0	109.5	L122 F235 P237 F241 Y311 N362	L122-I309 CarbonylContact O-C 3.52Å; L122-I309 WeakPolarHBondContact O-CA 3.48Å; F235-I309 HydrophobicContact CE1-CD1 3.28Å; F235-I309 HydrophobicContact CZ-CD1 3.41Å; F235-I309 VanDerWaalsContact CZ-CD1 3.41Å; P237-I309 HydrophobicContact CB-CD1 3.77Å; P237-I309 HydrophobicContact CB-CG2 4.4Å; F241-I309 HydrophobicContact CD1-CD1 3.59Å; F241-I309 HydrophobicContact CD1-CG1 4.22Å; F241-I309 HydrophobicContact CE1-CD1 4.2Å; I309-Y311 HydrophobicContact CG2-CD1 4.46Å; I309-N362 PolarHBondContact O-ND2 2.88Å
310	Y	67.5	Low	66.6	Low	61 Å²	61	48.3 Å²	48.3	24%	0.239	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	134.6	177	-58	-79.7	0	0	0	110.3	N121 L122 L123 Y124 N308 N362	N121-Y310 HydrophobicContact CB-CD2 4.4Å; N121-Y310 HydrophobicContact CB-CE2 3.82Å; L122-Y310 PolarHBondContact O-N 2.89Å; L123-Y310 HydrophobicContact CD2-CG 4.37Å; L123-Y310 HydrophobicContact CG-CD2 4.43Å; Y124-Y310 PolarHBondContact N-O 2.83Å; N308-Y310 HydrophobicContact CB-CE2 4.03Å; Y310-N362 CarbonylContact C-O 3.55Å; Y310-N362 WeakPolarHBondContact CA-O 3.44Å; Y310-N362 WeakPolarHBondContact CB-O 3.29Å
311	Y	70.2	Confident	67.9	Low	31 Å²	31	48.2 Å²	48.2	12%	0.122	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	149.3	-179.4	53	-92	0	0	0	110.8	R239 I309 D360 N362 F452	R239-Y311 HydrophobicContact CB-CD2 4.33Å; R239-Y311 HydrophobicContact CB-CE1 4.3Å; R239-Y311 HydrophobicContact CB-CE2 4.09Å; R239-Y311 HydrophobicContact CG-CD2 4.32Å; R239-Y311 HydrophobicContact CG-CG 4.37Å; R239-Y311 WeakPolarHBondContact O-CE1 3.41Å; R239-Y311 PolarHBondContact O-OH 2.72Å; I309-Y311 HydrophobicContact CG2-CD1 4.46Å; Y311-D360 HydrophobicContact CE2-CB 3.97Å; Y311-D360 VanDerWaalsContact CE2-O 3.24Å; Y311-D360 WeakPolarHBondContact CE2-O 3.41Å; Y311-N362 HydrophobicContact CD1-CB 3.99Å; Y311-N362 HydrophobicContact CD2-CB 4.39Å; Y311-N362 HydrophobicContact CE1-CB 3.54Å; Y311-N362 HydrophobicContact CE2-CB 3.97Å; Y311-N362 HydrophobicContact CG-CB 4.39Å; Y311-N362 PolarHBondContact N-O 3.38Å; Y311-N362 CarbonylContact O-C 3.47Å; Y311-N362 PolarHBondContact O-N 2.95Å; Y311-F452 VanDerWaalsContact CA-CE1 3.5Å
312	G	73.3	Confident	69.5	Low	10 Å²	10	50.3 Å²	50.3	10%	0.103	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	165.9	-179.1	0	0	0	0	0	112.5	H314	G312-H314 PolarHBondContact O-N 3.45Å
313	P	81.5	Confident	71.2	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.006	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	132.1	178.1	25.7	-32	0	0	0	109.3	F361 A447 Q455	P313-F361 HydrophobicContact CB-CB 4.14Å; P313-F361 HydrophobicContact CB-CD1 4.39Å; P313-A447 HydrophobicContact CB-CB 3.6Å; P313-A447 HydrophobicContact CG-CB 4.22Å; P313-A447 WeakPolarHBondContact CG-O 3.45Å; P313-Q455 HydrophobicContact CG-CG 4.39Å; P313-Q455 WeakPolarHBondContact O-CG 3.3Å; P313-Q455 PolarHBondContact O-NE2 3.49Å; P313-Q455 PolarHBondContact O-OE1 3.35Å
314	H	81.7	Confident	72.6	Confident	61 Å²	61	50.3 Å²	50.3	28%	0.282	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	124	161.6	174.5	84.9	0	0	0	109.5	R239 G312 T359 D360	R239-H314 PolarHBondContact NH1-CD2 2.78Å; R239-H314 PolarHBondContact NH1-ND1 3.45Å; G312-H314 PolarHBondContact O-N 3.45Å; H314-T359 PolarHBondContact N-OG1 2.87Å; H314-T359 WeakPolarHBondContact O-CA 3.15Å; H314-T359 WeakPolarHBondContact O-CB 3.49Å; H314-T359 PolarHBondContact O-OG1 3.16Å; H314-D360 VanDerWaalsContact CB-OD1 3.31Å; H314-D360 WeakPolarHBondContact CB-OD1 2.93Å; H314-D360 PolarHBondContact N-O 3.38Å; H314-D360 PolarHBondContact O-N 3.12Å
315	I	82	Confident	73.9	Confident	1 Å²	1	48 Å²	48	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	119.4	-180	-62.7	169.9	0	0	0	108.1	Q358 A447 Q455 A457	I315-Q358 WeakPolarHBondContact CA-O 3.34Å; I315-A447 HydrophobicContact CD1-CB 4.03Å; I315-A447 HydrophobicContact CG1-CB 3.92Å; I315-Q455 HydrophobicContact CD1-CB 3.86Å; I315-Q455 WeakPolarHBondContact CD1-O 3.47Å; I315-Q455 HydrophobicContact CG1-CB 4.09Å; I315-A457 HydrophobicContact CD1-CB 4.06Å; I315-A457 HydrophobicContact CG2-CB 3.83Å
316	D	75.9	Confident	75	Confident	71 Å²	71	50.1 Å²	50.1	38%	0.38	23%	0.232	S	C	.	.	S	Bend	trans	-63.3	136.8	172.4	-69.2	-32.3	0	0	0	109.6	Q358	D316-Q358 HydrophobicContact CB-CB 4.36Å; D316-Q358 PolarHBondContact N-O 3.4Å
317	N	71.7	Confident	75.7	Confident	115 Å²	115	49.7 Å²	49.7	62%	0.615	23%	0.231	S	C	*	.	S	Bend	trans	53	66.6	-173.1	-59.9	-25.8	0	0	0	111.5	E319 R459	N317-E319 PolarHBondContact O-N 2.82Å; N317-R459 PolarHBondContact O-NH1 2.88Å; N317-R459 PolarHBondContact O-NH2 2.95Å
318	R	67.7	Low	76.1	Confident	143 Å²	143	50 Å²	50	54%	0.54	23%	0.234	S	C	.	.			trans	-55.8	-27.7	172.5	-102.6	-175.2	174.1	-157.5	-6.4	112.9	Q455	R318-Q455 VanDerWaalsContact NH2-OE1 3.09Å
319	E	69.4	Low	76.4	Confident	165 Å²	165	53.7 Å²	53.7	77%	0.771	26%	0.261	S	S	*	.	S	Bend	trans	-57	151.8	175.8	-64.7	-178.6	-173.6	0	0	112	N317 Q321 R459	N317-E319 PolarHBondContact O-N 2.82Å; E319-Q321 PolarHBondContact O-N 3.34Å; E319-R459 PolarHBondContact O-NH1 3.48Å; E319-R459 VanDerWaalsContact O-NH1 3.16Å
320	N	73.4	Confident	76.6	Confident	35 Å²	35	56.2 Å²	56.2	19%	0.187	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-58	118.2	176.1	-66.3	-28.9	0	0	0	109.5	F322 D412 N458 F460	N320-F322 HydrophobicContact CB-CE2 3.8Å; N320-F322 HydrophobicContact CB-CZ 3.76Å; N320-F322 WeakPolarHBondContact O-CD2 3.3Å; N320-F322 WeakPolarHBondContact O-CE2 3.42Å; N320-D412 PolarHBondContact ND2-OD2 3.27Å; N320-N458 WeakPolarHBondContact OD1-CB 3.33Å; N320-F460 HydrophobicContact CB-CD2 4.04Å; N320-F460 HydrophobicContact CB-CE2 3.61Å
321	Q	78.8	Confident	76.5	Confident	62 Å²	62	55.7 Å²	55.7	29%	0.29	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	135.6	172.8	-60.2	-179.2	-17.1	0	0	109.9	E319 N458 R459 F460	E319-Q321 PolarHBondContact O-N 3.34Å; Q321-N458 PolarHBondContact N-O 2.82Å; Q321-R459 VanDerWaalsContact OE1-CD 3.25Å; Q321-R459 VanDerWaalsContact OE1-NE 3.08Å; Q321-F460 PolarHBondContact O-N 3.02Å
322	F	82.1	Confident	76	Confident	73 Å²	73	56.6 Å²	56.6	32%	0.32	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	127.3	-178.8	-59.5	-81.9	0	0	0	110.5	N320 M411 F460 I462 Y492	N320-F322 HydrophobicContact CB-CE2 3.8Å; N320-F322 HydrophobicContact CB-CZ 3.76Å; N320-F322 WeakPolarHBondContact O-CD2 3.3Å; N320-F322 WeakPolarHBondContact O-CE2 3.42Å; F322-M411 HydrophobicContact CE1-CE 3.71Å; F322-F460 CarbonylContact C-O 3.57Å; F322-F460 WeakPolarHBondContact CA-O 3.11Å; F322-F460 HydrophobicContact CD1-CB 3.63Å; F322-F460 HydrophobicContact CD1-CD2 4.03Å; F322-F460 HydrophobicContact CD1-CG 4.02Å; F322-F460 HydrophobicContact CE1-CB 3.97Å; F322-F460 AromaticContact CE1-CD2 3.67Å; F322-F460 HydrophobicContact CE1-CD2 3.67Å; F322-F460 HydrophobicContact CE1-CE2 4.33Å; F322-F460 AromaticContact CE1-CG 3.84Å; F322-F460 HydrophobicContact CE1-CG 3.84Å; F322-F460 HydrophobicContact CZ-CD2 4.22Å; F322-I462 HydrophobicContact CD1-CD1 3.39Å; F322-I462 HydrophobicContact CD1-CG1 4.24Å; F322-I462 HydrophobicContact CE1-CD1 3.91Å; F322-I462 HydrophobicContact CG-CD1 4.37Å; F322-Y492 HydrophobicContact CB-CE1 4.37Å; F322-Y492 HydrophobicContact CD1-CE1 4.05Å; F322-Y492 HydrophobicContact CD2-CE1 4.48Å; F322-Y492 HydrophobicContact CE1-CE1 4.47Å; F322-Y492 WeakPolarHBondContact CE1-OH 3.33Å; F322-Y492 HydrophobicContact CG-CE1 4.04Å; F322-Y492 WeakPolarHBondContact CZ-OH 2.97Å
323	Y	87.7	Confident	75.4	Confident	62 Å²	62	65.2 Å²	65.2	24%	0.243	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	120.3	170.8	-173.5	-84.8	0	0	0	108.9	L325 T350 I353 F460 I461 I462	Y323-L325 HydrophobicContact CD1-CD2 4.34Å; Y323-L325 HydrophobicContact CD1-CG 4.39Å; Y323-L325 HydrophobicContact CE1-CD2 3.8Å; Y323-L325 HydrophobicContact CE1-CG 4.33Å; Y323-T350 VanDerWaalsContact OH-CB 3.31Å; Y323-T350 WeakPolarHBondContact OH-CB 3.3Å; Y323-T350 VanDerWaalsContact OH-CG2 3.31Å; Y323-T350 WeakPolarHBondContact OH-CG2 2.98Å; Y323-T350 PolarHBondContact OH-OG1 2.53Å; Y323-I353 HydrophobicContact CD1-CD1 4.5Å; Y323-I353 HydrophobicContact CD1-CG1 4.45Å; Y323-I353 HydrophobicContact CD1-CG2 3.8Å; Y323-I353 HydrophobicContact CD2-CG2 4.16Å; Y323-I353 HydrophobicContact CE1-CB 4.37Å; Y323-I353 HydrophobicContact CE1-CD1 4.14Å; Y323-I353 HydrophobicContact CE1-CG1 3.81Å; Y323-I353 HydrophobicContact CE1-CG2 3.82Å; Y323-I353 HydrophobicContact CE2-CG2 4.17Å; Y323-I353 HydrophobicContact CG-CG2 3.96Å; Y323-F460 PolarHBondContact N-O 3.49Å; Y323-I461 HydrophobicContact CD1-CG2 4.25Å; Y323-I461 CarbonylContact O-C 3.59Å; Y323-I461 WeakPolarHBondContact O-CA 2.92Å; Y323-I462 PolarHBondContact O-N 3.24Å
324	I	86.4	Confident	74.2	Confident	39 Å²	39	74.8 Å²	74.8	20%	0.2	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	123.7	-173.1	-60.6	161.3	0	0	0	109.9	Y326 I462 A464 Y492 P493	I324-Y326 HydrophobicContact CB-CD2 4.48Å; I324-Y326 HydrophobicContact CB-CE2 3.8Å; I324-Y326 HydrophobicContact CG2-CD2 4.04Å; I324-Y326 HydrophobicContact CG2-CE1 4.41Å; I324-Y326 HydrophobicContact CG2-CE2 3.54Å; I324-Y326 WeakPolarHBondContact O-CD2 3.09Å; I324-I462 CarbonylContact C-O 3.38Å; I324-I462 WeakPolarHBondContact CA-O 2.89Å; I324-A464 HydrophobicContact CG2-CB 3.56Å; I324-Y492 HydrophobicContact CD1-CD1 4.39Å; I324-Y492 HydrophobicContact CG1-CD1 4.44Å; I324-P493 HydrophobicContact CD1-CB 4.06Å
325	L	86.5	Confident	73	Confident	0 Å²	0	76 Å²	76	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	109.3	176.3	-76.7	175.8	0	0	0	111.2	Y323 Y348 I353 L391 L394 W441 I461 I462 A464	Y323-L325 HydrophobicContact CD1-CD2 4.34Å; Y323-L325 HydrophobicContact CD1-CG 4.39Å; Y323-L325 HydrophobicContact CE1-CD2 3.8Å; Y323-L325 HydrophobicContact CE1-CG 4.33Å; L325-Y348 HydrophobicContact CB-CD1 3.86Å; L325-Y348 HydrophobicContact CB-CE1 3.93Å; L325-I353 HydrophobicContact CD1-CD1 4.32Å; L325-I353 HydrophobicContact CD2-CD1 3.81Å; L325-I353 HydrophobicContact CD2-CG1 4.48Å; L325-I353 HydrophobicContact CG-CD1 4.44Å; L325-L391 HydrophobicContact CD1-CD1 4.25Å; L325-L391 HydrophobicContact CD2-CD1 4.26Å; L325-L394 HydrophobicContact CD1-CD2 3.6Å; L325-W441 HydrophobicContact CD1-CH2 4.39Å; L325-W441 HydrophobicContact CD1-CZ3 3.79Å; L325-I461 HydrophobicContact CD1-CG2 3.39Å; L325-I461 HydrophobicContact CG-CG2 3.68Å; L325-I462 PolarHBondContact N-O 3.19Å; L325-A464 WeakPolarHBondContact O-CB 3.12Å; L325-A464 PolarHBondContact O-N 3.09Å
326	Y	83.3	Confident	71.8	Confident	57 Å²	57	81.7 Å²	81.7	22%	0.224	40%	0.401	C	S	.	.			trans	-87.8	123	-179.4	-68.9	-99.1	0	0	0	111.4	I324 Y348 I349 A464 P493 L578 M579	I324-Y326 HydrophobicContact CB-CD2 4.48Å; I324-Y326 HydrophobicContact CB-CE2 3.8Å; I324-Y326 HydrophobicContact CG2-CD2 4.04Å; I324-Y326 HydrophobicContact CG2-CE1 4.41Å; I324-Y326 HydrophobicContact CG2-CE2 3.54Å; I324-Y326 WeakPolarHBondContact O-CD2 3.09Å; Y326-Y348 WeakPolarHBondContact O-CA 3.23Å; Y326-Y348 VanDerWaalsContact O-CD1 3.3Å; Y326-Y348 WeakPolarHBondContact O-CD1 3.25Å; Y326-I349 HydrophobicContact CG-CD1 4.34Å; Y326-A464 HydrophobicContact CD1-CB 4.4Å; Y326-P493 HydrophobicContact CE1-CB 4.47Å; Y326-P493 HydrophobicContact CE1-CG 3.98Å; Y326-P493 WeakPolarHBondContact OH-CB 3.43Å; Y326-L578 HydrophobicContact CE1-CB 4.33Å; Y326-L578 HydrophobicContact CE1-CD1 3.74Å; Y326-M579 HydrophobicContact CD1-CE 3.13Å; Y326-M579 HydrophobicContact CE1-CE 3.5Å; Y326-M579 VanDerWaalsContact CE1-CE 3.5Å; Y326-M579 HydrophobicContact CG-CE 4.11Å
327	P	78	Confident	70.6	Confident	23 Å²	23	86.7 Å²	86.7	15%	0.149	42%	0.424	C	S	.	.	B	Isolated β-bridge	trans	-69.8	143.4	171.2	30.3	-33.4	0	0	0	110.2	S329 I330 L347 Y348 M579	P327-S329 PolarHBondContact O-N 2.8Å; P327-I330 HydrophobicContact CG-CD1 3.7Å; P327-I330 HydrophobicContact CG-CG1 4.39Å; P327-I330 PolarHBondContact O-N 2.93Å; P327-L347 CarbonylContact C-O 3.51Å; P327-L347 WeakPolarHBondContact CA-O 3.46Å; P327-Y348 HydrophobicContact CB-CE1 4.44Å; P327-M579 HydrophobicContact CG-SD 4.13Å
328	C	72.8	Confident	69.9	Low	7 Å²	7	86 Å²	86	5%	0.047	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-67.7	-13.7	-178.4	-87.2	0	0	0	0	114.6	I330 F331 C339 L347	C328-I330 PolarHBondContact O-N 2.74Å; C328-I330 VanDerWaalsContact O-N 3.09Å; C328-F331 PolarHBondContact O-N 2.8Å; C328-C339 HydrophobicContact CB-CB 3.81Å; C328-C339 WeakPolarHBondContact CB-SG 3.24Å; C328-C339 WeakPolarHBondContact SG-CB 3.33Å; C328-C339 CovalentContact SG-SG 2.02Å; C328-C339 PolarHBondContact SG-SG 2.66Å; C328-L347 HydrophobicContact CB-CB 3.38Å; C328-L347 VanDerWaalsContact CB-O 3.27Å; C328-L347 WeakPolarHBondContact CB-O 3.4Å; C328-L347 PolarHBondContact N-O 2.02Å; C328-L347 VanDerWaalsContact SG-C 3.59Å
329	S	70.7	Confident	69.5	Low	104 Å²	104	79.7 Å²	79.7	73%	0.727	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-57.4	-22	176.7	49.3	0	0	0	0	113.2	P327	P327-S329 PolarHBondContact O-N 2.8Å
330	I	67.9	Low	68.8	Low	59 Å²	59	79.5 Å²	79.5	30%	0.303	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-86.1	-20.6	-172.7	-61.8	167.9	0	0	0	111.8	P327 C328 L578 M579	P327-I330 HydrophobicContact CG-CD1 3.7Å; P327-I330 HydrophobicContact CG-CG1 4.39Å; P327-I330 PolarHBondContact O-N 2.93Å; C328-I330 PolarHBondContact O-N 2.74Å; C328-I330 VanDerWaalsContact O-N 3.09Å; I330-L578 VanDerWaalsContact CG2-O 3.3Å; I330-L578 WeakPolarHBondContact CG2-O 3.22Å; I330-M579 HydrophobicContact CD1-CB 4.45Å; I330-M579 HydrophobicContact CD1-CE 3.06Å; I330-M579 HydrophobicContact CD1-CG 4.28Å; I330-M579 HydrophobicContact CD1-SD 3.02Å; I330-M579 WeakPolarHBondContact CD1-SD 3.3Å; I330-M579 HydrophobicContact CG1-CE 4.49Å; I330-M579 HydrophobicContact CG1-SD 4.43Å
331	F	65.9	Low	67.6	Low	51 Å²	51	83.7 Å²	83.7	22%	0.224	42%	0.417	C	S	.	.	S	Bend	trans	-88.7	120.9	-177.8	-66.6	-75.5	0	0	0	109.8	C328 L335 I349	C328-F331 PolarHBondContact O-N 2.8Å; F331-L335 HydrophobicContact CB-CB 3.69Å; F331-L335 HydrophobicContact CD1-CB 4.09Å; F331-L335 HydrophobicContact CD1-CD1 3.81Å; F331-L335 HydrophobicContact CG-CB 4.24Å; F331-I349 HydrophobicContact CD2-CD1 3.97Å; F331-I349 HydrophobicContact CD2-CG1 4Å; F331-I349 HydrophobicContact CE1-CD1 4.1Å; F331-I349 HydrophobicContact CE2-CD1 3.07Å; F331-I349 HydrophobicContact CE2-CG1 3.51Å; F331-I349 HydrophobicContact CZ-CD1 3.14Å; F331-I349 HydrophobicContact CZ-CG1 4.08Å
332	G	59.8	Low	66.1	Low	50 Å²	50	89.7 Å²	89.7	52%	0.515	44%	0.442	S	S	.	.			trans	-53.5	160.7	175.5	0	0	0	0	0	111.9	K334 L335 K336	G332-K334 PolarHBondContact O-N 3.22Å; G332-L335 PolarHBondContact O-N 3.3Å; G332-K336 PolarHBondContact O-N 3.48Å
333	K	60	Low	64.3	Low	191 Å²	191	91.1 Å²	91.1	83%	0.83	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.2	-32.5	-172.3	-72	-176.7	179	178.6	0	115
334	K	57.5	Low	62.6	Low	202 Å²	202	91.8 Å²	91.8	88%	0.878	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-33.8	177.6	-78.7	-175.4	174.9	-179.7	0	114.4	G332	G332-K334 PolarHBondContact O-N 3.22Å
335	L	56.6	Low	60.9	Low	85 Å²	85	98.5 Å²	98.5	45%	0.445	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-92.3	-8.5	-178.8	-74.6	166.4	0	0	0	112.5	F331 G332 M337 L338	F331-L335 HydrophobicContact CB-CB 3.69Å; F331-L335 HydrophobicContact CD1-CB 4.09Å; F331-L335 HydrophobicContact CD1-CD1 3.81Å; F331-L335 HydrophobicContact CG-CB 4.24Å; G332-L335 PolarHBondContact O-N 3.3Å; L335-M337 PolarHBondContact O-N 2.86Å; L335-L338 HydrophobicContact CD2-CD1 3.72Å; L335-L338 WeakPolarHBondContact O-CB 3.39Å; L335-L338 PolarHBondContact O-N 3.15Å
336	K	56.2	Low	59.6	Low	121 Å²	121	104.2 Å²	104.2	53%	0.526	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	-56.3	-19.3	168.2	-70.9	-168.8	176.1	-168.7	0	113.3	G332 L338 C339	G332-K336 PolarHBondContact O-N 3.48Å; K336-L338 PolarHBondContact O-N 2.73Å; K336-C339 VanDerWaalsContact O-CB 3.3Å; K336-C339 WeakPolarHBondContact O-CB 3.14Å; K336-C339 PolarHBondContact O-N 3.32Å
337	M	50	Low	58.4	Low	177 Å²	177	105 Å²	105	87%	0.872	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-67.2	-21	175.2	-147.2	179.6	87	0	0	113	L335 C339	L335-M337 PolarHBondContact O-N 2.86Å; M337-C339 VanDerWaalsContact C-N 3.33Å
338	L	56.4	Low	57.9	Low	99 Å²	99	104.4 Å²	104.4	52%	0.518	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-85.3	-7.8	172.9	-68.4	163.7	0	0	0	112.7	L335 K336 W340	L335-L338 HydrophobicContact CD2-CD1 3.72Å; L335-L338 WeakPolarHBondContact O-CB 3.39Å; L335-L338 PolarHBondContact O-N 3.15Å; K336-L338 PolarHBondContact O-N 2.73Å; L338-W340 PolarHBondContact O-N 3.16Å
339	C	60	Low	57.3	Low	11 Å²	11	106.6 Å²	106.6	7%	0.074	55%	0.546	C	S	.	.	S	Bend	trans	-89.2	106.3	177	-66.1	0	0	0	0	108.8	C328 K336 M337 L347	C328-C339 HydrophobicContact CB-CB 3.81Å; C328-C339 WeakPolarHBondContact CB-SG 3.24Å; C328-C339 WeakPolarHBondContact SG-CB 3.33Å; C328-C339 CovalentContact SG-SG 2.02Å; C328-C339 PolarHBondContact SG-SG 2.66Å; K336-C339 VanDerWaalsContact O-CB 3.3Å; K336-C339 WeakPolarHBondContact O-CB 3.14Å; K336-C339 PolarHBondContact O-N 3.32Å; M337-C339 VanDerWaalsContact C-N 3.33Å; C339-L347 HydrophobicContact CB-CB 4.44Å
340	W	55.9	Low	57.2	Low	161 Å²	161	103.7 Å²	103.7	61%	0.61	52%	0.524	S	S	*	.			trans	-75.3	131.2	-174.7	-69.6	70.9	0	0	0	111	L338 K342 L347 Q351	L338-W340 PolarHBondContact O-N 3.16Å; W340-K342 PolarHBondContact O-N 3.4Å; W340-L347 WeakPolarHBondContact O-CD2 3.26Å; W340-Q351 HydrophobicContact CB-CG 4.33Å; W340-Q351 HydrophobicContact CG-CG 4.21Å; W340-Q351 VanDerWaalsContact CG-NE2 3.27Å
341	T	46.8	Very low	57.2	Low	124 Å²	124	105.4 Å²	105.4	76%	0.761	53%	0.531	S	S	*	.			trans	-82.3	97.8	-178	42.9	0	0	0	0	110.5
342	K	48.1	Very low	57.9	Low	188 Å²	188	109.8 Å²	109.8	82%	0.817	55%	0.552	S	S	*	*			trans	-173.7	125.7	143.6	-105.1	161.2	-176.1	-175.2	0	112.7	W340	W340-K342 PolarHBondContact O-N 3.4Å
343	S	44.5	Very low	59.2	Low	103 Å²	103	107.4 Å²	107.4	72%	0.72	53%	0.527	S	S	*	.	S	Bend	trans	106.3	-7	141.5	-154.6	0	0	0	0	122
344	T	51.1	Low	60.6	Low	76 Å²	76	101 Å²	101	47%	0.466	50%	0.504	S	S	.	.	S	Bend	trans	-153	150.9	165.9	53.8	0	0	0	0	110.9	K346 Q395	T344-K346 PolarHBondContact O-N 2.93Å; T344-Q395 PolarHBondContact OG1-OE1 3.5Å; T344-Q395 VanDerWaalsContact OG1-OE1 3.09Å
345	D	51.7	Low	62.2	Low	179 Å²	179	91.8 Å²	91.8	96%	0.957	46%	0.464	S	S	*	.	S	Bend	trans	-59.9	-3.5	-177.3	-73.1	-38	0	0	0	114.8
346	K	57.4	Low	63.8	Low	121 Å²	121	91.6 Å²	91.6	53%	0.526	46%	0.461	S	S	.	.	S	Bend	trans	-112.1	87.2	175.9	-61.9	-176.4	-179.2	-176.8	0	109	T344 Y348	T344-K346 PolarHBondContact O-N 2.93Å; K346-Y348 HydrophobicContact CB-CE2 3.81Å; K346-Y348 WeakPolarHBondContact O-CD2 3.24Å; K346-Y348 VanDerWaalsContact O-CE2 3.23Å; K346-Y348 WeakPolarHBondContact O-CE2 3.32Å
347	L	59.3	Low	65.4	Low	72 Å²	72	85.9 Å²	85.9	38%	0.377	44%	0.436	S	S	.	.			trans	-66.4	140.7	171.2	-71.5	161.8	0	0	0	109.7	P327 C328 C339 W340	P327-L347 CarbonylContact C-O 3.51Å; P327-L347 WeakPolarHBondContact CA-O 3.46Å; C328-L347 HydrophobicContact CB-CB 3.38Å; C328-L347 VanDerWaalsContact CB-O 3.27Å; C328-L347 WeakPolarHBondContact CB-O 3.4Å; C328-L347 PolarHBondContact N-O 2.02Å; C328-L347 VanDerWaalsContact SG-C 3.59Å; C339-L347 HydrophobicContact CB-CB 4.44Å; W340-L347 WeakPolarHBondContact O-CD2 3.26Å
348	Y	66.3	Low	67.1	Low	12 Å²	12	82.1 Å²	82.1	5%	0.047	42%	0.417	C	S	.	.	B	Isolated β-bridge	trans	-127.8	158.1	173.4	-65.5	-96.4	0	0	0	110.6	L325 Y326 P327 K346 L391 Q463	L325-Y348 HydrophobicContact CB-CD1 3.86Å; L325-Y348 HydrophobicContact CB-CE1 3.93Å; Y326-Y348 WeakPolarHBondContact O-CA 3.23Å; Y326-Y348 VanDerWaalsContact O-CD1 3.3Å; Y326-Y348 WeakPolarHBondContact O-CD1 3.25Å; P327-Y348 HydrophobicContact CB-CE1 4.44Å; K346-Y348 HydrophobicContact CB-CE2 3.81Å; K346-Y348 WeakPolarHBondContact O-CD2 3.24Å; K346-Y348 VanDerWaalsContact O-CE2 3.23Å; K346-Y348 WeakPolarHBondContact O-CE2 3.32Å; Y348-L391 HydrophobicContact CD2-CD1 4.18Å; Y348-L391 HydrophobicContact CD2-CD2 3.76Å; Y348-L391 HydrophobicContact CG-CD1 4.33Å; Y348-L391 HydrophobicContact CG-CD2 4.12Å; Y348-Q463 HydrophobicContact CE1-CG 4.26Å; Y348-Q463 PolarHBondContact OH-OE1 3.48Å
349	I	61.9	Low	68.3	Low	53 Å²	53	78.8 Å²	78.8	27%	0.272	40%	0.4	S	S	.	.	S	Bend	trans	-71.8	-34.4	-175.5	-47.5	171.8	0	0	0	112.3	Y326 F331	Y326-I349 HydrophobicContact CG-CD1 4.34Å; F331-I349 HydrophobicContact CD2-CD1 3.97Å; F331-I349 HydrophobicContact CD2-CG1 4Å; F331-I349 HydrophobicContact CE1-CD1 4.1Å; F331-I349 HydrophobicContact CE2-CD1 3.07Å; F331-I349 HydrophobicContact CE2-CG1 3.51Å; F331-I349 HydrophobicContact CZ-CD1 3.14Å; F331-I349 HydrophobicContact CZ-CG1 4.08Å
350	T	68	Low	69.1	Low	42 Å²	42	80.3 Å²	80.3	26%	0.258	41%	0.408	S	S	.	.			trans	-106.8	129.4	-170.6	55.1	0	0	0	0	111.1	Y323	Y323-T350 VanDerWaalsContact OH-CB 3.31Å; Y323-T350 WeakPolarHBondContact OH-CB 3.3Å; Y323-T350 VanDerWaalsContact OH-CG2 3.31Å; Y323-T350 WeakPolarHBondContact OH-CG2 2.98Å; Y323-T350 PolarHBondContact OH-OG1 2.53Å
351	Q	67.7	Low	70.2	Confident	96 Å²	96	75 Å²	75	45%	0.449	39%	0.389	S	S	.	.	S	Bend	trans	-90.1	-34.4	176	-69.8	-171.7	-40.7	0	0	112.1	W340 T390 L391	W340-Q351 HydrophobicContact CB-CG 4.33Å; W340-Q351 HydrophobicContact CG-CG 4.21Å; W340-Q351 VanDerWaalsContact CG-NE2 3.27Å; Q351-T390 CarbonylContact O-C 3.57Å; Q351-T390 VanDerWaalsContact O-CA 3.3Å; Q351-T390 WeakPolarHBondContact O-CA 3.28Å; Q351-L391 PolarHBondContact O-N 2.94Å
352	E	81.2	Confident	71.3	Confident	143 Å²	143	69.8 Å²	69.8	67%	0.668	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.9	129.1	-177.9	-65.3	-175.2	172.4	0	0	110.4
353	I	86.8	Confident	72.4	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	122.9	178.7	-53	169.1	0	0	0	107	Y323 L325 L355 Q388 L389 L394 I461	Y323-I353 HydrophobicContact CD1-CD1 4.5Å; Y323-I353 HydrophobicContact CD1-CG1 4.45Å; Y323-I353 HydrophobicContact CD1-CG2 3.8Å; Y323-I353 HydrophobicContact CD2-CG2 4.16Å; Y323-I353 HydrophobicContact CE1-CB 4.37Å; Y323-I353 HydrophobicContact CE1-CD1 4.14Å; Y323-I353 HydrophobicContact CE1-CG1 3.81Å; Y323-I353 HydrophobicContact CE1-CG2 3.82Å; Y323-I353 HydrophobicContact CE2-CG2 4.17Å; Y323-I353 HydrophobicContact CG-CG2 3.96Å; L325-I353 HydrophobicContact CD1-CD1 4.32Å; L325-I353 HydrophobicContact CD2-CD1 3.81Å; L325-I353 HydrophobicContact CD2-CG1 4.48Å; L325-I353 HydrophobicContact CG-CD1 4.44Å; I353-L355 HydrophobicContact CG2-CD2 4.32Å; I353-Q388 WeakPolarHBondContact O-CA 3.21Å; I353-L389 PolarHBondContact N-O 2.99Å; I353-L389 PolarHBondContact O-N 3.44Å; I353-L394 HydrophobicContact CD1-CD2 3.81Å; I353-I461 HydrophobicContact CD1-CD1 4.01Å; I353-I461 HydrophobicContact CD1-CG2 4.35Å; I353-I461 HydrophobicContact CG2-CD1 3.78Å; I353-I461 HydrophobicContact CG2-CG1 4.31Å
354	T	89	Confident	74.2	Confident	55 Å²	55	63.1 Å²	63.1	34%	0.337	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	112.5	176.2	-58.2	0	0	0	0	109.7	Q356 N386 L387 Q388	T354-Q356 HydrophobicContact CG2-CG 4.34Å; T354-N386 HydrophobicContact CG2-CB 4.26Å; T354-L387 WeakPolarHBondContact CA-O 3.48Å; T354-Q388 HydrophobicContact CG2-CG 4.11Å
355	L	90.7	Very high	75.8	Confident	9 Å²	9	60.8 Å²	60.8	5%	0.047	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	138.4	170.4	-56.7	178.6	0	0	0	109.3	I353 W369 N386 L387 F443 R459 I461	I353-L355 HydrophobicContact CG2-CD2 4.32Å; L355-W369 HydrophobicContact CB-CH2 3.81Å; L355-W369 HydrophobicContact CB-CZ3 4.1Å; L355-W369 HydrophobicContact CD1-CZ3 4.49Å; L355-N386 CarbonylContact O-C 3.58Å; L355-N386 WeakPolarHBondContact O-CA 3.41Å; L355-L387 HydrophobicContact CB-CB 4.31Å; L355-L387 HydrophobicContact CD1-CD2 4.23Å; L355-L387 PolarHBondContact N-O 3.3Å; L355-L387 PolarHBondContact O-N 3.16Å; L355-F443 HydrophobicContact CD1-CB 4.21Å; L355-F443 HydrophobicContact CD1-CD1 4.44Å; L355-F443 HydrophobicContact CD1-CD2 3.52Å; L355-F443 HydrophobicContact CD1-CE2 3.96Å; L355-F443 HydrophobicContact CD1-CG 3.8Å; L355-R459 HydrophobicContact CD1-CB 4.1Å; L355-R459 HydrophobicContact CD2-CB 4.44Å; L355-I461 HydrophobicContact CD1-CD1 4.19Å; L355-I461 HydrophobicContact CD1-CG1 4.32Å; L355-I461 HydrophobicContact CD2-CG1 4.22Å
356	Q	90.3	Very high	77.7	Confident	82 Å²	82	59.4 Å²	59.4	38%	0.383	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	140.1	-176.6	-57.4	-170	0	0	0	111.9	T354 N386 R459	T354-Q356 HydrophobicContact CG2-CG 4.34Å; Q356-N386 WeakPolarHBondContact CG-OD1 3.05Å; Q356-R459 PolarHBondContact O-NE 2.83Å
357	C	89.7	Confident	79.4	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.283	C	S	.	.			trans	-134.7	85.5	171.8	-167.2	0	0	0	0	107.4	I367 W369 S385 C445	C357-I367 HydrophobicContact CB-CG2 4.16Å; C357-I367 WeakPolarHBondContact O-CD1 3.37Å; C357-W369 HydrophobicContact CB-CH2 3.85Å; C357-W369 HydrophobicContact CB-CZ2 3.47Å; C357-W369 VanDerWaalsContact CB-CZ2 3.47Å; C357-S385 PolarHBondContact N-O 3.17Å; C357-C445 HydrophobicContact CB-CB 3.41Å; C357-C445 VanDerWaalsContact CB-CB 3.41Å; C357-C445 WeakPolarHBondContact CB-SG 3.39Å; C357-C445 WeakPolarHBondContact SG-CB 3.32Å; C357-C445 CovalentContact SG-SG 2.04Å; C357-C445 PolarHBondContact SG-SG 2.82Å
358	Q	85.7	Confident	81.2	Confident	99 Å²	99	52.5 Å²	52.5	46%	0.463	27%	0.273	S	S	.	.			trans	-85	138.5	178.8	-61.6	-173.1	6.8	0	0	109.1	I315 D316	I315-Q358 WeakPolarHBondContact CA-O 3.34Å; D316-Q358 HydrophobicContact CB-CB 4.36Å; D316-Q358 PolarHBondContact N-O 3.4Å
359	T	83.3	Confident	82.5	Confident	28 Å²	28	52 Å²	52	17%	0.172	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	139.4	178.7	174.4	0	0	0	0	111.7	H314 F361 I367 A447	H314-T359 PolarHBondContact N-OG1 2.87Å; H314-T359 WeakPolarHBondContact O-CA 3.15Å; H314-T359 WeakPolarHBondContact O-CB 3.49Å; H314-T359 PolarHBondContact O-OG1 3.16Å; T359-F361 HydrophobicContact CG2-CD1 3.44Å; T359-F361 VanDerWaalsContact CG2-CD1 3.44Å; T359-F361 HydrophobicContact CG2-CE1 3.46Å; T359-F361 VanDerWaalsContact CG2-CE1 3.46Å; T359-I367 HydrophobicContact CG2-CD1 3.48Å; T359-I367 VanDerWaalsContact CG2-CD1 3.48Å; T359-I367 HydrophobicContact CG2-CG1 3.79Å; T359-A447 HydrophobicContact CG2-CB 4Å
360	D	77	Confident	84.1	Confident	43 Å²	43	51 Å²	51	23%	0.23	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	99.7	164.5	62	-24.2	0	0	0	108.4	R239 Y311 H314	R239-D360 VanDerWaalsContact CB-OD2 3.22Å; R239-D360 WeakPolarHBondContact CB-OD2 3.49Å; R239-D360 VanDerWaalsContact CD-OD2 3.31Å; R239-D360 WeakPolarHBondContact CD-OD2 3.24Å; Y311-D360 HydrophobicContact CE2-CB 3.97Å; Y311-D360 VanDerWaalsContact CE2-O 3.24Å; Y311-D360 WeakPolarHBondContact CE2-O 3.41Å; H314-D360 VanDerWaalsContact CB-OD1 3.31Å; H314-D360 WeakPolarHBondContact CB-OD1 2.93Å; H314-D360 PolarHBondContact N-O 3.38Å; H314-D360 PolarHBondContact O-N 3.12Å
361	F	77.6	Confident	85.3	Confident	49 Å²	49	49.2 Å²	49.2	22%	0.215	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	145.8	167.1	42.6	-117.6	0	0	0	109.7	P313 T359 P363 S364 G365 I367	P313-F361 HydrophobicContact CB-CB 4.14Å; P313-F361 HydrophobicContact CB-CD1 4.39Å; T359-F361 HydrophobicContact CG2-CD1 3.44Å; T359-F361 VanDerWaalsContact CG2-CD1 3.44Å; T359-F361 HydrophobicContact CG2-CE1 3.46Å; T359-F361 VanDerWaalsContact CG2-CE1 3.46Å; F361-P363 CarbonylContact C-O 3.59Å; F361-S364 VanDerWaalsContact CE2-CA 3.46Å; F361-G365 WeakPolarHBondContact CZ-O 3.03Å; F361-I367 HydrophobicContact CE1-CD1 4.19Å; F361-I367 HydrophobicContact CE1-CG1 4.05Å
362	N	70.6	Confident	86.3	Confident	15 Å²	15	46.5 Å²	46.5	8%	0.08	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	110.3	169	-171.2	20.6	0	0	0	110.9	H242 I309 Y310 Y311	H242-N362 PolarHBondContact CE1-ND2 2.92Å; H242-N362 PolarHBondContact ND1-ND2 3.24Å; I309-N362 PolarHBondContact O-ND2 2.88Å; Y310-N362 CarbonylContact C-O 3.55Å; Y310-N362 WeakPolarHBondContact CA-O 3.44Å; Y310-N362 WeakPolarHBondContact CB-O 3.29Å; Y311-N362 HydrophobicContact CD1-CB 3.99Å; Y311-N362 HydrophobicContact CD2-CB 4.39Å; Y311-N362 HydrophobicContact CE1-CB 3.54Å; Y311-N362 HydrophobicContact CE2-CB 3.97Å; Y311-N362 HydrophobicContact CG-CB 4.39Å; Y311-N362 PolarHBondContact N-O 3.38Å; Y311-N362 CarbonylContact O-C 3.47Å; Y311-N362 PolarHBondContact O-N 2.95Å
363	P	70.9	Confident	86.6	Confident	44 Å²	44	43.2 Å²	43.2	29%	0.286	22%	0.222	S	C	.	.	S	Bend	cis	-75	172.1	13	33.4	-33.5	0	0	0	112.7	F361 G365 S449	F361-P363 CarbonylContact C-O 3.59Å; P363-G365 PolarHBondContact O-N 3.05Å; P363-S449 PolarHBondContact O-OG 2.96Å
364	S	81.6	Confident	86.3	Confident	108 Å²	108	46.4 Å²	46.4	76%	0.755	25%	0.245	S	C	*	.			trans	-52.4	126.2	178.3	-59.8	0	0	0	0	112.2	F361	F361-S364 VanDerWaalsContact CE2-CA 3.46Å
365	G	86	Confident	85.9	Confident	26 Å²	26	48.7 Å²	48.7	27%	0.268	26%	0.255	S	S	.	.			trans	-107.3	-169.1	177.1	0	0	0	0	0	112.4	F361 P363 S448	F361-G365 WeakPolarHBondContact CZ-O 3.03Å; P363-G365 PolarHBondContact O-N 3.05Å; G365-S448 CarbonylContact C-O 3.33Å; G365-S448 WeakPolarHBondContact CA-O 3.44Å
366	R	92	Very high	85.5	Confident	150 Å²	150	51.4 Å²	51.4	57%	0.566	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	146.7	174.8	64.9	-177.7	-178.6	-179	1.9	110.2	Q368 A447 S448	R366-Q368 HydrophobicContact CG-CG 4.45Å; R366-A447 WeakPolarHBondContact O-CA 3.2Å; R366-S448 WeakPolarHBondContact CG-OG 3.16Å; R366-S448 PolarHBondContact N-O 2.91Å; R366-S448 PolarHBondContact NE-OG 3.26Å; R366-S448 VanDerWaalsContact NE-OG 3.16Å; R366-S448 PolarHBondContact O-N 2.88Å
367	I	93.3	Very high	85.2	Confident	14 Å²	14	50.4 Å²	50.4	7%	0.072	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.6	174.2	-55.7	163.7	0	0	0	107.1	C357 T359 F361 N383 G384 C445 I446 A447	C357-I367 HydrophobicContact CB-CG2 4.16Å; C357-I367 WeakPolarHBondContact O-CD1 3.37Å; T359-I367 HydrophobicContact CG2-CD1 3.48Å; T359-I367 VanDerWaalsContact CG2-CD1 3.48Å; T359-I367 HydrophobicContact CG2-CG1 3.79Å; F361-I367 HydrophobicContact CE1-CD1 4.19Å; F361-I367 HydrophobicContact CE1-CG1 4.05Å; I367-N383 CarbonylContact O-C 3.52Å; I367-N383 VanDerWaalsContact O-CA 3.24Å; I367-N383 WeakPolarHBondContact O-CA 3.36Å; I367-G384 WeakPolarHBondContact CB-O 3.38Å; I367-G384 VanDerWaalsContact CG2-O 3.25Å; I367-G384 WeakPolarHBondContact CG2-O 3.44Å; I367-G384 PolarHBondContact O-N 3.03Å; I367-C445 HydrophobicContact CG2-CB 4.33Å; I367-I446 CarbonylContact C-O 3.52Å; I367-I446 WeakPolarHBondContact CA-O 3.38Å; I367-A447 HydrophobicContact CG1-CB 4.38Å
368	Q	95.4	Very high	85.2	Confident	35 Å²	35	54 Å²	54	16%	0.164	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	136.6	-178.2	-49.1	-164.2	-88.9	0	0	109.6	R366 F370 Y380 N383 C445 I446	R366-Q368 HydrophobicContact CG-CG 4.45Å; Q368-F370 HydrophobicContact CB-CD2 4.48Å; Q368-F370 HydrophobicContact CB-CE2 3.67Å; Q368-F370 HydrophobicContact CB-CZ 4.23Å; Q368-Y380 HydrophobicContact CB-CD2 4.49Å; Q368-Y380 HydrophobicContact CB-CE2 4.18Å; Q368-N383 WeakPolarHBondContact CG-OD1 3.47Å; Q368-N383 PolarHBondContact NE2-OD1 2.86Å; Q368-C445 CarbonylContact O-C 3.56Å; Q368-C445 WeakPolarHBondContact O-CA 3.33Å; Q368-I446 PolarHBondContact N-O 2.85Å; Q368-I446 PolarHBondContact O-N 3.39Å
369	W	95.3	Very high	85.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	135.8	177.9	-71.6	91.4	0	0	0	111.2	L355 C357 L381 T382 G384 L387 F443 C445 R459	L355-W369 HydrophobicContact CB-CH2 3.81Å; L355-W369 HydrophobicContact CB-CZ3 4.1Å; L355-W369 HydrophobicContact CD1-CZ3 4.49Å; C357-W369 HydrophobicContact CB-CH2 3.85Å; C357-W369 HydrophobicContact CB-CZ2 3.47Å; C357-W369 VanDerWaalsContact CB-CZ2 3.47Å; W369-L381 HydrophobicContact CB-CB 4.37Å; W369-L381 PolarHBondContact O-N 3.34Å; W369-T382 HydrophobicContact CB-CG2 4.24Å; W369-T382 HydrophobicContact CG-CG2 4.42Å; W369-T382 PolarHBondContact N-O 2.83Å; W369-G384 PolarHBondContact NE1-O 2.92Å; W369-L387 HydrophobicContact CB-CD2 4.24Å; W369-L387 HydrophobicContact CD2-CB 3.68Å; W369-L387 HydrophobicContact CD2-CD2 3.93Å; W369-L387 HydrophobicContact CD2-CG 4.41Å; W369-L387 HydrophobicContact CE3-CB 4.11Å; W369-L387 HydrophobicContact CE3-CD2 3.77Å; W369-L387 HydrophobicContact CG-CB 3.99Å; W369-L387 HydrophobicContact CG-CD2 4.16Å; W369-L387 HydrophobicContact CH2-CB 4.43Å; W369-L387 HydrophobicContact CZ2-CB 4.04Å; W369-L387 HydrophobicContact CZ3-CB 4.46Å; W369-L387 HydrophobicContact CZ3-CD2 4.41Å; W369-F443 HydrophobicContact CE3-CB 4.22Å; W369-F443 HydrophobicContact CZ3-CB 4.29Å; W369-C445 HydrophobicContact CD2-CB 3.97Å; W369-C445 HydrophobicContact CE3-CB 3.85Å; W369-C445 HydrophobicContact CH2-CB 3.91Å; W369-C445 HydrophobicContact CZ2-CB 4.01Å; W369-C445 HydrophobicContact CZ3-CB 3.83Å; W369-R459 HydrophobicContact CH2-CG 3.9Å; W369-R459 HydrophobicContact CZ3-CB 4.25Å; W369-R459 HydrophobicContact CZ3-CG 3.74Å
370	F	93.7	Very high	85.9	Confident	33 Å²	33	55.3 Å²	55.3	15%	0.145	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	139.4	177	-63.5	-93.9	0	0	0	110	Q368 Q378 T379 Y380 F443 T444 I446	Q368-F370 HydrophobicContact CB-CD2 4.48Å; Q368-F370 HydrophobicContact CB-CE2 3.67Å; Q368-F370 HydrophobicContact CB-CZ 4.23Å; F370-Q378 HydrophobicContact CB-CB 4.15Å; F370-Q378 HydrophobicContact CB-CG 4.42Å; F370-Q378 HydrophobicContact CD1-CB 4.23Å; F370-T379 CarbonylContact C-O 3.42Å; F370-T379 VanDerWaalsContact CA-O 3.32Å; F370-T379 WeakPolarHBondContact CA-O 3.01Å; F370-Y380 HydrophobicContact CE1-CD2 4.13Å; F370-Y380 HydrophobicContact CE1-CG 4.48Å; F370-Y380 HydrophobicContact CZ-CD2 4.14Å; F370-F443 CarbonylContact O-C 3.53Å; F370-F443 WeakPolarHBondContact O-CA 3.24Å; F370-T444 PolarHBondContact N-O 2.96Å; F370-T444 PolarHBondContact O-N 3.07Å; F370-I446 HydrophobicContact CD2-CD1 3.87Å; F370-I446 HydrophobicContact CD2-CG1 4.05Å; F370-I446 HydrophobicContact CE2-CB 4.31Å; F370-I446 HydrophobicContact CE2-CD1 3.62Å; F370-I446 HydrophobicContact CE2-CG1 3.99Å; F370-I446 HydrophobicContact CZ-CD1 4.43Å
371	L	93.1	Very high	86.6	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.021	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	137.3	167.2	174.9	68.7	0	0	0	109.3	Q378 T379 L381 L398 W441 F443	L371-Q378 CarbonylContact O-C 3.59Å; L371-Q378 VanDerWaalsContact O-CA 3.3Å; L371-Q378 WeakPolarHBondContact O-CA 3.4Å; L371-T379 PolarHBondContact N-O 2.8Å; L371-T379 PolarHBondContact O-N 3.15Å; L371-T379 PolarHBondContact O-OG1 3.12Å; L371-L381 HydrophobicContact CB-CD1 3.95Å; L371-L381 HydrophobicContact CB-CD2 4.1Å; L371-L381 HydrophobicContact CB-CG 4.04Å; L371-L398 HydrophobicContact CD2-CB 3.78Å; L371-L398 HydrophobicContact CD2-CD1 4.27Å; L371-L398 HydrophobicContact CD2-CD2 3.73Å; L371-L398 HydrophobicContact CD2-CG 4.1Å; L371-W441 HydrophobicContact CD1-CB 4.48Å; L371-F443 HydrophobicContact CB-CD1 4.47Å; L371-F443 HydrophobicContact CD1-CD1 4.09Å; L371-F443 HydrophobicContact CD1-CE1 3.76Å; L371-F443 HydrophobicContact CD1-CZ 4.01Å
372	W	90.1	Very high	87.4	Confident	40 Å²	40	56.2 Å²	56.2	15%	0.152	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	143.9	169.7	-72.8	78.8	0	0	0	112	N376 T377 Q378 I401 K442 T444	W372-N376 WeakPolarHBondContact CZ3-O 3.39Å; W372-N376 WeakPolarHBondContact CZ3-OD1 3Å; W372-T377 WeakPolarHBondContact CA-O 3.32Å; W372-Q378 HydrophobicContact CD2-CG 3.73Å; W372-Q378 HydrophobicContact CE3-CG 3.95Å; W372-Q378 HydrophobicContact CG-CG 4.21Å; W372-Q378 HydrophobicContact CH2-CG 4.23Å; W372-Q378 HydrophobicContact CZ2-CG 4.05Å; W372-Q378 HydrophobicContact CZ3-CG 4.14Å; W372-I401 HydrophobicContact CB-CD1 4.02Å; W372-K442 HydrophobicContact CB-CB 4.05Å; W372-K442 HydrophobicContact CB-CD 4.12Å; W372-K442 HydrophobicContact CB-CG 4.22Å; W372-K442 VanDerWaalsContact CD1-CG 3.45Å; W372-K442 HydrophobicContact CD2-CD 4.05Å; W372-K442 HydrophobicContact CG-CB 4.28Å; W372-K442 HydrophobicContact CG-CD 3.63Å; W372-K442 HydrophobicContact CG-CG 3.89Å; W372-K442 PolarHBondContact N-O 3.05Å; W372-T444 PolarHBondContact NE1-OG1 3.26Å
373	K	86.3	Confident	88.3	Confident	73 Å²	73	59.5 Å²	59.5	32%	0.317	32%	0.316	S	S	.	.			trans	-104.7	162.2	170.9	-67	-176.2	169.7	178.8	0	110.9	N375 N376 T377 T379	K373-N375 VanDerWaalsContact CB-OD1 3.3Å; K373-N375 WeakPolarHBondContact CB-OD1 3.44Å; K373-N375 PolarHBondContact O-N 3.19Å; K373-N375 VanDerWaalsContact O-N 3.15Å; K373-N376 PolarHBondContact O-N 2.6Å; K373-N376 VanDerWaalsContact O-N 3.12Å; K373-T377 PolarHBondContact N-O 3.43Å; K373-T379 HydrophobicContact CD-CG2 4.11Å
374	S	80.7	Confident	89.3	Confident	68 Å²	68	58.9 Å²	58.9	48%	0.476	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-28.5	179.2	57.5	0	0	0	0	114	N376 E399	S374-N376 PolarHBondContact O-N 3.12Å; S374-E399 WeakPolarHBondContact CB-OE1 3.44Å; S374-E399 PolarHBondContact N-OE1 3.29Å; S374-E399 PolarHBondContact OG-OE1 3.02Å
375	N	81.8	Confident	89.6	Confident	103 Å²	103	56.4 Å²	56.4	55%	0.551	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	17.4	178.7	70	-6.2	0	0	0	114.6	K373 T377	K373-N375 VanDerWaalsContact CB-OD1 3.3Å; K373-N375 WeakPolarHBondContact CB-OD1 3.44Å; K373-N375 PolarHBondContact O-N 3.19Å; K373-N375 VanDerWaalsContact O-N 3.15Å; N375-T377 PolarHBondContact ND2-OG1 2.92Å; N375-T377 PolarHBondContact O-N 2.71Å; N375-T377 WeakPolarHBondContact OD1-CB 3.06Å; N375-T377 WeakPolarHBondContact OD1-CG2 3.26Å; N375-T377 PolarHBondContact OD1-N 2.79Å; N375-T377 VanDerWaalsContact OD1-N 3.12Å; N375-T377 PolarHBondContact OD1-OG1 2.9Å
376	N	80.9	Confident	89.8	Confident	66 Å²	66	58.5 Å²	58.5	35%	0.353	31%	0.305	S	S	.	.	S	Bend	trans	63.9	21.7	-178	-158.9	36.6	0	0	0	114.7	W372 K373 S374 W409	W372-N376 WeakPolarHBondContact CZ3-O 3.39Å; W372-N376 WeakPolarHBondContact CZ3-OD1 3Å; K373-N376 PolarHBondContact O-N 2.6Å; K373-N376 VanDerWaalsContact O-N 3.12Å; S374-N376 PolarHBondContact O-N 3.12Å; N376-W409 HydrophobicContact CB-CH2 3.82Å; N376-W409 HydrophobicContact CB-CZ3 4.22Å; N376-W409 VanDerWaalsContact OD1-CZ3 3.26Å; N376-W409 WeakPolarHBondContact OD1-CZ3 3.49Å
377	T	85.5	Confident	89.8	Confident	60 Å²	60	51.8 Å²	51.8	37%	0.368	28%	0.28	S	S	.	.			trans	-101.5	155.1	173.6	67.8	0	0	0	0	111.2	W372 K373 N375	W372-T377 WeakPolarHBondContact CA-O 3.32Å; K373-T377 PolarHBondContact N-O 3.43Å; N375-T377 PolarHBondContact ND2-OG1 2.92Å; N375-T377 PolarHBondContact O-N 2.71Å; N375-T377 WeakPolarHBondContact OD1-CB 3.06Å; N375-T377 WeakPolarHBondContact OD1-CG2 3.26Å; N375-T377 PolarHBondContact OD1-N 2.79Å; N375-T377 VanDerWaalsContact OD1-N 3.12Å; N375-T377 PolarHBondContact OD1-OG1 2.9Å
378	Q	89.4	Confident	89.7	Confident	77 Å²	77	57.7 Å²	57.7	36%	0.36	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	137.9	177	-72.2	-178.8	-15.6	0	0	110.6	F370 L371 W372	F370-Q378 HydrophobicContact CB-CB 4.15Å; F370-Q378 HydrophobicContact CB-CG 4.42Å; F370-Q378 HydrophobicContact CD1-CB 4.23Å; L371-Q378 CarbonylContact O-C 3.59Å; L371-Q378 VanDerWaalsContact O-CA 3.3Å; L371-Q378 WeakPolarHBondContact O-CA 3.4Å; W372-Q378 HydrophobicContact CD2-CG 3.73Å; W372-Q378 HydrophobicContact CE3-CG 3.95Å; W372-Q378 HydrophobicContact CG-CG 4.21Å; W372-Q378 HydrophobicContact CH2-CG 4.23Å; W372-Q378 HydrophobicContact CZ2-CG 4.05Å; W372-Q378 HydrophobicContact CZ3-CG 4.14Å
379	T	90.7	Very high	89.3	Confident	43 Å²	43	56.8 Å²	56.8	26%	0.264	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	125.5	169.7	46.5	0	0	0	0	110.4	F370 L371 K373 L381	F370-T379 CarbonylContact C-O 3.42Å; F370-T379 VanDerWaalsContact CA-O 3.32Å; F370-T379 WeakPolarHBondContact CA-O 3.01Å; L371-T379 PolarHBondContact N-O 2.8Å; L371-T379 PolarHBondContact O-N 3.15Å; L371-T379 PolarHBondContact O-OG1 3.12Å; K373-T379 HydrophobicContact CD-CG2 4.11Å; T379-L381 PolarHBondContact O-N 2.57Å
380	Y	93.1	Very high	88.8	Confident	111 Å²	111	59.1 Å²	59.1	44%	0.435	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	134.2	173	172.4	-94.5	0	0	0	110.7	Q368 F370 T382 N383	Q368-Y380 HydrophobicContact CB-CD2 4.49Å; Q368-Y380 HydrophobicContact CB-CE2 4.18Å; F370-Y380 HydrophobicContact CE1-CD2 4.13Å; F370-Y380 HydrophobicContact CE1-CG 4.48Å; F370-Y380 HydrophobicContact CZ-CD2 4.14Å; Y380-T382 VanDerWaalsContact OH-C 3.29Å; Y380-N383 WeakPolarHBondContact CE2-OD1 3.14Å; Y380-N383 PolarHBondContact OH-N 2.8Å; Y380-N383 PolarHBondContact OH-ND2 3.01Å; Y380-N383 VanDerWaalsContact OH-ND2 3.1Å; Y380-N383 PolarHBondContact OH-OD1 3.27Å
381	L	91.4	Very high	88.2	Confident	54 Å²	54	58.6 Å²	58.6	28%	0.283	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	-62.3	177.7	-66.5	179.9	0	0	0	111.6	W369 L371 T379 L387 L398 F443	W369-L381 HydrophobicContact CB-CB 4.37Å; W369-L381 PolarHBondContact O-N 3.34Å; L371-L381 HydrophobicContact CB-CD1 3.95Å; L371-L381 HydrophobicContact CB-CD2 4.1Å; L371-L381 HydrophobicContact CB-CG 4.04Å; T379-L381 PolarHBondContact O-N 2.57Å; L381-L387 HydrophobicContact CD1-CD1 4.49Å; L381-L387 HydrophobicContact CD1-CD2 3.94Å; L381-L398 HydrophobicContact CD2-CD2 4.22Å; L381-F443 HydrophobicContact CD1-CD1 3.71Å; L381-F443 HydrophobicContact CD1-CE1 3.72Å
382	T	92.8	Very high	87.5	Confident	56 Å²	56	62.9 Å²	62.9	34%	0.344	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	169.7	-171.5	-167.2	0	0	0	0	111.9	W369 Y380 L387	W369-T382 HydrophobicContact CB-CG2 4.24Å; W369-T382 HydrophobicContact CG-CG2 4.42Å; W369-T382 PolarHBondContact N-O 2.83Å; Y380-T382 VanDerWaalsContact OH-C 3.29Å; T382-L387 HydrophobicContact CG2-CD1 3.74Å
383	N	90.8	Very high	87.1	Confident	85 Å²	85	65.2 Å²	65.2	46%	0.455	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	148.2	171	-66.6	-34.2	0	0	0	110.2	I367 Q368 Y380	I367-N383 CarbonylContact O-C 3.52Å; I367-N383 VanDerWaalsContact O-CA 3.24Å; I367-N383 WeakPolarHBondContact O-CA 3.36Å; Q368-N383 WeakPolarHBondContact CG-OD1 3.47Å; Q368-N383 PolarHBondContact NE2-OD1 2.86Å; Y380-N383 WeakPolarHBondContact CE2-OD1 3.14Å; Y380-N383 PolarHBondContact OH-N 2.8Å; Y380-N383 PolarHBondContact OH-ND2 3.01Å; Y380-N383 VanDerWaalsContact OH-ND2 3.1Å; Y380-N383 PolarHBondContact OH-OD1 3.27Å
384	G	90.9	Very high	86.9	Confident	30 Å²	30	61.8 Å²	61.8	31%	0.309	34%	0.337	S	S	.	.	S	Bend	trans	135.1	164.4	175.6	0	0	0	0	0	113.1	I367 W369 N386	I367-G384 WeakPolarHBondContact CB-O 3.38Å; I367-G384 VanDerWaalsContact CG2-O 3.25Å; I367-G384 WeakPolarHBondContact CG2-O 3.44Å; I367-G384 PolarHBondContact O-N 3.03Å; W369-G384 PolarHBondContact NE1-O 2.92Å; G384-N386 VanDerWaalsContact C-N 3.32Å
385	S	88.9	Confident	86.8	Confident	56 Å²	56	61.5 Å²	61.5	39%	0.392	33%	0.328	S	S	.	.	S	Bend	trans	-71.3	-26.7	179.3	50.9	0	0	0	0	113.4	C357	C357-S385 PolarHBondContact N-O 3.17Å
386	N	90.8	Very high	86.4	Confident	71 Å²	71	61.1 Å²	61.1	38%	0.38	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	137.9	-178.5	-61.5	-30.4	0	0	0	110.3	T354 L355 Q356 G384	T354-N386 HydrophobicContact CG2-CB 4.26Å; L355-N386 CarbonylContact O-C 3.58Å; L355-N386 WeakPolarHBondContact O-CA 3.41Å; Q356-N386 WeakPolarHBondContact CG-OD1 3.05Å; G384-N386 VanDerWaalsContact C-N 3.32Å
387	L	90.9	Very high	85.9	Confident	8 Å²	8	62.1 Å²	62.1	4%	0.042	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	110.7	169.8	172.8	62	0	0	0	108.1	T354 L355 W369 L381 T382 L389 F443	T354-L387 WeakPolarHBondContact CA-O 3.48Å; L355-L387 HydrophobicContact CB-CB 4.31Å; L355-L387 HydrophobicContact CD1-CD2 4.23Å; L355-L387 PolarHBondContact N-O 3.3Å; L355-L387 PolarHBondContact O-N 3.16Å; W369-L387 HydrophobicContact CB-CD2 4.24Å; W369-L387 HydrophobicContact CD2-CB 3.68Å; W369-L387 HydrophobicContact CD2-CD2 3.93Å; W369-L387 HydrophobicContact CD2-CG 4.41Å; W369-L387 HydrophobicContact CE3-CB 4.11Å; W369-L387 HydrophobicContact CE3-CD2 3.77Å; W369-L387 HydrophobicContact CG-CB 3.99Å; W369-L387 HydrophobicContact CG-CD2 4.16Å; W369-L387 HydrophobicContact CH2-CB 4.43Å; W369-L387 HydrophobicContact CZ2-CB 4.04Å; W369-L387 HydrophobicContact CZ3-CB 4.46Å; W369-L387 HydrophobicContact CZ3-CD2 4.41Å; L381-L387 HydrophobicContact CD1-CD1 4.49Å; L381-L387 HydrophobicContact CD1-CD2 3.94Å; T382-L387 HydrophobicContact CG2-CD1 3.74Å; L387-L389 HydrophobicContact CD1-CD2 4.03Å; L387-L389 HydrophobicContact CD1-CG 4.2Å; L387-L389 HydrophobicContact CD2-CD1 4.16Å; L387-L389 HydrophobicContact CG-CD1 4.2Å; L387-L389 HydrophobicContact CG-CD2 4.4Å; L387-L389 HydrophobicContact CG-CG 4.04Å; L387-F443 HydrophobicContact CD2-CD1 3.62Å; L387-F443 HydrophobicContact CD2-CE1 3.96Å; L387-F443 HydrophobicContact CD2-CG 4.29Å
388	Q	90.5	Very high	85.7	Confident	138 Å²	138	60.6 Å²	60.6	65%	0.645	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.1	127.4	174.9	-68.2	-177.5	-25.1	0	0	109.3	I353 T354	I353-Q388 WeakPolarHBondContact O-CA 3.21Å; T354-Q388 HydrophobicContact CG2-CG 4.11Å
389	L	88	Confident	85.5	Confident	16 Å²	16	60.6 Å²	60.6	8%	0.084	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	138.6	179.8	-64	169.4	0	0	0	109.1	I353 L387 L394 L398 F443 I461	I353-L389 PolarHBondContact N-O 2.99Å; I353-L389 PolarHBondContact O-N 3.44Å; L387-L389 HydrophobicContact CD1-CD2 4.03Å; L387-L389 HydrophobicContact CD1-CG 4.2Å; L387-L389 HydrophobicContact CD2-CD1 4.16Å; L387-L389 HydrophobicContact CG-CD1 4.2Å; L387-L389 HydrophobicContact CG-CD2 4.4Å; L387-L389 HydrophobicContact CG-CG 4.04Å; L389-L394 HydrophobicContact CD1-CD1 4.33Å; L389-L398 HydrophobicContact CD1-CD1 4.29Å; L389-L398 HydrophobicContact CD2-CD1 4.27Å; L389-F443 HydrophobicContact CD1-CE1 3.71Å; L389-F443 HydrophobicContact CD1-CE2 4.4Å; L389-F443 HydrophobicContact CD1-CZ 3.54Å; L389-I461 HydrophobicContact CD1-CD1 4.25Å
390	T	85.2	Confident	85.2	Confident	49 Å²	49	61.5 Å²	61.5	30%	0.301	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	153.7	164.5	67.5	0	0	0	0	110.3	Q351 D392 Q393 L394	Q351-T390 CarbonylContact O-C 3.57Å; Q351-T390 VanDerWaalsContact O-CA 3.3Å; Q351-T390 WeakPolarHBondContact O-CA 3.28Å; T390-D392 PolarHBondContact O-N 2.8Å; T390-Q393 VanDerWaalsContact N-OE1 3.07Å; T390-Q393 WeakPolarHBondContact O-CB 3.27Å; T390-Q393 PolarHBondContact O-N 3.33Å; T390-Q393 VanDerWaalsContact O-N 3.14Å; T390-Q393 VanDerWaalsContact OG1-CG 3.26Å; T390-Q393 WeakPolarHBondContact OG1-CG 3.47Å; T390-Q393 PolarHBondContact OG1-N 2.81Å; T390-L394 PolarHBondContact O-N 2.79Å
391	L	80.6	Confident	84.9	Confident	22 Å²	22	56.3 Å²	56.3	12%	0.115	32%	0.317	C	S	.	.	H	α-helix	trans	-57.9	-37.5	175.7	-173.4	70.3	0	0	0	112.1	L325 Y348 Q351 L394 Q395	L325-L391 HydrophobicContact CD1-CD1 4.25Å; L325-L391 HydrophobicContact CD2-CD1 4.26Å; Y348-L391 HydrophobicContact CD2-CD1 4.18Å; Y348-L391 HydrophobicContact CD2-CD2 3.76Å; Y348-L391 HydrophobicContact CG-CD1 4.33Å; Y348-L391 HydrophobicContact CG-CD2 4.12Å; Q351-L391 PolarHBondContact O-N 2.94Å; L391-L394 WeakPolarHBondContact O-CB 3.16Å; L391-L394 PolarHBondContact O-N 2.84Å; L391-Q395 PolarHBondContact O-N 2.79Å
392	D	77.6	Confident	84.7	Confident	94 Å²	94	56.3 Å²	56.3	50%	0.503	32%	0.319	S	S	.	.	H	α-helix	trans	-62.3	-43.2	176.3	-68.8	-23.6	0	0	0	111.5	T390 L394 Q395 S396	T390-D392 PolarHBondContact O-N 2.8Å; D392-L394 VanDerWaalsContact C-N 3.33Å; D392-L394 PolarHBondContact O-N 2.78Å; D392-Q395 PolarHBondContact O-N 2.82Å; D392-S396 WeakPolarHBondContact O-CB 3.26Å; D392-S396 PolarHBondContact O-N 3.08Å; D392-S396 PolarHBondContact O-OG 3.06Å
393	Q	81.6	Confident	84.1	Confident	90 Å²	90	53.6 Å²	53.6	42%	0.421	30%	0.303	S	S	.	.	H	α-helix	trans	-62.3	-43	174.8	-74.9	169.6	-16.2	0	0	111.1	T390 S397 L398	T390-Q393 VanDerWaalsContact N-OE1 3.07Å; T390-Q393 WeakPolarHBondContact O-CB 3.27Å; T390-Q393 PolarHBondContact O-N 3.33Å; T390-Q393 VanDerWaalsContact O-N 3.14Å; T390-Q393 VanDerWaalsContact OG1-CG 3.26Å; T390-Q393 WeakPolarHBondContact OG1-CG 3.47Å; T390-Q393 PolarHBondContact OG1-N 2.81Å; Q393-S397 WeakPolarHBondContact O-CA 3.49Å; Q393-S397 WeakPolarHBondContact O-CB 3.39Å; Q393-S397 PolarHBondContact O-N 2.94Å; Q393-L398 PolarHBondContact O-N 3.39Å
394	L	83.2	Confident	83.6	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-62.7	-44.1	-179.8	-169.3	72.3	0	0	0	112.1	L325 I353 L389 T390 L391 D392 L398 W441 F443 I461	L325-L394 HydrophobicContact CD1-CD2 3.6Å; I353-L394 HydrophobicContact CD1-CD2 3.81Å; L389-L394 HydrophobicContact CD1-CD1 4.33Å; T390-L394 PolarHBondContact O-N 2.79Å; L391-L394 WeakPolarHBondContact O-CB 3.16Å; L391-L394 PolarHBondContact O-N 2.84Å; D392-L394 VanDerWaalsContact C-N 3.33Å; D392-L394 PolarHBondContact O-N 2.78Å; L394-L398 HydrophobicContact CD1-CD1 4.07Å; L394-W441 HydrophobicContact CD1-CB 4.2Å; L394-W441 HydrophobicContact CD1-CD2 3.58Å; L394-W441 HydrophobicContact CD1-CE3 4.13Å; L394-W441 HydrophobicContact CD1-CG 3.62Å; L394-W441 HydrophobicContact CD1-CZ2 4.37Å; L394-W441 HydrophobicContact CD2-CD2 3.98Å; L394-W441 HydrophobicContact CD2-CE3 3.73Å; L394-W441 HydrophobicContact CD2-CH2 3.71Å; L394-W441 HydrophobicContact CD2-CZ2 3.99Å; L394-W441 HydrophobicContact CD2-CZ3 3.61Å; L394-W441 HydrophobicContact CG-CD2 3.72Å; L394-W441 HydrophobicContact CG-CE3 4.02Å; L394-W441 HydrophobicContact CG-CG 4.28Å; L394-W441 HydrophobicContact CG-CH2 3.91Å; L394-W441 HydrophobicContact CG-CZ2 3.63Å; L394-W441 HydrophobicContact CG-CZ3 4.13Å; L394-W441 PolarHBondContact O-NE1 3.3Å; L394-F443 HydrophobicContact CD1-CZ 4Å; L394-I461 HydrophobicContact CD1-CD1 3.94Å; L394-I461 HydrophobicContact CD2-CD1 4.23Å; L394-I461 HydrophobicContact CD2-CG2 3.92Å
395	Q	78.2	Confident	82.6	Confident	62 Å²	62	50.8 Å²	50.8	29%	0.29	28%	0.282	S	S	.	.	H	α-helix	trans	-80.9	-38.2	-177.5	-69.7	-175.4	0.1	0	0	114	T344 L391 D392	T344-Q395 PolarHBondContact OG1-OE1 3.5Å; T344-Q395 VanDerWaalsContact OG1-OE1 3.09Å; L391-Q395 PolarHBondContact O-N 2.79Å; D392-Q395 PolarHBondContact O-N 2.82Å
396	S	73.1	Confident	81.8	Confident	96 Å²	96	56 Å²	56	67%	0.671	30%	0.297	S	S	*	.	H	α-helix	trans	-89.8	-29.6	-173.4	67.3	0	0	0	0	113.7	D392	D392-S396 WeakPolarHBondContact O-CB 3.26Å; D392-S396 PolarHBondContact O-N 3.08Å; D392-S396 PolarHBondContact O-OG 3.06Å
397	S	69.7	Low	81	Confident	87 Å²	87	54.1 Å²	54.1	61%	0.608	29%	0.287	S	S	*	.	H	α-helix	trans	-115.3	-22.8	-166.1	-52.4	0	0	0	0	113.5	Q393	Q393-S397 WeakPolarHBondContact O-CA 3.49Å; Q393-S397 WeakPolarHBondContact O-CB 3.39Å; Q393-S397 PolarHBondContact O-N 2.94Å
398	L	82.1	Confident	80	Confident	28 Å²	28	54.1 Å²	54.1	15%	0.147	29%	0.288	C	S	.	.	S	Bend	trans	-112.5	132.1	-174.6	-54.7	-171.5	0	0	0	111.2	L371 L381 L389 Q393 L394 M400 W441 F443	L371-L398 HydrophobicContact CD2-CB 3.78Å; L371-L398 HydrophobicContact CD2-CD1 4.27Å; L371-L398 HydrophobicContact CD2-CD2 3.73Å; L371-L398 HydrophobicContact CD2-CG 4.1Å; L381-L398 HydrophobicContact CD2-CD2 4.22Å; L389-L398 HydrophobicContact CD1-CD1 4.29Å; L389-L398 HydrophobicContact CD2-CD1 4.27Å; Q393-L398 PolarHBondContact O-N 3.39Å; L394-L398 HydrophobicContact CD1-CD1 4.07Å; L398-M400 PolarHBondContact O-N 3.13Å; L398-W441 PolarHBondContact O-NE1 2.96Å; L398-F443 HydrophobicContact CD1-CE1 3.99Å; L398-F443 HydrophobicContact CD1-CZ 4.04Å
399	E	84.7	Confident	79	Confident	76 Å²	76	52.2 Å²	52.2	36%	0.355	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-67.6	121.8	178.3	-171.8	-174.8	160.1	0	0	110.5	S374 W441	S374-E399 WeakPolarHBondContact CB-OE1 3.44Å; S374-E399 PolarHBondContact N-OE1 3.29Å; S374-E399 PolarHBondContact OG-OE1 3.02Å; E399-W441 VanDerWaalsContact O-CD1 3.24Å
400	M	85.5	Confident	78.1	Confident	63 Å²	63	51.7 Å²	51.7	31%	0.31	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-79.6	131.2	170.8	-179.5	-169.3	-81	0	0	109.4	L398 H439 W441	L398-M400 PolarHBondContact O-N 3.13Å; M400-H439 HydrophobicContact CE-CB 4.38Å; M400-H439 HydrophobicContact CG-CB 4.25Å; M400-H439 HydrophobicContact SD-CB 3.58Å; M400-H439 VanDerWaalsContact SD-CB 3.58Å; M400-W441 HydrophobicContact CB-CZ2 4Å; M400-W441 HydrophobicContact CE-CH2 3.13Å; M400-W441 HydrophobicContact CE-CZ2 3.39Å; M400-W441 HydrophobicContact CE-CZ3 3.82Å; M400-W441 HydrophobicContact CG-CZ2 4.24Å
401	I	87	Confident	77.2	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	127.3	175.7	-55.9	174.7	0	0	0	108.4	W372 V403 I410 L440 K442	W372-I401 HydrophobicContact CB-CD1 4.02Å; I401-V403 HydrophobicContact CG2-CG2 3.96Å; I401-I410 HydrophobicContact CD1-CG2 4.25Å; I401-I410 HydrophobicContact CG2-CD1 3.86Å; I401-I410 HydrophobicContact CG2-CG2 4.39Å; I401-L440 HydrophobicContact CB-CD1 4.21Å; I401-L440 PolarHBondContact N-O 2.82Å; I401-L440 PolarHBondContact O-N 3.01Å; I401-K442 HydrophobicContact CD1-CB 4.26Å
402	T	86.3	Confident	76.3	Confident	54 Å²	54	49.9 Å²	49.9	33%	0.331	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	111.6	166.6	-55.5	0	0	0	0	108.7	N407 Q437 I438 H439	T402-N407 PolarHBondContact O-ND2 3.32Å; T402-Q437 HydrophobicContact CG2-CB 3.98Å; T402-Q437 HydrophobicContact CG2-CG 4.05Å; T402-I438 WeakPolarHBondContact CA-O 3.48Å; T402-H439 PolarHBondContact OG1-CE1 2.85Å; T402-H439 VanDerWaalsContact OG1-CE1 3.27Å; T402-H439 PolarHBondContact OG1-ND1 2.86Å; T402-H439 VanDerWaalsContact OG1-ND1 3.16Å
403	V	80.4	Confident	75.2	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	128.3	175.4	-180	0	0	0	0	109.6	I401 N407 L408 M411 Q437 I438 L440	I401-V403 HydrophobicContact CG2-CG2 3.96Å; V403-N407 VanDerWaalsContact CA-OD1 3.26Å; V403-N407 WeakPolarHBondContact CA-OD1 3.37Å; V403-L408 HydrophobicContact CG1-CD1 3.89Å; V403-M411 HydrophobicContact CG1-CG 4.22Å; V403-M411 HydrophobicContact CG2-CG 4.28Å; V403-M411 HydrophobicContact CG2-SD 4.46Å; V403-Q437 CarbonylContact O-C 3.5Å; V403-Q437 VanDerWaalsContact O-CA 3.32Å; V403-Q437 WeakPolarHBondContact O-CA 3.49Å; V403-I438 HydrophobicContact CB-CB 4.37Å; V403-I438 PolarHBondContact N-O 3.21Å; V403-I438 PolarHBondContact O-N 2.8Å; V403-L440 HydrophobicContact CB-CD2 4.34Å; V403-L440 HydrophobicContact CG2-CD1 4.3Å; V403-L440 HydrophobicContact CG2-CD2 3.7Å; V403-L440 HydrophobicContact CG2-CG 4.04Å
404	N	79.5	Confident	73.4	Confident	43 Å²	43	54.1 Å²	54.1	23%	0.23	28%	0.275	C	S	.	.			trans	-128.1	-174.8	175	63.5	29	0	0	0	109.6	K406 N407 L408 F436	N404-K406 PolarHBondContact O-N 2.87Å; N404-K406 WeakPolarHBondContact OD1-CA 3.22Å; N404-K406 WeakPolarHBondContact OD1-CB 3.39Å; N404-K406 PolarHBondContact OD1-N 3.32Å; N404-N407 PolarHBondContact N-OD1 2.93Å; N404-N407 PolarHBondContact O-N 2.76Å; N404-N407 PolarHBondContact O-OD1 2.91Å; N404-N407 PolarHBondContact OD1-N 2.83Å; N404-N407 VanDerWaalsContact OD1-N 3.12Å; N404-N407 PolarHBondContact OD1-OD1 2.86Å; N404-L408 PolarHBondContact O-N 2.98Å; N404-L408 VanDerWaalsContact O-N 3.16Å; N404-F436 VanDerWaalsContact CA-O 3.24Å; N404-F436 WeakPolarHBondContact CA-O 3.33Å; N404-F436 VanDerWaalsContact CB-O 3.25Å; N404-F436 WeakPolarHBondContact CB-O 3.42Å
405	S	71.5	Confident	71.6	Confident	13 Å²	13	55.7 Å²	55.7	9%	0.091	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-54.3	-38	177.3	55	0	0	0	0	114.6	L431 D432 V434	S405-L431 WeakPolarHBondContact CB-O 3.42Å; S405-D432 PolarHBondContact OG-O 3.09Å; S405-V434 VanDerWaalsContact CB-O 3.31Å; S405-V434 WeakPolarHBondContact CB-O 3.46Å; S405-V434 PolarHBondContact OG-O 2.78Å
406	K	72	Confident	69.9	Low	164 Å²	164	57.8 Å²	57.8	71%	0.713	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-78.1	-25.9	-173	-59	-176.6	178.6	-178.3	0	113.5	N404 W409	N404-K406 PolarHBondContact O-N 2.87Å; N404-K406 WeakPolarHBondContact OD1-CA 3.22Å; N404-K406 WeakPolarHBondContact OD1-CB 3.39Å; N404-K406 PolarHBondContact OD1-N 3.32Å; K406-W409 PolarHBondContact O-NE1 2.78Å
407	N	73	Confident	68.4	Low	32 Å²	32	59.3 Å²	59.3	17%	0.171	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-119.5	22	-177.6	71.3	-4	0	0	0	113.4	T402 V403 N404 W409 I410	T402-N407 PolarHBondContact O-ND2 3.32Å; V403-N407 VanDerWaalsContact CA-OD1 3.26Å; V403-N407 WeakPolarHBondContact CA-OD1 3.37Å; N404-N407 PolarHBondContact N-OD1 2.93Å; N404-N407 PolarHBondContact O-N 2.76Å; N404-N407 PolarHBondContact O-OD1 2.91Å; N404-N407 PolarHBondContact OD1-N 2.83Å; N404-N407 VanDerWaalsContact OD1-N 3.12Å; N404-N407 PolarHBondContact OD1-OD1 2.86Å; N407-W409 PolarHBondContact O-N 3.34Å; N407-W409 VanDerWaalsContact O-N 3.13Å; N407-I410 HydrophobicContact CB-CD1 3.76Å; N407-I410 HydrophobicContact CB-CG1 4.28Å; N407-I410 VanDerWaalsContact O-CB 3.28Å; N407-I410 WeakPolarHBondContact O-CB 3.49Å; N407-I410 WeakPolarHBondContact O-CG1 3.26Å; N407-I410 PolarHBondContact O-N 3.33Å
408	L	70.7	Confident	67	Low	9 Å²	9	61.6 Å²	61.6	5%	0.047	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-57.5	-27.6	178.3	-164.3	50.2	0	0	0	113.6	V403 N404 I410 M411 F416 F436 F552	V403-L408 HydrophobicContact CG1-CD1 3.89Å; N404-L408 PolarHBondContact O-N 2.98Å; N404-L408 VanDerWaalsContact O-N 3.16Å; L408-I410 PolarHBondContact O-N 2.92Å; L408-M411 PolarHBondContact O-N 2.76Å; L408-F416 HydrophobicContact CB-CZ 4.45Å; L408-F416 HydrophobicContact CD2-CE1 4.4Å; L408-F416 HydrophobicContact CD2-CE2 4.39Å; L408-F416 HydrophobicContact CD2-CZ 3.61Å; L408-F416 HydrophobicContact CG-CE2 4.03Å; L408-F416 HydrophobicContact CG-CZ 3.74Å; L408-F436 HydrophobicContact CD1-CE2 4.25Å; L408-F436 HydrophobicContact CD1-CZ 3.8Å; L408-F436 HydrophobicContact CD2-CZ 4.11Å; L408-F436 HydrophobicContact CG-CZ 4.45Å; L408-F552 HydrophobicContact CD1-CD1 4.28Å; L408-F552 HydrophobicContact CD1-CD2 3.93Å; L408-F552 HydrophobicContact CD1-CE1 4.01Å; L408-F552 HydrophobicContact CD1-CE2 3.64Å; L408-F552 HydrophobicContact CD1-CG 4.31Å; L408-F552 HydrophobicContact CD1-CZ 3.74Å; L408-F552 HydrophobicContact CD2-CE1 4.19Å; L408-F552 HydrophobicContact CD2-CE2 3.72Å; L408-F552 HydrophobicContact CD2-CZ 3.41Å; L408-F552 VanDerWaalsContact CD2-CZ 3.41Å; L408-F552 HydrophobicContact CG-CE1 4.09Å; L408-F552 HydrophobicContact CG-CE2 4.1Å; L408-F552 HydrophobicContact CG-CZ 3.76Å
409	W	68.3	Low	65.1	Low	97 Å²	97	65 Å²	65	37%	0.367	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-57.3	-17.5	172.3	61.3	-100	0	0	0	113.9	N376 K406 N407 M411 D412	N376-W409 HydrophobicContact CB-CH2 3.82Å; N376-W409 HydrophobicContact CB-CZ3 4.22Å; N376-W409 VanDerWaalsContact OD1-CZ3 3.26Å; N376-W409 WeakPolarHBondContact OD1-CZ3 3.49Å; K406-W409 PolarHBondContact O-NE1 2.78Å; N407-W409 PolarHBondContact O-N 3.34Å; N407-W409 VanDerWaalsContact O-N 3.13Å; W409-M411 PolarHBondContact O-N 2.98Å; W409-D412 CarbonylContact O-C 3.43Å
410	I	69.7	Low	62.7	Low	6 Å²	6	64.6 Å²	64.6	3%	0.031	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-61.5	-34.7	173.6	-68.4	172.7	0	0	0	110.5	I401 N407 L408 K442	I401-I410 HydrophobicContact CD1-CG2 4.25Å; I401-I410 HydrophobicContact CG2-CD1 3.86Å; I401-I410 HydrophobicContact CG2-CG2 4.39Å; N407-I410 HydrophobicContact CB-CD1 3.76Å; N407-I410 HydrophobicContact CB-CG1 4.28Å; N407-I410 VanDerWaalsContact O-CB 3.28Å; N407-I410 WeakPolarHBondContact O-CB 3.49Å; N407-I410 WeakPolarHBondContact O-CG1 3.26Å; N407-I410 PolarHBondContact O-N 3.33Å; L408-I410 PolarHBondContact O-N 2.92Å; I410-K442 HydrophobicContact CG2-CD 4.08Å; I410-K442 WeakPolarHBondContact O-CD 3.33Å; I410-K442 WeakPolarHBondContact O-CE 3.3Å; I410-K442 PolarHBondContact O-NZ 3.44Å
411	M	67	Low	60.2	Low	7 Å²	7	68.6 Å²	68.6	3%	0.034	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-40.4	-176.6	-66.6	-62.7	-81.7	0	0	111.9	F322 V403 L408 W409 L440 F460 I462	F322-M411 HydrophobicContact CE1-CE 3.71Å; V403-M411 HydrophobicContact CG1-CG 4.22Å; V403-M411 HydrophobicContact CG2-CG 4.28Å; V403-M411 HydrophobicContact CG2-SD 4.46Å; L408-M411 PolarHBondContact O-N 2.76Å; W409-M411 PolarHBondContact O-N 2.98Å; M411-L440 HydrophobicContact CE-CD2 3.55Å; M411-L440 HydrophobicContact CG-CD2 4.3Å; M411-L440 HydrophobicContact SD-CD1 3.91Å; M411-L440 HydrophobicContact SD-CD2 3.22Å; M411-L440 WeakPolarHBondContact SD-CD2 3.33Å; M411-L440 HydrophobicContact SD-CG 4.21Å; M411-F460 HydrophobicContact CE-CD1 3.7Å; M411-F460 HydrophobicContact CE-CE1 3.88Å; M411-F460 HydrophobicContact CE-CG 4.18Å; M411-F460 WeakPolarHBondContact O-CZ 3.45Å; M411-F460 HydrophobicContact SD-CD1 3.53Å; M411-F460 VanDerWaalsContact SD-CD1 3.53Å; M411-F460 HydrophobicContact SD-CE1 3.33Å; M411-F460 WeakPolarHBondContact SD-CE1 3.27Å; M411-F460 HydrophobicContact SD-CZ 4.25Å; M411-I462 HydrophobicContact CE-CD1 4.16Å
412	D	60.8	Low	58	Low	25 Å²	25	77.8 Å²	77.8	13%	0.134	39%	0.388	C	S	.	.			trans	-158.8	126.3	175.6	-142.5	-42.3	0	0	0	111.2	N320 W409 E414 V415 F416	N320-D412 PolarHBondContact ND2-OD2 3.27Å; W409-D412 CarbonylContact O-C 3.43Å; D412-E414 PolarHBondContact OD1-N 3.4Å; D412-V415 HydrophobicContact CB-CB 4.08Å; D412-V415 HydrophobicContact CB-CG2 3.85Å; D412-V415 VanDerWaalsContact CG-CG2 3.49Å; D412-V415 WeakPolarHBondContact OD2-CG2 3.16Å; D412-F416 WeakPolarHBondContact O-CD2 3.47Å
413	K	54.3	Low	55.9	Low	129 Å²	129	79.7 Å²	79.7	56%	0.561	40%	0.396	S	S	*	.	S	Bend	trans	-86.7	-20.6	170.7	-79.8	-173.5	175.4	-176.2	0	111.5	N417	K413-N417 PolarHBondContact O-ND2 2.9Å
414	E	45.3	Very low	53.9	Low	144 Å²	144	83.7 Å²	83.7	67%	0.673	42%	0.422	S	S	*	.	S	Bend	trans	-86.4	-38.3	-171.7	-66.4	-179.8	171.4	0	0	111.2	D412 F416 N417 D418	D412-E414 PolarHBondContact OD1-N 3.4Å; E414-F416 VanDerWaalsContact C-N 3.29Å; E414-F416 PolarHBondContact O-N 3.31Å; E414-N417 PolarHBondContact O-N 3.01Å; E414-N417 VanDerWaalsContact O-N 3.09Å; E414-D418 PolarHBondContact O-N 3.09Å
415	V	44	Very low	52	Low	34 Å²	34	87.7 Å²	87.7	21%	0.206	45%	0.448	C	S	.	.	H	α-helix	trans	-64.3	-30	-177.9	177.1	0	0	0	0	113.3	D412 H419 A551	D412-V415 HydrophobicContact CB-CB 4.08Å; D412-V415 HydrophobicContact CB-CG2 3.85Å; D412-V415 VanDerWaalsContact CG-CG2 3.49Å; D412-V415 WeakPolarHBondContact OD2-CG2 3.16Å; V415-H419 PolarHBondContact O-CD2 3.49Å; V415-A551 HydrophobicContact CG2-CB 4.32Å
416	F	42.7	Very low	50.6	Low	105 Å²	105	93.2 Å²	93.2	46%	0.461	48%	0.476	S	S	.	.	H	α-helix	trans	-80.6	-21.6	177.3	-70.6	-76.8	0	0	0	113.4	L408 D412 E414 F552	L408-F416 HydrophobicContact CB-CZ 4.45Å; L408-F416 HydrophobicContact CD2-CE1 4.4Å; L408-F416 HydrophobicContact CD2-CE2 4.39Å; L408-F416 HydrophobicContact CD2-CZ 3.61Å; L408-F416 HydrophobicContact CG-CE2 4.03Å; L408-F416 HydrophobicContact CG-CZ 3.74Å; D412-F416 WeakPolarHBondContact O-CD2 3.47Å; E414-F416 VanDerWaalsContact C-N 3.29Å; E414-F416 PolarHBondContact O-N 3.31Å; F416-F552 HydrophobicContact CE2-CE1 4.44Å; F416-F552 AromaticContact CZ-CE1 3.98Å; F416-F552 HydrophobicContact CZ-CE1 3.98Å; F416-F552 HydrophobicContact CZ-CZ 4.07Å
417	N	41.5	Very low	49.5	Very low	129 Å²	129	90.9 Å²	90.9	69%	0.69	47%	0.472	S	S	*	.	H	α-helix	trans	-94.8	-32.2	-176.3	-73.1	-20	0	0	0	112.6	K413 E414	K413-N417 PolarHBondContact O-ND2 2.9Å; E414-N417 PolarHBondContact O-N 3.01Å; E414-N417 VanDerWaalsContact O-N 3.09Å
418	D	40.3	Very low	48.5	Very low	134 Å²	134	93.1 Å²	93.1	72%	0.717	49%	0.488	S	S	*	.	H	α-helix	trans	-83.2	-12.1	-177.8	-81.2	-13.3	0	0	0	114.4	E414 G420	E414-D418 PolarHBondContact O-N 3.09Å; D418-G420 VanDerWaalsContact C-N 3.32Å; D418-G420 PolarHBondContact O-N 2.86Å
419	H	41.8	Very low	47.6	Very low	101 Å²	101	93.7 Å²	93.7	47%	0.468	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	14.4	178	-69.1	-39.4	0	0	0	115	V415 N421 Y422	V415-H419 PolarHBondContact O-CD2 3.49Å; H419-N421 PolarHBondContact O-N 3.1Å; H419-Y422 PolarHBondContact O-N 3.46Å
420	G	35.2	Very low	46.9	Very low	66 Å²	66	96 Å²	96	68%	0.68	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-6.1	178.8	0	0	0	0	0	116.6	D418	D418-G420 VanDerWaalsContact C-N 3.32Å; D418-G420 PolarHBondContact O-N 2.86Å
421	N	33.9	Very low	46.4	Very low	148 Å²	148	97.1 Å²	97.1	79%	0.791	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.9	3.1	-175.7	-75	-24.6	0	0	0	116.2	H419	H419-N421 PolarHBondContact O-N 3.1Å
422	Y	39.9	Very low	45.9	Very low	193 Å²	193	101 Å²	101	76%	0.757	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.5	2.7	-175.2	-78.8	-79.6	0	0	0	116.4	H419	H419-Y422 PolarHBondContact O-N 3.46Å
423	L	41.3	Very low	45.8	Very low	95 Å²	95	107.3 Å²	107.3	50%	0.497	56%	0.564	S	S	.	*	S	Bend	trans	-79.3	125.4	162.3	-76	160	0	0	0	107.6	T425	L423-T425 PolarHBondContact O-N 3.42Å
424	P	38.6	Very low	46.4	Very low	83 Å²	83	101.5 Å²	101.5	54%	0.539	54%	0.54	S	S	.	.			trans	-52.3	118.8	160.5	-12.2	25.6	0	0	0	105.3	D426	P424-D426 PolarHBondContact O-N 2.9Å
425	T	40	Very low	47.6	Very low	127 Å²	127	100.5 Å²	100.5	78%	0.779	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	2.1	-173.6	38.1	0	0	0	0	114.3	L423	L423-T425 PolarHBondContact O-N 3.42Å
426	D	43.4	Very low	49.1	Very low	129 Å²	129	99 Å²	99	69%	0.69	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	-6	-161	-63.2	-5	0	0	0	113.8	P424	P424-D426 PolarHBondContact O-N 2.9Å
427	D	48	Very low	51	Low	116 Å²	116	98.6 Å²	98.6	62%	0.62	53%	0.529	S	S	*	.			trans	-171.1	82.6	163.9	-89.4	-35.7	0	0	0	112.4	I429	D427-I429 PolarHBondContact O-N 3.38Å; D427-I429 VanDerWaalsContact O-N 3.15Å
428	P	50.9	Low	53.1	Low	78 Å²	78	93 Å²	93	51%	0.506	50%	0.499	S	S	.	.			trans	-69.9	108.9	160.5	29	-28	0	0	0	106.8	K430	P428-K430 PolarHBondContact O-N 2.8Å
429	I	51.8	Low	55.3	Low	22 Å²	22	88.5 Å²	88.5	11%	0.113	47%	0.474	C	S	.	.			trans	-55.2	101	161	-65.4	171.4	0	0	0	105.3	D427 L431 H472 I486 N488	D427-I429 PolarHBondContact O-N 3.38Å; D427-I429 VanDerWaalsContact O-N 3.15Å; I429-L431 PolarHBondContact O-N 3.46Å; I429-H472 VanDerWaalsContact CG1-CE1 3.47Å; I429-H472 WeakPolarHBondContact CG1-CE1 3.32Å; I429-I486 HydrophobicContact CD1-CB 3.92Å; I429-I486 HydrophobicContact CD1-CG2 3.52Å; I429-N488 WeakPolarHBondContact CB-ND2 3.45Å; I429-N488 VanDerWaalsContact CG2-ND2 3.3Å; I429-N488 WeakPolarHBondContact CG2-ND2 3.4Å
430	K	55.4	Low	57.6	Low	145 Å²	145	83.7 Å²	83.7	63%	0.63	45%	0.451	S	S	*	.			trans	-64.6	105.3	173	-75.4	-175.1	179.2	-179.5	0	105.1	P428 D432	P428-K430 PolarHBondContact O-N 2.8Å; K430-D432 HydrophobicContact CB-CB 4.23Å; K430-D432 PolarHBondContact O-N 3.07Å
431	L	59.3	Low	60.3	Low	30 Å²	30	80.7 Å²	80.7	16%	0.157	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-57.7	-16.5	171.5	-89.7	116	0	0	0	111.2	S405 I429 D433 V434 F436	S405-L431 WeakPolarHBondContact CB-O 3.42Å; I429-L431 PolarHBondContact O-N 3.46Å; L431-D433 PolarHBondContact O-N 3.08Å; L431-V434 WeakPolarHBondContact O-CB 3.39Å; L431-V434 PolarHBondContact O-N 2.77Å; L431-F436 HydrophobicContact CD2-CD1 3.95Å; L431-F436 HydrophobicContact CD2-CE1 3.41Å; L431-F436 VanDerWaalsContact CD2-CE1 3.41Å; L431-F436 HydrophobicContact CD2-CZ 4.21Å
432	D	55.6	Low	63	Low	88 Å²	88	74.4 Å²	74.4	47%	0.471	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-40.5	-38.3	-177	-61.6	-17.9	0	0	0	114.5	S405 K430	S405-D432 PolarHBondContact OG-O 3.09Å; K430-D432 HydrophobicContact CB-CB 4.23Å; K430-D432 PolarHBondContact O-N 3.07Å
433	D	59.2	Low	65.6	Low	157 Å²	157	65.2 Å²	65.2	84%	0.84	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-98.2	4.3	-177.3	-65.2	-36.6	0	0	0	114.9	L431	L431-D433 PolarHBondContact O-N 3.08Å
434	V	66.5	Low	68	Low	8 Å²	8	60.9 Å²	60.9	5%	0.048	33%	0.326	C	S	.	.			trans	-97.3	109.3	-173.7	-171.3	0	0	0	0	110.6	S405 L431 F436 F468 H470	S405-V434 VanDerWaalsContact CB-O 3.31Å; S405-V434 WeakPolarHBondContact CB-O 3.46Å; S405-V434 PolarHBondContact OG-O 2.78Å; L431-V434 WeakPolarHBondContact O-CB 3.39Å; L431-V434 PolarHBondContact O-N 2.77Å; V434-F436 HydrophobicContact CG1-CD1 4.37Å; V434-F436 WeakPolarHBondContact O-CD1 3.38Å; V434-F436 PolarHBondContact O-N 2.83Å; V434-F468 HydrophobicContact CG1-CE1 3.32Å; V434-F468 HydrophobicContact CG1-CZ 3.29Å; V434-H470 HydrophobicContact CG1-CB 3.92Å; V434-H470 WeakPolarHBondContact CG2-CD2 3.33Å; V434-H470 VanDerWaalsContact CG2-NE2 3.35Å; V434-H470 WeakPolarHBondContact CG2-NE2 3.22Å
435	N	69.7	Low	70.6	Confident	122 Å²	122	56.9 Å²	56.9	65%	0.652	30%	0.301	S	S	*	.			trans	-79.4	64	-179	-170.4	22.7	0	0	0	112.4
436	F	76.4	Confident	73.1	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.009	27%	0.273	C	S	.	.			trans	-85.1	154.3	164.1	73.6	-88.8	0	0	0	110.2	N404 L408 L431 V434 I438 F468 V490	N404-F436 VanDerWaalsContact CA-O 3.24Å; N404-F436 WeakPolarHBondContact CA-O 3.33Å; N404-F436 VanDerWaalsContact CB-O 3.25Å; N404-F436 WeakPolarHBondContact CB-O 3.42Å; L408-F436 HydrophobicContact CD1-CE2 4.25Å; L408-F436 HydrophobicContact CD1-CZ 3.8Å; L408-F436 HydrophobicContact CD2-CZ 4.11Å; L408-F436 HydrophobicContact CG-CZ 4.45Å; L431-F436 HydrophobicContact CD2-CD1 3.95Å; L431-F436 HydrophobicContact CD2-CE1 3.41Å; L431-F436 VanDerWaalsContact CD2-CE1 3.41Å; L431-F436 HydrophobicContact CD2-CZ 4.21Å; V434-F436 HydrophobicContact CG1-CD1 4.37Å; V434-F436 WeakPolarHBondContact O-CD1 3.38Å; V434-F436 PolarHBondContact O-N 2.83Å; F436-I438 HydrophobicContact CD2-CD1 4.3Å; F436-I438 HydrophobicContact CD2-CG1 3.92Å; F436-I438 HydrophobicContact CE2-CD1 3.99Å; F436-I438 HydrophobicContact CE2-CG1 4.02Å; F436-F468 HydrophobicContact CB-CB 4.37Å; F436-F468 HydrophobicContact CB-CD1 3.49Å; F436-F468 VanDerWaalsContact CB-CD1 3.49Å; F436-F468 HydrophobicContact CB-CD2 3.68Å; F436-F468 HydrophobicContact CB-CE1 3.6Å; F436-F468 HydrophobicContact CB-CE2 3.77Å; F436-F468 HydrophobicContact CB-CG 3.54Å; F436-F468 HydrophobicContact CB-CZ 3.74Å; F436-F468 HydrophobicContact CD1-CE1 4.47Å; F436-F468 HydrophobicContact CG-CD1 4.28Å; F436-F468 HydrophobicContact CG-CE1 4.4Å; F436-V490 HydrophobicContact CD2-CG1 4.4Å
437	Q	83	Confident	75.5	Confident	98 Å²	98	46.6 Å²	46.6	46%	0.458	24%	0.24	S	C	.	.			trans	-133.3	123	175.8	-64.7	-176	7.7	0	0	108.6	T402 V403	T402-Q437 HydrophobicContact CG2-CB 3.98Å; T402-Q437 HydrophobicContact CG2-CG 4.05Å; V403-Q437 CarbonylContact O-C 3.5Å; V403-Q437 VanDerWaalsContact O-CA 3.32Å; V403-Q437 WeakPolarHBondContact O-CA 3.49Å
438	I	84.5	Confident	77.5	Confident	11 Å²	11	42 Å²	42	6%	0.056	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	128.3	169.2	-50.6	175.8	0	0	0	107.3	T402 V403 F436 L440 I462 V490	T402-I438 WeakPolarHBondContact CA-O 3.48Å; V403-I438 HydrophobicContact CB-CB 4.37Å; V403-I438 PolarHBondContact N-O 3.21Å; V403-I438 PolarHBondContact O-N 2.8Å; F436-I438 HydrophobicContact CD2-CD1 4.3Å; F436-I438 HydrophobicContact CD2-CG1 3.92Å; F436-I438 HydrophobicContact CE2-CD1 3.99Å; F436-I438 HydrophobicContact CE2-CG1 4.02Å; I438-L440 HydrophobicContact CG2-CD2 3.99Å; I438-I462 HydrophobicContact CG2-CG2 3.88Å; I438-V490 HydrophobicContact CD1-CG1 3.41Å; I438-V490 VanDerWaalsContact CD1-CG1 3.41Å; I438-V490 HydrophobicContact CG1-CG1 3.96Å
439	H	87.3	Confident	79.2	Confident	40 Å²	40	38.8 Å²	38.8	19%	0.185	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	121	176.4	-69.7	-54.8	0	0	0	111	M400 T402 Q463 E465	M400-H439 HydrophobicContact CE-CB 4.38Å; M400-H439 HydrophobicContact CG-CB 4.25Å; M400-H439 HydrophobicContact SD-CB 3.58Å; M400-H439 VanDerWaalsContact SD-CB 3.58Å; T402-H439 PolarHBondContact OG1-CE1 2.85Å; T402-H439 VanDerWaalsContact OG1-CE1 3.27Å; T402-H439 PolarHBondContact OG1-ND1 2.86Å; T402-H439 VanDerWaalsContact OG1-ND1 3.16Å; H439-Q463 HydrophobicContact CB-CB 4.12Å; H439-Q463 PolarHBondContact O-N 3.25Å; H439-E465 IonicContact CD2-OE1 2.74Å; H439-E465 PolarHBondContact CD2-OE1 2.97Å; H439-E465 VanDerWaalsContact CD2-OE1 3.3Å
440	L	90.5	Very high	80.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	165.4	-175.7	62.8	88.1	0	0	0	114.3	I401 V403 M411 I438 K442 F460 I461 I462	I401-L440 HydrophobicContact CB-CD1 4.21Å; I401-L440 PolarHBondContact N-O 2.82Å; I401-L440 PolarHBondContact O-N 3.01Å; V403-L440 HydrophobicContact CB-CD2 4.34Å; V403-L440 HydrophobicContact CG2-CD1 4.3Å; V403-L440 HydrophobicContact CG2-CD2 3.7Å; V403-L440 HydrophobicContact CG2-CG 4.04Å; M411-L440 HydrophobicContact CE-CD2 3.55Å; M411-L440 HydrophobicContact CG-CD2 4.3Å; M411-L440 HydrophobicContact SD-CD1 3.91Å; M411-L440 HydrophobicContact SD-CD2 3.22Å; M411-L440 WeakPolarHBondContact SD-CD2 3.33Å; M411-L440 HydrophobicContact SD-CG 4.21Å; I438-L440 HydrophobicContact CG2-CD2 3.99Å; L440-K442 HydrophobicContact CD1-CB 4.21Å; L440-F460 HydrophobicContact CD1-CD1 4.28Å; L440-I461 CarbonylContact C-O 3.43Å; L440-I461 WeakPolarHBondContact CA-O 3.47Å; L440-I461 WeakPolarHBondContact CB-O 3.43Å; L440-I462 HydrophobicContact CB-CB 4.49Å; L440-I462 HydrophobicContact CB-CG1 3.94Å; L440-I462 HydrophobicContact CD2-CG1 4.49Å
441	W	91.4	Very high	81.3	Confident	3 Å²	3	41 Å²	41	1%	0.011	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.1	165.9	-62.5	-95.5	0	0	0	109.1	L325 L371 L394 L398 E399 M400 F443 F460 I461	L325-W441 HydrophobicContact CD1-CH2 4.39Å; L325-W441 HydrophobicContact CD1-CZ3 3.79Å; L371-W441 HydrophobicContact CD1-CB 4.48Å; L394-W441 HydrophobicContact CD1-CB 4.2Å; L394-W441 HydrophobicContact CD1-CD2 3.58Å; L394-W441 HydrophobicContact CD1-CE3 4.13Å; L394-W441 HydrophobicContact CD1-CG 3.62Å; L394-W441 HydrophobicContact CD1-CZ2 4.37Å; L394-W441 HydrophobicContact CD2-CD2 3.98Å; L394-W441 HydrophobicContact CD2-CE3 3.73Å; L394-W441 HydrophobicContact CD2-CH2 3.71Å; L394-W441 HydrophobicContact CD2-CZ2 3.99Å; L394-W441 HydrophobicContact CD2-CZ3 3.61Å; L394-W441 HydrophobicContact CG-CD2 3.72Å; L394-W441 HydrophobicContact CG-CE3 4.02Å; L394-W441 HydrophobicContact CG-CG 4.28Å; L394-W441 HydrophobicContact CG-CH2 3.91Å; L394-W441 HydrophobicContact CG-CZ2 3.63Å; L394-W441 HydrophobicContact CG-CZ3 4.13Å; L394-W441 PolarHBondContact O-NE1 3.3Å; L398-W441 PolarHBondContact O-NE1 2.96Å; E399-W441 VanDerWaalsContact O-CD1 3.24Å; M400-W441 HydrophobicContact CB-CZ2 4Å; M400-W441 HydrophobicContact CE-CH2 3.13Å; M400-W441 HydrophobicContact CE-CZ2 3.39Å; M400-W441 HydrophobicContact CE-CZ3 3.82Å; M400-W441 HydrophobicContact CG-CZ2 4.24Å; W441-F443 HydrophobicContact CB-CD2 4.4Å; W441-F443 HydrophobicContact CB-CE2 3.51Å; W441-F443 HydrophobicContact CB-CZ 3.91Å; W441-F460 WeakPolarHBondContact O-CA 3.35Å; W441-I461 HydrophobicContact CB-CB 4.38Å; W441-I461 HydrophobicContact CE3-CB 4.1Å; W441-I461 HydrophobicContact CE3-CG2 3.89Å; W441-I461 HydrophobicContact CZ3-CG2 4.24Å; W441-I461 PolarHBondContact N-O 3.23Å; W441-I461 PolarHBondContact O-N 3.27Å
442	K	91.2	Very high	82.1	Confident	15 Å²	15	40.7 Å²	40.7	7%	0.065	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	123	178.2	177.5	-173.9	-179	-177	0	110.1	W372 I401 I410 L440 F460	W372-K442 HydrophobicContact CB-CB 4.05Å; W372-K442 HydrophobicContact CB-CD 4.12Å; W372-K442 HydrophobicContact CB-CG 4.22Å; W372-K442 VanDerWaalsContact CD1-CG 3.45Å; W372-K442 HydrophobicContact CD2-CD 4.05Å; W372-K442 HydrophobicContact CG-CB 4.28Å; W372-K442 HydrophobicContact CG-CD 3.63Å; W372-K442 HydrophobicContact CG-CG 3.89Å; W372-K442 PolarHBondContact N-O 3.05Å; I401-K442 HydrophobicContact CD1-CB 4.26Å; I410-K442 HydrophobicContact CG2-CD 4.08Å; I410-K442 WeakPolarHBondContact O-CD 3.33Å; I410-K442 WeakPolarHBondContact O-CE 3.3Å; I410-K442 PolarHBondContact O-NZ 3.44Å; L440-K442 HydrophobicContact CD1-CB 4.21Å; K442-F460 HydrophobicContact CB-CD1 3.95Å; K442-F460 HydrophobicContact CB-CE1 3.87Å; K442-F460 HydrophobicContact CD-CE1 3.78Å; K442-F460 HydrophobicContact CD-CZ 4.28Å; K442-F460 HydrophobicContact CG-CD1 3.99Å; K442-F460 HydrophobicContact CG-CE1 3.48Å; K442-F460 VanDerWaalsContact CG-CE1 3.48Å; K442-F460 HydrophobicContact CG-CZ 4.08Å
443	F	92.7	Very high	83.3	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	146.3	175.2	-55.5	-94.8	0	0	0	109.7	L355 W369 F370 L371 L381 L387 L389 L394 L398 W441 N458 R459 I461	L355-F443 HydrophobicContact CD1-CB 4.21Å; L355-F443 HydrophobicContact CD1-CD1 4.44Å; L355-F443 HydrophobicContact CD1-CD2 3.52Å; L355-F443 HydrophobicContact CD1-CE2 3.96Å; L355-F443 HydrophobicContact CD1-CG 3.8Å; W369-F443 HydrophobicContact CE3-CB 4.22Å; W369-F443 HydrophobicContact CZ3-CB 4.29Å; F370-F443 CarbonylContact O-C 3.53Å; F370-F443 WeakPolarHBondContact O-CA 3.24Å; L371-F443 HydrophobicContact CB-CD1 4.47Å; L371-F443 HydrophobicContact CD1-CD1 4.09Å; L371-F443 HydrophobicContact CD1-CE1 3.76Å; L371-F443 HydrophobicContact CD1-CZ 4.01Å; L381-F443 HydrophobicContact CD1-CD1 3.71Å; L381-F443 HydrophobicContact CD1-CE1 3.72Å; L387-F443 HydrophobicContact CD2-CD1 3.62Å; L387-F443 HydrophobicContact CD2-CE1 3.96Å; L387-F443 HydrophobicContact CD2-CG 4.29Å; L389-F443 HydrophobicContact CD1-CE1 3.71Å; L389-F443 HydrophobicContact CD1-CE2 4.4Å; L389-F443 HydrophobicContact CD1-CZ 3.54Å; L394-F443 HydrophobicContact CD1-CZ 4Å; L398-F443 HydrophobicContact CD1-CE1 3.99Å; L398-F443 HydrophobicContact CD1-CZ 4.04Å; W441-F443 HydrophobicContact CB-CD2 4.4Å; W441-F443 HydrophobicContact CB-CE2 3.51Å; W441-F443 HydrophobicContact CB-CZ 3.91Å; F443-N458 CarbonylContact O-C 3.45Å; F443-N458 VanDerWaalsContact O-CA 3.31Å; F443-N458 WeakPolarHBondContact O-CA 3.21Å; F443-R459 HydrophobicContact CB-CB 4.33Å; F443-R459 PolarHBondContact N-O 2.74Å; F443-R459 PolarHBondContact O-N 2.74Å; F443-I461 HydrophobicContact CD2-CD1 4.48Å; F443-I461 HydrophobicContact CD2-CG1 4.48Å; F443-I461 HydrophobicContact CE2-CB 4.44Å; F443-I461 HydrophobicContact CE2-CD1 3.58Å; F443-I461 HydrophobicContact CE2-CG1 3.89Å; F443-I461 HydrophobicContact CZ-CD1 4.08Å
444	T	92.5	Very high	84.6	Confident	4 Å²	4	37.9 Å²	37.9	3%	0.025	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127.4	169.6	-62.4	0	0	0	0	108.4	F370 W372 I446 A457 N458	F370-T444 PolarHBondContact N-O 2.96Å; F370-T444 PolarHBondContact O-N 3.07Å; W372-T444 PolarHBondContact NE1-OG1 3.26Å; T444-I446 HydrophobicContact CG2-CG1 3.97Å; T444-A457 WeakPolarHBondContact CA-O 3.43Å; T444-N458 PolarHBondContact OG1-OD1 2.8Å
445	C	93.6	Very high	85.5	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	136	164.7	68.2	0	0	0	0	109.3	C357 I367 Q368 W369 S456 A457	C357-C445 HydrophobicContact CB-CB 3.41Å; C357-C445 VanDerWaalsContact CB-CB 3.41Å; C357-C445 WeakPolarHBondContact CB-SG 3.39Å; C357-C445 WeakPolarHBondContact SG-CB 3.32Å; C357-C445 CovalentContact SG-SG 2.04Å; C357-C445 PolarHBondContact SG-SG 2.82Å; I367-C445 HydrophobicContact CG2-CB 4.33Å; Q368-C445 CarbonylContact O-C 3.56Å; Q368-C445 WeakPolarHBondContact O-CA 3.33Å; W369-C445 HydrophobicContact CD2-CB 3.97Å; W369-C445 HydrophobicContact CE3-CB 3.85Å; W369-C445 HydrophobicContact CH2-CB 3.91Å; W369-C445 HydrophobicContact CZ2-CB 4.01Å; W369-C445 HydrophobicContact CZ3-CB 3.83Å; C445-S456 CarbonylContact O-C 3.59Å; C445-S456 WeakPolarHBondContact O-CA 3.44Å; C445-A457 PolarHBondContact N-O 3.28Å; C445-A457 PolarHBondContact O-N 2.67Å
446	I	93.2	Very high	86.4	Confident	39 Å²	39	36.7 Å²	36.7	20%	0.2	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	115.2	176	-55.9	-176.2	0	0	0	108	I367 Q368 F370 T444 Q455	I367-I446 CarbonylContact C-O 3.52Å; I367-I446 WeakPolarHBondContact CA-O 3.38Å; Q368-I446 PolarHBondContact N-O 2.85Å; Q368-I446 PolarHBondContact O-N 3.39Å; F370-I446 HydrophobicContact CD2-CD1 3.87Å; F370-I446 HydrophobicContact CD2-CG1 4.05Å; F370-I446 HydrophobicContact CE2-CB 4.31Å; F370-I446 HydrophobicContact CE2-CD1 3.62Å; F370-I446 HydrophobicContact CE2-CG1 3.99Å; F370-I446 HydrophobicContact CZ-CD1 4.43Å; T444-I446 HydrophobicContact CG2-CG1 3.97Å; I446-Q455 CarbonylContact C-O 3.57Å; I446-Q455 WeakPolarHBondContact CA-O 3.23Å
447	A	92	Very high	87	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	126.5	172	0	0	0	0	0	109.3	P313 I315 T359 R366 I367 S454 Q455	P313-A447 HydrophobicContact CB-CB 3.6Å; P313-A447 HydrophobicContact CG-CB 4.22Å; P313-A447 WeakPolarHBondContact CG-O 3.45Å; I315-A447 HydrophobicContact CD1-CB 4.03Å; I315-A447 HydrophobicContact CG1-CB 3.92Å; T359-A447 HydrophobicContact CG2-CB 4Å; R366-A447 WeakPolarHBondContact O-CA 3.2Å; I367-A447 HydrophobicContact CG1-CB 4.38Å; A447-S454 CarbonylContact O-C 3.54Å; A447-S454 VanDerWaalsContact O-CA 3.23Å; A447-S454 WeakPolarHBondContact O-CA 3.02Å; A447-S454 WeakPolarHBondContact O-CB 3.3Å; A447-Q455 PolarHBondContact N-O 3.1Å; A447-Q455 PolarHBondContact O-N 3.17Å
448	S	90.7	Very high	87.3	Confident	21 Å²	21	33.7 Å²	33.7	15%	0.147	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	135.6	-180	53.9	0	0	0	0	110.7	G365 R366	G365-S448 CarbonylContact C-O 3.33Å; G365-S448 WeakPolarHBondContact CA-O 3.44Å; R366-S448 WeakPolarHBondContact CG-OG 3.16Å; R366-S448 PolarHBondContact N-O 2.91Å; R366-S448 PolarHBondContact NE-OG 3.26Å; R366-S448 VanDerWaalsContact NE-OG 3.16Å; R366-S448 PolarHBondContact O-N 2.88Å
449	S	86.2	Confident	87.6	Confident	9 Å²	9	33.2 Å²	33.2	6%	0.063	20%	0.204	C	C	.	.			trans	-129	149.5	172.6	-171.7	0	0	0	0	109.7	P363 G451 F452	P363-S449 PolarHBondContact O-OG 2.96Å; S449-G451 PolarHBondContact O-N 3.3Å; S449-F452 PolarHBondContact O-N 2.82Å
450	L	79.8	Confident	87.7	Confident	144 Å²	144	31.3 Å²	31.3	75%	0.754	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	125.6	-174.3	-176.1	69.7	0	0	0	110.7	F452	L450-F452 VanDerWaalsContact C-N 3.32Å; L450-F452 VanDerWaalsContact O-CD2 3.26Å; L450-F452 WeakPolarHBondContact O-CD2 3.28Å
451	G	71.9	Confident	87.7	Confident	71 Å²	71	31.3 Å²	31.3	73%	0.732	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	83	6.1	-179.5	0	0	0	0	0	114.7	S449	S449-G451 PolarHBondContact O-N 3.3Å
452	F	77.2	Confident	87.6	Confident	22 Å²	22	31.2 Å²	31.2	10%	0.096	19%	0.194	C	C	.	.	S	Bend	trans	-125.4	149.4	179.2	-63.7	-84.3	0	0	0	111.3	L123 Y124 Y311 S449 L450	L123-F452 HydrophobicContact CD2-CE1 4.09Å; L123-F452 HydrophobicContact CD2-CE2 4.3Å; L123-F452 HydrophobicContact CD2-CZ 3.5Å; Y124-F452 HydrophobicContact CD2-CD1 4.23Å; Y124-F452 AromaticContact CD2-CE1 3.82Å; Y124-F452 HydrophobicContact CD2-CE1 3.82Å; Y124-F452 AromaticContact CE2-CD1 3.25Å; Y124-F452 HydrophobicContact CE2-CD1 3.25Å; Y124-F452 AromaticContact CE2-CE1 3.3Å; Y124-F452 HydrophobicContact CE2-CE1 3.3Å; Y124-F452 AromaticContact CZ-CD1 3.59Å; Y124-F452 AromaticContact CZ-CE1 3.97Å; Y124-F452 WeakPolarHBondContact OH-CD1 3.23Å; Y311-F452 VanDerWaalsContact CA-CE1 3.5Å; S449-F452 PolarHBondContact O-N 2.82Å; L450-F452 VanDerWaalsContact C-N 3.32Å; L450-F452 VanDerWaalsContact O-CD2 3.26Å; L450-F452 WeakPolarHBondContact O-CD2 3.28Å
453	D	80.6	Confident	87.4	Confident	110 Å²	110	31.6 Å²	31.6	59%	0.588	20%	0.196	S	C	*	.			trans	-64	137.4	173.4	-60.2	-30	0	0	0	110.1
454	S	85.4	Confident	87.1	Confident	77 Å²	77	31.7 Å²	31.7	54%	0.538	20%	0.197	S	C	.	.			trans	-70.1	144.8	175.8	55.6	0	0	0	0	111	A447	A447-S454 CarbonylContact O-C 3.54Å; A447-S454 VanDerWaalsContact O-CA 3.23Å; A447-S454 WeakPolarHBondContact O-CA 3.02Å; A447-S454 WeakPolarHBondContact O-CB 3.3Å
455	Q	86.1	Confident	86.9	Confident	32 Å²	32	34.3 Å²	34.3	15%	0.15	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	146.9	168.6	-65.1	-160.2	13.7	0	0	110.4	P313 I315 R318 I446 A447	P313-Q455 HydrophobicContact CG-CG 4.39Å; P313-Q455 WeakPolarHBondContact O-CG 3.3Å; P313-Q455 PolarHBondContact O-NE2 3.49Å; P313-Q455 PolarHBondContact O-OE1 3.35Å; I315-Q455 HydrophobicContact CD1-CB 3.86Å; I315-Q455 WeakPolarHBondContact CD1-O 3.47Å; I315-Q455 HydrophobicContact CG1-CB 4.09Å; R318-Q455 VanDerWaalsContact NH2-OE1 3.09Å; I446-Q455 CarbonylContact C-O 3.57Å; I446-Q455 WeakPolarHBondContact CA-O 3.23Å; A447-Q455 PolarHBondContact N-O 3.1Å; A447-Q455 PolarHBondContact O-N 3.17Å
456	S	89.1	Confident	86.6	Confident	73 Å²	73	40.3 Å²	40.3	51%	0.51	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	147.5	174.3	58.9	0	0	0	0	111.4	C445	C445-S456 CarbonylContact O-C 3.59Å; C445-S456 WeakPolarHBondContact O-CA 3.44Å
457	A	88.7	Confident	86.5	Confident	3 Å²	3	38.5 Å²	38.5	3%	0.025	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	143.7	170.7	0	0	0	0	0	110.5	I315 T444 C445	I315-A457 HydrophobicContact CD1-CB 4.06Å; I315-A457 HydrophobicContact CG2-CB 3.83Å; T444-A457 WeakPolarHBondContact CA-O 3.43Å; C445-A457 PolarHBondContact N-O 3.28Å; C445-A457 PolarHBondContact O-N 2.67Å
458	N	89	Confident	86.4	Confident	34 Å²	34	41.6 Å²	41.6	18%	0.182	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	146	178.9	-58.9	-48.1	0	0	0	111.1	N320 Q321 F443 T444 F460	N320-N458 WeakPolarHBondContact OD1-CB 3.33Å; Q321-N458 PolarHBondContact N-O 2.82Å; F443-N458 CarbonylContact O-C 3.45Å; F443-N458 VanDerWaalsContact O-CA 3.31Å; F443-N458 WeakPolarHBondContact O-CA 3.21Å; T444-N458 PolarHBondContact OG1-OD1 2.8Å; N458-F460 HydrophobicContact CB-CD2 4.46Å; N458-F460 HydrophobicContact CB-CE2 3.51Å; N458-F460 HydrophobicContact CB-CZ 3.72Å
459	R	90.3	Very high	86.3	Confident	1 Å²	1	41.1 Å²	41.1	0%	0.004	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	134.9	176.1	-55.3	-66.2	177.9	-113.8	13.4	107.9	N317 E319 Q321 L355 Q356 W369 F443	N317-R459 PolarHBondContact O-NH1 2.88Å; N317-R459 PolarHBondContact O-NH2 2.95Å; E319-R459 PolarHBondContact O-NH1 3.48Å; E319-R459 VanDerWaalsContact O-NH1 3.16Å; Q321-R459 VanDerWaalsContact OE1-CD 3.25Å; Q321-R459 VanDerWaalsContact OE1-NE 3.08Å; L355-R459 HydrophobicContact CD1-CB 4.1Å; L355-R459 HydrophobicContact CD2-CB 4.44Å; Q356-R459 PolarHBondContact O-NE 2.83Å; W369-R459 HydrophobicContact CH2-CG 3.9Å; W369-R459 HydrophobicContact CZ3-CB 4.25Å; W369-R459 HydrophobicContact CZ3-CG 3.74Å; F443-R459 HydrophobicContact CB-CB 4.33Å; F443-R459 PolarHBondContact N-O 2.74Å; F443-R459 PolarHBondContact O-N 2.74Å
460	F	89.3	Confident	86.4	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	135.8	-173.5	-59.7	-92.4	0	0	0	109.9	N320 Q321 F322 Y323 M411 L440 W441 K442 N458 I462	N320-F460 HydrophobicContact CB-CD2 4.04Å; N320-F460 HydrophobicContact CB-CE2 3.61Å; Q321-F460 PolarHBondContact O-N 3.02Å; F322-F460 CarbonylContact C-O 3.57Å; F322-F460 WeakPolarHBondContact CA-O 3.11Å; F322-F460 HydrophobicContact CD1-CB 3.63Å; F322-F460 HydrophobicContact CD1-CD2 4.03Å; F322-F460 HydrophobicContact CD1-CG 4.02Å; F322-F460 HydrophobicContact CE1-CB 3.97Å; F322-F460 AromaticContact CE1-CD2 3.67Å; F322-F460 HydrophobicContact CE1-CD2 3.67Å; F322-F460 HydrophobicContact CE1-CE2 4.33Å; F322-F460 AromaticContact CE1-CG 3.84Å; F322-F460 HydrophobicContact CE1-CG 3.84Å; F322-F460 HydrophobicContact CZ-CD2 4.22Å; Y323-F460 PolarHBondContact N-O 3.49Å; M411-F460 HydrophobicContact CE-CD1 3.7Å; M411-F460 HydrophobicContact CE-CE1 3.88Å; M411-F460 HydrophobicContact CE-CG 4.18Å; M411-F460 WeakPolarHBondContact O-CZ 3.45Å; M411-F460 HydrophobicContact SD-CD1 3.53Å; M411-F460 VanDerWaalsContact SD-CD1 3.53Å; M411-F460 HydrophobicContact SD-CE1 3.33Å; M411-F460 WeakPolarHBondContact SD-CE1 3.27Å; M411-F460 HydrophobicContact SD-CZ 4.25Å; L440-F460 HydrophobicContact CD1-CD1 4.28Å; W441-F460 WeakPolarHBondContact O-CA 3.35Å; K442-F460 HydrophobicContact CB-CD1 3.95Å; K442-F460 HydrophobicContact CB-CE1 3.87Å; K442-F460 HydrophobicContact CD-CE1 3.78Å; K442-F460 HydrophobicContact CD-CZ 4.28Å; K442-F460 HydrophobicContact CG-CD1 3.99Å; K442-F460 HydrophobicContact CG-CE1 3.48Å; K442-F460 VanDerWaalsContact CG-CE1 3.48Å; K442-F460 HydrophobicContact CG-CZ 4.08Å; N458-F460 HydrophobicContact CB-CD2 4.46Å; N458-F460 HydrophobicContact CB-CE2 3.51Å; N458-F460 HydrophobicContact CB-CZ 3.72Å; F460-I462 HydrophobicContact CB-CG1 4.26Å
461	I	90.7	Very high	86.6	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	118.1	164.9	-60	174.4	0	0	0	106.3	Y323 L325 I353 L355 L389 L394 L440 W441 F443	Y323-I461 HydrophobicContact CD1-CG2 4.25Å; Y323-I461 CarbonylContact O-C 3.59Å; Y323-I461 WeakPolarHBondContact O-CA 2.92Å; L325-I461 HydrophobicContact CD1-CG2 3.39Å; L325-I461 HydrophobicContact CG-CG2 3.68Å; I353-I461 HydrophobicContact CD1-CD1 4.01Å; I353-I461 HydrophobicContact CD1-CG2 4.35Å; I353-I461 HydrophobicContact CG2-CD1 3.78Å; I353-I461 HydrophobicContact CG2-CG1 4.31Å; L355-I461 HydrophobicContact CD1-CD1 4.19Å; L355-I461 HydrophobicContact CD1-CG1 4.32Å; L355-I461 HydrophobicContact CD2-CG1 4.22Å; L389-I461 HydrophobicContact CD1-CD1 4.25Å; L394-I461 HydrophobicContact CD1-CD1 3.94Å; L394-I461 HydrophobicContact CD2-CD1 4.23Å; L394-I461 HydrophobicContact CD2-CG2 3.92Å; L440-I461 CarbonylContact C-O 3.43Å; L440-I461 WeakPolarHBondContact CA-O 3.47Å; L440-I461 WeakPolarHBondContact CB-O 3.43Å; W441-I461 HydrophobicContact CB-CB 4.38Å; W441-I461 HydrophobicContact CE3-CB 4.1Å; W441-I461 HydrophobicContact CE3-CG2 3.89Å; W441-I461 HydrophobicContact CZ3-CG2 4.24Å; W441-I461 PolarHBondContact N-O 3.23Å; W441-I461 PolarHBondContact O-N 3.27Å; F443-I461 HydrophobicContact CD2-CD1 4.48Å; F443-I461 HydrophobicContact CD2-CG1 4.48Å; F443-I461 HydrophobicContact CE2-CB 4.44Å; F443-I461 HydrophobicContact CE2-CD1 3.58Å; F443-I461 HydrophobicContact CE2-CG1 3.89Å; F443-I461 HydrophobicContact CZ-CD1 4.08Å
462	I	88.8	Confident	87.1	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.1	-175	-60.2	-176.4	0	0	0	109.3	F322 Y323 I324 L325 M411 I438 L440 F460 Y492	F322-I462 HydrophobicContact CD1-CD1 3.39Å; F322-I462 HydrophobicContact CD1-CG1 4.24Å; F322-I462 HydrophobicContact CE1-CD1 3.91Å; F322-I462 HydrophobicContact CG-CD1 4.37Å; Y323-I462 PolarHBondContact O-N 3.24Å; I324-I462 CarbonylContact C-O 3.38Å; I324-I462 WeakPolarHBondContact CA-O 2.89Å; L325-I462 PolarHBondContact N-O 3.19Å; M411-I462 HydrophobicContact CE-CD1 4.16Å; I438-I462 HydrophobicContact CG2-CG2 3.88Å; L440-I462 HydrophobicContact CB-CB 4.49Å; L440-I462 HydrophobicContact CB-CG1 3.94Å; L440-I462 HydrophobicContact CD2-CG1 4.49Å; F460-I462 HydrophobicContact CB-CG1 4.26Å; I462-Y492 HydrophobicContact CD1-CD1 3.86Å; I462-Y492 HydrophobicContact CD1-CD2 3.84Å; I462-Y492 HydrophobicContact CD1-CE1 3.77Å; I462-Y492 HydrophobicContact CD1-CE2 3.74Å; I462-Y492 HydrophobicContact CD1-CG 3.88Å; I462-Y492 HydrophobicContact CG2-CD2 4.24Å; I462-Y492 HydrophobicContact CG2-CG 4.02Å
463	Q	87	Confident	87.5	Confident	23 Å²	23	37.6 Å²	37.6	11%	0.107	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	128.3	170	-166.1	-175.6	-65.2	0	0	109.6	Y348 H439 E465	Y348-Q463 HydrophobicContact CE1-CG 4.26Å; Y348-Q463 PolarHBondContact OH-OE1 3.48Å; H439-Q463 HydrophobicContact CB-CB 4.12Å; H439-Q463 PolarHBondContact O-N 3.25Å; Q463-E465 PolarHBondContact NE2-OE1 3.26Å
464	A	87.8	Confident	87.9	Confident	3 Å²	3	37.3 Å²	37.3	3%	0.025	20%	0.196	C	C	.	.			trans	-71.4	131	-179.1	0	0	0	0	0	111.5	I324 L325 Y326 Y492 M579	I324-A464 HydrophobicContact CG2-CB 3.56Å; L325-A464 WeakPolarHBondContact O-CB 3.12Å; L325-A464 PolarHBondContact O-N 3.09Å; Y326-A464 HydrophobicContact CD1-CB 4.4Å; A464-Y492 WeakPolarHBondContact CA-O 3.34Å; A464-M579 VanDerWaalsContact C-SD 3.51Å; A464-M579 HydrophobicContact CB-CE 3.4Å; A464-M579 VanDerWaalsContact CB-CE 3.4Å; A464-M579 HydrophobicContact CB-CG 4.05Å; A464-M579 HydrophobicContact CB-SD 3.28Å; A464-M579 WeakPolarHBondContact CB-SD 3.39Å
465	E	86.7	Confident	88.1	Confident	59 Å²	59	34.9 Å²	34.9	28%	0.276	18%	0.178	S	C	.	.			trans	-141.6	164.2	-176.6	-65.7	-171.2	172.2	0	0	112.3	H439 Q463 Y492 N577 M579	H439-E465 IonicContact CD2-OE1 2.74Å; H439-E465 PolarHBondContact CD2-OE1 2.97Å; H439-E465 VanDerWaalsContact CD2-OE1 3.3Å; Q463-E465 PolarHBondContact NE2-OE1 3.26Å; E465-Y492 PolarHBondContact N-O 3.46Å; E465-N577 PolarHBondContact O-ND2 2.59Å; E465-M579 VanDerWaalsContact C-CB 3.45Å; E465-M579 VanDerWaalsContact C-CG 3.45Å; E465-M579 WeakPolarHBondContact O-CB 3.47Å; E465-M579 VanDerWaalsContact O-CG 3.26Å; E465-M579 WeakPolarHBondContact O-CG 3.23Å
466	K	89.2	Confident	88.3	Confident	125 Å²	125	38.2 Å²	38.2	54%	0.543	20%	0.197	S	C	.	.	P	Polyproline II helix	trans	-61.3	151.5	174.6	-66.9	-177.7	-177	-178.5	0	109.9	F468 M579	K466-F468 PolarHBondContact O-N 3.14Å; K466-M579 WeakPolarHBondContact CE-O 3.36Å; K466-M579 HydrophobicContact CG-CB 4.07Å; K466-M579 WeakPolarHBondContact CG-O 2.98Å
467	P	89.8	Confident	88.3	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.006	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-57.2	133	177.4	-21.9	34.9	0	0	0	110	V469 V489 F575 N577 G580 S582	P467-V469 HydrophobicContact CB-CG2 4.3Å; P467-V489 HydrophobicContact CB-CG1 4.22Å; P467-F575 HydrophobicContact CB-CB 4.13Å; P467-F575 HydrophobicContact CG-CB 4.36Å; P467-N577 WeakPolarHBondContact CD-OD1 3.31Å; P467-N577 HydrophobicContact CG-CB 3.97Å; P467-G580 WeakPolarHBondContact CD-O 3.41Å; P467-S582 WeakPolarHBondContact O-CB 3.2Å; P467-S582 PolarHBondContact O-OG 3.41Å
468	F	89.4	Confident	88.3	Confident	65 Å²	65	38.9 Å²	38.9	29%	0.285	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	121	167.3	177.3	-88.5	0	0	0	108.3	V434 F436 K466 H470 V489 V490	V434-F468 HydrophobicContact CG1-CE1 3.32Å; V434-F468 HydrophobicContact CG1-CZ 3.29Å; F436-F468 HydrophobicContact CB-CB 4.37Å; F436-F468 HydrophobicContact CB-CD1 3.49Å; F436-F468 VanDerWaalsContact CB-CD1 3.49Å; F436-F468 HydrophobicContact CB-CD2 3.68Å; F436-F468 HydrophobicContact CB-CE1 3.6Å; F436-F468 HydrophobicContact CB-CE2 3.77Å; F436-F468 HydrophobicContact CB-CG 3.54Å; F436-F468 HydrophobicContact CB-CZ 3.74Å; F436-F468 HydrophobicContact CD1-CE1 4.47Å; F436-F468 HydrophobicContact CG-CD1 4.28Å; F436-F468 HydrophobicContact CG-CE1 4.4Å; K466-F468 PolarHBondContact O-N 3.14Å; F468-H470 HydrophobicContact CE1-CB 3.62Å; F468-H470 HydrophobicContact CZ-CB 4.07Å; F468-V489 CarbonylContact O-C 3.56Å; F468-V489 WeakPolarHBondContact O-CA 2.99Å; F468-V490 HydrophobicContact CB-CB 4.26Å; F468-V490 HydrophobicContact CD1-CB 4.48Å; F468-V490 PolarHBondContact N-O 3.48Å; F468-V490 PolarHBondContact O-N 3.5Å
469	V	88.9	Confident	88.2	Confident	12 Å²	12	39.6 Å²	39.6	7%	0.073	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	129.1	-175.8	-172.7	0	0	0	0	108.8	P467 C487 N488 V489 C573 F575	P467-V469 HydrophobicContact CB-CG2 4.3Å; V469-C487 HydrophobicContact CG1-CB 4.49Å; V469-N488 WeakPolarHBondContact CA-O 3.35Å; V469-V489 HydrophobicContact CG1-CG2 4.43Å; V469-V489 HydrophobicContact CG2-CG1 4.43Å; V469-V489 HydrophobicContact CG2-CG2 4.47Å; V469-C573 VanDerWaalsContact CG1-SG 3.6Å; V469-F575 HydrophobicContact CB-CD2 4.47Å; V469-F575 HydrophobicContact CG1-CD2 3.89Å; V469-F575 HydrophobicContact CG1-CE2 4.1Å; V469-F575 HydrophobicContact CG2-CB 4.1Å; V469-F575 HydrophobicContact CG2-CD2 3.67Å; V469-F575 HydrophobicContact CG2-CG 4.3Å
470	H	88	Confident	88	Confident	43 Å²	43	41.5 Å²	41.5	20%	0.199	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	144.8	-179.7	179.8	73.8	0	0	0	111.7	V434 F468 N488 Y584	V434-H470 HydrophobicContact CG1-CB 3.92Å; V434-H470 WeakPolarHBondContact CG2-CD2 3.33Å; V434-H470 VanDerWaalsContact CG2-NE2 3.35Å; V434-H470 WeakPolarHBondContact CG2-NE2 3.22Å; F468-H470 HydrophobicContact CE1-CB 3.62Å; F468-H470 HydrophobicContact CZ-CB 4.07Å; H470-N488 PolarHBondContact N-O 3.3Å; H470-N488 PolarHBondContact O-N 2.67Å; H470-Y584 AromaticContact ND1-CE2 3.93Å
471	S	85.6	Confident	88	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.007	25%	0.245	C	C	.	.			trans	-151.5	177.3	176	-170.2	0	0	0	0	110.3	I486 Y584 I586	S471-I486 VanDerWaalsContact CB-O 3.23Å; S471-I486 WeakPolarHBondContact CB-O 3.45Å; S471-I486 PolarHBondContact OG-O 2.9Å; S471-Y584 VanDerWaalsContact CB-CD1 3.5Å; S471-Y584 WeakPolarHBondContact O-CE1 3.39Å; S471-Y584 VanDerWaalsContact O-CZ 3.24Å; S471-Y584 PolarHBondContact O-OH 2.74Å; S471-I586 WeakPolarHBondContact OG-CD1 3.2Å; S471-I586 WeakPolarHBondContact OG-CG1 3.47Å
472	H	82.2	Confident	88	Confident	78 Å²	78	50.8 Å²	50.8	36%	0.361	27%	0.265	S	S	.	.			trans	-69.4	130	164.7	-62.3	115.7	0	0	0	109.6	I429 H474 V475	I429-H472 VanDerWaalsContact CG1-CE1 3.47Å; I429-H472 WeakPolarHBondContact CG1-CE1 3.32Å; H472-H474 VanDerWaalsContact C-N 3.27Å; H472-H474 PolarHBondContact O-N 3.24Å; H472-V475 HydrophobicContact CB-CG2 4.18Å
473	S	84.9	Confident	88.1	Confident	49 Å²	49	51.6 Å²	51.6	34%	0.343	27%	0.27	S	S	.	.	S	Bend	trans	-70.4	-23.9	-179.7	60	0	0	0	0	113.6	N587	S473-N587 PolarHBondContact O-N 2.02Å; S473-N587 PolarHBondContact O-ND2 3.21Å
474	H	88.9	Confident	88.3	Confident	104 Å²	104	54.6 Å²	54.6	48%	0.481	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	131.3	-179.3	-55.4	-67.2	0	0	0	110.2	H472 N587 Y589	H472-H474 VanDerWaalsContact C-N 3.27Å; H472-H474 PolarHBondContact O-N 3.24Å; H474-N587 WeakPolarHBondContact CA-O 3.19Å; H474-N587 PolarHBondContact CE1-ND2 2.85Å; H474-Y589 HydrophobicContact CB-CE2 4.18Å; H474-Y589 AromaticContact ND1-CE2 3.42Å; H474-Y589 WeakPolarHBondContact ND1-CE2 2.98Å; H474-Y589 AromaticContact ND1-CZ 3.99Å
475	V	90.6	Very high	88.5	Confident	27 Å²	27	54.5 Å²	54.5	16%	0.164	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	131.5	176.9	-171.3	0	0	0	0	108.2	H472 I483 L485 I586 N587 L588 Y589	H472-V475 HydrophobicContact CB-CG2 4.18Å; V475-I483 HydrophobicContact CB-CD1 4.45Å; V475-I483 HydrophobicContact CG1-CD1 3.39Å; V475-I483 HydrophobicContact CG1-CG1 4.03Å; V475-L485 HydrophobicContact CB-CD2 3.98Å; V475-L485 HydrophobicContact CG1-CD2 4Å; V475-L485 HydrophobicContact CG2-CD2 4.06Å; V475-I586 HydrophobicContact CB-CG2 4.4Å; V475-I586 HydrophobicContact CG2-CG2 3.63Å; V475-N587 PolarHBondContact N-O 3.43Å; V475-L588 WeakPolarHBondContact O-CA 3.49Å; V475-L588 WeakPolarHBondContact O-CD1 3.44Å; V475-Y589 PolarHBondContact O-N 2.84Å
476	N	90.3	Very high	88.6	Confident	102 Å²	102	53.2 Å²	53.2	55%	0.545	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	119	179.8	-66.7	-26.6	0	0	0	110.5	Y589	N476-Y589 CarbonylContact C-O 3.53Å; N476-Y589 WeakPolarHBondContact CA-O 3.39Å
477	G	89	Confident	88.6	Confident	2 Å²	2	47.2 Å²	47.2	2%	0.021	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	157.9	175.5	0	0	0	0	0	113.3	I483 Y589 N591	G477-I483 VanDerWaalsContact CA-CD1 3.5Å; G477-Y589 PolarHBondContact N-O 2.96Å; G477-N591 PolarHBondContact O-N 3.09Å
478	I	88	Confident	88.5	Confident	87 Å²	87	47.5 Å²	47.5	45%	0.446	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.3	172.4	-58.9	172.9	0	0	0	107.8	G480 K481 L563	I478-G480 PolarHBondContact O-N 3.45Å; I478-K481 HydrophobicContact CB-CB 4.2Å; I478-K481 HydrophobicContact CB-CG 3.9Å; I478-K481 HydrophobicContact CG2-CG 3.89Å; I478-K481 WeakPolarHBondContact O-CB 3.42Å; I478-K481 PolarHBondContact O-N 3.02Å; I478-L563 WeakPolarHBondContact O-CD1 3.33Å
479	L	87.6	Confident	88.4	Confident	49 Å²	49	44.4 Å²	44.4	26%	0.257	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	135.2	177.3	-72.6	165.2	0	0	0	111.7	K481 L565 L590	L479-K481 PolarHBondContact O-N 2.67Å; L479-L565 HydrophobicContact CD1-CD2 4.33Å; L479-L565 HydrophobicContact CD2-CD2 4.04Å; L479-L565 HydrophobicContact CD2-CG 4.21Å; L479-L590 HydrophobicContact CD2-CD1 4.02Å
480	G	85.1	Confident	88.3	Confident	41 Å²	41	44.2 Å²	44.2	42%	0.423	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	-3.9	-177.8	0	0	0	0	0	115.4	I478 N562 L563	I478-G480 PolarHBondContact O-N 3.45Å; G480-N562 WeakPolarHBondContact CA-OD1 3.32Å; G480-L563 PolarHBondContact N-O 2.97Å
481	K	90	Very high	88.2	Confident	133 Å²	133	42.3 Å²	42.3	58%	0.578	23%	0.23	S	C	*	.	S	Bend	trans	-95	166.4	175.4	-60.4	-60.8	-175.5	-179.9	0	111.1	I478 L479 N562 L563	I478-K481 HydrophobicContact CB-CB 4.2Å; I478-K481 HydrophobicContact CB-CG 3.9Å; I478-K481 HydrophobicContact CG2-CG 3.89Å; I478-K481 WeakPolarHBondContact O-CB 3.42Å; I478-K481 PolarHBondContact O-N 3.02Å; L479-K481 PolarHBondContact O-N 2.67Å; K481-N562 PolarHBondContact O-N 2.9Å; K481-L563 WeakPolarHBondContact O-CB 3.32Å; K481-L563 WeakPolarHBondContact O-CG 3.26Å; K481-L563 PolarHBondContact O-N 3.48Å
482	S	89.9	Confident	88.2	Confident	62 Å²	62	43.1 Å²	43.1	43%	0.434	23%	0.233	S	C	.	.			trans	-91.7	142.9	169.6	58.7	0	0	0	0	110.8	I560	S482-I560 CarbonylContact C-O 3.54Å; S482-I560 WeakPolarHBondContact CA-O 3.46Å; S482-I560 WeakPolarHBondContact CB-O 3.3Å
483	I	92	Very high	88.4	Confident	18 Å²	18	39.8 Å²	39.8	9%	0.092	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	156.7	174.6	-161.1	168.7	0	0	0	111.1	V475 G477 K559 I560 L563 L588	V475-I483 HydrophobicContact CB-CD1 4.45Å; V475-I483 HydrophobicContact CG1-CD1 3.39Å; V475-I483 HydrophobicContact CG1-CG1 4.03Å; G477-I483 VanDerWaalsContact CA-CD1 3.5Å; I483-K559 WeakPolarHBondContact O-CA 3.3Å; I483-I560 HydrophobicContact CG2-CB 4.01Å; I483-I560 HydrophobicContact CG2-CD1 4.1Å; I483-I560 HydrophobicContact CG2-CG1 4.32Å; I483-I560 PolarHBondContact N-O 2.8Å; I483-I560 PolarHBondContact O-N 2.96Å; I483-L563 HydrophobicContact CB-CD1 3.83Å; I483-L563 HydrophobicContact CD1-CD1 4.47Å; I483-L563 HydrophobicContact CG2-CD1 3.78Å; I483-L563 HydrophobicContact CG2-CD2 3.79Å; I483-L563 HydrophobicContact CG2-CG 4.07Å; I483-L588 HydrophobicContact CD1-CD1 3.49Å; I483-L588 VanDerWaalsContact CD1-CD1 3.49Å; I483-L588 HydrophobicContact CG2-CD1 4.49Å; I483-L588 HydrophobicContact CG2-CD2 4.46Å
484	H	90.7	Very high	88.4	Confident	86 Å²	86	42.2 Å²	42.2	40%	0.398	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	111.3	-179.4	-70	-122.2	0	0	0	108.7	T557	H484-T557 HydrophobicContact CB-CG2 3.73Å
485	L	91.6	Very high	88.1	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	121.4	170.3	-51.1	-174.8	0	0	0	108.2	V475 W502 T557 L558 I560 Y571 I586 L588	V475-L485 HydrophobicContact CB-CD2 3.98Å; V475-L485 HydrophobicContact CG1-CD2 4Å; V475-L485 HydrophobicContact CG2-CD2 4.06Å; L485-W502 HydrophobicContact CB-CH2 3.95Å; L485-W502 HydrophobicContact CB-CZ3 3.97Å; L485-W502 HydrophobicContact CD1-CZ3 4.36Å; L485-T557 CarbonylContact O-C 3.58Å; L485-T557 VanDerWaalsContact O-CA 3.24Å; L485-T557 WeakPolarHBondContact O-CA 3.25Å; L485-L558 HydrophobicContact CB-CB 4.32Å; L485-L558 HydrophobicContact CD1-CD2 4.34Å; L485-L558 PolarHBondContact N-O 3.05Å; L485-L558 PolarHBondContact O-N 3.42Å; L485-I560 HydrophobicContact CD1-CD1 3.95Å; L485-I560 HydrophobicContact CG-CD1 4.3Å; L485-Y571 HydrophobicContact CD1-CD1 3.76Å; L485-Y571 HydrophobicContact CD1-CD2 3.6Å; L485-Y571 HydrophobicContact CD1-CE1 4.25Å; L485-Y571 HydrophobicContact CD1-CE2 4.1Å; L485-Y571 HydrophobicContact CD1-CG 3.4Å; L485-Y571 VanDerWaalsContact CD1-CG 3.4Å; L485-I586 HydrophobicContact CB-CD1 4.11Å; L485-I586 HydrophobicContact CD2-CG2 4.21Å; L485-L588 HydrophobicContact CD2-CD1 4.46Å
486	I	90.1	Very high	87.4	Confident	32 Å²	32	41.8 Å²	41.8	16%	0.164	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	117.2	-168.2	-56.7	173.5	0	0	0	110.3	I429 S471 I555 T557	I429-I486 HydrophobicContact CD1-CB 3.92Å; I429-I486 HydrophobicContact CD1-CG2 3.52Å; S471-I486 VanDerWaalsContact CB-O 3.23Å; S471-I486 WeakPolarHBondContact CB-O 3.45Å; S471-I486 PolarHBondContact OG-O 2.9Å; I486-I555 HydrophobicContact CG2-CG2 3.51Å; I486-T557 HydrophobicContact CG1-CG2 4.11Å
487	C	89.2	Confident	86.2	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	123.8	170.6	-71.5	0	0	0	0	111.7	V469 W502 I556 C573 F575	V469-C487 HydrophobicContact CG1-CB 4.49Å; C487-W502 HydrophobicContact CB-CH2 4.33Å; C487-W502 HydrophobicContact CB-CZ2 4.27Å; C487-W502 VanDerWaalsContact SG-CH2 3.5Å; C487-I556 PolarHBondContact N-O 2.85Å; C487-I556 PolarHBondContact O-N 2.85Å; C487-C573 HydrophobicContact CB-CB 3.86Å; C487-C573 WeakPolarHBondContact CB-SG 3.23Å; C487-C573 WeakPolarHBondContact SG-CB 3.18Å; C487-C573 CovalentContact SG-SG 2.02Å; C487-C573 PolarHBondContact SG-SG 2.96Å; C487-F575 HydrophobicContact CB-CE2 4.29Å
488	N	86.8	Confident	84.8	Confident	7 Å²	7	42.9 Å²	42.9	4%	0.037	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	125.5	170.3	-71.9	-15.1	0	0	0	109.5	I429 V469 H470	I429-N488 WeakPolarHBondContact CB-ND2 3.45Å; I429-N488 VanDerWaalsContact CG2-ND2 3.3Å; I429-N488 WeakPolarHBondContact CG2-ND2 3.4Å; V469-N488 WeakPolarHBondContact CA-O 3.35Å; H470-N488 PolarHBondContact N-O 3.3Å; H470-N488 PolarHBondContact O-N 2.67Å
489	V	87.3	Confident	83.3	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	120.2	-178.5	-174.2	0	0	0	0	108.9	P467 F468 V469 P495 Y550 G553 W554 I556 F575	P467-V489 HydrophobicContact CB-CG1 4.22Å; F468-V489 CarbonylContact O-C 3.56Å; F468-V489 WeakPolarHBondContact O-CA 2.99Å; V469-V489 HydrophobicContact CG1-CG2 4.43Å; V469-V489 HydrophobicContact CG2-CG1 4.43Å; V469-V489 HydrophobicContact CG2-CG2 4.47Å; V489-P495 HydrophobicContact CG1-CG 4.45Å; V489-Y550 PolarHBondContact O-OH 2.91Å; V489-G553 CarbonylContact O-C 3.5Å; V489-G553 WeakPolarHBondContact O-CA 3.35Å; V489-W554 HydrophobicContact CB-CE3 4.49Å; V489-W554 HydrophobicContact CG1-CE3 4.38Å; V489-W554 PolarHBondContact N-O 2.98Å; V489-W554 PolarHBondContact O-N 3.02Å; V489-I556 HydrophobicContact CG2-CG1 4.36Å; V489-F575 HydrophobicContact CG1-CB 4.19Å; V489-F575 HydrophobicContact CG1-CD1 4.31Å; V489-F575 HydrophobicContact CG1-CD2 4.33Å; V489-F575 HydrophobicContact CG1-CG 3.99Å; V489-F575 HydrophobicContact CG2-CD1 3.93Å; V489-F575 HydrophobicContact CG2-CD2 3.38Å; V489-F575 HydrophobicContact CG2-CE1 3.84Å; V489-F575 HydrophobicContact CG2-CE2 3.26Å; V489-F575 HydrophobicContact CG2-CG 3.71Å; V489-F575 HydrophobicContact CG2-CZ 3.52Å
490	V	87.4	Confident	82.5	Confident	8 Å²	8	45.3 Å²	45.3	5%	0.048	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	118.2	171.5	172.8	0	0	0	0	107	F436 I438 F468 Y550 F552	F436-V490 HydrophobicContact CD2-CG1 4.4Å; I438-V490 HydrophobicContact CD1-CG1 3.41Å; I438-V490 VanDerWaalsContact CD1-CG1 3.41Å; I438-V490 HydrophobicContact CG1-CG1 3.96Å; F468-V490 HydrophobicContact CB-CB 4.26Å; F468-V490 HydrophobicContact CD1-CB 4.48Å; F468-V490 PolarHBondContact N-O 3.48Å; F468-V490 PolarHBondContact O-N 3.5Å; V490-Y550 WeakPolarHBondContact CG2-OH 3.38Å; V490-F552 HydrophobicContact CG1-CD2 4.28Å; V490-F552 HydrophobicContact CG2-CD2 3.99Å; V490-F552 HydrophobicContact CG2-CE2 4.12Å
491	S	85.8	Confident	82.3	Confident	3 Å²	3	45.6 Å²	45.6	2%	0.021	23%	0.225	C	C	.	.			trans	-153.1	125.1	-172.8	178.1	0	0	0	0	113	P493 N577	S491-P493 CarbonylContact C-O 3.53Å; S491-P493 CarbonylContact O-C 3.55Å; S491-P493 PolarHBondContact OG-O 3.01Å; S491-N577 PolarHBondContact OG-ND2 2.75Å
492	Y	84.6	Confident	82.2	Confident	18 Å²	18	39.4 Å²	39.4	7%	0.071	20%	0.198	C	C	.	.	S	Bend	trans	-131.1	117.4	167.2	-73.9	-83.5	0	0	0	109.1	F322 I324 I462 A464 E465 A551 F552	F322-Y492 HydrophobicContact CB-CE1 4.37Å; F322-Y492 HydrophobicContact CD1-CE1 4.05Å; F322-Y492 HydrophobicContact CD2-CE1 4.48Å; F322-Y492 HydrophobicContact CE1-CE1 4.47Å; F322-Y492 WeakPolarHBondContact CE1-OH 3.33Å; F322-Y492 HydrophobicContact CG-CE1 4.04Å; F322-Y492 WeakPolarHBondContact CZ-OH 2.97Å; I324-Y492 HydrophobicContact CD1-CD1 4.39Å; I324-Y492 HydrophobicContact CG1-CD1 4.44Å; I462-Y492 HydrophobicContact CD1-CD1 3.86Å; I462-Y492 HydrophobicContact CD1-CD2 3.84Å; I462-Y492 HydrophobicContact CD1-CE1 3.77Å; I462-Y492 HydrophobicContact CD1-CE2 3.74Å; I462-Y492 HydrophobicContact CD1-CG 3.88Å; I462-Y492 HydrophobicContact CG2-CD2 4.24Å; I462-Y492 HydrophobicContact CG2-CG 4.02Å; A464-Y492 WeakPolarHBondContact CA-O 3.34Å; E465-Y492 PolarHBondContact N-O 3.46Å; Y492-A551 PolarHBondContact OH-O 3.31Å; Y492-F552 HydrophobicContact CE2-CB 3.87Å; Y492-F552 WeakPolarHBondContact OH-CA 3.24Å
493	P	86.3	Confident	82.2	Confident	7 Å²	7	37.6 Å²	37.6	5%	0.045	18%	0.183	C	C	.	.	S	Bend	cis	-64.8	163.5	1	27.3	-35.1	0	0	0	114.2	I324 Y326 S491 N577 L578 M579	I324-P493 HydrophobicContact CD1-CB 4.06Å; Y326-P493 HydrophobicContact CE1-CB 4.47Å; Y326-P493 HydrophobicContact CE1-CG 3.98Å; Y326-P493 WeakPolarHBondContact OH-CB 3.43Å; S491-P493 CarbonylContact C-O 3.53Å; S491-P493 CarbonylContact O-C 3.55Å; S491-P493 PolarHBondContact OG-O 3.01Å; P493-N577 HydrophobicContact CG-CB 4.23Å; P493-N577 PolarHBondContact O-ND2 3.43Å; P493-L578 HydrophobicContact CG-CB 4.06Å; P493-L578 HydrophobicContact CG-CD1 4.38Å; P493-L578 HydrophobicContact CG-CG 4.47Å; P493-M579 HydrophobicContact CG-CE 4.43Å; P493-M579 HydrophobicContact CG-CG 4.5Å
494	E	85.4	Confident	82.2	Confident	101 Å²	101	38.1 Å²	38.1	47%	0.472	19%	0.185	S	C	.	.	P	Polyproline II helix	trans	-55.5	136.4	175.1	-50.1	-160.5	171.4	0	0	109.8	K549 W554	E494-K549 IonicContact OE1-NZ 3.3Å; E494-K549 PolarHBondContact OE1-NZ 3.16Å; E494-K549 IonicContact OE2-NZ 3.3Å; E494-K549 PolarHBondContact OE2-NZ 3.34Å; E494-W554 HydrophobicContact CB-CH2 3.64Å; E494-W554 HydrophobicContact CB-CZ2 3.76Å; E494-W554 HydrophobicContact CG-CH2 3.68Å; E494-W554 HydrophobicContact CG-CZ2 3.78Å
495	P	83.7	Confident	82.1	Confident	7 Å²	7	38.6 Å²	38.6	5%	0.045	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-72.4	155.5	-179.7	32	-32.2	0	0	0	109.5	V489 F497 W554 T576 N577	V489-P495 HydrophobicContact CG1-CG 4.45Å; P495-F497 HydrophobicContact CG-CD2 4.32Å; P495-F497 HydrophobicContact CG-CE1 4.01Å; P495-F497 HydrophobicContact CG-CE2 3.49Å; P495-F497 VanDerWaalsContact CG-CE2 3.49Å; P495-F497 HydrophobicContact CG-CZ 3.28Å; P495-F497 VanDerWaalsContact O-CD2 3.23Å; P495-F497 WeakPolarHBondContact O-CD2 3.31Å; P495-F497 PolarHBondContact O-N 3.03Å; P495-W554 HydrophobicContact CG-CE3 4.13Å; P495-W554 HydrophobicContact CG-CH2 4.46Å; P495-W554 HydrophobicContact CG-CZ3 4.06Å; P495-T576 WeakPolarHBondContact CA-O 3.35Å; P495-T576 WeakPolarHBondContact CB-O 3.41Å; P495-N577 HydrophobicContact CB-CB 4.35Å
496	N	74.3	Confident	81.9	Confident	114 Å²	114	41.4 Å²	41.4	61%	0.61	22%	0.219	S	C	*	.			trans	-75.6	95.4	180	-171.4	4.6	0	0	0	109.4	T498 T576	N496-T498 PolarHBondContact ND2-OG1 3.27Å; N496-T498 PolarHBondContact O-N 2.72Å; N496-T498 VanDerWaalsContact O-N 3.12Å; N496-T498 PolarHBondContact OD1-OG1 3.12Å; N496-T576 PolarHBondContact N-O 2.98Å
497	F	65.9	Low	81.8	Confident	52 Å²	52	47 Å²	47	23%	0.228	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	3.7	-177.3	-75.6	-70.7	0	0	0	115.4	P495 Y499 Y515 W554 I556 F575	P495-F497 HydrophobicContact CG-CD2 4.32Å; P495-F497 HydrophobicContact CG-CE1 4.01Å; P495-F497 HydrophobicContact CG-CE2 3.49Å; P495-F497 VanDerWaalsContact CG-CE2 3.49Å; P495-F497 HydrophobicContact CG-CZ 3.28Å; P495-F497 VanDerWaalsContact O-CD2 3.23Å; P495-F497 WeakPolarHBondContact O-CD2 3.31Å; P495-F497 PolarHBondContact O-N 3.03Å; F497-Y499 PolarHBondContact O-N 2.84Å; F497-Y515 PolarHBondContact O-OH 3.07Å; F497-W554 HydrophobicContact CE1-CB 4.28Å; F497-W554 AromaticContact CE1-CD1 4Å; F497-W554 HydrophobicContact CE1-CD2 4.25Å; F497-W554 AromaticContact CE1-CG 3.92Å; F497-W554 HydrophobicContact CE1-CG 3.92Å; F497-W554 AromaticContact CE2-CD1 3.66Å; F497-W554 AromaticContact CE2-CD2 3.56Å; F497-W554 HydrophobicContact CE2-CD2 3.56Å; F497-W554 AromaticContact CE2-CE2 3.16Å; F497-W554 HydrophobicContact CE2-CE3 4.18Å; F497-W554 AromaticContact CE2-CG 3.9Å; F497-W554 HydrophobicContact CE2-CG 3.9Å; F497-W554 HydrophobicContact CE2-CH2 4.29Å; F497-W554 AromaticContact CE2-CZ2 3.58Å; F497-W554 HydrophobicContact CE2-CZ2 3.58Å; F497-W554 AromaticContact CE2-NE1 3.18Å; F497-W554 HydrophobicContact CZ-CB 3.96Å; F497-W554 AromaticContact CZ-CD1 3.32Å; F497-W554 AromaticContact CZ-CD2 3.13Å; F497-W554 HydrophobicContact CZ-CD2 3.13Å; F497-W554 AromaticContact CZ-CE2 3.33Å; F497-W554 AromaticContact CZ-CE3 3.69Å; F497-W554 HydrophobicContact CZ-CE3 3.69Å; F497-W554 AromaticContact CZ-CG 3.2Å; F497-W554 HydrophobicContact CZ-CG 3.2Å; F497-W554 HydrophobicContact CZ-CZ2 4.08Å; F497-W554 HydrophobicContact CZ-CZ3 4.41Å; F497-W554 AromaticContact CZ-NE1 3.37Å; F497-I556 HydrophobicContact CE1-CD1 3.94Å; F497-F575 HydrophobicContact CE1-CD1 4.49Å; F497-F575 HydrophobicContact CE1-CE1 4.32Å
498	T	59.7	Low	81.6	Confident	75 Å²	75	55 Å²	55	46%	0.46	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-31.1	177.6	34.4	0	0	0	0	111.5	N496 Y515	N496-T498 PolarHBondContact ND2-OG1 3.27Å; N496-T498 PolarHBondContact O-N 2.72Å; N496-T498 VanDerWaalsContact O-N 3.12Å; N496-T498 PolarHBondContact OD1-OG1 3.12Å; T498-Y515 PolarHBondContact O-OH 3.34Å
499	Y	57.3	Low	81.5	Confident	173 Å²	173	55.7 Å²	55.7	68%	0.678	28%	0.279	S	S	*	.			trans	-149.6	96.3	172.1	-50.7	-81.4	0	0	0	110.5	F497 I501	F497-Y499 PolarHBondContact O-N 2.84Å; Y499-I501 WeakPolarHBondContact O-CG1 3.31Å; Y499-I501 PolarHBondContact O-N 2.83Å
500	P	69.9	Low	80.8	Confident	14 Å²	14	64.2 Å²	64.2	9%	0.091	32%	0.319	C	S	.	.			trans	-60.7	112.8	164.1	25.7	-29.9	0	0	0	107.6	W502 Y515 I545 I556 F575	P500-W502 PolarHBondContact O-N 2.78Å; P500-Y515 WeakPolarHBondContact CD-OH 3.47Å; P500-I545 HydrophobicContact CB-CD1 4.41Å; P500-I545 HydrophobicContact CG-CD1 3.74Å; P500-I545 HydrophobicContact CG-CG2 4.18Å; P500-I556 HydrophobicContact CB-CG2 4.26Å; P500-F575 HydrophobicContact CB-CE1 3.95Å; P500-F575 HydrophobicContact CB-CZ 4.41Å
501	I	81.1	Confident	80	Confident	47 Å²	47	66.2 Å²	66.2	24%	0.241	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	113.4	-173.7	-60.9	172.7	0	0	0	107.8	Y499 L503 Y508 S574	Y499-I501 WeakPolarHBondContact O-CG1 3.31Å; Y499-I501 PolarHBondContact O-N 2.83Å; I501-L503 HydrophobicContact CG2-CD2 4.15Å; I501-L503 HydrophobicContact CG2-CG 4.06Å; I501-Y508 HydrophobicContact CD1-CE1 4.5Å; I501-Y508 HydrophobicContact CG2-CD1 3.85Å; I501-Y508 HydrophobicContact CG2-CE1 3.5Å; I501-S574 PolarHBondContact N-O 2.8Å; I501-S574 PolarHBondContact O-N 3.27Å
502	W	88.5	Confident	78.7	Confident	4 Å²	4	73 Å²	73	2%	0.015	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	127.3	165.3	-73.7	83	0	0	0	109	L485 C487 P500 I509 I545 I556 L558 Q572 C573 I586	L485-W502 HydrophobicContact CB-CH2 3.95Å; L485-W502 HydrophobicContact CB-CZ3 3.97Å; L485-W502 HydrophobicContact CD1-CZ3 4.36Å; C487-W502 HydrophobicContact CB-CH2 4.33Å; C487-W502 HydrophobicContact CB-CZ2 4.27Å; C487-W502 VanDerWaalsContact SG-CH2 3.5Å; P500-W502 PolarHBondContact O-N 2.78Å; W502-I509 HydrophobicContact CB-CD1 3.86Å; W502-I509 HydrophobicContact CB-CG1 4.35Å; W502-I509 PolarHBondContact O-N 2.86Å; W502-I509 VanDerWaalsContact O-N 3.08Å; W502-I545 VanDerWaalsContact CD1-CD1 3.43Å; W502-I545 HydrophobicContact CG-CD1 4.46Å; W502-I556 HydrophobicContact CZ2-CG2 4.27Å; W502-L558 HydrophobicContact CB-CD2 4.37Å; W502-L558 HydrophobicContact CD2-CB 3.79Å; W502-L558 HydrophobicContact CD2-CD2 3.83Å; W502-L558 HydrophobicContact CD2-CG 4.31Å; W502-L558 HydrophobicContact CE3-CB 3.93Å; W502-L558 HydrophobicContact CE3-CD2 3.59Å; W502-L558 HydrophobicContact CE3-CG 4.37Å; W502-L558 HydrophobicContact CG-CB 4.46Å; W502-L558 HydrophobicContact CG-CD2 4.19Å; W502-L558 HydrophobicContact CH2-CB 3.82Å; W502-L558 HydrophobicContact CZ2-CB 3.7Å; W502-L558 HydrophobicContact CZ3-CB 3.94Å; W502-L558 HydrophobicContact CZ3-CD2 4.12Å; W502-Q572 WeakPolarHBondContact CA-O 3.46Å; W502-C573 HydrophobicContact CD2-CB 4.05Å; W502-C573 HydrophobicContact CE3-CB 4.02Å; W502-C573 HydrophobicContact CH2-CB 3.88Å; W502-C573 HydrophobicContact CZ2-CB 3.88Å; W502-C573 HydrophobicContact CZ3-CB 3.94Å; W502-I586 HydrophobicContact CH2-CD1 4.06Å; W502-I586 HydrophobicContact CZ3-CD1 3.94Å
503	L	89.3	Confident	77	Confident	23 Å²	23	78.8 Å²	78.8	12%	0.12	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	142.7	172.5	-55.7	162.1	0	0	0	108.6	I501 E507 Y508 Y571 Q572	I501-L503 HydrophobicContact CG2-CD2 4.15Å; I501-L503 HydrophobicContact CG2-CG 4.06Å; L503-E507 CarbonylContact C-O 3.58Å; L503-E507 WeakPolarHBondContact CA-O 3.38Å; L503-Y508 HydrophobicContact CD2-CD1 3.73Å; L503-Y508 HydrophobicContact CD2-CD2 4.06Å; L503-Y508 HydrophobicContact CD2-CE1 3.87Å; L503-Y508 HydrophobicContact CD2-CE2 4.16Å; L503-Y508 HydrophobicContact CD2-CG 3.83Å; L503-Y571 CarbonylContact O-C 3.6Å; L503-Y571 VanDerWaalsContact O-CA 3.24Å; L503-Y571 WeakPolarHBondContact O-CA 3.34Å; L503-Q572 HydrophobicContact CB-CB 4.19Å; L503-Q572 HydrophobicContact CD1-CB 4.39Å; L503-Q572 HydrophobicContact CD1-CG 4.47Å; L503-Q572 PolarHBondContact N-O 3.21Å; L503-Q572 PolarHBondContact O-N 3.22Å
504	H	91.3	Very high	74.9	Confident	30 Å²	30	81.3 Å²	81.3	14%	0.139	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	119.2	168.9	174.8	-122.8	0	0	0	107.7	G506 E507 I509 N566 D567 E568 Y571	H504-G506 PolarHBondContact O-N 2.79Å; H504-E507 PolarHBondContact N-O 2.81Å; H504-E507 PolarHBondContact O-N 2.83Å; H504-I509 HydrophobicContact CB-CD1 4Å; H504-I509 HydrophobicContact CB-CG1 3.85Å; H504-N566 PolarHBondContact CE1-O 2.93Å; H504-D567 PolarHBondContact NE2-O 2.82Å; H504-E568 PolarHBondContact NE2-O 3.03Å; H504-Y571 HydrophobicContact CB-CD1 4.11Å; H504-Y571 HydrophobicContact CB-CE1 3.85Å; H504-Y571 AromaticContact CD2-CD2 3.96Å; H504-Y571 AromaticContact CD2-CE1 3.59Å; H504-Y571 AromaticContact CD2-CE2 3.45Å; H504-Y571 VanDerWaalsContact CD2-CE2 3.45Å; H504-Y571 WeakPolarHBondContact CD2-CE2 3.45Å; H504-Y571 AromaticContact CD2-CZ 3.23Å; H504-Y571 AromaticContact CG-CE1 3.88Å; H504-Y571 AromaticContact CG-CZ 3.91Å; H504-Y571 AromaticContact NE2-CE2 3.91Å; H504-Y571 AromaticContact NE2-CZ 3.75Å
505	N	89.8	Confident	73	Confident	96 Å²	96	81.6 Å²	81.6	51%	0.513	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	32	-175.4	-61.8	-34	0	0	0	114.2	G569 I570	N505-G569 WeakPolarHBondContact OD1-CA 3.43Å; N505-I570 PolarHBondContact N-O 3.25Å; N505-I570 PolarHBondContact OD1-N 3.38Å
506	G	87.1	Confident	70.7	Confident	58 Å²	58	83.8 Å²	83.8	60%	0.598	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.7	-5.5	-179	0	0	0	0	0	115.1	H504	H504-G506 PolarHBondContact O-N 2.79Å
507	E	87.3	Confident	68.8	Low	151 Å²	151	85.1 Å²	85.1	71%	0.706	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	146.9	178.3	-61.5	-172.1	163.3	0	0	111.4	L503 H504 I509	L503-E507 CarbonylContact C-O 3.58Å; L503-E507 WeakPolarHBondContact CA-O 3.38Å; H504-E507 PolarHBondContact N-O 2.81Å; H504-E507 PolarHBondContact O-N 2.83Å; E507-I509 PolarHBondContact O-N 3.04Å
508	Y	85.5	Confident	67.2	Low	168 Å²	168	90.3 Å²	90.3	66%	0.659	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	132.8	178.1	-70.1	-91.2	0	0	0	110.7	I501 L503 E510	I501-Y508 HydrophobicContact CD1-CE1 4.5Å; I501-Y508 HydrophobicContact CG2-CD1 3.85Å; I501-Y508 HydrophobicContact CG2-CE1 3.5Å; L503-Y508 HydrophobicContact CD2-CD1 3.73Å; L503-Y508 HydrophobicContact CD2-CD2 4.06Å; L503-Y508 HydrophobicContact CD2-CE1 3.87Å; L503-Y508 HydrophobicContact CD2-CE2 4.16Å; L503-Y508 HydrophobicContact CD2-CG 3.83Å; Y508-E510 PolarHBondContact O-N 2.97Å
509	I	83.9	Confident	66	Low	21 Å²	21	93.8 Å²	93.8	11%	0.108	48%	0.483	C	S	.	.			trans	-76.9	111.3	170.3	-55.7	-179.6	0	0	0	107.8	W502 H504 E507 I511 Y543 L558 Y571	W502-I509 HydrophobicContact CB-CD1 3.86Å; W502-I509 HydrophobicContact CB-CG1 4.35Å; W502-I509 PolarHBondContact O-N 2.86Å; W502-I509 VanDerWaalsContact O-N 3.08Å; H504-I509 HydrophobicContact CB-CD1 4Å; H504-I509 HydrophobicContact CB-CG1 3.85Å; E507-I509 PolarHBondContact O-N 3.04Å; I509-I511 HydrophobicContact CG2-CG1 4.23Å; I509-I511 PolarHBondContact O-N 3.35Å; I509-Y543 HydrophobicContact CD1-CE1 4.5Å; I509-Y543 HydrophobicContact CG2-CD1 3.93Å; I509-Y543 HydrophobicContact CG2-CD2 3.47Å; I509-Y543 VanDerWaalsContact CG2-CD2 3.47Å; I509-Y543 HydrophobicContact CG2-CE1 4.23Å; I509-Y543 HydrophobicContact CG2-CE2 3.8Å; I509-Y543 HydrophobicContact CG2-CG 3.54Å; I509-L558 HydrophobicContact CD1-CD2 3.58Å; I509-Y571 HydrophobicContact CD1-CD1 3.79Å; I509-Y571 HydrophobicContact CD1-CE1 3.66Å
510	E	72.3	Confident	64.4	Low	179 Å²	179	89.6 Å²	89.6	84%	0.836	48%	0.48	S	S	*	.			trans	-68.2	114.5	168.9	-69.1	-172.3	173.4	0	0	109.1	Y508	Y508-E510 PolarHBondContact O-N 2.97Å
511	I	71.1	Confident	62.4	Low	49 Å²	49	94.4 Å²	94.4	25%	0.251	51%	0.511	S	S	.	.			trans	-101.5	110.8	175.7	-63.1	148.5	0	0	0	105.9	I509 D513 I545	I509-I511 HydrophobicContact CG2-CG1 4.23Å; I509-I511 PolarHBondContact O-N 3.35Å; I511-D513 PolarHBondContact O-N 2.82Å; I511-I545 HydrophobicContact CD1-CD1 3.2Å; I511-I545 HydrophobicContact CD1-CG1 3.65Å; I511-I545 HydrophobicContact CG1-CD1 4.43Å; I511-I545 HydrophobicContact CG1-CG1 4.46Å
512	E	58.5	Low	59.8	Low	147 Å²	147	100.7 Å²	100.7	69%	0.687	54%	0.541	S	S	*	.			trans	-59.3	113.8	167.1	-70.5	-178.1	165.5	0	0	107.7	S514	E512-S514 PolarHBondContact O-N 2.84Å
513	D	47.9	Very low	56.8	Low	138 Å²	138	107.4 Å²	107.4	74%	0.738	58%	0.577	S	S	*	*			trans	-48.3	96.4	-167.3	-79.6	-43.5	0	0	0	113.3	I511 Y515	I511-D513 PolarHBondContact O-N 2.82Å; D513-Y515 VanDerWaalsContact C-N 3.32Å
514	S	43.8	Very low	54	Low	60 Å²	60	111.6 Å²	111.6	42%	0.42	61%	0.609	S	S	.	*			trans	-101.4	48.1	155.8	168.3	0	0	0	0	108.7	E512 G516	E512-S514 PolarHBondContact O-N 2.84Å; S514-G516 PolarHBondContact O-N 3.28Å
515	Y	44	Very low	51	Low	107 Å²	107	116.8 Å²	116.8	42%	0.42	64%	0.643	S	S	.	*			trans	-71.3	72.7	148.9	-76.3	-77.9	0	0	0	107.4	F497 T498 P500 D513 N517	F497-Y515 PolarHBondContact O-OH 3.07Å; T498-Y515 PolarHBondContact O-OH 3.34Å; P500-Y515 WeakPolarHBondContact CD-OH 3.47Å; D513-Y515 VanDerWaalsContact C-N 3.32Å; Y515-N517 PolarHBondContact O-N 3.49Å
516	G	36	Very low	48.5	Very low	54 Å²	54	120 Å²	120	56%	0.557	66%	0.658	S	S	*	*			trans	-57.1	121.8	163.2	0	0	0	0	0	107.2	S514 D518	S514-G516 PolarHBondContact O-N 3.28Å; G516-D518 PolarHBondContact O-N 3.05Å
517	N	33.6	Very low	46	Very low	141 Å²	141	125.2 Å²	125.2	75%	0.754	67%	0.667	S	S	*	*			trans	-61.3	41.6	-178.8	-77.5	-41.2	0	0	0	114.7	Y515 I519	Y515-N517 PolarHBondContact O-N 3.49Å; N517-I519 PolarHBondContact O-N 2.98Å
518	D	33	Very low	43.5	Very low	161 Å²	161	125.4 Å²	125.4	86%	0.861	67%	0.673	S	S	*	*			trans	-80.6	8	178.8	-71.2	-17.9	0	0	0	113	G516	G516-D518 PolarHBondContact O-N 3.05Å
519	I	33.9	Very low	41.2	Very low	148 Å²	148	122.7 Å²	122.7	76%	0.759	68%	0.678	S	S	*	*	S	Bend	trans	-134.5	69.6	166.2	-45.9	175.5	0	0	0	108.7	N517	N517-I519 PolarHBondContact O-N 2.98Å
520	S	25.4	Very low	38.8	Very low	86 Å²	86	131.5 Å²	131.5	60%	0.601	72%	0.716	S	S	*	*			trans	-124.3	127.4	159.8	-168.6	0	0	0	0	109.2	M522	S520-M522 PolarHBondContact O-N 2.74Å
521	P	26.5	Very low	37.1	Very low	114 Å²	114	131.9 Å²	131.9	74%	0.74	72%	0.715	S	S	*	*			trans	-63.5	130.8	169.9	28.6	-30.2	0	0	0	107.9	N523	P521-N523 PolarHBondContact O-N 2.99Å
522	M	26.2	Very low	35.4	Very low	179 Å²	179	135.1 Å²	135.1	88%	0.882	74%	0.739	S	S	*	*	S	Bend	trans	-36.2	110.7	167	-81.8	168.7	125.6	0	0	110.5	S520	S520-M522 PolarHBondContact O-N 2.74Å
523	N	26.3	Very low	34.2	Very low	145 Å²	145	136.2 Å²	136.2	78%	0.775	75%	0.748	S	S	*	*			trans	164.1	87	148	-83.9	-16.4	0	0	0	110.9	P521	P521-N523 PolarHBondContact O-N 2.99Å
524	S	30.6	Very low	33.4	Very low	111 Å²	111	134.1 Å²	134.1	78%	0.776	74%	0.744	S	S	*	*			trans	-166.2	107.8	141.1	51.3	0	0	0	0	111.4	I526	S524-I526 PolarHBondContact O-N 3.2Å
525	T	28.5	Very low	32.7	Very low	140 Å²	140	139.3 Å²	139.3	86%	0.859	77%	0.766	S	S	*	*			trans	-61.8	113	157.7	43.5	0	0	0	0	109.8
526	I	37.8	Very low	32.2	Very low	162 Å²	162	139.7 Å²	139.7	83%	0.831	78%	0.78	S	S	*	*			trans	-137.9	120.1	155.2	-61.9	-174.8	0	0	0	109	S524	S524-I526 PolarHBondContact O-N 3.2Å
527	E	34.9	Very low	32.2	Very low	169 Å²	169	145.1 Å²	145.1	79%	0.79	79%	0.791	S	S	*	*			trans	-71.2	152.1	-179	-64.9	165.8	143.3	0	0	112.9
528	D	34.3	Very low	32.5	Very low	154 Å²	154	147.4 Å²	147.4	82%	0.824	80%	0.796	S	S	*	*			trans	49.6	99.9	139.8	-63.5	-15.3	0	0	0	119.7
529	S	36.4	Very low	33.3	Very low	111 Å²	111	148.1 Å²	148.1	78%	0.776	79%	0.792	S	S	*	*				-153.8	130.4	128.9	51.8	0	0	0	0	113	F531	S529-F531 PolarHBondContact O-N 2.95Å
530	K	34.4	Very low	34.6	Very low	207 Å²	207	145.9 Å²	145.9	90%	0.9	79%	0.785	S	S	*	*			trans	-54.3	121.3	175.9	-68	163.8	173	172.6	0	111.9
531	F	35.5	Very low	37	Very low	187 Å²	187	143.5 Å²	143.5	82%	0.82	77%	0.767	S	S	*	*			trans	-131.3	137.5	150.6	-91.1	-86.8	0	0	0	110	S529	S529-F531 PolarHBondContact O-N 2.95Å
532	P	35.6	Very low	40	Very low	117 Å²	117	140.9 Å²	140.9	76%	0.76	74%	0.744	S	S	*	*			trans	-71.3	133.6	-173.9	29.9	-30.7	0	0	0	109.9	S534	P532-S534 PolarHBondContact O-N 2.89Å
533	I	33.6	Very low	42.9	Very low	170 Å²	170	134.4 Å²	134.4	87%	0.872	71%	0.711	S	S	*	*			trans	-64.9	96.1	173.7	-60.4	164.7	0	0	0	107.6
534	S	31.8	Very low	45.8	Very low	93 Å²	93	131.6 Å²	131.6	65%	0.65	69%	0.691	S	S	*	*			trans	-81.6	126.1	162	-179.4	0	0	0	0	107.8	P532 T536	P532-S534 PolarHBondContact O-N 2.89Å; S534-T536 PolarHBondContact O-N 3.21Å
535	L	29	Very low	48.4	Very low	169 Å²	169	127.6 Å²	127.6	89%	0.885	66%	0.661	S	S	*	*			trans	-55.8	103.9	173.4	-72.3	90.8	0	0	0	109.8
536	T	33.6	Very low	51	Low	116 Å²	116	123.3 Å²	123.3	71%	0.712	63%	0.632	S	S	*	*			trans	-104.6	123.1	167	51.3	0	0	0	0	108.7	S534	S534-T536 PolarHBondContact O-N 3.21Å
537	H	34.7	Very low	53.1	Low	168 Å²	168	119.7 Å²	119.7	78%	0.778	61%	0.612	S	S	*	*			trans	-42.5	142.5	166.1	-72.6	-25.8	0	0	0	110.1	F539	H537-F539 PolarHBondContact O-N 2.79Å
538	H	39.5	Very low	55.2	Low	189 Å²	189	117.5 Å²	117.5	88%	0.875	60%	0.596	S	S	*	*			trans	-58.9	86.2	177.1	-71.5	38.1	0	0	0	109.6	V540	H538-V540 PolarHBondContact O-N 2.83Å
539	F	50.3	Low	57.3	Low	176 Å²	176	116 Å²	116	77%	0.772	58%	0.583	S	S	*	*			trans	-69.9	98.7	171.8	-108.3	-93.1	0	0	0	106.1	H537 P541	H537-F539 PolarHBondContact O-N 2.79Å; F539-P541 WeakPolarHBondContact O-CD 3.13Å
540	V	61.4	Low	59	Low	101 Å²	101	112.5 Å²	112.5	61%	0.612	55%	0.552	S	S	*	*			trans	-76.4	114.6	166.2	-179.6	0	0	0	0	105.5	H538 K542 N561	H538-V540 PolarHBondContact O-N 2.83Å; V540-K542 PolarHBondContact O-N 2.94Å; V540-N561 HydrophobicContact CG1-CB 4.35Å
541	P	76.8	Confident	60.5	Low	35 Å²	35	104.4 Å²	104.4	23%	0.227	52%	0.524	C	S	.	.			trans	-60.4	140	-177.3	24.7	-33.5	0	0	0	109.6	F539 Y543 N561	F539-P541 WeakPolarHBondContact O-CD 3.13Å; P541-Y543 VanDerWaalsContact C-N 3.26Å; P541-Y543 PolarHBondContact O-N 2.97Å; P541-N561 PolarHBondContact O-ND2 3.21Å
542	K	87.9	Confident	62.1	Low	59 Å²	59	96 Å²	96	26%	0.257	49%	0.488	S	S	.	.	S	Bend	trans	-55.1	-46.6	178.3	179.7	77.3	-173.7	-166.2	0	110.4	V540 I560 N561 N562 D564 D567	V540-K542 PolarHBondContact O-N 2.94Å; K542-I560 CarbonylContact O-C 3.43Å; K542-I560 WeakPolarHBondContact O-CA 3.09Å; K542-N561 WeakPolarHBondContact CD-O 3.26Å; K542-N561 PolarHBondContact O-N 2.92Å; K542-N562 PolarHBondContact NZ-O 3.19Å; K542-D564 IonicContact NZ-OD2 3.6Å; K542-D564 PolarHBondContact NZ-OD2 2.87Å; K542-D567 VanDerWaalsContact CE-CG 3.49Å; K542-D567 WeakPolarHBondContact CE-OD1 3.11Å; K542-D567 WeakPolarHBondContact CE-OD2 3.28Å; K542-D567 IonicContact NZ-OD1 2.66Å; K542-D567 PolarHBondContact NZ-OD1 2.04Å; K542-D567 IonicContact NZ-OD2 3.85Å; K542-D567 PolarHBondContact NZ-OD2 2.57Å
543	Y	87.8	Confident	64.1	Low	44 Å²	44	90.5 Å²	90.5	17%	0.173	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	136.1	179.8	-58.4	-71.7	0	0	0	110.9	I509 P541 L558 K559 I560 D567	I509-Y543 HydrophobicContact CD1-CE1 4.5Å; I509-Y543 HydrophobicContact CG2-CD1 3.93Å; I509-Y543 HydrophobicContact CG2-CD2 3.47Å; I509-Y543 VanDerWaalsContact CG2-CD2 3.47Å; I509-Y543 HydrophobicContact CG2-CE1 4.23Å; I509-Y543 HydrophobicContact CG2-CE2 3.8Å; I509-Y543 HydrophobicContact CG2-CG 3.54Å; P541-Y543 VanDerWaalsContact C-N 3.26Å; P541-Y543 PolarHBondContact O-N 2.97Å; Y543-L558 HydrophobicContact CD1-CD1 4.23Å; Y543-K559 CarbonylContact C-O 3.49Å; Y543-K559 WeakPolarHBondContact CA-O 3.42Å; Y543-I560 HydrophobicContact CD1-CB 4.43Å; Y543-I560 HydrophobicContact CD1-CG1 3.93Å; Y543-I560 HydrophobicContact CD1-CG2 4.19Å; Y543-I560 HydrophobicContact CE1-CB 4.42Å; Y543-I560 HydrophobicContact CE1-CD1 4.36Å; Y543-I560 HydrophobicContact CE1-CG1 3.93Å; Y543-I560 HydrophobicContact CE1-CG2 3.84Å; Y543-D567 PolarHBondContact OH-OD1 3.38Å
544	K	87.2	Confident	66.5	Low	85 Å²	85	82.9 Å²	82.9	37%	0.37	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	122.7	171.8	178.3	175.5	-177.5	171.5	0	110	I546 K559	K544-I546 HydrophobicContact CG-CG1 4.46Å; K544-K559 HydrophobicContact CB-CB 4.28Å; K544-K559 PolarHBondContact N-O 3.23Å; K544-K559 WeakPolarHBondContact O-CB 3.44Å; K544-K559 PolarHBondContact O-N 2.89Å
545	I	84.5	Confident	69	Low	27 Å²	27	80.6 Å²	80.6	14%	0.138	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	135.4	171.3	-64.9	-169.7	0	0	0	110.2	P500 W502 I511 I556 T557 L558	P500-I545 HydrophobicContact CB-CD1 4.41Å; P500-I545 HydrophobicContact CG-CD1 3.74Å; P500-I545 HydrophobicContact CG-CG2 4.18Å; W502-I545 VanDerWaalsContact CD1-CD1 3.43Å; W502-I545 HydrophobicContact CG-CD1 4.46Å; I511-I545 HydrophobicContact CD1-CD1 3.2Å; I511-I545 HydrophobicContact CD1-CG1 3.65Å; I511-I545 HydrophobicContact CG1-CD1 4.43Å; I511-I545 HydrophobicContact CG1-CG1 4.46Å; I545-I556 HydrophobicContact CG2-CG2 4.05Å; I545-T557 CarbonylContact C-O 3.48Å; I545-T557 WeakPolarHBondContact CA-O 3.5Å; I545-L558 HydrophobicContact CG1-CD1 4.04Å
546	I	84.3	Confident	71.8	Confident	51 Å²	51	72.5 Å²	72.5	26%	0.262	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	123	170.8	-55.9	168.9	0	0	0	107	K544 T557	K544-I546 HydrophobicContact CG-CG1 4.46Å; I546-T557 PolarHBondContact N-O 2.86Å; I546-T557 PolarHBondContact O-N 3.01Å
547	H	80.7	Confident	74.4	Confident	86 Å²	86	67.7 Å²	67.7	40%	0.398	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	138.4	175	58.2	-95.3	0	0	0	110.1	I555 I556	H547-I555 CarbonylContact C-O 3.57Å; H547-I555 WeakPolarHBondContact CA-O 3.47Å; H547-I556 HydrophobicContact CB-CD1 3.39Å
548	R	78.9	Confident	77.1	Confident	122 Å²	122	59.7 Å²	59.7	46%	0.46	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	117.7	173.9	-65.6	-177	178.9	-173	-2.2	109	W554 I555	R548-W554 CarbonylContact O-C 3.51Å; R548-W554 VanDerWaalsContact O-CA 3.26Å; R548-W554 WeakPolarHBondContact O-CA 3.08Å; R548-I555 HydrophobicContact CB-CB 4.43Å; R548-I555 PolarHBondContact N-O 3.28Å; R548-I555 PolarHBondContact O-N 3.1Å
549	K	78.4	Confident	79.5	Confident	124 Å²	124	53.2 Å²	53.2	54%	0.539	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	136.1	174.2	-174.1	171.4	-176.2	169.2	0	109.4	E494	E494-K549 IonicContact OE1-NZ 3.3Å; E494-K549 PolarHBondContact OE1-NZ 3.16Å; E494-K549 IonicContact OE2-NZ 3.3Å; E494-K549 PolarHBondContact OE2-NZ 3.34Å
550	Y	73.2	Confident	81.5	Confident	36 Å²	36	44.8 Å²	44.8	14%	0.141	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	176.5	164.5	58.8	-96.4	0	0	0	108.8	V489 V490 F552 G553 W554 I555	V489-Y550 PolarHBondContact O-OH 2.91Å; V490-Y550 WeakPolarHBondContact CG2-OH 3.38Å; Y550-F552 AromaticContact CD2-CD1 3.77Å; Y550-F552 HydrophobicContact CD2-CD1 3.77Å; Y550-F552 HydrophobicContact CD2-CD2 4.11Å; Y550-F552 AromaticContact CD2-CE1 3.56Å; Y550-F552 HydrophobicContact CD2-CE1 3.56Å; Y550-F552 AromaticContact CD2-CE2 3.91Å; Y550-F552 HydrophobicContact CD2-CE2 3.91Å; Y550-F552 AromaticContact CD2-CG 3.97Å; Y550-F552 HydrophobicContact CD2-CG 3.97Å; Y550-F552 AromaticContact CD2-CZ 3.57Å; Y550-F552 HydrophobicContact CD2-CZ 3.57Å; Y550-F552 HydrophobicContact CE2-CB 4.49Å; Y550-F552 AromaticContact CE2-CD1 3.92Å; Y550-F552 HydrophobicContact CE2-CD1 3.92Å; Y550-F552 AromaticContact CE2-CD2 3.39Å; Y550-F552 HydrophobicContact CE2-CD2 3.39Å; Y550-F552 AromaticContact CE2-CE1 3.75Å; Y550-F552 HydrophobicContact CE2-CE1 3.75Å; Y550-F552 AromaticContact CE2-CE2 3.17Å; Y550-F552 HydrophobicContact CE2-CE2 3.17Å; Y550-F552 AromaticContact CE2-CG 3.69Å; Y550-F552 HydrophobicContact CE2-CG 3.69Å; Y550-F552 AromaticContact CE2-CZ 3.31Å; Y550-F552 HydrophobicContact CE2-CZ 3.31Å; Y550-F552 AromaticContact CZ-CE2 3.99Å; Y550-F552 PolarHBondContact O-N 2.84Å; Y550-G553 WeakPolarHBondContact CD1-O 3.47Å; Y550-G553 PolarHBondContact N-O 3.17Å; Y550-G553 PolarHBondContact O-N 3.02Å; Y550-G553 VanDerWaalsContact O-O 3.06Å; Y550-W554 VanDerWaalsContact CE1-C 3.43Å; Y550-W554 VanDerWaalsContact CE1-N 3.25Å; Y550-I555 HydrophobicContact CD1-CD1 4.41Å; Y550-I555 HydrophobicContact CD1-CG1 3.83Å; Y550-I555 HydrophobicContact CE1-CD1 4.49Å; Y550-I555 HydrophobicContact CE1-CG1 3.65Å
551	A	66	Low	83	Confident	38 Å²	38	40.9 Å²	40.9	31%	0.314	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-30.4	-167	0	0	0	0	0	115.6	V415 Y492	V415-A551 HydrophobicContact CG2-CB 4.32Å; Y492-A551 PolarHBondContact OH-O 3.31Å
552	F	69	Low	83.5	Confident	10 Å²	10	44.4 Å²	44.4	4%	0.044	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.7	12.4	-174.1	55.6	-80.9	0	0	0	114.2	L408 F416 V490 Y492 Y550	L408-F552 HydrophobicContact CD1-CD1 4.28Å; L408-F552 HydrophobicContact CD1-CD2 3.93Å; L408-F552 HydrophobicContact CD1-CE1 4.01Å; L408-F552 HydrophobicContact CD1-CE2 3.64Å; L408-F552 HydrophobicContact CD1-CG 4.31Å; L408-F552 HydrophobicContact CD1-CZ 3.74Å; L408-F552 HydrophobicContact CD2-CE1 4.19Å; L408-F552 HydrophobicContact CD2-CE2 3.72Å; L408-F552 HydrophobicContact CD2-CZ 3.41Å; L408-F552 VanDerWaalsContact CD2-CZ 3.41Å; L408-F552 HydrophobicContact CG-CE1 4.09Å; L408-F552 HydrophobicContact CG-CE2 4.1Å; L408-F552 HydrophobicContact CG-CZ 3.76Å; F416-F552 HydrophobicContact CE2-CE1 4.44Å; F416-F552 AromaticContact CZ-CE1 3.98Å; F416-F552 HydrophobicContact CZ-CE1 3.98Å; F416-F552 HydrophobicContact CZ-CZ 4.07Å; V490-F552 HydrophobicContact CG1-CD2 4.28Å; V490-F552 HydrophobicContact CG2-CD2 3.99Å; V490-F552 HydrophobicContact CG2-CE2 4.12Å; Y492-F552 HydrophobicContact CE2-CB 3.87Å; Y492-F552 WeakPolarHBondContact OH-CA 3.24Å; Y550-F552 AromaticContact CD2-CD1 3.77Å; Y550-F552 HydrophobicContact CD2-CD1 3.77Å; Y550-F552 HydrophobicContact CD2-CD2 4.11Å; Y550-F552 AromaticContact CD2-CE1 3.56Å; Y550-F552 HydrophobicContact CD2-CE1 3.56Å; Y550-F552 AromaticContact CD2-CE2 3.91Å; Y550-F552 HydrophobicContact CD2-CE2 3.91Å; Y550-F552 AromaticContact CD2-CG 3.97Å; Y550-F552 HydrophobicContact CD2-CG 3.97Å; Y550-F552 AromaticContact CD2-CZ 3.57Å; Y550-F552 HydrophobicContact CD2-CZ 3.57Å; Y550-F552 HydrophobicContact CE2-CB 4.49Å; Y550-F552 AromaticContact CE2-CD1 3.92Å; Y550-F552 HydrophobicContact CE2-CD1 3.92Å; Y550-F552 AromaticContact CE2-CD2 3.39Å; Y550-F552 HydrophobicContact CE2-CD2 3.39Å; Y550-F552 AromaticContact CE2-CE1 3.75Å; Y550-F552 HydrophobicContact CE2-CE1 3.75Å; Y550-F552 AromaticContact CE2-CE2 3.17Å; Y550-F552 HydrophobicContact CE2-CE2 3.17Å; Y550-F552 AromaticContact CE2-CG 3.69Å; Y550-F552 HydrophobicContact CE2-CG 3.69Å; Y550-F552 AromaticContact CE2-CZ 3.31Å; Y550-F552 HydrophobicContact CE2-CZ 3.31Å; Y550-F552 AromaticContact CZ-CE2 3.99Å; Y550-F552 PolarHBondContact O-N 2.84Å
553	G	77.7	Confident	83.7	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.6	-166.3	-172.8	0	0	0	0	0	114.5	V489 Y550	V489-G553 CarbonylContact O-C 3.5Å; V489-G553 WeakPolarHBondContact O-CA 3.35Å; Y550-G553 WeakPolarHBondContact CD1-O 3.47Å; Y550-G553 PolarHBondContact N-O 3.17Å; Y550-G553 PolarHBondContact O-N 3.02Å; Y550-G553 VanDerWaalsContact O-O 3.06Å
554	W	83.8	Confident	83.8	Confident	11 Å²	11	42.6 Å²	42.6	4%	0.042	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	142.3	-176.5	-57.1	-102.8	0	0	0	110.5	V489 E494 P495 F497 R548 Y550 I556	V489-W554 HydrophobicContact CB-CE3 4.49Å; V489-W554 HydrophobicContact CG1-CE3 4.38Å; V489-W554 PolarHBondContact N-O 2.98Å; V489-W554 PolarHBondContact O-N 3.02Å; E494-W554 HydrophobicContact CB-CH2 3.64Å; E494-W554 HydrophobicContact CB-CZ2 3.76Å; E494-W554 HydrophobicContact CG-CH2 3.68Å; E494-W554 HydrophobicContact CG-CZ2 3.78Å; P495-W554 HydrophobicContact CG-CE3 4.13Å; P495-W554 HydrophobicContact CG-CH2 4.46Å; P495-W554 HydrophobicContact CG-CZ3 4.06Å; F497-W554 HydrophobicContact CE1-CB 4.28Å; F497-W554 AromaticContact CE1-CD1 4Å; F497-W554 HydrophobicContact CE1-CD2 4.25Å; F497-W554 AromaticContact CE1-CG 3.92Å; F497-W554 HydrophobicContact CE1-CG 3.92Å; F497-W554 AromaticContact CE2-CD1 3.66Å; F497-W554 AromaticContact CE2-CD2 3.56Å; F497-W554 HydrophobicContact CE2-CD2 3.56Å; F497-W554 AromaticContact CE2-CE2 3.16Å; F497-W554 HydrophobicContact CE2-CE3 4.18Å; F497-W554 AromaticContact CE2-CG 3.9Å; F497-W554 HydrophobicContact CE2-CG 3.9Å; F497-W554 HydrophobicContact CE2-CH2 4.29Å; F497-W554 AromaticContact CE2-CZ2 3.58Å; F497-W554 HydrophobicContact CE2-CZ2 3.58Å; F497-W554 AromaticContact CE2-NE1 3.18Å; F497-W554 HydrophobicContact CZ-CB 3.96Å; F497-W554 AromaticContact CZ-CD1 3.32Å; F497-W554 AromaticContact CZ-CD2 3.13Å; F497-W554 HydrophobicContact CZ-CD2 3.13Å; F497-W554 AromaticContact CZ-CE2 3.33Å; F497-W554 AromaticContact CZ-CE3 3.69Å; F497-W554 HydrophobicContact CZ-CE3 3.69Å; F497-W554 AromaticContact CZ-CG 3.2Å; F497-W554 HydrophobicContact CZ-CG 3.2Å; F497-W554 HydrophobicContact CZ-CZ2 4.08Å; F497-W554 HydrophobicContact CZ-CZ3 4.41Å; F497-W554 AromaticContact CZ-NE1 3.37Å; R548-W554 CarbonylContact O-C 3.51Å; R548-W554 VanDerWaalsContact O-CA 3.26Å; R548-W554 WeakPolarHBondContact O-CA 3.08Å; Y550-W554 VanDerWaalsContact CE1-C 3.43Å; Y550-W554 VanDerWaalsContact CE1-N 3.25Å; W554-I556 HydrophobicContact CB-CD1 3.89Å; W554-I556 HydrophobicContact CB-CG1 4.2Å
555	I	84.6	Confident	83.8	Confident	44 Å²	44	43.1 Å²	43.1	23%	0.226	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	114.6	165	-54	-177.1	0	0	0	106	I486 H547 R548 Y550	I486-I555 HydrophobicContact CG2-CG2 3.51Å; H547-I555 CarbonylContact C-O 3.57Å; H547-I555 WeakPolarHBondContact CA-O 3.47Å; R548-I555 HydrophobicContact CB-CB 4.43Å; R548-I555 PolarHBondContact N-O 3.28Å; R548-I555 PolarHBondContact O-N 3.1Å; Y550-I555 HydrophobicContact CD1-CD1 4.41Å; Y550-I555 HydrophobicContact CD1-CG1 3.83Å; Y550-I555 HydrophobicContact CE1-CD1 4.49Å; Y550-I555 HydrophobicContact CE1-CG1 3.65Å
556	I	87.4	Confident	84.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	115.1	180	-53.2	-60.7	0	0	0	107.7	C487 V489 F497 P500 W502 I545 H547 W554 F575	C487-I556 PolarHBondContact N-O 2.85Å; C487-I556 PolarHBondContact O-N 2.85Å; V489-I556 HydrophobicContact CG2-CG1 4.36Å; F497-I556 HydrophobicContact CE1-CD1 3.94Å; P500-I556 HydrophobicContact CB-CG2 4.26Å; W502-I556 HydrophobicContact CZ2-CG2 4.27Å; I545-I556 HydrophobicContact CG2-CG2 4.05Å; H547-I556 HydrophobicContact CB-CD1 3.39Å; W554-I556 HydrophobicContact CB-CD1 3.89Å; W554-I556 HydrophobicContact CB-CG1 4.2Å; I556-F575 HydrophobicContact CB-CE1 4.43Å; I556-F575 HydrophobicContact CB-CZ 3.85Å; I556-F575 HydrophobicContact CG1-CE1 3.73Å; I556-F575 HydrophobicContact CG1-CZ 3.59Å; I556-F575 HydrophobicContact CG2-CZ 4.04Å
557	T	88.4	Confident	84.4	Confident	14 Å²	14	45.9 Å²	45.9	9%	0.086	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	121.8	-178.9	-53.6	0	0	0	0	110	H484 L485 I486 I545 I546	H484-T557 HydrophobicContact CB-CG2 3.73Å; L485-T557 CarbonylContact O-C 3.58Å; L485-T557 VanDerWaalsContact O-CA 3.24Å; L485-T557 WeakPolarHBondContact O-CA 3.25Å; I486-T557 HydrophobicContact CG1-CG2 4.11Å; I545-T557 CarbonylContact C-O 3.48Å; I545-T557 WeakPolarHBondContact CA-O 3.5Å; I546-T557 PolarHBondContact N-O 2.86Å; I546-T557 PolarHBondContact O-N 3.01Å
558	L	91	Very high	85	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	110.2	164.3	179.1	66.9	0	0	0	108.4	L485 W502 I509 Y543 I545 I560 Y571	L485-L558 HydrophobicContact CB-CB 4.32Å; L485-L558 HydrophobicContact CD1-CD2 4.34Å; L485-L558 PolarHBondContact N-O 3.05Å; L485-L558 PolarHBondContact O-N 3.42Å; W502-L558 HydrophobicContact CB-CD2 4.37Å; W502-L558 HydrophobicContact CD2-CB 3.79Å; W502-L558 HydrophobicContact CD2-CD2 3.83Å; W502-L558 HydrophobicContact CD2-CG 4.31Å; W502-L558 HydrophobicContact CE3-CB 3.93Å; W502-L558 HydrophobicContact CE3-CD2 3.59Å; W502-L558 HydrophobicContact CE3-CG 4.37Å; W502-L558 HydrophobicContact CG-CB 4.46Å; W502-L558 HydrophobicContact CG-CD2 4.19Å; W502-L558 HydrophobicContact CH2-CB 3.82Å; W502-L558 HydrophobicContact CZ2-CB 3.7Å; W502-L558 HydrophobicContact CZ3-CB 3.94Å; W502-L558 HydrophobicContact CZ3-CD2 4.12Å; I509-L558 HydrophobicContact CD1-CD2 3.58Å; Y543-L558 HydrophobicContact CD1-CD1 4.23Å; I545-L558 HydrophobicContact CG1-CD1 4.04Å; L558-I560 HydrophobicContact CD2-CD1 4.49Å; L558-I560 HydrophobicContact CD2-CG1 4.33Å; L558-I560 HydrophobicContact CG-CG1 4.2Å; L558-Y571 HydrophobicContact CD2-CD1 3.84Å; L558-Y571 HydrophobicContact CD2-CE1 4Å
559	K	91.4	Very high	85.7	Confident	53 Å²	53	40.6 Å²	40.6	23%	0.23	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	120.2	171.5	-171.8	-173.9	-171.2	-157.6	0	109.1	I483 Y543 K544 N561	I483-K559 WeakPolarHBondContact O-CA 3.3Å; Y543-K559 CarbonylContact C-O 3.49Å; Y543-K559 WeakPolarHBondContact CA-O 3.42Å; K544-K559 HydrophobicContact CB-CB 4.28Å; K544-K559 PolarHBondContact N-O 3.23Å; K544-K559 WeakPolarHBondContact O-CB 3.44Å; K544-K559 PolarHBondContact O-N 2.89Å; K559-N561 WeakPolarHBondContact CD-OD1 3.43Å; K559-N561 WeakPolarHBondContact CE-OD1 3.34Å; K559-N561 PolarHBondContact NZ-OD1 3.26Å; K559-N561 VanDerWaalsContact NZ-OD1 3.1Å
560	I	92.1	Very high	86.4	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	118	173.1	-48.4	169.5	0	0	0	106.7	S482 I483 L485 K542 Y543 L558 L563 Y571 L588	S482-I560 CarbonylContact C-O 3.54Å; S482-I560 WeakPolarHBondContact CA-O 3.46Å; S482-I560 WeakPolarHBondContact CB-O 3.3Å; I483-I560 HydrophobicContact CG2-CB 4.01Å; I483-I560 HydrophobicContact CG2-CD1 4.1Å; I483-I560 HydrophobicContact CG2-CG1 4.32Å; I483-I560 PolarHBondContact N-O 2.8Å; I483-I560 PolarHBondContact O-N 2.96Å; L485-I560 HydrophobicContact CD1-CD1 3.95Å; L485-I560 HydrophobicContact CG-CD1 4.3Å; K542-I560 CarbonylContact O-C 3.43Å; K542-I560 WeakPolarHBondContact O-CA 3.09Å; Y543-I560 HydrophobicContact CD1-CB 4.43Å; Y543-I560 HydrophobicContact CD1-CG1 3.93Å; Y543-I560 HydrophobicContact CD1-CG2 4.19Å; Y543-I560 HydrophobicContact CE1-CB 4.42Å; Y543-I560 HydrophobicContact CE1-CD1 4.36Å; Y543-I560 HydrophobicContact CE1-CG1 3.93Å; Y543-I560 HydrophobicContact CE1-CG2 3.84Å; L558-I560 HydrophobicContact CD2-CD1 4.49Å; L558-I560 HydrophobicContact CD2-CG1 4.33Å; L558-I560 HydrophobicContact CG-CG1 4.2Å; I560-L563 HydrophobicContact CB-CD2 4.15Å; I560-L563 HydrophobicContact CG2-CD2 3.8Å; I560-Y571 HydrophobicContact CD1-CE1 3.83Å; I560-Y571 HydrophobicContact CD1-CE2 4.16Å; I560-Y571 WeakPolarHBondContact CD1-OH 2.93Å; I560-L588 HydrophobicContact CD1-CD2 3.98Å
561	N	91.1	Very high	87.4	Confident	19 Å²	19	36.4 Å²	36.4	10%	0.102	20%	0.197	C	C	.	.			trans	-93.2	142	179.5	-62.9	-52.7	0	0	0	110.1	V540 P541 K542 K559	V540-N561 HydrophobicContact CG1-CB 4.35Å; P541-N561 PolarHBondContact O-ND2 3.21Å; K542-N561 WeakPolarHBondContact CD-O 3.26Å; K542-N561 PolarHBondContact O-N 2.92Å; K559-N561 WeakPolarHBondContact CD-OD1 3.43Å; K559-N561 WeakPolarHBondContact CE-OD1 3.34Å; K559-N561 PolarHBondContact NZ-OD1 3.26Å; K559-N561 VanDerWaalsContact NZ-OD1 3.1Å
562	N	89	Confident	88.7	Confident	109 Å²	109	36.9 Å²	36.9	58%	0.583	19%	0.192	S	C	*	.	S	Bend	trans	53.2	67.2	176.2	-170.2	44.6	0	0	0	112.9	G480 K481 K542 D564	G480-N562 WeakPolarHBondContact CA-OD1 3.32Å; K481-N562 PolarHBondContact O-N 2.9Å; K542-N562 PolarHBondContact NZ-O 3.19Å; N562-D564 PolarHBondContact O-N 3.33Å
563	L	90.8	Very high	89.8	Confident	5 Å²	5	36.4 Å²	36.4	3%	0.026	19%	0.19	C	C	.	.			trans	-54.5	131.8	-178.2	-78.1	171.5	0	0	0	112.7	I478 G480 K481 I483 I560 D567 L588 L590	I478-L563 WeakPolarHBondContact O-CD1 3.33Å; G480-L563 PolarHBondContact N-O 2.97Å; K481-L563 WeakPolarHBondContact O-CB 3.32Å; K481-L563 WeakPolarHBondContact O-CG 3.26Å; K481-L563 PolarHBondContact O-N 3.48Å; I483-L563 HydrophobicContact CB-CD1 3.83Å; I483-L563 HydrophobicContact CD1-CD1 4.47Å; I483-L563 HydrophobicContact CG2-CD1 3.78Å; I483-L563 HydrophobicContact CG2-CD2 3.79Å; I483-L563 HydrophobicContact CG2-CG 4.07Å; I560-L563 HydrophobicContact CB-CD2 4.15Å; I560-L563 HydrophobicContact CG2-CD2 3.8Å; L563-D567 VanDerWaalsContact CA-OD2 3.25Å; L563-D567 WeakPolarHBondContact CA-OD2 3.26Å; L563-D567 HydrophobicContact CD2-CB 3.86Å; L563-L588 HydrophobicContact CD2-CD2 3.93Å; L563-L590 HydrophobicContact CB-CD2 4.16Å; L563-L590 HydrophobicContact CD1-CD2 3.83Å; L563-L590 HydrophobicContact CD2-CD2 4.13Å; L563-L590 HydrophobicContact CG-CD2 4.28Å
564	D	90.2	Very high	90.4	Very high	59 Å²	59	37.3 Å²	37.3	32%	0.316	20%	0.197	S	C	.	.			trans	-125.9	171.8	173.6	63.9	51.1	0	0	0	110.8	K542 N562 N566 D567 L590	K542-D564 IonicContact NZ-OD2 3.6Å; K542-D564 PolarHBondContact NZ-OD2 2.87Å; N562-D564 PolarHBondContact O-N 3.33Å; D564-N566 PolarHBondContact O-N 2.78Å; D564-N566 VanDerWaalsContact O-N 3.16Å; D564-N566 WeakPolarHBondContact OD1-CA 3.17Å; D564-N566 VanDerWaalsContact OD1-CB 3.29Å; D564-N566 WeakPolarHBondContact OD1-CB 3.07Å; D564-N566 PolarHBondContact OD1-N 2.96Å; D564-D567 PolarHBondContact N-OD2 3.37Å; D564-D567 WeakPolarHBondContact O-CB 3.31Å; D564-D567 PolarHBondContact O-N 3.16Å; D564-D567 PolarHBondContact OD1-N 2.8Å; D564-L590 WeakPolarHBondContact O-CD1 3.09Å
565	L	88.2	Confident	90.7	Very high	96 Å²	96	37.1 Å²	37.1	50%	0.503	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-20.4	-176.7	-67.4	171.7	0	0	0	114	L479 D567	L479-L565 HydrophobicContact CD1-CD2 4.33Å; L479-L565 HydrophobicContact CD2-CD2 4.04Å; L479-L565 HydrophobicContact CD2-CG 4.21Å; L565-D567 VanDerWaalsContact C-N 3.34Å
566	N	89.8	Confident	90.9	Very high	133 Å²	133	38.1 Å²	38.1	71%	0.711	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-19.8	178.4	-58.5	-27.9	0	0	0	111.5	H504 D564 E568	H504-N566 PolarHBondContact CE1-O 2.93Å; D564-N566 PolarHBondContact O-N 2.78Å; D564-N566 VanDerWaalsContact O-N 3.16Å; D564-N566 WeakPolarHBondContact OD1-CA 3.17Å; D564-N566 VanDerWaalsContact OD1-CB 3.29Å; D564-N566 WeakPolarHBondContact OD1-CB 3.07Å; D564-N566 PolarHBondContact OD1-N 2.96Å; N566-E568 PolarHBondContact O-N 2.97Å
567	D	91.6	Very high	90.9	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.021	21%	0.208	C	C	.	.	S	Bend	trans	-72.9	-17.8	175.2	-59.1	-46.4	0	0	0	112.3	H504 K542 Y543 L563 D564 L565 G569 Y571 L588	H504-D567 PolarHBondContact NE2-O 2.82Å; K542-D567 VanDerWaalsContact CE-CG 3.49Å; K542-D567 WeakPolarHBondContact CE-OD1 3.11Å; K542-D567 WeakPolarHBondContact CE-OD2 3.28Å; K542-D567 IonicContact NZ-OD1 2.66Å; K542-D567 PolarHBondContact NZ-OD1 2.04Å; K542-D567 IonicContact NZ-OD2 3.85Å; K542-D567 PolarHBondContact NZ-OD2 2.57Å; Y543-D567 PolarHBondContact OH-OD1 3.38Å; L563-D567 VanDerWaalsContact CA-OD2 3.25Å; L563-D567 WeakPolarHBondContact CA-OD2 3.26Å; L563-D567 HydrophobicContact CD2-CB 3.86Å; D564-D567 PolarHBondContact N-OD2 3.37Å; D564-D567 WeakPolarHBondContact O-CB 3.31Å; D564-D567 PolarHBondContact O-N 3.16Å; D564-D567 PolarHBondContact OD1-N 2.8Å; L565-D567 VanDerWaalsContact C-N 3.34Å; D567-G569 PolarHBondContact O-N 3.31Å; D567-Y571 VanDerWaalsContact O-CE2 3.23Å; D567-Y571 WeakPolarHBondContact O-CE2 3.39Å; D567-Y571 PolarHBondContact O-OH 3.34Å; D567-L588 HydrophobicContact CB-CD2 4.46Å
568	E	92.4	Very high	90.8	Very high	80 Å²	80	43.7 Å²	43.7	37%	0.374	23%	0.233	S	C	.	.			trans	-61.6	138.4	177.1	-160.3	173.3	175.8	0	0	111.1	H504 N566 L588 L590	H504-E568 PolarHBondContact NE2-O 3.03Å; N566-E568 PolarHBondContact O-N 2.97Å; E568-L588 VanDerWaalsContact CG-O 3.25Å; E568-L588 WeakPolarHBondContact CG-O 3.29Å; E568-L590 HydrophobicContact CB-CD1 3.83Å; E568-L590 HydrophobicContact CB-CG 4.05Å; E568-L590 HydrophobicContact CG-CG 4.25Å
569	G	93.3	Very high	90.5	Very high	17 Å²	17	44.8 Å²	44.8	18%	0.175	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	146.6	-162.1	178.4	0	0	0	0	0	115.1	N505 D567 L588	N505-G569 WeakPolarHBondContact OD1-CA 3.43Å; D567-G569 PolarHBondContact O-N 3.31Å; G569-L588 PolarHBondContact N-O 2.92Å; G569-L588 PolarHBondContact O-N 3.28Å
570	I	94.1	Very high	90.4	Very high	72 Å²	72	43.3 Å²	43.3	37%	0.369	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	115.5	-176.5	-50.8	-177.1	0	0	0	108.7	N505 E585	N505-I570 PolarHBondContact N-O 3.25Å; N505-I570 PolarHBondContact OD1-N 3.38Å; I570-E585 HydrophobicContact CG2-CB 4.13Å; I570-E585 HydrophobicContact CG2-CG 4.21Å
571	Y	94.3	Very high	90.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	135.6	171	-71.7	-94.6	0	0	0	109.9	L485 L503 H504 I509 L558 I560 D567 E585 I586 L588	L485-Y571 HydrophobicContact CD1-CD1 3.76Å; L485-Y571 HydrophobicContact CD1-CD2 3.6Å; L485-Y571 HydrophobicContact CD1-CE1 4.25Å; L485-Y571 HydrophobicContact CD1-CE2 4.1Å; L485-Y571 HydrophobicContact CD1-CG 3.4Å; L485-Y571 VanDerWaalsContact CD1-CG 3.4Å; L503-Y571 CarbonylContact O-C 3.6Å; L503-Y571 VanDerWaalsContact O-CA 3.24Å; L503-Y571 WeakPolarHBondContact O-CA 3.34Å; H504-Y571 HydrophobicContact CB-CD1 4.11Å; H504-Y571 HydrophobicContact CB-CE1 3.85Å; H504-Y571 AromaticContact CD2-CD2 3.96Å; H504-Y571 AromaticContact CD2-CE1 3.59Å; H504-Y571 AromaticContact CD2-CE2 3.45Å; H504-Y571 VanDerWaalsContact CD2-CE2 3.45Å; H504-Y571 WeakPolarHBondContact CD2-CE2 3.45Å; H504-Y571 AromaticContact CD2-CZ 3.23Å; H504-Y571 AromaticContact CG-CE1 3.88Å; H504-Y571 AromaticContact CG-CZ 3.91Å; H504-Y571 AromaticContact NE2-CE2 3.91Å; H504-Y571 AromaticContact NE2-CZ 3.75Å; I509-Y571 HydrophobicContact CD1-CD1 3.79Å; I509-Y571 HydrophobicContact CD1-CE1 3.66Å; L558-Y571 HydrophobicContact CD2-CD1 3.84Å; L558-Y571 HydrophobicContact CD2-CE1 4Å; I560-Y571 HydrophobicContact CD1-CE1 3.83Å; I560-Y571 HydrophobicContact CD1-CE2 4.16Å; I560-Y571 WeakPolarHBondContact CD1-OH 2.93Å; D567-Y571 VanDerWaalsContact O-CE2 3.23Å; D567-Y571 WeakPolarHBondContact O-CE2 3.39Å; D567-Y571 PolarHBondContact O-OH 3.34Å; Y571-E585 CarbonylContact O-C 3.55Å; Y571-E585 WeakPolarHBondContact O-CA 3.45Å; Y571-I586 PolarHBondContact N-O 3.22Å; Y571-I586 PolarHBondContact O-N 3.37Å; Y571-L588 HydrophobicContact CD2-CB 3.86Å; Y571-L588 HydrophobicContact CD2-CD2 4.44Å; Y571-L588 HydrophobicContact CE2-CB 3.73Å; Y571-L588 HydrophobicContact CE2-CD2 3.62Å; Y571-L588 HydrophobicContact CE2-CG 4.31Å
572	Q	93	Very high	90.2	Very high	47 Å²	47	47.4 Å²	47.4	22%	0.22	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	122.6	175.9	-177.1	-174.2	-2	0	0	109.6	W502 L503 S583 Y584 E585	W502-Q572 WeakPolarHBondContact CA-O 3.46Å; L503-Q572 HydrophobicContact CB-CB 4.19Å; L503-Q572 HydrophobicContact CD1-CB 4.39Å; L503-Q572 HydrophobicContact CD1-CG 4.47Å; L503-Q572 PolarHBondContact N-O 3.21Å; L503-Q572 PolarHBondContact O-N 3.22Å; Q572-S583 PolarHBondContact NE2-OG 2.8Å; Q572-Y584 WeakPolarHBondContact CA-O 3.47Å; Q572-E585 HydrophobicContact CB-CG 4.42Å; Q572-E585 HydrophobicContact CG-CG 4.32Å
573	C	91.4	Very high	90.3	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	125.6	170.8	63.2	0	0	0	0	109.1	V469 C487 W502 F575 S583 Y584	V469-C573 VanDerWaalsContact CG1-SG 3.6Å; C487-C573 HydrophobicContact CB-CB 3.86Å; C487-C573 WeakPolarHBondContact CB-SG 3.23Å; C487-C573 WeakPolarHBondContact SG-CB 3.18Å; C487-C573 CovalentContact SG-SG 2.02Å; C487-C573 PolarHBondContact SG-SG 2.96Å; W502-C573 HydrophobicContact CD2-CB 4.05Å; W502-C573 HydrophobicContact CE3-CB 4.02Å; W502-C573 HydrophobicContact CH2-CB 3.88Å; W502-C573 HydrophobicContact CZ2-CB 3.88Å; W502-C573 HydrophobicContact CZ3-CB 3.94Å; C573-F575 HydrophobicContact CB-CE2 3.91Å; C573-S583 CarbonylContact O-C 3.5Å; C573-S583 WeakPolarHBondContact O-CA 3.45Å; C573-S583 WeakPolarHBondContact O-CB 3.21Å; C573-Y584 PolarHBondContact N-O 2.67Å; C573-Y584 PolarHBondContact O-N 2.82Å
574	S	90.9	Very high	90.4	Very high	21 Å²	21	47.6 Å²	47.6	15%	0.147	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130.2	-174.8	-175	0	0	0	0	111.1	I501	I501-S574 PolarHBondContact N-O 2.8Å; I501-S574 PolarHBondContact O-N 3.27Å
575	F	90	Very high	90.6	Very high	6 Å²	6	50 Å²	50	3%	0.026	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	139.3	-177.5	-64.5	-86.2	0	0	0	110.2	P467 V469 C487 V489 F497 P500 I556 C573 S581 S582	P467-F575 HydrophobicContact CB-CB 4.13Å; P467-F575 HydrophobicContact CG-CB 4.36Å; V469-F575 HydrophobicContact CB-CD2 4.47Å; V469-F575 HydrophobicContact CG1-CD2 3.89Å; V469-F575 HydrophobicContact CG1-CE2 4.1Å; V469-F575 HydrophobicContact CG2-CB 4.1Å; V469-F575 HydrophobicContact CG2-CD2 3.67Å; V469-F575 HydrophobicContact CG2-CG 4.3Å; C487-F575 HydrophobicContact CB-CE2 4.29Å; V489-F575 HydrophobicContact CG1-CB 4.19Å; V489-F575 HydrophobicContact CG1-CD1 4.31Å; V489-F575 HydrophobicContact CG1-CD2 4.33Å; V489-F575 HydrophobicContact CG1-CG 3.99Å; V489-F575 HydrophobicContact CG2-CD1 3.93Å; V489-F575 HydrophobicContact CG2-CD2 3.38Å; V489-F575 HydrophobicContact CG2-CE1 3.84Å; V489-F575 HydrophobicContact CG2-CE2 3.26Å; V489-F575 HydrophobicContact CG2-CG 3.71Å; V489-F575 HydrophobicContact CG2-CZ 3.52Å; F497-F575 HydrophobicContact CE1-CD1 4.49Å; F497-F575 HydrophobicContact CE1-CE1 4.32Å; P500-F575 HydrophobicContact CB-CE1 3.95Å; P500-F575 HydrophobicContact CB-CZ 4.41Å; I556-F575 HydrophobicContact CB-CE1 4.43Å; I556-F575 HydrophobicContact CB-CZ 3.85Å; I556-F575 HydrophobicContact CG1-CE1 3.73Å; I556-F575 HydrophobicContact CG1-CZ 3.59Å; I556-F575 HydrophobicContact CG2-CZ 4.04Å; C573-F575 HydrophobicContact CB-CE2 3.91Å; F575-S581 CarbonylContact O-C 3.59Å; F575-S581 VanDerWaalsContact O-CA 3.27Å; F575-S581 WeakPolarHBondContact O-CA 3.24Å; F575-S582 PolarHBondContact N-O 2.8Å; F575-S582 PolarHBondContact O-N 3.37Å
576	T	88.5	Confident	90.8	Very high	66 Å²	66	45.5 Å²	45.5	41%	0.405	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	132.9	-178.6	-57.5	0	0	0	0	110.4	P495 N496 G580 S581	P495-T576 WeakPolarHBondContact CA-O 3.35Å; P495-T576 WeakPolarHBondContact CB-O 3.41Å; N496-T576 PolarHBondContact N-O 2.98Å; T576-G580 WeakPolarHBondContact CA-O 3.49Å; T576-S581 WeakPolarHBondContact OG1-CB 3.29Å
577	N	88.3	Confident	91	Very high	12 Å²	12	41 Å²	41	6%	0.064	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	-174.7	167.5	75.6	7.2	0	0	0	109.7	E465 P467 S491 P493 P495 M579 G580	E465-N577 PolarHBondContact O-ND2 2.59Å; P467-N577 WeakPolarHBondContact CD-OD1 3.31Å; P467-N577 HydrophobicContact CG-CB 3.97Å; S491-N577 PolarHBondContact OG-ND2 2.75Å; P493-N577 HydrophobicContact CG-CB 4.23Å; P493-N577 PolarHBondContact O-ND2 3.43Å; P495-N577 HydrophobicContact CB-CB 4.35Å; N577-M579 PolarHBondContact O-N 2.87Å; N577-M579 VanDerWaalsContact O-N 3.1Å; N577-M579 WeakPolarHBondContact OD1-CA 2.9Å; N577-M579 WeakPolarHBondContact OD1-CB 3.31Å; N577-M579 PolarHBondContact OD1-N 3.36Å; N577-G580 PolarHBondContact N-O 3.35Å; N577-G580 PolarHBondContact O-N 2.89Å; N577-G580 PolarHBondContact OD1-N 3.45Å; N577-G580 PolarHBondContact OD1-O 3.47Å
578	L	85	Confident	91.1	Very high	118 Å²	118	40.8 Å²	40.8	62%	0.618	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-16.8	-179.6	-68.3	170.1	0	0	0	114.3	Y326 I330 P493	Y326-L578 HydrophobicContact CE1-CB 4.33Å; Y326-L578 HydrophobicContact CE1-CD1 3.74Å; I330-L578 VanDerWaalsContact CG2-O 3.3Å; I330-L578 WeakPolarHBondContact CG2-O 3.22Å; P493-L578 HydrophobicContact CG-CB 4.06Å; P493-L578 HydrophobicContact CG-CD1 4.38Å; P493-L578 HydrophobicContact CG-CG 4.47Å
579	M	86	Confident	91.1	Very high	24 Å²	24	41.7 Å²	41.7	12%	0.118	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-19	-179.1	-50.5	-76.6	121.3	0	0	112.5	Y326 P327 I330 A464 E465 K466 P493 N577	Y326-M579 HydrophobicContact CD1-CE 3.13Å; Y326-M579 HydrophobicContact CE1-CE 3.5Å; Y326-M579 VanDerWaalsContact CE1-CE 3.5Å; Y326-M579 HydrophobicContact CG-CE 4.11Å; P327-M579 HydrophobicContact CG-SD 4.13Å; I330-M579 HydrophobicContact CD1-CB 4.45Å; I330-M579 HydrophobicContact CD1-CE 3.06Å; I330-M579 HydrophobicContact CD1-CG 4.28Å; I330-M579 HydrophobicContact CD1-SD 3.02Å; I330-M579 WeakPolarHBondContact CD1-SD 3.3Å; I330-M579 HydrophobicContact CG1-CE 4.49Å; I330-M579 HydrophobicContact CG1-SD 4.43Å; A464-M579 VanDerWaalsContact C-SD 3.51Å; A464-M579 HydrophobicContact CB-CE 3.4Å; A464-M579 VanDerWaalsContact CB-CE 3.4Å; A464-M579 HydrophobicContact CB-CG 4.05Å; A464-M579 HydrophobicContact CB-SD 3.28Å; A464-M579 WeakPolarHBondContact CB-SD 3.39Å; E465-M579 VanDerWaalsContact C-CB 3.45Å; E465-M579 VanDerWaalsContact C-CG 3.45Å; E465-M579 WeakPolarHBondContact O-CB 3.47Å; E465-M579 VanDerWaalsContact O-CG 3.26Å; E465-M579 WeakPolarHBondContact O-CG 3.23Å; K466-M579 WeakPolarHBondContact CE-O 3.36Å; K466-M579 HydrophobicContact CG-CB 4.07Å; K466-M579 WeakPolarHBondContact CG-O 2.98Å; P493-M579 HydrophobicContact CG-CE 4.43Å; P493-M579 HydrophobicContact CG-CG 4.5Å; N577-M579 PolarHBondContact O-N 2.87Å; N577-M579 VanDerWaalsContact O-N 3.1Å; N577-M579 WeakPolarHBondContact OD1-CA 2.9Å; N577-M579 WeakPolarHBondContact OD1-CB 3.31Å; N577-M579 PolarHBondContact OD1-N 3.36Å
580	G	87.6	Confident	91	Very high	22 Å²	22	41.5 Å²	41.5	23%	0.227	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	142.4	-168.9	-179.8	0	0	0	0	0	112.8	P467 T576 N577	P467-G580 WeakPolarHBondContact CD-O 3.41Å; T576-G580 WeakPolarHBondContact CA-O 3.49Å; N577-G580 PolarHBondContact N-O 3.35Å; N577-G580 PolarHBondContact O-N 2.89Å; N577-G580 PolarHBondContact OD1-N 3.45Å; N577-G580 PolarHBondContact OD1-O 3.47Å
581	S	89.5	Confident	90.3	Very high	68 Å²	68	42 Å²	42	48%	0.476	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	154.9	178.6	57.2	0	0	0	0	112	F575 T576	F575-S581 CarbonylContact O-C 3.59Å; F575-S581 VanDerWaalsContact O-CA 3.27Å; F575-S581 WeakPolarHBondContact O-CA 3.24Å; T576-S581 WeakPolarHBondContact OG1-CB 3.29Å
582	S	91	Very high	89	Confident	36 Å²	36	46.6 Å²	46.6	25%	0.252	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	149.8	170.5	-69.7	0	0	0	0	109.4	P467 F575	P467-S582 WeakPolarHBondContact O-CB 3.2Å; P467-S582 PolarHBondContact O-OG 3.41Å; F575-S582 PolarHBondContact N-O 2.8Å; F575-S582 PolarHBondContact O-N 3.37Å
583	S	91.3	Very high	87.6	Confident	56 Å²	56	49 Å²	49	39%	0.392	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	157	-174.7	60	0	0	0	0	111.8	Q572 C573	Q572-S583 PolarHBondContact NE2-OG 2.8Å; C573-S583 CarbonylContact O-C 3.5Å; C573-S583 WeakPolarHBondContact O-CA 3.45Å; C573-S583 WeakPolarHBondContact O-CB 3.21Å
584	Y	92.4	Very high	86.1	Confident	63 Å²	63	52.6 Å²	52.6	25%	0.247	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	139.5	175.8	-164.8	-85.4	0	0	0	110.2	H470 S471 Q572 C573 I586	H470-Y584 AromaticContact ND1-CE2 3.93Å; S471-Y584 VanDerWaalsContact CB-CD1 3.5Å; S471-Y584 WeakPolarHBondContact O-CE1 3.39Å; S471-Y584 VanDerWaalsContact O-CZ 3.24Å; S471-Y584 PolarHBondContact O-OH 2.74Å; Q572-Y584 WeakPolarHBondContact CA-O 3.47Å; C573-Y584 PolarHBondContact N-O 2.67Å; C573-Y584 PolarHBondContact O-N 2.82Å; Y584-I586 HydrophobicContact CD1-CG1 4.28Å
585	E	93.4	Very high	84.9	Confident	110 Å²	110	54.2 Å²	54.2	51%	0.514	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	136.7	-179.7	-68.6	176.8	-176.4	0	0	111.1	I570 Y571 Q572	I570-E585 HydrophobicContact CG2-CB 4.13Å; I570-E585 HydrophobicContact CG2-CG 4.21Å; Y571-E585 CarbonylContact O-C 3.55Å; Y571-E585 WeakPolarHBondContact O-CA 3.45Å; Q572-E585 HydrophobicContact CB-CG 4.42Å; Q572-E585 HydrophobicContact CG-CG 4.32Å
586	I	93.6	Very high	83.9	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	119.7	-179.5	-55.5	172.1	0	0	0	107.2	S471 V475 L485 W502 Y571 Y584	S471-I586 WeakPolarHBondContact OG-CD1 3.2Å; S471-I586 WeakPolarHBondContact OG-CG1 3.47Å; V475-I586 HydrophobicContact CB-CG2 4.4Å; V475-I586 HydrophobicContact CG2-CG2 3.63Å; L485-I586 HydrophobicContact CB-CD1 4.11Å; L485-I586 HydrophobicContact CD2-CG2 4.21Å; W502-I586 HydrophobicContact CH2-CD1 4.06Å; W502-I586 HydrophobicContact CZ3-CD1 3.94Å; Y571-I586 PolarHBondContact N-O 3.22Å; Y571-I586 PolarHBondContact O-N 3.37Å; Y584-I586 HydrophobicContact CD1-CG1 4.28Å
587	N	93.7	Very high	83.3	Confident	38 Å²	38	63.1 Å²	63.1	20%	0.203	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	115.5	174	-59.8	-68.2	0	0	0	109.4	S473 H474 V475 Y589	S473-N587 PolarHBondContact O-N 2.02Å; S473-N587 PolarHBondContact O-ND2 3.21Å; H474-N587 WeakPolarHBondContact CA-O 3.19Å; H474-N587 PolarHBondContact CE1-ND2 2.85Å; V475-N587 PolarHBondContact N-O 3.43Å; N587-Y589 HydrophobicContact CB-CE2 3.96Å
588	L	94	Very high	82.7	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.005	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	116.3	172	178.3	58.7	0	0	0	109.1	V475 I483 L485 I560 L563 D567 E568 G569 Y571 L590	V475-L588 WeakPolarHBondContact O-CA 3.49Å; V475-L588 WeakPolarHBondContact O-CD1 3.44Å; I483-L588 HydrophobicContact CD1-CD1 3.49Å; I483-L588 VanDerWaalsContact CD1-CD1 3.49Å; I483-L588 HydrophobicContact CG2-CD1 4.49Å; I483-L588 HydrophobicContact CG2-CD2 4.46Å; L485-L588 HydrophobicContact CD2-CD1 4.46Å; I560-L588 HydrophobicContact CD1-CD2 3.98Å; L563-L588 HydrophobicContact CD2-CD2 3.93Å; D567-L588 HydrophobicContact CB-CD2 4.46Å; E568-L588 VanDerWaalsContact CG-O 3.25Å; E568-L588 WeakPolarHBondContact CG-O 3.29Å; G569-L588 PolarHBondContact N-O 2.92Å; G569-L588 PolarHBondContact O-N 3.28Å; Y571-L588 HydrophobicContact CD2-CB 3.86Å; Y571-L588 HydrophobicContact CD2-CD2 4.44Å; Y571-L588 HydrophobicContact CE2-CB 3.73Å; Y571-L588 HydrophobicContact CE2-CD2 3.62Å; Y571-L588 HydrophobicContact CE2-CG 4.31Å; L588-L590 HydrophobicContact CG-CD2 4.43Å
589	Y	92.3	Very high	82.5	Confident	98 Å²	98	66.1 Å²	66.1	38%	0.384	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	138	170.7	-59	-70.1	0	0	0	110.2	H474 V475 N476 G477 N587	H474-Y589 HydrophobicContact CB-CE2 4.18Å; H474-Y589 AromaticContact ND1-CE2 3.42Å; H474-Y589 WeakPolarHBondContact ND1-CE2 2.98Å; H474-Y589 AromaticContact ND1-CZ 3.99Å; V475-Y589 PolarHBondContact O-N 2.84Å; N476-Y589 CarbonylContact C-O 3.53Å; N476-Y589 WeakPolarHBondContact CA-O 3.39Å; G477-Y589 PolarHBondContact N-O 2.96Å; N587-Y589 HydrophobicContact CB-CE2 3.96Å
590	L	89.8	Confident	82.3	Confident	14 Å²	14	69.2 Å²	69.2	7%	0.073	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	116.6	176.4	-63.4	176.8	0	0	0	109.8	L479 L563 D564 E568 L588 H592	L479-L590 HydrophobicContact CD2-CD1 4.02Å; L563-L590 HydrophobicContact CB-CD2 4.16Å; L563-L590 HydrophobicContact CD1-CD2 3.83Å; L563-L590 HydrophobicContact CD2-CD2 4.13Å; L563-L590 HydrophobicContact CG-CD2 4.28Å; D564-L590 WeakPolarHBondContact O-CD1 3.09Å; E568-L590 HydrophobicContact CB-CD1 3.83Å; E568-L590 HydrophobicContact CB-CG 4.05Å; E568-L590 HydrophobicContact CG-CG 4.25Å; L588-L590 HydrophobicContact CG-CD2 4.43Å; L590-H592 PolarHBondContact O-N 2.71Å
591	N	79.6	Confident	82.2	Confident	81 Å²	81	73.5 Å²	73.5	43%	0.433	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	102.4	170.7	-81	-16.6	0	0	0	108.3	G477 T593	G477-N591 PolarHBondContact O-N 3.09Å; N591-T593 PolarHBondContact O-N 2.83Å
592	H	67.1	Low	82.1	Confident	97 Å²	97	74.4 Å²	74.4	45%	0.449	38%	0.381	S	S	.	.			trans	-71.6	80.3	171	-143.6	-66.1	0	0	0	108.3	L590 L594	L590-H592 PolarHBondContact O-N 2.71Å; H592-L594 PolarHBondContact O-N 3.25Å
593	T	64.2	Low	82.1	Confident	98 Å²	98	75.9 Å²	75.9	60%	0.601	39%	0.386	S	S	*	.			trans	-68.6	91.6	161.8	55.6	0	0	0	0	105.8	N591 S595	N591-T593 PolarHBondContact O-N 2.83Å; T593-S595 PolarHBondContact O-N 3.26Å
594	L	60.7	Low	82.1	Confident	76 Å²	76	76.7 Å²	76.7	40%	0.398	39%	0.388	S	S	.	.			trans	-46.5	116.1	162.9	-81	153.8	0	0	0	105.5	H592 M596 Q598 F599 I602	H592-L594 PolarHBondContact O-N 3.25Å; L594-M596 PolarHBondContact O-N 2.8Å; L594-Q598 HydrophobicContact CB-CB 4.5Å; L594-Q598 HydrophobicContact CD2-CB 3.83Å; L594-F599 HydrophobicContact CD1-CD2 4.45Å; L594-I602 HydrophobicContact CD2-CD1 3.9Å
595	S	65.8	Low	82.1	Confident	54 Å²	54	76.4 Å²	76.4	38%	0.378	40%	0.395	S	S	.	.			trans	-52.4	143.6	174.9	63.1	0	0	0	0	107.5	T593 N597 Q598 F599	T593-S595 PolarHBondContact O-N 3.26Å; S595-N597 CarbonylContact O-C 3.54Å; S595-N597 PolarHBondContact O-N 3.18Å; S595-Q598 WeakPolarHBondContact O-CA 3.39Å; S595-Q598 WeakPolarHBondContact O-CB 2.85Å; S595-Q598 PolarHBondContact O-N 3.02Å; S595-Q598 WeakPolarHBondContact OG-CG 3.39Å; S595-Q598 PolarHBondContact OG-N 3.43Å; S595-F599 PolarHBondContact O-N 2.84Å
596	M	67.4	Low	82.2	Confident	146 Å²	146	74.6 Å²	74.6	72%	0.719	39%	0.394	S	S	*	.	H	α-helix	trans	-49.1	-32.6	178.2	-74.5	-69.4	-94.1	0	0	111.1	L594 F599 I600	L594-M596 PolarHBondContact O-N 2.8Å; M596-F599 PolarHBondContact O-N 2.91Å; M596-I600 WeakPolarHBondContact O-CB 3.38Å; M596-I600 WeakPolarHBondContact O-CD1 3.11Å; M596-I600 WeakPolarHBondContact O-CG1 2.71Å; M596-I600 PolarHBondContact O-N 3.12Å
597	N	76.3	Confident	82.2	Confident	113 Å²	113	81.3 Å²	81.3	60%	0.604	42%	0.423	S	S	*	.	H	α-helix	trans	-63.5	-45.7	172.9	-65.1	-13.1	0	0	0	113.8	S595 I600 I601	S595-N597 CarbonylContact O-C 3.54Å; S595-N597 PolarHBondContact O-N 3.18Å; N597-I600 PolarHBondContact O-N 2.86Å; N597-I601 WeakPolarHBondContact O-CB 3.26Å; N597-I601 WeakPolarHBondContact O-CD1 3.49Å; N597-I601 WeakPolarHBondContact O-CG1 3.06Å; N597-I601 PolarHBondContact O-N 2.86Å
598	Q	76.8	Confident	82.3	Confident	86 Å²	86	83.9 Å²	83.9	40%	0.402	44%	0.436	S	S	.	.	H	α-helix	trans	-64.5	-41	174.9	-78	173.3	-23.8	0	0	111.7	L594 S595 I600 I601 I602	L594-Q598 HydrophobicContact CB-CB 4.5Å; L594-Q598 HydrophobicContact CD2-CB 3.83Å; S595-Q598 WeakPolarHBondContact O-CA 3.39Å; S595-Q598 WeakPolarHBondContact O-CB 2.85Å; S595-Q598 PolarHBondContact O-N 3.02Å; S595-Q598 WeakPolarHBondContact OG-CG 3.39Å; S595-Q598 PolarHBondContact OG-N 3.43Å; Q598-I600 VanDerWaalsContact C-N 3.34Å; Q598-I601 PolarHBondContact O-N 2.9Å; Q598-I602 VanDerWaalsContact O-CG1 3.32Å; Q598-I602 WeakPolarHBondContact O-CG1 3.29Å; Q598-I602 PolarHBondContact O-N 3.08Å
599	F	79.1	Confident	82.3	Confident	108 Å²	108	88.1 Å²	88.1	47%	0.474	46%	0.458	S	S	.	.	H	α-helix	trans	-62.6	-43.1	175.8	-165.6	-102.6	0	0	0	111.3	L594 S595 M596 I602 I603	L594-F599 HydrophobicContact CD1-CD2 4.45Å; S595-F599 PolarHBondContact O-N 2.84Å; M596-F599 PolarHBondContact O-N 2.91Å; F599-I602 PolarHBondContact O-N 3.26Å; F599-I603 HydrophobicContact CD1-CD1 3.54Å; F599-I603 HydrophobicContact CD1-CG1 4.4Å; F599-I603 HydrophobicContact CE1-CD1 3.26Å; F599-I603 HydrophobicContact CE1-CG1 4.27Å; F599-I603 HydrophobicContact CG-CD1 4.47Å; F599-I603 HydrophobicContact CZ-CD1 3.99Å; F599-I603 WeakPolarHBondContact O-CB 3.5Å; F599-I603 WeakPolarHBondContact O-CG1 3.42Å; F599-I603 PolarHBondContact O-N 3.47Å
600	I	83.1	Confident	82.5	Confident	89 Å²	89	89.1 Å²	89.1	46%	0.456	47%	0.469	S	S	.	.	H	α-helix	trans	-62.1	-43.7	173.6	-70.2	163.1	0	0	0	111.1	M596 N597 Q598 I602 I603 V604	M596-I600 WeakPolarHBondContact O-CB 3.38Å; M596-I600 WeakPolarHBondContact O-CD1 3.11Å; M596-I600 WeakPolarHBondContact O-CG1 2.71Å; M596-I600 PolarHBondContact O-N 3.12Å; N597-I600 PolarHBondContact O-N 2.86Å; Q598-I600 VanDerWaalsContact C-N 3.34Å; I600-I602 PolarHBondContact O-N 3.3Å; I600-I603 PolarHBondContact O-N 2.86Å; I600-V604 HydrophobicContact CG2-CG2 4.11Å; I600-V604 WeakPolarHBondContact O-CB 3.05Å; I600-V604 WeakPolarHBondContact O-CG2 3.1Å; I600-V604 PolarHBondContact O-N 3.12Å
601	I	85.9	Confident	82.7	Confident	112 Å²	112	93.2 Å²	93.2	57%	0.574	49%	0.49	S	S	*	.	H	α-helix	trans	-62.4	-43.1	178.1	-71	162.7	0	0	0	111	N597 Q598 V604 S605	N597-I601 WeakPolarHBondContact O-CB 3.26Å; N597-I601 WeakPolarHBondContact O-CD1 3.49Å; N597-I601 WeakPolarHBondContact O-CG1 3.06Å; N597-I601 PolarHBondContact O-N 2.86Å; Q598-I601 PolarHBondContact O-N 2.9Å; I601-V604 PolarHBondContact O-N 3.08Å; I601-S605 VanDerWaalsContact O-CB 3.24Å; I601-S605 WeakPolarHBondContact O-CB 3.18Å; I601-S605 PolarHBondContact O-N 2.77Å
602	I	87.5	Confident	83.4	Confident	86 Å²	86	94.2 Å²	94.2	44%	0.441	50%	0.495	S	S	.	.	H	α-helix	trans	-62.4	-46.8	176.5	-68.9	167.4	0	0	0	110.1	L594 Q598 F599 I600 S605 C606	L594-I602 HydrophobicContact CD2-CD1 3.9Å; Q598-I602 VanDerWaalsContact O-CG1 3.32Å; Q598-I602 WeakPolarHBondContact O-CG1 3.29Å; Q598-I602 PolarHBondContact O-N 3.08Å; F599-I602 PolarHBondContact O-N 3.26Å; I600-I602 PolarHBondContact O-N 3.3Å; I602-S605 PolarHBondContact O-N 3.07Å; I602-C606 WeakPolarHBondContact O-CB 3.39Å; I602-C606 PolarHBondContact O-N 3.21Å; I602-C606 PolarHBondContact O-SG 3.33Å
603	I	89.6	Confident	84.7	Confident	68 Å²	68	94.7 Å²	94.7	35%	0.349	50%	0.499	S	S	.	.	H	α-helix	trans	-59.9	-48.9	177	-74	176.1	0	0	0	111	F599 I600 S605 C606 F607	F599-I603 HydrophobicContact CD1-CD1 3.54Å; F599-I603 HydrophobicContact CD1-CG1 4.4Å; F599-I603 HydrophobicContact CE1-CD1 3.26Å; F599-I603 HydrophobicContact CE1-CG1 4.27Å; F599-I603 HydrophobicContact CG-CD1 4.47Å; F599-I603 HydrophobicContact CZ-CD1 3.99Å; F599-I603 WeakPolarHBondContact O-CB 3.5Å; F599-I603 WeakPolarHBondContact O-CG1 3.42Å; F599-I603 PolarHBondContact O-N 3.47Å; I600-I603 PolarHBondContact O-N 2.86Å; I603-S605 VanDerWaalsContact C-N 3.35Å; I603-S605 PolarHBondContact O-N 3.39Å; I603-C606 PolarHBondContact O-N 3.16Å; I603-F607 HydrophobicContact CG2-CD2 3.58Å; I603-F607 HydrophobicContact CG2-CE2 3.56Å; I603-F607 VanDerWaalsContact O-CD2 3.23Å; I603-F607 WeakPolarHBondContact O-CD2 3.49Å; I603-F607 PolarHBondContact O-N 3.2Å
604	V	92	Very high	86.2	Confident	73 Å²	73	94.4 Å²	94.4	44%	0.442	49%	0.494	S	S	.	.	H	α-helix	trans	-62.2	-42.5	179.5	170.3	0	0	0	0	110.9	I600 I601 F607 I608	I600-V604 HydrophobicContact CG2-CG2 4.11Å; I600-V604 WeakPolarHBondContact O-CB 3.05Å; I600-V604 WeakPolarHBondContact O-CG2 3.1Å; I600-V604 PolarHBondContact O-N 3.12Å; I601-V604 PolarHBondContact O-N 3.08Å; V604-F607 PolarHBondContact O-N 2.73Å; V604-I608 HydrophobicContact CG1-CD1 3.83Å; V604-I608 HydrophobicContact CG1-CG1 4.45Å; V604-I608 VanDerWaalsContact O-CG1 3.28Å; V604-I608 WeakPolarHBondContact O-CG1 3.11Å; V604-I608 PolarHBondContact O-N 3.12Å
605	S	93.1	Very high	87.8	Confident	56 Å²	56	95.8 Å²	95.8	39%	0.392	50%	0.501	S	S	.	.	H	α-helix	trans	-61.6	-45.7	175.4	-174.6	0	0	0	0	111.7	I601 I602 I603 F607 I608 I609	I601-S605 VanDerWaalsContact O-CB 3.24Å; I601-S605 WeakPolarHBondContact O-CB 3.18Å; I601-S605 PolarHBondContact O-N 2.77Å; I602-S605 PolarHBondContact O-N 3.07Å; I603-S605 VanDerWaalsContact C-N 3.35Å; I603-S605 PolarHBondContact O-N 3.39Å; S605-F607 VanDerWaalsContact C-N 3.35Å; S605-F607 PolarHBondContact O-N 3.18Å; S605-I608 PolarHBondContact O-N 2.9Å; S605-I609 VanDerWaalsContact O-CG1 3.32Å; S605-I609 WeakPolarHBondContact O-CG1 3.43Å; S605-I609 PolarHBondContact O-N 2.78Å
606	C	94.2	Very high	89.1	Confident	73 Å²	73	99.8 Å²	99.8	49%	0.493	51%	0.512	S	S	.	.	H	α-helix	trans	-59.1	-43.9	173.7	-77	0	0	0	0	111.9	I602 I603 I609 L610	I602-C606 WeakPolarHBondContact O-CB 3.39Å; I602-C606 PolarHBondContact O-N 3.21Å; I602-C606 PolarHBondContact O-SG 3.33Å; I603-C606 PolarHBondContact O-N 3.16Å; C606-I609 PolarHBondContact O-N 2.82Å; C606-L610 VanDerWaalsContact O-CB 3.31Å; C606-L610 WeakPolarHBondContact O-CB 3.42Å; C606-L610 PolarHBondContact O-N 2.77Å
607	F	94.5	Very high	90.3	Very high	140 Å²	140	95.4 Å²	95.4	61%	0.614	50%	0.496	S	S	*	.	H	α-helix	trans	-62.5	-41.9	176	-88.4	-70.5	0	0	0	112.4	I603 V604 S605 L610 L611	I603-F607 HydrophobicContact CG2-CD2 3.58Å; I603-F607 HydrophobicContact CG2-CE2 3.56Å; I603-F607 VanDerWaalsContact O-CD2 3.23Å; I603-F607 WeakPolarHBondContact O-CD2 3.49Å; I603-F607 PolarHBondContact O-N 3.2Å; V604-F607 PolarHBondContact O-N 2.73Å; S605-F607 VanDerWaalsContact C-N 3.35Å; S605-F607 PolarHBondContact O-N 3.18Å; F607-L610 PolarHBondContact O-N 3.35Å; F607-L611 WeakPolarHBondContact O-CB 2.98Å; F607-L611 PolarHBondContact O-N 3.1Å
608	I	94.9	Very high	91	Very high	92 Å²	92	93.7 Å²	93.7	47%	0.472	49%	0.486	S	S	.	.	H	α-helix	trans	-63.4	-46.7	176.8	-69.4	166.5	0	0	0	110.6	V604 S605 L610 L611 I612	V604-I608 HydrophobicContact CG1-CD1 3.83Å; V604-I608 HydrophobicContact CG1-CG1 4.45Å; V604-I608 VanDerWaalsContact O-CG1 3.28Å; V604-I608 WeakPolarHBondContact O-CG1 3.11Å; V604-I608 PolarHBondContact O-N 3.12Å; S605-I608 PolarHBondContact O-N 2.9Å; I608-L610 VanDerWaalsContact C-N 3.31Å; I608-L610 PolarHBondContact O-N 3.31Å; I608-L611 WeakPolarHBondContact O-CB 3.34Å; I608-L611 PolarHBondContact O-N 3.01Å; I608-I612 HydrophobicContact CG2-CD1 3.81Å; I608-I612 HydrophobicContact CG2-CG1 4.45Å; I608-I612 VanDerWaalsContact O-CG1 3.29Å; I608-I612 WeakPolarHBondContact O-CG1 3.48Å; I608-I612 PolarHBondContact O-N 3.37Å
609	I	95	Very high	91.6	Very high	91 Å²	91	92.9 Å²	92.9	47%	0.467	49%	0.49	S	S	.	.	H	α-helix	trans	-60.1	-43.8	177.4	-68.7	167.2	0	0	0	110.4	S605 C606 L611 I612 I613	S605-I609 VanDerWaalsContact O-CG1 3.32Å; S605-I609 WeakPolarHBondContact O-CG1 3.43Å; S605-I609 PolarHBondContact O-N 2.78Å; C606-I609 PolarHBondContact O-N 2.82Å; I609-L611 VanDerWaalsContact C-N 3.34Å; I609-L611 PolarHBondContact O-N 3.44Å; I609-I612 PolarHBondContact O-N 3.37Å; I609-I613 HydrophobicContact CG2-CD1 3.83Å; I609-I613 HydrophobicContact CG2-CG1 4.47Å; I609-I613 VanDerWaalsContact O-CG1 3.3Å; I609-I613 WeakPolarHBondContact O-CG1 3.13Å; I609-I613 PolarHBondContact O-N 3.19Å
610	L	95	Very high	92.1	Very high	119 Å²	119	92.1 Å²	92.1	62%	0.623	49%	0.49	S	S	*	.	H	α-helix	trans	-66.7	-36.4	179.8	-147.1	144.8	0	0	0	111.6	C606 F607 I608 I613 L614	C606-L610 VanDerWaalsContact O-CB 3.31Å; C606-L610 WeakPolarHBondContact O-CB 3.42Å; C606-L610 PolarHBondContact O-N 2.77Å; F607-L610 PolarHBondContact O-N 3.35Å; I608-L610 VanDerWaalsContact C-N 3.31Å; I608-L610 PolarHBondContact O-N 3.31Å; L610-I613 PolarHBondContact O-N 3.09Å; L610-L614 WeakPolarHBondContact O-CB 3.17Å; L610-L614 PolarHBondContact O-N 2.72Å
611	L	94.6	Very high	92.4	Very high	99 Å²	99	94.7 Å²	94.7	52%	0.518	50%	0.495	S	S	.	.	H	α-helix	trans	-64.8	-42.1	171.3	-115	148.7	0	0	0	112.3	F607 I608 I609 L614 L615	F607-L611 WeakPolarHBondContact O-CB 2.98Å; F607-L611 PolarHBondContact O-N 3.1Å; I608-L611 WeakPolarHBondContact O-CB 3.34Å; I608-L611 PolarHBondContact O-N 3.01Å; I609-L611 VanDerWaalsContact C-N 3.34Å; I609-L611 PolarHBondContact O-N 3.44Å; L611-L614 PolarHBondContact O-N 2.93Å; L611-L615 HydrophobicContact CD2-CD1 4.43Å; L611-L615 WeakPolarHBondContact O-CB 3.17Å; L611-L615 VanDerWaalsContact O-CG 3.3Å; L611-L615 WeakPolarHBondContact O-CG 3.33Å; L611-L615 PolarHBondContact O-N 2.05Å
612	I	95	Very high	92.5	Very high	103 Å²	103	96.8 Å²	96.8	53%	0.528	50%	0.497	S	S	.	.	H	α-helix	trans	-63.7	-43.8	176	-68.7	166.5	0	0	0	110.3	I608 I609 L614 L615 F616	I608-I612 HydrophobicContact CG2-CD1 3.81Å; I608-I612 HydrophobicContact CG2-CG1 4.45Å; I608-I612 VanDerWaalsContact O-CG1 3.29Å; I608-I612 WeakPolarHBondContact O-CG1 3.48Å; I608-I612 PolarHBondContact O-N 3.37Å; I609-I612 PolarHBondContact O-N 3.37Å; I612-L614 VanDerWaalsContact C-N 3.34Å; I612-L614 PolarHBondContact O-N 3.2Å; I612-L615 PolarHBondContact O-N 3.49Å; I612-F616 VanDerWaalsContact O-CB 3.32Å; I612-F616 WeakPolarHBondContact O-CB 3.1Å; I612-F616 PolarHBondContact O-N 3.17Å
613	I	94.5	Very high	92.3	Very high	106 Å²	106	96 Å²	96	54%	0.544	50%	0.496	S	S	.	.	H	α-helix	trans	-63.3	-40.6	176	-67.2	167.3	0	0	0	110.9	I609 L610 F616 S617	I609-I613 HydrophobicContact CG2-CD1 3.83Å; I609-I613 HydrophobicContact CG2-CG1 4.47Å; I609-I613 VanDerWaalsContact O-CG1 3.3Å; I609-I613 WeakPolarHBondContact O-CG1 3.13Å; I609-I613 PolarHBondContact O-N 3.19Å; L610-I613 PolarHBondContact O-N 3.09Å; I613-F616 PolarHBondContact O-N 2.9Å; I613-S617 WeakPolarHBondContact O-CB 3.43Å; I613-S617 PolarHBondContact O-N 2.74Å; I613-S617 PolarHBondContact O-OG 2.85Å
614	L	94.5	Very high	91.9	Very high	93 Å²	93	98 Å²	98	49%	0.487	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-45.4	175.4	-166.7	89.3	0	0	0	111.5	L610 L611 I612 F616 S617 I618	L610-L614 WeakPolarHBondContact O-CB 3.17Å; L610-L614 PolarHBondContact O-N 2.72Å; L611-L614 PolarHBondContact O-N 2.93Å; I612-L614 VanDerWaalsContact C-N 3.34Å; I612-L614 PolarHBondContact O-N 3.2Å; L614-F616 VanDerWaalsContact C-N 3.35Å; L614-F616 PolarHBondContact O-N 3.28Å; L614-S617 WeakPolarHBondContact CA-OG 3.48Å; L614-S617 PolarHBondContact O-N 3.38Å; L614-S617 PolarHBondContact O-OG 3.32Å; L614-I618 HydrophobicContact CD2-CD1 4.14Å; L614-I618 HydrophobicContact CG-CD1 4.02Å; L614-I618 WeakPolarHBondContact O-CB 3.46Å; L614-I618 VanDerWaalsContact O-CG1 3.23Å; L614-I618 WeakPolarHBondContact O-CG1 3.38Å; L614-I618 PolarHBondContact O-N 2.78Å
615	L	94.2	Very high	91.2	Very high	105 Å²	105	100.6 Å²	100.6	55%	0.55	51%	0.509	S	S	.	.	H	α-helix	trans	-65.1	-39.6	177.2	-72.2	170.7	0	0	0	111.8	L611 I612 I618 S619	L611-L615 HydrophobicContact CD2-CD1 4.43Å; L611-L615 WeakPolarHBondContact O-CB 3.17Å; L611-L615 VanDerWaalsContact O-CG 3.3Å; L611-L615 WeakPolarHBondContact O-CG 3.33Å; L611-L615 PolarHBondContact O-N 2.05Å; I612-L615 PolarHBondContact O-N 3.49Å; L615-I618 PolarHBondContact O-N 2.8Å; L615-S619 VanDerWaalsContact O-CB 3.3Å; L615-S619 WeakPolarHBondContact O-CB 3.36Å; L615-S619 PolarHBondContact O-N 3.43Å
616	F	93.3	Very high	90.4	Very high	137 Å²	137	104.3 Å²	104.3	60%	0.601	52%	0.52	S	S	*	.	H	α-helix	trans	-65.4	-42.3	176.3	-167.2	-103.5	0	0	0	111.6	I612 I613 L614 S619 L620	I612-F616 VanDerWaalsContact O-CB 3.32Å; I612-F616 WeakPolarHBondContact O-CB 3.1Å; I612-F616 PolarHBondContact O-N 3.17Å; I613-F616 PolarHBondContact O-N 2.9Å; L614-F616 VanDerWaalsContact C-N 3.35Å; L614-F616 PolarHBondContact O-N 3.28Å; F616-S619 PolarHBondContact O-N 3.34Å; F616-L620 HydrophobicContact CD1-CD1 3.56Å; F616-L620 HydrophobicContact CD1-CG 4.29Å; F616-L620 HydrophobicContact CE1-CD1 3.37Å; F616-L620 HydrophobicContact CE1-CG 4.09Å; F616-L620 HydrophobicContact CZ-CD1 4.2Å; F616-L620 WeakPolarHBondContact O-CB 3.33Å; F616-L620 WeakPolarHBondContact O-CG 3.24Å; F616-L620 PolarHBondContact O-N 3.32Å
617	S	92.7	Very high	89.4	Confident	54 Å²	54	104.7 Å²	104.7	38%	0.378	52%	0.522	S	S	.	.	H	α-helix	trans	-68	-37.8	175.7	53.3	0	0	0	0	112.9	I613 L614 L620 Y621	I613-S617 WeakPolarHBondContact O-CB 3.43Å; I613-S617 PolarHBondContact O-N 2.74Å; I613-S617 PolarHBondContact O-OG 2.85Å; L614-S617 WeakPolarHBondContact CA-OG 3.48Å; L614-S617 PolarHBondContact O-N 3.38Å; L614-S617 PolarHBondContact O-OG 3.32Å; S617-L620 PolarHBondContact O-N 3.16Å; S617-Y621 VanDerWaalsContact O-CB 3.29Å; S617-Y621 WeakPolarHBondContact O-CB 3.3Å; S617-Y621 PolarHBondContact O-N 3.45Å
618	I	92.4	Very high	88.2	Confident	77 Å²	77	103.2 Å²	103.2	40%	0.395	52%	0.518	S	S	.	.	H	α-helix	trans	-64.1	-43.2	171.7	-68.7	165.6	0	0	0	110.7	L614 L615 Y621 Y622	L614-I618 HydrophobicContact CD2-CD1 4.14Å; L614-I618 HydrophobicContact CG-CD1 4.02Å; L614-I618 WeakPolarHBondContact O-CB 3.46Å; L614-I618 VanDerWaalsContact O-CG1 3.23Å; L614-I618 WeakPolarHBondContact O-CG1 3.38Å; L614-I618 PolarHBondContact O-N 2.78Å; L615-I618 PolarHBondContact O-N 2.8Å; I618-Y621 WeakPolarHBondContact O-CB 3.49Å; I618-Y621 PolarHBondContact O-N 3.27Å; I618-Y622 HydrophobicContact CG2-CD2 3.85Å; I618-Y622 HydrophobicContact CG2-CE2 4.11Å; I618-Y622 WeakPolarHBondContact O-CD2 3.37Å; I618-Y622 PolarHBondContact O-N 3.29Å
619	S	88.7	Confident	87	Confident	69 Å²	69	106.7 Å²	106.7	48%	0.483	53%	0.526	S	S	.	.	H	α-helix	trans	-63.7	-43.6	177.1	-173.3	0	0	0	0	112	L615 F616 Y621 Y622 T623	L615-S619 VanDerWaalsContact O-CB 3.3Å; L615-S619 WeakPolarHBondContact O-CB 3.36Å; L615-S619 PolarHBondContact O-N 3.43Å; F616-S619 PolarHBondContact O-N 3.34Å; S619-Y621 VanDerWaalsContact C-N 3.34Å; S619-Y621 PolarHBondContact O-N 3.13Å; S619-Y622 PolarHBondContact O-N 2.83Å; S619-T623 WeakPolarHBondContact O-CG2 3.49Å; S619-T623 PolarHBondContact O-N 2.77Å; S619-T623 PolarHBondContact O-OG1 2.99Å
620	L	89.6	Confident	85.7	Confident	92 Å²	92	108.9 Å²	108.9	48%	0.482	53%	0.532	S	S	.	.	H	α-helix	trans	-61.3	-41.8	172	-81.2	169	0	0	0	112	F616 S617 T623 H624	F616-L620 HydrophobicContact CD1-CD1 3.56Å; F616-L620 HydrophobicContact CD1-CG 4.29Å; F616-L620 HydrophobicContact CE1-CD1 3.37Å; F616-L620 HydrophobicContact CE1-CG 4.09Å; F616-L620 HydrophobicContact CZ-CD1 4.2Å; F616-L620 WeakPolarHBondContact O-CB 3.33Å; F616-L620 WeakPolarHBondContact O-CG 3.24Å; F616-L620 PolarHBondContact O-N 3.32Å; S617-L620 PolarHBondContact O-N 3.16Å; L620-T623 WeakPolarHBondContact CA-OG1 3.33Å; L620-T623 PolarHBondContact O-N 3.01Å; L620-T623 PolarHBondContact O-OG1 3.48Å; L620-H624 VanDerWaalsContact O-CB 3.25Å; L620-H624 WeakPolarHBondContact O-CB 3.37Å; L620-H624 PolarHBondContact O-N 3.12Å
621	Y	90.1	Very high	84.2	Confident	144 Å²	144	110.1 Å²	110.1	57%	0.565	54%	0.535	S	S	*	.	H	α-helix	trans	-63.7	-42.5	176.5	-178.2	-97.4	0	0	0	111.8	S617 I618 S619 K625	S617-Y621 VanDerWaalsContact O-CB 3.29Å; S617-Y621 WeakPolarHBondContact O-CB 3.3Å; S617-Y621 PolarHBondContact O-N 3.45Å; I618-Y621 WeakPolarHBondContact O-CB 3.49Å; I618-Y621 PolarHBondContact O-N 3.27Å; S619-Y621 VanDerWaalsContact C-N 3.34Å; S619-Y621 PolarHBondContact O-N 3.13Å; Y621-K625 HydrophobicContact CE1-CD 4.37Å; Y621-K625 WeakPolarHBondContact O-CB 3.16Å; Y621-K625 PolarHBondContact O-N 2.91Å
622	Y	86.9	Confident	82.9	Confident	156 Å²	156	113.6 Å²	113.6	61%	0.612	54%	0.541	S	S	*	.	H	α-helix	trans	-66.1	-43.5	176.6	-99.3	-79.9	0	0	0	112.8	I618 S619 K625 Q626	I618-Y622 HydrophobicContact CG2-CD2 3.85Å; I618-Y622 HydrophobicContact CG2-CE2 4.11Å; I618-Y622 WeakPolarHBondContact O-CD2 3.37Å; I618-Y622 PolarHBondContact O-N 3.29Å; S619-Y622 PolarHBondContact O-N 2.83Å; Y622-K625 PolarHBondContact O-N 3.4Å; Y622-Q626 PolarHBondContact O-N 3.47Å
623	T	82.9	Confident	81.6	Confident	69 Å²	69	112.3 Å²	112.3	42%	0.423	54%	0.535	S	S	.	.	H	α-helix	trans	-66.1	-40.7	176.9	50.6	0	0	0	0	111.3	S619 L620 K625 Q626 C627	S619-T623 WeakPolarHBondContact O-CG2 3.49Å; S619-T623 PolarHBondContact O-N 2.77Å; S619-T623 PolarHBondContact O-OG1 2.99Å; L620-T623 WeakPolarHBondContact CA-OG1 3.33Å; L620-T623 PolarHBondContact O-N 3.01Å; L620-T623 PolarHBondContact O-OG1 3.48Å; T623-K625 PolarHBondContact O-N 3.44Å; T623-Q626 PolarHBondContact O-N 3.36Å; T623-C627 WeakPolarHBondContact O-CB 3.47Å; T623-C627 PolarHBondContact O-N 2.85Å; T623-C627 PolarHBondContact O-SG 2.71Å; T623-C627 VanDerWaalsContact O-SG 3.36Å
624	H	80.9	Confident	80	Confident	111 Å²	111	113.8 Å²	113.8	51%	0.514	54%	0.539	S	S	.	.	H	α-helix	trans	-61.5	-43	173.8	-175.3	-92.8	0	0	0	112.2	L620 C627 Q628	L620-H624 VanDerWaalsContact O-CB 3.25Å; L620-H624 WeakPolarHBondContact O-CB 3.37Å; L620-H624 PolarHBondContact O-N 3.12Å; H624-C627 PolarHBondContact O-N 3.29Å; H624-Q628 PolarHBondContact CE1-NE2 2.8Å; H624-Q628 VanDerWaalsContact CE1-NE2 3.27Å; H624-Q628 PolarHBondContact O-N 2.84Å
625	K	78.5	Confident	78.4	Confident	127 Å²	127	115.4 Å²	115.4	55%	0.552	54%	0.544	S	S	*	.	H	α-helix	trans	-68.1	-36.4	178.2	-154	-179.2	-175.9	-179.2	0	112.3	Y621 Y622 T623 Y629	Y621-K625 HydrophobicContact CE1-CD 4.37Å; Y621-K625 WeakPolarHBondContact O-CB 3.16Å; Y621-K625 PolarHBondContact O-N 2.91Å; Y622-K625 PolarHBondContact O-N 3.4Å; T623-K625 PolarHBondContact O-N 3.44Å; K625-Y629 PolarHBondContact O-N 3.49Å
626	Q	76.1	Confident	76.8	Confident	134 Å²	134	116.5 Å²	116.5	63%	0.626	54%	0.542	S	S	*	.	H	α-helix	trans	-67.5	-39	172	-80.8	-162.5	-9.2	0	0	112.5	Y622 T623 Y629 F630	Y622-Q626 PolarHBondContact O-N 3.47Å; T623-Q626 PolarHBondContact O-N 3.36Å; Q626-Y629 WeakPolarHBondContact O-CB 3.47Å; Q626-Y629 PolarHBondContact O-N 2.82Å; Q626-F630 PolarHBondContact O-N 3.25Å
627	C	72.1	Confident	75.2	Confident	80 Å²	80	114.7 Å²	114.7	54%	0.541	54%	0.538	S	S	.	.	H	α-helix	trans	-63	-43.3	174.4	-74.8	0	0	0	0	111.8	T623 H624 Y629 F630 E631	T623-C627 WeakPolarHBondContact O-CB 3.47Å; T623-C627 PolarHBondContact O-N 2.85Å; T623-C627 PolarHBondContact O-SG 2.71Å; T623-C627 VanDerWaalsContact O-SG 3.36Å; H624-C627 PolarHBondContact O-N 3.29Å; C627-Y629 VanDerWaalsContact C-N 3.28Å; C627-Y629 PolarHBondContact O-N 2.8Å; C627-F630 PolarHBondContact O-N 3.44Å; C627-F630 VanDerWaalsContact O-N 3.17Å; C627-E631 PolarHBondContact O-N 3.1Å
628	Q	70.4	Confident	73.5	Confident	109 Å²	109	116.4 Å²	116.4	51%	0.509	55%	0.549	S	S	.	.	H	α-helix	trans	-62.1	-36.2	173.6	-76.7	-170.7	-21	0	0	112.4	H624 W632	H624-Q628 PolarHBondContact CE1-NE2 2.8Å; H624-Q628 VanDerWaalsContact CE1-NE2 3.27Å; H624-Q628 PolarHBondContact O-N 2.84Å; Q628-W632 WeakPolarHBondContact O-CB 3.38Å; Q628-W632 PolarHBondContact O-N 2.85Å
629	Y	69.3	Low	71.9	Confident	165 Å²	165	118.5 Å²	118.5	65%	0.647	56%	0.56	S	S	*	*	H	α-helix	trans	-67.7	-36.9	175.4	-152.3	-91.6	0	0	0	111.9	K625 Q626 C627 W632 L633	K625-Y629 PolarHBondContact O-N 3.49Å; Q626-Y629 WeakPolarHBondContact O-CB 3.47Å; Q626-Y629 PolarHBondContact O-N 2.82Å; C627-Y629 VanDerWaalsContact C-N 3.28Å; C627-Y629 PolarHBondContact O-N 2.8Å; Y629-W632 PolarHBondContact O-N 3.03Å; Y629-L633 WeakPolarHBondContact O-CB 3.46Å; Y629-L633 PolarHBondContact O-N 2.76Å
630	F	67.3	Low	70.3	Confident	137 Å²	137	122.9 Å²	122.9	60%	0.601	57%	0.57	S	S	*	*	H	α-helix	trans	-69.2	-40.4	175.7	-106.8	-82.9	0	0	0	112.8	Q626 C627 W632 L633 H634	Q626-F630 PolarHBondContact O-N 3.25Å; C627-F630 PolarHBondContact O-N 3.44Å; C627-F630 VanDerWaalsContact O-N 3.17Å; F630-W632 VanDerWaalsContact C-N 3.33Å; F630-L633 PolarHBondContact O-N 2.76Å; F630-H634 WeakPolarHBondContact O-CB 3.03Å; F630-H634 PolarHBondContact O-N 3.44Å
631	E	65.2	Low	68.6	Low	146 Å²	146	123.2 Å²	123.2	68%	0.682	58%	0.579	S	S	*	*	H	α-helix	trans	-63.3	-40.8	173	-77.7	-169	156	0	0	111.5	C627 L633 H634 H635	C627-E631 PolarHBondContact O-N 3.1Å; E631-L633 PolarHBondContact O-N 3.26Å; E631-H634 PolarHBondContact O-N 3.34Å; E631-H635 WeakPolarHBondContact O-CB 3.44Å; E631-H635 PolarHBondContact O-N 3.06Å
632	W	67	Low	66.4	Low	171 Å²	171	125.4 Å²	125.4	65%	0.648	59%	0.592	S	S	*	*	H	α-helix	trans	-64.7	-40.3	176.1	-154.7	84.8	0	0	0	111.8	Q628 Y629 F630 H635 Y636	Q628-W632 WeakPolarHBondContact O-CB 3.38Å; Q628-W632 PolarHBondContact O-N 2.85Å; Y629-W632 PolarHBondContact O-N 3.03Å; F630-W632 VanDerWaalsContact C-N 3.33Å; W632-H635 PolarHBondContact O-N 3.12Å; W632-Y636 HydrophobicContact CH2-CD2 4.35Å; W632-Y636 HydrophobicContact CZ3-CD2 4.37Å; W632-Y636 VanDerWaalsContact O-CB 3.23Å; W632-Y636 WeakPolarHBondContact O-CB 3.42Å; W632-Y636 PolarHBondContact O-N 3.07Å
633	L	68.1	Low	64.3	Low	76 Å²	76	127 Å²	127	40%	0.398	60%	0.602	S	S	.	*	H	α-helix	trans	-66.7	-41.7	175.9	-158.2	83.5	0	0	0	111.9	Y629 F630 E631 Y636 L637	Y629-L633 WeakPolarHBondContact O-CB 3.46Å; Y629-L633 PolarHBondContact O-N 2.76Å; F630-L633 PolarHBondContact O-N 2.76Å; E631-L633 PolarHBondContact O-N 3.26Å; L633-Y636 PolarHBondContact O-N 2.99Å; L633-L637 HydrophobicContact CD2-CD1 4.32Å; L633-L637 HydrophobicContact CG-CD1 4.11Å; L633-L637 WeakPolarHBondContact O-CB 3.05Å; L633-L637 PolarHBondContact O-N 2.77Å
634	H	60.3	Low	62.4	Low	137 Å²	137	129.8 Å²	129.8	63%	0.634	62%	0.619	S	S	*	*	H	α-helix	trans	-66	-39.9	176.5	-115.4	-81.5	0	0	0	111.7	F630 E631 C638	F630-H634 WeakPolarHBondContact O-CB 3.03Å; F630-H634 PolarHBondContact O-N 3.44Å; E631-H634 PolarHBondContact O-N 3.34Å; H634-C638 WeakPolarHBondContact O-CB 3.45Å; H634-C638 PolarHBondContact O-N 3.02Å
635	H	60	Low	60.7	Low	128 Å²	128	133.1 Å²	133.1	59%	0.593	64%	0.64	S	S	*	*	H	α-helix	trans	-69.6	-37.2	176.7	-151.7	-80	0	0	0	111.6	E631 W632 C638 I639	E631-H635 WeakPolarHBondContact O-CB 3.44Å; E631-H635 PolarHBondContact O-N 3.06Å; W632-H635 PolarHBondContact O-N 3.12Å; H635-C638 PolarHBondContact O-N 3.32Å; H635-I639 WeakPolarHBondContact ND1-CD1 3.14Å; H635-I639 VanDerWaalsContact O-CG1 3.31Å; H635-I639 WeakPolarHBondContact O-CG1 3.38Å; H635-I639 PolarHBondContact O-N 3.3Å; H635-I639 VanDerWaalsContact O-N 3.09Å
636	Y	61.4	Low	58.9	Low	128 Å²	128	134.8 Å²	134.8	50%	0.502	66%	0.655	S	S	.	*	H	α-helix	trans	-68.2	-40.2	175.6	-169.3	-100.4	0	0	0	112.6	W632 L633 K640	W632-Y636 HydrophobicContact CH2-CD2 4.35Å; W632-Y636 HydrophobicContact CZ3-CD2 4.37Å; W632-Y636 VanDerWaalsContact O-CB 3.23Å; W632-Y636 WeakPolarHBondContact O-CB 3.42Å; W632-Y636 PolarHBondContact O-N 3.07Å; L633-Y636 PolarHBondContact O-N 2.99Å; Y636-K640 PolarHBondContact O-N 2.91Å
637	L	59.7	Low	57	Low	98 Å²	98	139.3 Å²	139.3	51%	0.513	67%	0.666	S	S	.	*	H	α-helix	trans	-70.1	-37	173.9	-88.8	150.9	0	0	0	112.5	L633 K640 C641	L633-L637 HydrophobicContact CD2-CD1 4.32Å; L633-L637 HydrophobicContact CG-CD1 4.11Å; L633-L637 WeakPolarHBondContact O-CB 3.05Å; L633-L637 PolarHBondContact O-N 2.77Å; L637-K640 PolarHBondContact O-N 3.37Å; L637-C641 PolarHBondContact O-N 3.12Å
638	C	57	Low	55.6	Low	91 Å²	91	145.6 Å²	145.6	62%	0.615	68%	0.684	S	S	*	*	H	α-helix	trans	-71.2	-32.4	-180	-158.1	0	0	0	0	112.6	H634 H635 K640	H634-C638 WeakPolarHBondContact O-CB 3.45Å; H634-C638 PolarHBondContact O-N 3.02Å; H635-C638 PolarHBondContact O-N 3.32Å; C638-K640 VanDerWaalsContact C-N 3.35Å
639	I	58.9	Low	54	Low	120 Å²	120	145.5 Å²	145.5	62%	0.615	69%	0.693	S	S	*	*	H	α-helix	trans	-69.6	-32.3	173.5	-70.9	170.5	0	0	0	111.6	H635	H635-I639 WeakPolarHBondContact ND1-CD1 3.14Å; H635-I639 VanDerWaalsContact O-CG1 3.31Å; H635-I639 WeakPolarHBondContact O-CG1 3.38Å; H635-I639 PolarHBondContact O-N 3.3Å; H635-I639 VanDerWaalsContact O-N 3.09Å
640	K	54.3	Low	52.6	Low	161 Å²	161	148 Å²	148	70%	0.7	70%	0.703	S	S	*	*	H	α-helix	trans	-84.4	-19.9	-177.7	-126.1	176.6	-178.9	178.5	0	114.6	Y636 L637 C638	Y636-K640 PolarHBondContact O-N 2.91Å; L637-K640 PolarHBondContact O-N 3.37Å; C638-K640 VanDerWaalsContact C-N 3.35Å
641	C	54.5	Low	51.5	Low	100 Å²	100	148.9 Å²	148.9	68%	0.676	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	9.6	-178.7	-71.5	0	0	0	0	115.3	L637 F643	L637-C641 PolarHBondContact O-N 3.12Å; C641-F643 PolarHBondContact O-N 2.86Å
642	K	43.9	Very low	50.3	Low	189 Å²	189	149.3 Å²	149.3	82%	0.822	71%	0.708	S	S	*	*			trans	-91.4	20.7	-175.1	-145.4	176.8	-176.4	176.4	0	115.6
643	F	42.5	Very low	49.1	Very low	190 Å²	190	147 Å²	147	83%	0.833	71%	0.709	S	S	*	*	S	Bend	trans	-115.8	133.5	170.5	-101.3	-94.4	0	0	0	109.8	C641	C641-F643 PolarHBondContact O-N 2.86Å
644	T	43.3	Very low	47.9	Very low	128 Å²	128	148.7 Å²	148.7	79%	0.785	72%	0.718	S	S	*	*			trans	76.3	92.5	175.9	61.3	0	0	0	0	117.2
645	L	44	Very low	46.9	Very low	181 Å²	181	151.5 Å²	151.5	95%	0.948	72%	0.723	S	S	*	*				-179	144	114.1	-100	139.2	0	0	0	112.8
646	N	41	Very low	46	Very low	161 Å²	161	154.7 Å²	154.7	86%	0.861	73%	0.73	S	S	*	*			trans	-80.9	148.5	-153.7	-121.6	-28.5	0	0	0	115.1
647	R	37.1	Very low	45	Very low	229 Å²	229	157.3 Å²	157.3	86%	0.864	74%	0.74	S	S	*	*			trans	-47.1	140.1	166.5	-85.1	172.5	160.3	169	-5.4	114.3
648	K	41.5	Very low	44.2	Very low	212 Å²	212	159 Å²	159	92%	0.922	75%	0.749	S	S	*	*				-153.7	128	127.1	-80.4	-165.8	-179.4	173.8	0	110.2
649	P	38.5	Very low	43.4	Very low	107 Å²	107	164 Å²	164	70%	0.695	76%	0.764	S	S	*	*			trans	-104.4	150.5	174.3	36.8	-27.8	0	0	0	111.4
650	Y	39.7	Very low	42.5	Very low	218 Å²	218	167.2 Å²	167.2	86%	0.855	77%	0.774	S	S	*	*			trans	-175.6	128.2	149.2	-107.4	-78.8	0	0	0	111.6
651	H	42.8	Very low	42	Very low	155 Å²	155	165.2 Å²	165.2	72%	0.718	78%	0.777	S	S	*	*			trans	15	161.5	142.1	-79.8	-92.9	0	0	0	121.6
652	K	41.9	Very low	41.2	Very low	155 Å²	155	166.1 Å²	166.1	67%	0.674	78%	0.779	S	S	*	*			cis	168	143.7	-12.4	168.8	174.1	179.1	-178	0	104.7
653	N	41.7	Very low	41	Very low	124 Å²	124	160.7 Å²	160.7	66%	0.663	78%	0.777	S	S	*	*			trans	86.3	127	155.6	-79.7	9.6	0	0	0	123.7
654	D	41.5	Very low	40.6	Very low	111 Å²	111	161.1 Å²	161.1	59%	0.594	77%	0.774	S	S	*	*				88.2	115	127.6	-86	13	0	0	0	124.4
655	R	40.1	Very low	40.4	Very low	196 Å²	196	166.6 Å²	166.6	74%	0.74	78%	0.782	S	S	*	*				93.6	114.9	129.6	-69.5	174.3	-159.5	-165.9	4.1	122.4
656	R	40.3	Very low	40.2	Very low	195 Å²	195	163.5 Å²	163.5	74%	0.736	77%	0.771	S	S	*	*			trans	53.8	121.2	130.5	-55.9	-175.7	-171.8	179.3	2.4	120.5
657	Y	41.5	Very low	40	Very low	183 Å²	183	161.2 Å²	161.2	72%	0.718	78%	0.775	S	S	*	*				170.6	129.7	96.2	-106.2	-84.9	0	0	0	112.2
658	N	41.4	Very low	40.1	Very low	132 Å²	132	156 Å²	156	71%	0.706	77%	0.768	S	S	*	*			trans	25.8	125.8	149.7	-59	-11.4	0	0	0	122.4
659	Q	41.5	Very low	39.9	Very low	196 Å²	196	153 Å²	153	92%	0.916	76%	0.762	S	S	*	*				177.8	148.1	96.1	-90.5	-178.8	-10.2	0	0	112.2
660	K	39.4	Very low	40	Very low	189 Å²	189	156 Å²	156	82%	0.822	77%	0.771	S	S	*	*			trans	-62.3	173.7	-176.2	-89.9	178.5	178.5	-179.9	0	115
661	P	43.3	Very low	39.7	Very low	119 Å²	119	150 Å²	150	77%	0.773	76%	0.761	S	S	*	*			cis	-141.1	150.5	26.4	36.4	-14.4	0	0	0	120
662	V	38	Very low	39.4	Very low	118 Å²	118	151.6 Å²	151.6	72%	0.715	77%	0.769	S	S	*	*			trans	21.7	118.8	138.9	-165.4	0	0	0	0	120.5	Y664	V662-Y664 HydrophobicContact CG1-CD2 4.33Å
663	G	39.3	Very low	39.2	Very low	76 Å²	76	150.4 Å²	150.4	78%	0.784	78%	0.775	S	S	*	*			trans	-165.1	105.3	154.6	0	0	0	0	0	109.7
664	Y	34.9	Very low	39.1	Very low	198 Å²	198	152.6 Å²	152.6	78%	0.776	78%	0.784	S	S	*	*			trans	-95.3	134.3	179.4	-80.4	-91.8	0	0	0	110.6	V662	V662-Y664 HydrophobicContact CG1-CD2 4.33Å
665	Y	38.1	Very low	38.9	Very low	243 Å²	243	155.7 Å²	155.7	95%	0.953	80%	0.796	S	S	*	*			trans	-137.8	111	153.9	-83.4	-81.7	0	0	0	108.3
666	T	40	Very low	38.8	Very low	116 Å²	116	153.6 Å²	153.6	71%	0.712	80%	0.799	S	S	*	*			trans	-118	120.4	164.3	47.4	0	0	0	0	106.5
667	A	38.1	Very low	38.7	Very low	114 Å²	114	149.6 Å²	149.6	94%	0.942	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-95.4	125.5	168.9	0	0	0	0	0	108.5
668	V	39.4	Very low	38.5	Very low	119 Å²	119	147.8 Å²	147.8	72%	0.721	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-97.7	148.6	-167	170.3	0	0	0	0	109.8
669	D	37.6	Very low	38.4	Very low	148 Å²	148	147.8 Å²	147.8	79%	0.791	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-58.9	133.7	173.6	-152.3	-10.4	0	0	0	111.7
670	L	39.2	Very low	38.3	Very low	170 Å²	170	145.1 Å²	145.1	89%	0.89	79%	0.794	S	S	*	*			trans	-104.5	76.5	-170.6	-127.9	113.6	0	0	0	111.1
671	S	33.8	Very low	38.3	Very low	92 Å²	92	143.7 Å²	143.7	64%	0.643	80%	0.795	S	S	*	*			trans	-118.3	139.3	155.9	52.2	0	0	0	0	107.5
672	E	36.4	Very low	38.1	Very low	190 Å²	190	145.1 Å²	145.1	89%	0.888	80%	0.796	S	S	*	*			trans	80	68.3	177.9	-59.6	-176.2	134	0	0	118.3
673	V	38.7	Very low	38.2	Very low	130 Å²	130	149.4 Å²	149.4	79%	0.788	80%	0.801	S	S	*	*			trans	-146.4	95.1	148.7	-177.4	0	0	0	0	108
674	I	39.5	Very low	38.1	Very low	169 Å²	169	153.1 Å²	153.1	87%	0.867	80%	0.796	S	S	*	*			trans	178.3	73.4	145.3	-80.4	147.1	0	0	0	105.3
675	Q	37.2	Very low	38.3	Very low	177 Å²	177	150.1 Å²	150.1	83%	0.827	79%	0.793	S	S	*	*			trans	-144.5	133	157.1	-95.1	-169.2	-15.3	0	0	107.1
676	N	36.4	Very low	38.2	Very low	152 Å²	152	144 Å²	144	81%	0.813	78%	0.781	S	S	*	*			trans	93.4	99.1	160.4	-55	-18.2	0	0	0	120.2
677	S	38.9	Very low	38.2	Very low	110 Å²	110	145.9 Å²	145.9	77%	0.769	79%	0.785	S	S	*	*			trans	-167.1	126.5	142.8	50.9	0	0	0	0	105.8
678	L	38	Very low	38.1	Very low	146 Å²	146	147.4 Å²	147.4	76%	0.764	78%	0.777	S	S	*	*			cis	-159.2	135.9	17.3	-77.9	129.4	0	0	0	108
679	I	39.8	Very low	38.1	Very low	131 Å²	131	149.6 Å²	149.6	67%	0.672	79%	0.785	S	S	*	*				74.1	101.5	108.2	-60	-176	0	0	0	115
680	D	37.9	Very low	38.1	Very low	141 Å²	141	151.1 Å²	151.1	75%	0.754	78%	0.784	S	S	*	*				81.2	115.2	109.1	-73.8	-25.8	0	0	0	115.8
681	D	40.1	Very low	37.9	Very low	158 Å²	158	150.8 Å²	150.8	85%	0.845	78%	0.776	S	S	*	*				-178.5	139.3	104.2	-97.4	-24.5	0	0	0	111.6
682	D	39.2	Very low	37.9	Very low	150 Å²	150	152.3 Å²	152.3	80%	0.802	78%	0.775	S	S	*	*			trans	-62.7	145.8	-174.2	-68.6	-49.7	0	0	0	115.8
683	Y	39.5	Very low	37.7	Very low	207 Å²	207	150.2 Å²	150.2	81%	0.812	77%	0.77	S	S	*	*				-174.5	113.5	115.9	-130.9	-105.6	0	0	0	114.4
684	F	38.4	Very low	37.3	Very low	155 Å²	155	152.4 Å²	152.4	68%	0.68	77%	0.772	S	S	*	*			trans	42.1	104.6	143	-77.4	-92.4	0	0	0	123.1
685	D	38.1	Very low	37	Very low	134 Å²	134	150 Å²	150	72%	0.717	77%	0.77	S	S	*	*				56.6	121	106.1	-87.4	-7.2	0	0	0	123.6
686	V	35.9	Very low	36.6	Very low	115 Å²	115	150.4 Å²	150.4	70%	0.697	77%	0.77	S	S	*	*				81.6	113.7	123.9	-176.8	0	0	0	0	117.3
687	I	39.5	Very low	36.4	Very low	155 Å²	155	152.6 Å²	152.6	80%	0.795	77%	0.774	S	S	*	*				-169	121.9	105.3	-84.6	164.8	0	0	0	109.3
688	N	36.7	Very low	36	Very low	146 Å²	146	154.5 Å²	154.5	78%	0.781	77%	0.771	S	S	*	*			trans	-52.7	145.9	165.6	-83.9	-51.5	0	0	0	113
689	N	38.7	Very low	35.7	Very low	166 Å²	166	153.1 Å²	153.1	89%	0.888	77%	0.771	S	S	*	*				-162.3	147.6	116.9	-100	-30.5	0	0	0	114.9
690	K	38.2	Very low	35.2	Very low	179 Å²	179	155.9 Å²	155.9	78%	0.778	78%	0.775	S	S	*	*			trans	-103.3	155.8	-161.7	-147.4	-179.1	-174.2	166.8	0	109.4
691	K	35.3	Very low	34.9	Very low	164 Å²	164	157.5 Å²	157.5	71%	0.713	78%	0.782	S	S	*	*			trans	98.8	113	145.1	-72.2	-171.9	165.4	-179.2	0	121.2
692	I	33.6	Very low	34.4	Very low	124 Å²	124	156.5 Å²	156.5	64%	0.636	78%	0.775	S	S	*	*				66.4	110.2	114.3	-59.8	167.9	0	0	0	117.4
693	N	33.2	Very low	33.9	Very low	145 Å²	145	156.6 Å²	156.6	78%	0.775	78%	0.776	S	S	*	*				-178.5	145.5	106	-103.7	-29.1	0	0	0	114.2
694	Q	30.3	Very low	33.5	Very low	176 Å²	176	151.5 Å²	151.5	82%	0.822	77%	0.768	S	S	*	*			trans	-64.9	152.4	-175.5	-62.3	153.6	-38.2	0	0	115.1
695	S	31.5	Very low	33.1	Very low	120 Å²	120	150.8 Å²	150.8	84%	0.839	78%	0.776	S	S	*	*				-160.2	116	118.3	58.5	0	0	0	0	110.8
696	F	28.6	Very low	32.6	Very low	185 Å²	185	151.3 Å²	151.3	81%	0.811	78%	0.778	S	S	*	*			trans	-88.5	132.4	167.9	-107.2	-96.4	0	0	0	107.8
697	H	33.4	Very low	32.1	Very low	197 Å²	197	150.6 Å²	150.6	91%	0.912	78%	0.778	S	S	*	*			trans	-156.7	98.8	147.7	-91.5	-58.8	0	0	0	109.4
698	Q	30.3	Very low	31.5	Very low	150 Å²	150	150.9 Å²	150.9	70%	0.701	78%	0.78	S	S	*	*			trans	-87.5	163.2	149.9	-87.4	-178.5	-24	0	0	108.5
699	P	32.4	Very low	31.1	Very low	118 Å²	118	151.1 Å²	151.1	77%	0.766	78%	0.781	S	S	*	*				-138.1	132.4	110.6	33.7	-19.8	0	0	0	114.2
700	Y	29.2	Very low	30.4	Very low	189 Å²	189	152.5 Å²	152.5	74%	0.741	78%	0.782	S	S	*	*			trans	21.2	121.9	136.7	-66.4	-89.7	0	0	0	119.6
701	L	31.1	Very low	29.9	Very low	175 Å²	175	148.5 Å²	148.5	92%	0.916	78%	0.777	S	S	*	*			trans	-139.8	115.6	136.2	-107.1	148.3	0	0	0	108.2
702	I	29.5	Very low	29.5	Very low	137 Å²	137	147.6 Å²	147.6	70%	0.703	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-79.5	117.5	175.4	-65.7	161.9	0	0	0	106.1
703	D	29.5	Very low	29.1	Very low	151 Å²	151	148.7 Å²	148.7	81%	0.807	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-94.4	135.2	161.3	-95.1	-30.1	0	0	0	109.9
704	P	30.9	Very low	28.7	Very low	100 Å²	100	152.5 Å²	152.5	65%	0.649	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-75.4	130.4	-176	30.1	-32	0	0	0	111	I706	P704-I706 PolarHBondContact O-N 3.25Å
705	V	29.3	Very low	28.3	Very low	141 Å²	141	149.6 Å²	149.6	86%	0.855	79%	0.786	S	S	*	*			trans	-56.6	104.3	164.4	176.3	0	0	0	0	108.7	S707	V705-S707 PolarHBondContact O-N 2.98Å
706	I	28.2	Very low	28	Very low	145 Å²	145	150.4 Å²	150.4	74%	0.744	79%	0.786	S	S	*	*			trans	-73.3	111.9	169.1	-65	173.5	0	0	0	107.5	P704 L708	P704-I706 PolarHBondContact O-N 3.25Å; I706-L708 PolarHBondContact O-N 3.24Å
707	S	24.7	Very low	27.7	Very low	100 Å²	100	146.3 Å²	146.3	70%	0.699	78%	0.779	S	S	*	*			trans	-74.3	106.1	168.5	28.8	0	0	0	0	109	V705 N709	V705-S707 PolarHBondContact O-N 2.98Å; S707-N709 PolarHBondContact O-N 3.34Å
708	L	27.7	Very low	27.3	Very low	160 Å²	160	144.1 Å²	144.1	84%	0.838	77%	0.774	S	S	*	*			trans	-78.1	103.3	162.9	-104	146.8	0	0	0	107.9	I706 Q710	I706-L708 PolarHBondContact O-N 3.24Å; L708-Q710 PolarHBondContact O-N 3.43Å
709	N	27	Very low	27.1	Very low	151 Å²	151	142.4 Å²	142.4	81%	0.807	78%	0.776	S	S	*	*			trans	-48.3	109.6	169.4	-89.9	-24.3	0	0	0	110.2	S707 S711	S707-N709 PolarHBondContact O-N 3.34Å; N709-S711 PolarHBondContact O-N 2.94Å
710	Q	25.4	Very low	26.7	Very low	196 Å²	196	144.2 Å²	144.2	92%	0.916	78%	0.778	S	S	*	*			trans	-73.5	113	156.1	-73	177.4	-17.4	0	0	107.6	L708	L708-Q710 PolarHBondContact O-N 3.43Å
711	S	27.1	Very low	26.6	Very low	94 Å²	94	143.4 Å²	143.4	66%	0.657	79%	0.786	S	S	*	*			trans	-147	128.4	159.3	69.7	0	0	0	0	110.8	N709	N709-S711 PolarHBondContact O-N 2.94Å
712	N	26.3	Very low	26.3	Very low	145 Å²	145	141.2 Å²	141.2	78%	0.775	78%	0.775	S	S	*	*			trans	94.5	78.8	162.2	-57	-9.8	0	0	0	116.6
713	D	24.8	Very low	26	Very low	148 Å²	148	141 Å²	141	79%	0.791	78%	0.775	S	S	*	*			trans	-20.5	124.8	133.7	-64.4	-45.8	0	0	0	114.3
714	Y	24.6	Very low	25.9	Very low	224 Å²	224	143 Å²	143	88%	0.878	78%	0.78	S	S	*	*			trans	-140.3	107	138	-93.9	-78.8	0	0	0	109.2
715	V	23.2	Very low	25.6	Very low	115 Å²	115	147.3 Å²	147.3	70%	0.697	79%	0.791	S	S	*	*			trans	-69.1	127	162.8	172.7	0	0	0	0	108.5
716	T	24.9	Very low	25.5	Very low	138 Å²	138	146.1 Å²	146.1	85%	0.847	79%	0.789	S	S	*	*			trans	-133	110.2	150.3	45.2	0	0	0	0	109
717	C	22.5	Very low	25.3	Very low	98 Å²	98	145.5 Å²	145.5	66%	0.662	79%	0.792	S	S	*	*			trans	-91	157	169.4	-70.8	0	0	0	0	111.4
718	N	24.7	Very low	25.4	Very low	151 Å²	151	149.1 Å²	149.1	81%	0.807	80%	0.802	S	S	*	*			trans	90.1	154.7	148.5	-69.7	-10.2	0	0	0	119.7
719	P	26.3	Very low	25.2	Very low	115 Å²	115	150.3 Å²	150.3	75%	0.747	80%	0.804	S	S	*	*			cis	-137.6	167.8	-16	26.8	-3.8	0	0	0	115.8
720	I	23.4	Very low	25	Very low	155 Å²	155	151.2 Å²	151.2	80%	0.795	80%	0.803	S	S	*	*			trans	-59.1	136.9	160.9	-64.5	157.8	0	0	0	111.3
721	L	27.2	Very low	24.9	Very low	173 Å²	173	152.3 Å²	152.3	91%	0.906	81%	0.805	S	S	*	*			trans	-167.4	142.3	142.7	-111.1	138.4	0	0	0	113.9
722	N	24.6	Very low	24.7	Very low	129 Å²	129	152.3 Å²	152.3	69%	0.69	80%	0.804	S	S	*	*			trans	-76.8	166.1	-168.6	-106.2	8.9	0	0	0	116.3
723	D	24.7	Very low	24.5	Very low	133 Å²	133	154.2 Å²	154.2	71%	0.711	81%	0.813	S	S	*	*			trans	69	112	148.8	-59.4	-27.9	0	0	0	120
724	Q	26.8	Very low	24.4	Very low	193 Å²	193	151.5 Å²	151.5	90%	0.902	81%	0.805	S	S	*	*				176.5	147.6	94.5	-87	-163.7	-15	0	0	112.7
725	Q	24.2	Very low	24.3	Very low	190 Å²	190	150 Å²	150	89%	0.888	81%	0.806	S	S	*	*			trans	-59	140.8	-172.3	-65.2	156.8	-39.1	0	0	115.4
726	S	27.5	Very low	24.3	Very low	115 Å²	115	152.5 Å²	152.5	80%	0.804	81%	0.807	S	S	*	*				-163.3	114.8	125	49.1	0	0	0	0	111.7
727	T	24.4	Very low	24.2	Very low	133 Å²	133	155.4 Å²	155.4	82%	0.816	81%	0.809	S	S	*	*			trans	-17.4	119.1	158.7	50.5	0	0	0	0	118.3
728	L	25.5	Very low	24.4	Very low	175 Å²	175	156.3 Å²	156.3	92%	0.916	81%	0.807	S	S	*	*			trans	-158.7	137.8	131.6	-132.9	91.5	0	0	0	110.1
729	Q	24.3	Very low	24.3	Very low	186 Å²	186	156.4 Å²	156.4	87%	0.869	81%	0.807	S	S	*	*			trans	-61.8	135	-155.4	-70.7	163	-50.6	0	0	119
730	E	23.1	Very low	24.3	Very low	170 Å²	170	156.6 Å²	156.6	79%	0.794	81%	0.81	S	S	*	*			trans	11.6	124.8	142.1	-64.2	176.2	161.5	0	0	121.3
731	K	23.9	Very low	24.2	Very low	218 Å²	218	157.4 Å²	157.4	95%	0.948	81%	0.81	S	S	*	*				-134.2	84.1	129.2	-100.4	-174.3	179.7	179.4	0	109.2
732	C	21.9	Very low	24.3	Very low	95 Å²	95	157.2 Å²	157.2	64%	0.642	80%	0.804	S	S	*	*			trans	-70.2	129.5	156.2	-71.3	0	0	0	0	108.2	C734	C732-C734 VanDerWaalsContact C-N 3.3Å; C732-C734 PolarHBondContact O-N 3.04Å
733	L	23	Very low	24.3	Very low	184 Å²	184	159.1 Å²	159.1	96%	0.963	81%	0.809	S	S	*	*			trans	-82.2	89.5	156.3	-126.5	98.5	0	0	0	106.6
734	C	22.4	Very low	24.4	Very low	91 Å²	91	161.3 Å²	161.3	62%	0.615	82%	0.82	S	S	*	*			trans	-76.7	126	160	-66.1	0	0	0	0	107.6	C732 F736	C732-C734 VanDerWaalsContact C-N 3.3Å; C732-C734 PolarHBondContact O-N 3.04Å; C734-F736 PolarHBondContact O-N 2.98Å
735	E	22	Very low	24.3	Very low	194 Å²	194	159.2 Å²	159.2	91%	0.907	82%	0.815	S	S	*	*			trans	-66.1	116.3	160.3	-158.2	171.9	-156.2	0	0	107.2	K737	E735-K737 PolarHBondContact O-N 3.2Å
736	F	22.5	Very low	24.4	Very low	166 Å²	166	155 Å²	155	73%	0.728	81%	0.807	S	S	*	*			trans	-70.5	94.5	-172.2	-108.1	-85.3	0	0	0	110.9	C734 N738	C734-F736 PolarHBondContact O-N 2.98Å; F736-N738 HydrophobicContact CD1-CB 3.99Å; F736-N738 WeakPolarHBondContact CD1-ND2 3.49Å; F736-N738 WeakPolarHBondContact CD1-OD1 3.41Å; F736-N738 VanDerWaalsContact CE1-CG 3.47Å; F736-N738 VanDerWaalsContact CE1-ND2 3.28Å; F736-N738 WeakPolarHBondContact CE1-ND2 3.33Å; F736-N738 VanDerWaalsContact CE1-OD1 3.29Å; F736-N738 WeakPolarHBondContact CE1-OD1 3.47Å; F736-N738 PolarHBondContact O-N 3.24Å
737	K	23.5	Very low	24.4	Very low	200 Å²	200	158.6 Å²	158.6	87%	0.87	81%	0.808	S	S	*	*			trans	-84.3	82.6	152.7	-125.9	-179	-175.5	177.6	0	107.5	E735 N739	E735-K737 PolarHBondContact O-N 3.2Å; K737-N739 PolarHBondContact O-N 3.32Å
738	N	25.7	Very low	24.4	Very low	116 Å²	116	158.7 Å²	158.7	62%	0.62	80%	0.804	S	S	*	*			trans	-87.5	95.8	173.1	-107.7	5.3	0	0	0	110.3	F736	F736-N738 HydrophobicContact CD1-CB 3.99Å; F736-N738 WeakPolarHBondContact CD1-ND2 3.49Å; F736-N738 WeakPolarHBondContact CD1-OD1 3.41Å; F736-N738 VanDerWaalsContact CE1-CG 3.47Å; F736-N738 VanDerWaalsContact CE1-ND2 3.28Å; F736-N738 WeakPolarHBondContact CE1-ND2 3.33Å; F736-N738 VanDerWaalsContact CE1-OD1 3.29Å; F736-N738 WeakPolarHBondContact CE1-OD1 3.47Å; F736-N738 PolarHBondContact O-N 3.24Å
739	N	24	Very low	24.5	Very low	153 Å²	153	158.3 Å²	158.3	82%	0.818	80%	0.801	S	S	*	*			trans	-69	118	150.6	-77.6	-11.7	0	0	0	108.2	K737	K737-N739 PolarHBondContact O-N 3.32Å
740	C	24.9	Very low	24.5	Very low	119 Å²	119	155 Å²	155	80%	0.804	80%	0.796	S	S	*	*			trans	-117.2	71	160.5	-77.3	0	0	0	0	108.6
741	E	23	Very low	24.5	Very low	172 Å²	172	152.1 Å²	152.1	80%	0.804	79%	0.794	S	S	*	*			trans	-85.3	113.7	147.8	-81.8	-174.3	149.6	0	0	106.8
742	H	28.1	Very low	24.8	Very low	169 Å²	169	151 Å²	151	78%	0.782	79%	0.789	S	S	*	*			trans	174.7	126	131.5	-92.4	-54.9	0	0	0	110.8
743	Q	25	Very low	24.9	Very low	170 Å²	170	150.7 Å²	150.7	79%	0.794	79%	0.788	S	S	*	*			trans	70.1	94.7	147.8	-59.7	-179.6	2.2	0	0	117.5
744	L	27	Very low	25.1	Very low	178 Å²	178	149.6 Å²	149.6	93%	0.932	78%	0.783	S	S	*	*				-160.2	126.7	112	-100.5	153.9	0	0	0	110.5
745	N	24.8	Very low	25.1	Very low	149 Å²	149	151.1 Å²	151.1	80%	0.797	79%	0.794	S	S	*	*			trans	-61.6	160.8	-174.3	-75.7	-41.4	0	0	0	114.3
746	S	25	Very low	25.3	Very low	102 Å²	102	146.9 Å²	146.9	71%	0.713	79%	0.785	S	S	*	*			trans	81.3	125.5	150.3	80.7	0	0	0	0	115.8
747	F	27.6	Very low	25.3	Very low	190 Å²	190	145 Å²	145	83%	0.833	79%	0.788	S	S	*	*			cis	-147.6	142.6	27.5	-105.3	-95.5	0	0	0	112.3
748	N	25.3	Very low	25.3	Very low	136 Å²	136	140.8 Å²	140.8	73%	0.727	78%	0.782	S	S	*	*			trans	-21.4	145.2	163.3	-62.5	-31.1	0	0	0	119.2
749	I	26.9	Very low	25.1	Very low	167 Å²	167	139.3 Å²	139.3	86%	0.856	78%	0.781	S	S	*	*				-179.3	144.6	104.6	-84.8	155.1	0	0	0	109.9
750	P	25.7	Very low	25.2	Very low	117 Å²	117	140 Å²	140	76%	0.76	78%	0.779	S	S	*	*			trans	-106.4	161.8	-144.3	37.4	-28.1	0	0	0	117.2
751	S	23.3	Very low	25.2	Very low	108 Å²	108	141.3 Å²	141.3	76%	0.755	78%	0.776	S	S	*	*			trans	-34.7	150.8	162.5	56.7	0	0	0	0	118.7
752	K	28.3	Very low	25.3	Very low	194 Å²	194	142.4 Å²	142.4	84%	0.843	78%	0.778	S	S	*	*			trans	-170.7	104.8	135.8	-100.9	175.4	-178.7	-178.6	0	108.4
753	S	24.7	Very low	25	Very low	90 Å²	90	140 Å²	140	63%	0.629	78%	0.777	S	S	*	*				62.3	110.4	86.4	74.7	0	0	0	0	114.8
754	N	28.2	Very low	25.1	Very low	161 Å²	161	140 Å²	140	86%	0.861	78%	0.782	S	S	*	*				-178.6	127.2	114.4	-90.4	-7.2	0	0	0	112.8
755	C	22.1	Very low	24.9	Very low	123 Å²	123	138.7 Å²	138.7	83%	0.831	77%	0.774	S	S	*	*			trans	-62.2	162	174	-54.8	0	0	0	0	114.6
756	S	25.4	Very low	24.9	Very low	104 Å²	104	139.8 Å²	139.8	73%	0.727	78%	0.775	S	S	*	*				151.9	108.8	128.1	51	0	0	0	0	110.5
757	T	23.1	Very low	24.9	Very low	127 Å²	127	140.3 Å²	140.3	78%	0.779	77%	0.774	S	S	*	*				49.6	129.2	101.4	58.7	0	0	0	0	113.2
758	C	22.3	Very low	24.8	Very low	112 Å²	112	140 Å²	140	76%	0.757	77%	0.772	S	S	*	*			cis	-176.3	136.7	35.8	-120.1	0	0	0	0	107.5
759	S	23.1	Very low	24.8	Very low	84 Å²	84	139.4 Å²	139.4	59%	0.587	77%	0.769	S	S	*	*				75.8	132.3	110.4	80	0	0	0	0	119.6
760	H	24.9	Very low	24.8	Very low	168 Å²	168	137.6 Å²	137.6	78%	0.778	76%	0.761	S	S	*	*			trans	99.2	117	138.9	-69.9	-47	0	0	0	122.6
761	I	25.1	Very low	25	Very low	147 Å²	147	138.3 Å²	138.3	75%	0.754	76%	0.758	S	S	*	*			trans	105.2	104.6	132	-64	158.3	0	0	0	120
762	K	24.7	Very low	25.2	Very low	195 Å²	195	139.2 Å²	139.2	85%	0.848	76%	0.755	S	S	*	*			trans	61.7	143.1	135.4	-74.9	-177.6	175	176.5	0	123.5
763	P	23.6	Very low	25.2	Very low	117 Å²	117	136.5 Å²	136.5	76%	0.76	75%	0.749	S	S	*	*			trans	-92.3	156.9	-176.1	39	-34	0	0	0	113.1
764	L	26	Very low	25.1	Very low	171 Å²	171	138.8 Å²	138.8	90%	0.895	76%	0.755	S	S	*	*			trans	-140.8	124.5	161.9	-116.8	130.9	0	0	0	110.5
765	I	23	Very low	25	Very low	150 Å²	150	140 Å²	140	77%	0.769	76%	0.755	S	S	*	*			trans	-79.3	133.1	171.9	-65.5	164.4	0	0	0	108.2
766	Q	25.7	Very low	25.1	Very low	173 Å²	173	141.7 Å²	141.7	81%	0.808	76%	0.756	S	S	*	*			trans	-167.6	108.1	139.8	-109.4	174.4	4.6	0	0	113.4
767	T	23.7	Very low	24.9	Very low	113 Å²	113	142.9 Å²	142.9	69%	0.693	76%	0.762	S	S	*	*			trans	39.5	126.6	131.1	54.5	0	0	0	0	123.1
768	K	25.5	Very low	24.9	Very low	184 Å²	184	143.2 Å²	143.2	80%	0.8	77%	0.768	S	S	*	*			trans	72.3	112.2	135	-85.8	-171.4	171.9	176.4	0	119.7
769	N	25.8	Very low	24.9	Very low	122 Å²	122	146.4 Å²	146.4	65%	0.652	77%	0.772	S	S	*	*				140.1	127.1	97.7	-95.3	0.9	0	0	0	112.5
770	N	27.4	Very low	24.8	Very low	130 Å²	130	150.1 Å²	150.1	70%	0.695	79%	0.785	S	S	*	*			trans	65.4	122.6	141.2	-66.6	1.7	0	0	0	121.4
771	N	28.3	Very low	24.8	Very low	131 Å²	131	150.2 Å²	150.2	70%	0.701	78%	0.783	S	S	*	*			trans	88.6	114.7	137.1	-64.9	9.8	0	0	0	118.8
772	D	27.7	Very low	24.7	Very low	128 Å²	128	151.7 Å²	151.7	68%	0.684	79%	0.786	S	S	*	*			trans	78.7	114.1	131.5	-61.3	-16.8	0	0	0	119.8
773	N	28.3	Very low	24.7	Very low	136 Å²	136	151.7 Å²	151.7	73%	0.727	78%	0.782	S	S	*	*			trans	90.1	115.3	138.4	-59.3	-17.9	0	0	0	118.9
774	D	24.3	Very low	24.8	Very low	139 Å²	139	150.9 Å²	150.9	74%	0.743	78%	0.777	S	S	*	*			trans	50.6	105.3	140.5	-65.1	-21.4	0	0	0	117.9
775	H	25.5	Very low	24.7	Very low	186 Å²	186	150.4 Å²	150.4	86%	0.861	78%	0.775	S	S	*	*				-174.2	144.7	116.5	-89.8	-11.1	0	0	0	112.5
776	D	23.4	Very low	24.8	Very low	159 Å²	159	149.3 Å²	149.3	85%	0.85	78%	0.777	S	S	*	*			trans	-41.8	127.6	174.3	-72.6	-50.9	0	0	0	113.8
777	C	22.1	Very low	24.7	Very low	128 Å²	128	146.2 Å²	146.2	87%	0.865	78%	0.775	S	S	*	*			trans	-149.6	109.4	154.1	-98.9	0	0	0	0	110.4	E779	C777-E779 PolarHBondContact O-N 3.12Å
778	C	22.1	Very low	24.7	Very low	134 Å²	134	150 Å²	150	91%	0.905	78%	0.782	S	S	*	*			trans	-63.9	115.7	168.7	-64.6	0	0	0	0	110.4
779	E	23.3	Very low	24.6	Very low	180 Å²	180	148 Å²	148	84%	0.841	79%	0.785	S	S	*	*			trans	-95.1	117.9	163.9	-87.3	-169.9	159.6	0	0	111.1	C777 K781	C777-E779 PolarHBondContact O-N 3.12Å; E779-K781 PolarHBondContact O-N 3.26Å
780	L	21.2	Very low	24.5	Very low	162 Å²	162	149.7 Å²	149.7	85%	0.848	79%	0.794	S	S	*	*			trans	-56.7	115.8	165.4	-88.7	129.8	0	0	0	110.9
781	K	24	Very low	24.3	Very low	170 Å²	170	149.4 Å²	149.4	74%	0.739	80%	0.802	S	S	*	*			trans	-112.7	99.1	155.3	-80.3	-177.7	177.7	174.8	0	109	E779 Y783	E779-K781 PolarHBondContact O-N 3.26Å; K781-Y783 HydrophobicContact CB-CD2 4.29Å; K781-Y783 HydrophobicContact CB-CE2 4.24Å; K781-Y783 HydrophobicContact CD-CE2 4.43Å; K781-Y783 PolarHBondContact O-N 3.02Å
782	Q	22.5	Very low	24.1	Very low	177 Å²	177	146.6 Å²	146.6	83%	0.827	80%	0.803	S	S	*	*			trans	-65.2	120.9	162.9	-84.4	174.1	-24.9	0	0	109.1
783	Y	25.1	Very low	23.8	Very low	195 Å²	195	150.3 Å²	150.3	77%	0.765	81%	0.809	S	S	*	*			trans	-131	143.7	158.8	-80.4	-82.6	0	0	0	108.4	K781	K781-Y783 HydrophobicContact CB-CD2 4.29Å; K781-Y783 HydrophobicContact CB-CE2 4.24Å; K781-Y783 HydrophobicContact CD-CE2 4.43Å; K781-Y783 PolarHBondContact O-N 3.02Å
784	P	25.5	Very low	23.6	Very low	100 Å²	100	155.1 Å²	155.1	65%	0.649	82%	0.819	S	S	*	*			trans	-77.4	147.8	-159.7	30.4	-33.3	0	0	0	113.3
785	L	24.1	Very low	23.6	Very low	161 Å²	161	153.6 Å²	153.6	84%	0.843	81%	0.81	S	S	*	*			trans	-57.7	140.9	179	-75.3	85.8	0	0	0	113
786	P	25.4	Very low	23.6	Very low	127 Å²	127	152.2 Å²	152.2	83%	0.825	81%	0.809	S	S	*	*			trans	-83.6	115.1	148.4	28.1	-18.8	0	0	0	108.9	K788	P786-K788 PolarHBondContact O-N 2.72Å
787	S	24.2	Very low	23.6	Very low	109 Å²	109	152.3 Å²	152.3	76%	0.762	80%	0.804	S	S	*	*			trans	-66.8	124.3	173.9	43.7	0	0	0	0	110.9
788	K	22.4	Very low	23.8	Very low	191 Å²	191	151.5 Å²	151.5	83%	0.83	80%	0.797	S	S	*	*			trans	-63.5	133.1	163.3	-74.3	174.1	173.7	176.4	0	109.3	P786	P786-K788 PolarHBondContact O-N 2.72Å
789	T	24.4	Very low	23.8	Very low	142 Å²	142	150.8 Å²	150.8	87%	0.871	79%	0.793	S	S	*	*			trans	-127.6	116.6	143.4	27	0	0	0	0	109.5
790	L	22.7	Very low	23.7	Very low	159 Å²	159	147.5 Å²	147.5	83%	0.832	79%	0.79	S	S	*	*			trans	-47.8	140.7	164.5	-91.4	65.4	0	0	0	110.7
791	S	23.9	Very low	23.7	Very low	124 Å²	124	146.1 Å²	146.1	87%	0.867	79%	0.789	S	S	*	*			trans	-140	118.7	135.3	60.3	0	0	0	0	109.5
792	G	23.5	Very low	23.4	Very low	71 Å²	71	144.1 Å²	144.1	73%	0.732	79%	0.79	S	S	*	*			trans	-80.8	153.7	174.5	0	0	0	0	0	111.4
793	Y	21.7	Very low	23.4	Very low	207 Å²	207	145.3 Å²	145.3	81%	0.812	79%	0.793	S	S	*	*			trans	-40.3	135.8	163.7	-81.3	-103.7	0	0	0	113.4
794	Y	25.1	Very low	23.1	Very low	236 Å²	236	141.4 Å²	141.4	93%	0.925	79%	0.789	S	S	*	*				-153.9	127.3	126.3	-101.4	-75.2	0	0	0	110.8
795	I	23	Very low	22.9	Very low	107 Å²	107	144.6 Å²	144.6	55%	0.549	80%	0.8	S	S	.	*			trans	-79.5	135.4	173.6	-66.4	162.2	0	0	0	108.3
796	N	26.9	Very low	22.7	Very low	157 Å²	157	143.3 Å²	143.3	84%	0.84	79%	0.789	S	S	*	*			trans	177.9	112.8	132	-88.5	-22.3	0	0	0	111.3
797	H	23.4	Very low	22.6	Very low	161 Å²	161	144.1 Å²	144.1	75%	0.745	79%	0.786	S	S	*	*			trans	-54.8	-179.3	154.9	-84.2	-72.6	0	0	0	111.9
798	P	25.2	Very low	22.5	Very low	112 Å²	112	145.4 Å²	145.4	73%	0.727	78%	0.781	S	S	*	*			cis	-133.8	157.8	-9.4	25.5	-3.3	0	0	0	114
799	S	23.3	Very low	22.6	Very low	118 Å²	118	145.5 Å²	145.5	83%	0.825	78%	0.781	S	S	*	*			trans	178.2	123	132.9	38.1	0	0	0	0	110.9
800	S	19.7	Very low	22.5	Very low	111 Å²	111	148.5 Å²	148.5	78%	0.776	78%	0.777	S	S	*	*			trans	-57.7	129.1	166.7	46.1	0	0	0	0	112.8
801	T	21.1	Very low	22.4	Very low	134 Å²	134	152.1 Å²	152.1	82%	0.822	78%	0.781	S	S	*	*			trans	-145.4	104.2	138.2	34.8	0	0	0	0	108.5	K803	T801-K803 PolarHBondContact O-N 3.44Å
802	V	19.2	Very low	22.5	Very low	127 Å²	127	154.9 Å²	154.9	77%	0.77	78%	0.777	S	S	*	*			trans	-68.2	117	162.2	177.8	0	0	0	0	107	V804	V802-V804 HydrophobicContact CG1-CG2 3.58Å
803	K	20.8	Very low	22.4	Very low	202 Å²	202	157.3 Å²	157.3	88%	0.878	78%	0.778	S	S	*	*			trans	-98.6	96.2	160.9	-91.4	-174.9	176.5	178.9	0	108.1	T801 L805	T801-K803 PolarHBondContact O-N 3.44Å; K803-L805 PolarHBondContact O-N 3.31Å
804	V	19.9	Very low	22.6	Very low	113 Å²	113	154.6 Å²	154.6	69%	0.685	78%	0.782	S	S	*	*			trans	-72.8	114.1	161	-178.7	0	0	0	0	107	V802 H806	V802-V804 HydrophobicContact CG1-CG2 3.58Å; V804-H806 HydrophobicContact CG1-CB 4.4Å; V804-H806 PolarHBondContact O-N 3.19Å
805	L	21.4	Very low	22.5	Very low	167 Å²	167	150.3 Å²	150.3	87%	0.874	78%	0.775	S	S	*	*			trans	-88.7	96.3	161.9	-97.9	157.7	0	0	0	107.8	K803	K803-L805 PolarHBondContact O-N 3.31Å
806	H	20.5	Very low	22.6	Very low	134 Å²	134	155.8 Å²	155.8	62%	0.62	79%	0.789	S	S	*	*			trans	-79.6	109	172.9	-161.2	79.5	0	0	0	107.8	V804	V804-H806 HydrophobicContact CG1-CB 4.4Å; V804-H806 PolarHBondContact O-N 3.19Å
807	N	22.3	Very low	22.8	Very low	144 Å²	144	154.9 Å²	154.9	77%	0.77	78%	0.784	S	S	*	*			trans	-105	105.1	161.8	-95.5	-12.5	0	0	0	108.8
808	Q	22.2	Very low	22.9	Very low	137 Å²	137	154.1 Å²	154.1	64%	0.64	79%	0.785	S	S	*	*			trans	-88.6	106.1	179.9	-166.3	-179.2	38.5	0	0	107.8
809	F	23.5	Very low	23.2	Very low	193 Å²	193	158.7 Å²	158.7	85%	0.846	79%	0.794	S	S	*	*			trans	-108.8	108.5	164.6	-85.5	-78.5	0	0	0	110.3
810	R	22.7	Very low	23.4	Very low	205 Å²	205	160.2 Å²	160.2	77%	0.774	79%	0.793	S	S	*	*			trans	-68	127.3	174.7	-82.2	177.8	172.9	169.8	-1.6	110.7
811	Y	21.3	Very low	24.1	Very low	235 Å²	235	161.8 Å²	161.8	92%	0.922	80%	0.797	S	S	*	*			trans	-66.7	125.3	153.4	-92	-97.1	0	0	0	109.8
812	K	25.1	Very low	24.6	Very low	182 Å²	182	161.8 Å²	161.8	79%	0.791	79%	0.792	S	S	*	*			trans	-145.4	103.9	157.8	-105.6	-174.1	178.9	-174.8	0	110.2
813	T	22.7	Very low	25.1	Very low	121 Å²	121	162.3 Å²	162.3	74%	0.742	79%	0.791	S	S	*	*			trans	-8.3	132.9	147.2	37.9	0	0	0	0	118.2
814	V	25.3	Very low	25.6	Very low	150 Å²	150	159 Å²	159	91%	0.909	78%	0.783	S	S	*	*			trans	-140.1	126.9	136.5	-178.3	0	0	0	0	108.3
815	L	23.8	Very low	26.1	Very low	146 Å²	146	160.4 Å²	160.4	76%	0.764	79%	0.786	S	S	*	*			trans	-81.2	173.6	-177.4	-77.5	138.4	0	0	0	113.2
816	R	25.4	Very low	26.5	Very low	222 Å²	222	158.7 Å²	158.7	84%	0.838	78%	0.782	S	S	*	*			trans	88.1	136.3	154.9	-76	-175	-175.8	166.5	-0.2	116.3
817	D	29.4	Very low	26.8	Very low	138 Å²	138	157.4 Å²	157.4	74%	0.738	79%	0.786	S	S	*	*			cis	-149.3	153.7	20.7	-94.2	-38.4	0	0	0	112.5
818	D	26	Very low	27	Very low	146 Å²	146	159.1 Å²	159.1	78%	0.781	79%	0.794	S	S	*	*			trans	-58.5	153	171.3	-63.4	-58.9	0	0	0	114.5
819	K	31.2	Very low	27.1	Very low	208 Å²	208	155.7 Å²	155.7	90%	0.904	80%	0.795	S	S	*	*				-178.6	122.6	114	-98.2	169.3	-175.7	179.1	0	114.5
820	N	27.7	Very low	27.2	Very low	150 Å²	150	155.9 Å²	155.9	80%	0.802	80%	0.796	S	S	*	*			trans	-45.2	142.7	159.1	-68.7	-33.3	0	0	0	114.5
821	V	34.9	Very low	27.2	Very low	144 Å²	144	152.7 Å²	152.7	87%	0.873	80%	0.795	S	S	*	*			trans	-149.8	107.1	132.8	-174.9	0	0	0	0	110.2
822	N	32.2	Very low	27.4	Very low	134 Å²	134	150.4 Å²	150.4	72%	0.717	79%	0.792	S	S	*	*			trans	-2.7	130.4	142.4	-73.3	-4.5	0	0	0	118.6
823	N	29.2	Very low	27.4	Very low	138 Å²	138	148.8 Å²	148.8	74%	0.738	80%	0.798	S	S	*	*				93.5	145.1	73.7	-122.4	39.5	0	0	0	112.9
824	D	31.8	Very low	27.4	Very low	133 Å²	133	148.1 Å²	148.1	71%	0.711	80%	0.795	S	S	*	*			trans	89	136.8	162.8	-46.8	-14.7	0	0	0	116.5
825	D	30.1	Very low	27.3	Very low	141 Å²	141	148.2 Å²	148.2	75%	0.754	79%	0.79	S	S	*	*			cis	-177.9	154.9	-22.2	-128.6	-22.1	0	0	0	106.9
826	V	28.9	Very low	27.3	Very low	131 Å²	131	150.6 Å²	150.6	79%	0.794	80%	0.795	S	S	*	*			trans	89.9	137.5	150.1	176.1	0	0	0	0	121.1
827	P	27.4	Very low	27.2	Very low	108 Å²	108	146.2 Å²	146.2	70%	0.701	79%	0.788	S	S	*	*			trans	-126.4	177.9	-143.7	41.5	-24.1	0	0	0	115.1
828	L	26.7	Very low	27	Very low	180 Å²	180	147.8 Å²	147.8	94%	0.942	79%	0.791	S	S	*	*			trans	175.8	106.8	152.7	-92.8	148.8	0	0	0	105.3
829	G	23.5	Very low	26.7	Very low	64 Å²	64	147.9 Å²	147.9	66%	0.66	79%	0.79	S	S	*	*				114.6	124.5	65.6	0	0	0	0	0	108.8
830	F	25.2	Very low	26.4	Very low	198 Å²	198	148.4 Å²	148.4	87%	0.868	79%	0.787	S	S	*	*			trans	110.9	99.3	168.7	-64.8	-74	0	0	0	118.8
831	N	23	Very low	26.1	Very low	138 Å²	138	145.4 Å²	145.4	74%	0.738	78%	0.778	S	S	*	*			trans	46.9	99	135	-66.2	-8.2	0	0	0	119.3
832	Q	25.9	Very low	25.4	Very low	186 Å²	186	145.4 Å²	145.4	87%	0.869	77%	0.773	S	S	*	*			trans	157.2	105.9	134	-87.3	167.5	13.3	0	0	107.2	P834	Q832-P834 VanDerWaalsContact O-CD 3.28Å; Q832-P834 WeakPolarHBondContact O-CD 3.46Å
833	T	24.2	Very low	25	Very low	149 Å²	149	146.9 Å²	146.9	91%	0.914	78%	0.781	S	S	*	*			trans	-73.5	120.1	176.2	29.8	0	0	0	0	110.6
834	P	24.1	Very low	24.5	Very low	106 Å²	106	146.7 Å²	146.7	69%	0.688	79%	0.785	S	S	*	*			trans	-94.2	168	174.5	36.6	-27.6	0	0	0	111.7	Q832	Q832-P834 VanDerWaalsContact O-CD 3.28Å; Q832-P834 WeakPolarHBondContact O-CD 3.46Å
835	L	22.1	Very low	24.1	Very low	153 Å²	153	146.4 Å²	146.4	80%	0.801	79%	0.792	S	S	*	*			trans	-44.9	142.7	172	-78	85.3	0	0	0	113.7
836	F	24.2	Very low	23.5	Very low	196 Å²	196	147 Å²	147	86%	0.86	79%	0.794	S	S	*	*			trans	-125.7	114.2	149.4	-100	-84.2	0	0	0	110.1
837	N	23.3	Very low	23.3	Very low	129 Å²	129	146.6 Å²	146.6	69%	0.69	79%	0.787	S	S	*	*			trans	-65.3	136.4	161.4	-93.3	-25.8	0	0	0	109.8
838	H	24.5	Very low	23.1	Very low	172 Å²	172	148.6 Å²	148.6	80%	0.796	79%	0.787	S	S	*	*			trans	-128.5	109.7	148.9	-97.5	-65.3	0	0	0	109.3
839	I	21.3	Very low	22.8	Very low	148 Å²	148	147.2 Å²	147.2	76%	0.759	78%	0.78	S	S	*	*			trans	-72.3	122.5	162.3	-66.6	164.7	0	0	0	107
840	Y	23.9	Very low	22.8	Very low	219 Å²	219	150.3 Å²	150.3	86%	0.859	79%	0.786	S	S	*	*			trans	-146.1	132.6	149.7	-99.4	-77.7	0	0	0	110.3
841	S	21.6	Very low	22.7	Very low	86 Å²	86	145 Å²	145	60%	0.601	77%	0.774	S	S	*	*			trans	-80.7	161.1	-170.5	53.2	0	0	0	0	115.3
842	N	21.4	Very low	22.7	Very low	145 Å²	145	147.1 Å²	147.1	78%	0.775	79%	0.785	S	S	*	*			trans	63.9	109.8	147.9	-63.7	-13.6	0	0	0	118.9
843	N	22.2	Very low	22.6	Very low	165 Å²	165	141.9 Å²	141.9	88%	0.882	77%	0.769	S	S	*	*			trans	-152.8	110.3	138.4	-90.9	-29	0	0	0	110.4
844	V	20.1	Very low	22.7	Very low	134 Å²	134	143.8 Å²	143.8	81%	0.812	77%	0.77	S	S	*	*			trans	-84.9	129.6	162.2	170.6	0	0	0	0	107.2
845	C	21.8	Very low	22.7	Very low	127 Å²	127	144.3 Å²	144.3	86%	0.858	77%	0.766	S	S	*	*			trans	-140.7	111.2	163.2	-84.2	0	0	0	0	109.5
846	L	19.4	Very low	23	Very low	153 Å²	153	143.6 Å²	143.6	80%	0.801	76%	0.763	S	S	*	*			trans	-69.9	138.1	157.4	-114.6	93.9	0	0	0	108.7
847	N	23.5	Very low	23.1	Very low	122 Å²	122	140 Å²	140	65%	0.652	75%	0.752	S	S	*	*			trans	172.7	114.5	132.9	-93.5	12.4	0	0	0	108
848	E	22.6	Very low	23.1	Very low	151 Å²	151	140.2 Å²	140.2	71%	0.706	75%	0.749	S	S	*	*				95.3	123.1	93	-80.3	179.6	152.6	0	0	111.2
849	L	21.7	Very low	23.1	Very low	150 Å²	150	142.4 Å²	142.4	79%	0.785	75%	0.752	S	S	*	*			trans	31.6	111.9	140.6	-70.9	135.9	0	0	0	116.1
850	T	23.7	Very low	23.2	Very low	130 Å²	130	141 Å²	141	80%	0.798	76%	0.755	S	S	*	*				171.2	138.5	110.4	34	0	0	0	0	113.6
851	S	23.5	Very low	23.1	Very low	87 Å²	87	136.8 Å²	136.8	61%	0.608	75%	0.753	S	S	*	*			trans	57.1	106.6	143.3	60.4	0	0	0	0	120.2	S853	S851-S853 VanDerWaalsContact C-N 3.33Å; S851-S853 PolarHBondContact O-N 3.35Å
852	N	22.3	Very low	23.1	Very low	181 Å²	181	142.4 Å²	142.4	97%	0.968	76%	0.762	S	S	*	*				-40.5	97.6	128.6	-76.2	-29.6	0	0	0	110.8
853	S	23.4	Very low	23.2	Very low	77 Å²	77	140.8 Å²	140.8	54%	0.538	76%	0.761	S	S	.	*			trans	-167.1	108.1	155.8	58.7	0	0	0	0	109.6	S851	S851-S853 VanDerWaalsContact C-N 3.33Å; S851-S853 PolarHBondContact O-N 3.35Å
854	M	26.2	Very low	23.3	Very low	188 Å²	188	141 Å²	141	93%	0.926	76%	0.757	S	S	*	*			trans	-116.2	93.5	148.2	-85.8	-159.5	172.7	0	0	108.2
855	I	25.2	Very low	23.4	Very low	118 Å²	118	139.7 Å²	139.7	61%	0.605	75%	0.752	S	S	*	*			trans	-51.4	129.7	158.1	-65.3	162	0	0	0	108.1
856	N	27.3	Very low	23.6	Very low	138 Å²	138	140.5 Å²	140.5	74%	0.738	75%	0.748	S	S	*	*			trans	-140.6	105.4	142.9	-122.9	-7.5	0	0	0	109.9
857	D	26.2	Very low	23.9	Very low	120 Å²	120	140.9 Å²	140.9	64%	0.642	75%	0.75	S	S	*	*			trans	-64.6	162.8	168.3	-92.1	-37.4	0	0	0	111.8
858	Q	23	Very low	24	Very low	134 Å²	134	144.5 Å²	144.5	63%	0.626	76%	0.76	S	S	*	*	S	Bend	trans	-60.6	165.2	-174.4	-66.3	170.5	-26.1	0	0	114.2
859	Y	25.1	Very low	24.3	Very low	217 Å²	217	142.5 Å²	142.5	85%	0.851	76%	0.762	S	S	*	*			trans	110.4	83	169.2	-56.8	-65.2	0	0	0	115.3	T861	Y859-T861 PolarHBondContact O-N 3.37Å
860	S	22.7	Very low	24.5	Very low	119 Å²	119	142.6 Å²	142.6	83%	0.832	76%	0.763	S	S	*	*			trans	-77	107.4	163.9	51.3	0	0	0	0	111.1
861	T	21.8	Very low	24.5	Very low	131 Å²	131	144.6 Å²	144.6	80%	0.804	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-91.9	126.6	162.8	41.8	0	0	0	0	110.7	Y859	Y859-T861 PolarHBondContact O-N 3.37Å
862	Y	23	Very low	24.5	Very low	203 Å²	203	146.5 Å²	146.5	80%	0.796	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-82.2	131.8	175.4	-111.3	-95.8	0	0	0	111.2	H884	Y862-H884 AromaticContact CE1-NE2 3.7Å
863	C	22.9	Very low	24.7	Very low	112 Å²	112	147.2 Å²	147.2	76%	0.757	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-99.9	135.3	171.2	-81.1	0	0	0	0	111.2
864	Q	23.6	Very low	24.6	Very low	168 Å²	168	147 Å²	147	79%	0.785	78%	0.779	S	S	*	*			trans	-117.5	110	170.4	-174.3	171.9	2.6	0	0	109.1
865	C	23.7	Very low	24.6	Very low	107 Å²	107	146.3 Å²	146.3	72%	0.723	77%	0.774	S	S	*	*			trans	-89	123.6	174.5	-75.6	0	0	0	0	110.5
866	N	25.1	Very low	24.4	Very low	145 Å²	145	152.2 Å²	152.2	78%	0.775	79%	0.79	S	S	*	*			trans	-106.8	111.8	168.4	-89.4	-18.1	0	0	0	109.2
867	I	25.9	Very low	24.2	Very low	161 Å²	161	154 Å²	154	83%	0.826	79%	0.792	S	S	*	*			trans	-83.2	116.5	170.6	-58	172	0	0	0	107.5
868	K	25.5	Very low	24.1	Very low	198 Å²	198	155.2 Å²	155.2	86%	0.861	80%	0.803	S	S	*	*			trans	-96.9	104.7	162.1	-88.1	-175.1	174.2	-177.9	0	107.7
869	S	28	Very low	24.1	Very low	108 Å²	108	155.5 Å²	155.5	76%	0.755	81%	0.809	S	S	*	*			trans	-90.1	128.1	160.1	69.1	0	0	0	0	108.8
870	N	25.9	Very low	24.1	Very low	152 Å²	152	150.3 Å²	150.3	81%	0.813	80%	0.802	S	S	*	*			trans	-78.9	121.5	168	-84.7	-18.7	0	0	0	108.4
871	Q	23.7	Very low	24.2	Very low	172 Å²	172	149.4 Å²	149.4	80%	0.804	79%	0.793	S	S	*	*			trans	20.9	124.6	147.9	-53.5	-175	-24.4	0	0	117
872	T	24.7	Very low	24.4	Very low	127 Å²	127	152.2 Å²	152.2	78%	0.779	79%	0.79	S	S	*	*				-178.2	152.5	64	27.6	0	0	0	0	108.1
873	Q	25.7	Very low	24.4	Very low	196 Å²	196	151.2 Å²	151.2	92%	0.916	79%	0.792	S	S	*	*			trans	75.8	91.1	170.8	-63.5	-174.8	-12.7	0	0	118.1
874	G	22.3	Very low	24.5	Very low	73 Å²	73	151.6 Å²	151.6	75%	0.753	78%	0.783	S	S	*	*				64.3	82.5	120.6	0	0	0	0	0	118.6
875	Q	25	Very low	24.4	Very low	174 Å²	174	149.8 Å²	149.8	81%	0.813	79%	0.787	S	S	*	*			trans	-169.5	125.8	133.1	-103.6	169.1	17.9	0	0	109	F877	Q875-F877 PolarHBondContact O-N 3.09Å
876	Y	22	Very low	24.4	Very low	242 Å²	242	152 Å²	152	95%	0.949	79%	0.788	S	S	*	*			trans	-70.9	112.9	178.1	-74.4	-95.5	0	0	0	109.6
877	F	23.5	Very low	24.3	Very low	176 Å²	176	153.2 Å²	153.2	77%	0.772	79%	0.794	S	S	*	*			trans	-110.2	112.2	161.1	-91.4	-86.2	0	0	0	109.3	Q875 L879	Q875-F877 PolarHBondContact O-N 3.09Å; F877-L879 PolarHBondContact O-N 3.35Å
878	T	22.6	Very low	24.2	Very low	144 Å²	144	154.2 Å²	154.2	88%	0.883	79%	0.789	S	S	*	*			trans	-79.7	103	164.3	15.1	0	0	0	0	108.6
879	L	24.4	Very low	24	Very low	140 Å²	140	149.7 Å²	149.7	73%	0.733	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-87.5	136.2	169.3	-92.3	141.2	0	0	0	110.3	F877	F877-L879 PolarHBondContact O-N 3.35Å
880	P	24.8	Very low	23.9	Very low	109 Å²	109	151.6 Å²	151.6	71%	0.708	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-65.1	146.3	169.9	-10.9	25.3	0	0	0	110.6
881	P	23.8	Very low	24	Very low	99 Å²	99	151.6 Å²	151.6	64%	0.643	78%	0.782	S	S	*	*	S	Bend	trans	-68.8	155.2	174.1	30.9	-31.3	0	0	0	109.8
882	Y	25.9	Very low	24	Very low	191 Å²	191	151.8 Å²	151.8	75%	0.749	79%	0.785	S	S	*	*			trans	92.1	66.3	175.5	-43.9	-67.7	0	0	0	117.6	H884	Y882-H884 AromaticContact CD1-CE1 3.9Å
883	H	24.4	Very low	24.1	Very low	181 Å²	181	153.8 Å²	153.8	84%	0.838	79%	0.791	S	S	*	*			trans	-100.1	109.6	148.7	-89.7	-29.3	0	0	0	109.8
884	H	24.7	Very low	24	Very low	121 Å²	121	153.7 Å²	153.7	56%	0.56	79%	0.788	S	S	*	*			trans	-99.6	107.4	169.8	-68.5	88.1	0	0	0	108.5	Y862 Y882	Y862-H884 AromaticContact CE1-NE2 3.7Å; Y882-H884 AromaticContact CD1-CE1 3.9Å
885	C	21.5	Very low	24.2	Very low	130 Å²	130	157.2 Å²	157.2	88%	0.878	79%	0.789	S	S	*	*			trans	-84.2	117.7	165.7	-69	0	0	0	0	108.7
886	M	23.4	Very low	24.1	Very low	152 Å²	152	156.2 Å²	156.2	75%	0.749	79%	0.788	S	S	*	*			trans	-106.2	124.3	165.8	-77.5	-168.1	-67	0	0	109.1	Y888	M886-Y888 HydrophobicContact CB-CE2 4.48Å; M886-Y888 HydrophobicContact SD-CE2 4.44Å
887	L	22.1	Very low	24.3	Very low	171 Å²	171	154.7 Å²	154.7	90%	0.895	78%	0.782	S	S	*	*			trans	-108.1	112.4	174.5	-130.9	148.9	0	0	0	106.8
888	Y	24.7	Very low	24.2	Very low	183 Å²	183	152.3 Å²	152.3	72%	0.718	78%	0.782	S	S	*	*			trans	-91.5	125.7	172.4	-83.7	-89.3	0	0	0	109.2	M886	M886-Y888 HydrophobicContact CB-CE2 4.48Å; M886-Y888 HydrophobicContact SD-CE2 4.44Å
889	S	22	Very low	24.4	Very low	102 Å²	102	155.2 Å²	155.2	71%	0.713	78%	0.783	S	S	*	*			trans	-122.8	114.9	171.1	154.3	0	0	0	0	108.4
890	N	25	Very low	24.4	Very low	149 Å²	149	155.7 Å²	155.7	80%	0.797	79%	0.786	S	S	*	*			trans	-153	108.8	144.8	-103.9	-15.8	0	0	0	110.3
891	I	28.1	Very low	24.5	Very low	151 Å²	151	157.2 Å²	157.2	77%	0.774	79%	0.788	S	S	*	*			trans	59.4	92.1	143	-48.4	178.9	0	0	0	117.9
892	M	24.2	Very low	24.7	Very low	176 Å²	176	162 Å²	162	87%	0.867	80%	0.802	S	S	*	*			trans	23.4	104.7	143.1	-64.3	-134.1	-89.4	0	0	119.8
893	N	26.2	Very low	24.8	Very low	170 Å²	170	161.3 Å²	161.3	91%	0.909	81%	0.806	S	S	*	*			trans	-127.6	125.5	133.7	-114.9	-17	0	0	0	108.7	N895	N893-N895 PolarHBondContact O-N 3.49Å
894	K	23.4	Very low	25.1	Very low	193 Å²	193	159.7 Å²	159.7	84%	0.839	80%	0.803	S	S	*	*			trans	-58.6	121.3	-172.8	-77.3	172.4	173.6	173.6	0	111.4
895	N	25.6	Very low	25.4	Very low	147 Å²	147	162.7 Å²	162.7	79%	0.786	82%	0.818	S	S	*	*			trans	-160.1	106.8	140.3	-88.6	-26	0	0	0	108.1	N893	N893-N895 PolarHBondContact O-N 3.49Å
896	I	23.2	Very low	25.7	Very low	153 Å²	153	160.1 Å²	160.1	79%	0.785	80%	0.8	S	S	*	*			trans	-81.6	121.8	-179.5	-65.4	168.4	0	0	0	107.9	T898	I896-T898 HydrophobicContact CG2-CG2 4.26Å
897	Y	25.9	Very low	26.1	Very low	211 Å²	211	158.1 Å²	158.1	83%	0.827	79%	0.791	S	S	*	*			trans	-112	114.1	159.1	-77	-80.6	0	0	0	108.8
898	T	22.3	Very low	26.5	Very low	125 Å²	125	156.1 Å²	156.1	77%	0.767	78%	0.777	S	S	*	*			trans	-74.7	128.2	174.1	38.1	0	0	0	0	111.2	I896	I896-T898 HydrophobicContact CG2-CG2 4.26Å
899	F	26.7	Very low	26.6	Very low	205 Å²	205	150.2 Å²	150.2	90%	0.899	76%	0.762	S	S	*	*			trans	-110.5	128.7	160.4	-86.6	-84.8	0	0	0	109.8
900	N	25.5	Very low	27	Very low	151 Å²	151	149.6 Å²	149.6	81%	0.807	75%	0.754	S	S	*	*			trans	-88.4	136.8	-174.8	-115.3	-12.6	0	0	0	111.9
901	N	25.3	Very low	27.1	Very low	141 Å²	141	147.8 Å²	147.8	75%	0.754	74%	0.744	S	S	*	*			trans	45.2	110.7	150.5	-73.1	-11.1	0	0	0	121
902	Q	28.5	Very low	27.1	Very low	200 Å²	200	148.4 Å²	148.4	94%	0.935	74%	0.741	S	S	*	*				-153.9	138.8	114.5	-104	-178	-1.3	0	0	110.1
903	Q	29.2	Very low	27.3	Very low	175 Å²	175	146 Å²	146	82%	0.818	74%	0.738	S	S	*	*			trans	-75.7	159.1	-160.4	-71.1	163.7	-57.3	0	0	115.2
904	D	28.8	Very low	27.5	Very low	147 Å²	147	148.6 Å²	148.6	79%	0.786	74%	0.735	S	S	*	*			trans	79.6	58	153	-60.3	-18	0	0	0	121.2
905	Q	31.3	Very low	27.7	Very low	185 Å²	185	146 Å²	146	86%	0.864	74%	0.736	S	S	*	*			trans	-148.3	108.7	151.3	-66.4	-168.6	-6.4	0	0	112.2
906	C	28.5	Very low	27.9	Very low	76 Å²	76	144.2 Å²	144.2	51%	0.514	74%	0.735	S	S	.	*	P	Polyproline II helix	trans	-81.1	127.4	167.7	-72.8	0	0	0	0	110	C929	C906-C929 WeakPolarHBondContact CB-SG 3.43Å; C906-C929 WeakPolarHBondContact SG-CB 3.04Å; C906-C929 CovalentContact SG-SG 2.07Å; C906-C929 PolarHBondContact SG-SG 3.48Å
907	I	30.9	Very low	28.2	Very low	110 Å²	110	145 Å²	145	56%	0.564	74%	0.74	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.9	122.4	175.6	-58.6	174.8	0	0	0	108.6	Y928	I907-Y928 PolarHBondContact O-N 2.82Å
908	H	31.1	Very low	28.4	Very low	129 Å²	129	142.6 Å²	142.6	60%	0.597	74%	0.741	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-102.8	117.9	171.7	-73	-64.4	0	0	0	110.3
909	C	27.7	Very low	28.7	Very low	59 Å²	59	141.4 Å²	141.4	40%	0.399	74%	0.744	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.2	127.3	174.6	-69.1	0	0	0	0	109.9	F926	C909-F926 PolarHBondContact N-O 2.88Å; C909-F926 PolarHBondContact O-N 3.23Å
910	T	29.7	Very low	28.7	Very low	89 Å²	89	137.4 Å²	137.4	55%	0.546	74%	0.738	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.1	118.7	173.5	-34.9	0	0	0	0	109.1
911	L	26.9	Very low	28.9	Very low	110 Å²	110	139.9 Å²	139.9	58%	0.576	74%	0.742	S	S	*	*			trans	-78.2	123	171.9	-97.1	131.4	0	0	0	109.7	F926	L911-F926 HydrophobicContact CD1-CD2 4.48Å; L911-F926 HydrophobicContact CD1-CE2 3.8Å
912	K	28.6	Very low	29.1	Very low	165 Å²	165	140 Å²	140	72%	0.717	74%	0.742	S	S	*	*			trans	-126.7	119.6	168.9	-86.4	-173.9	175.3	179.8	0	109.8
913	P	28.5	Very low	29.2	Very low	124 Å²	124	135.8 Å²	135.8	81%	0.805	73%	0.726	S	S	*	*			trans	-71.8	131.6	169.1	27.8	-29.2	0	0	0	109.5
914	R	29.2	Very low	29.2	Very low	226 Å²	226	131.8 Å²	131.8	85%	0.853	71%	0.707	S	S	*	*			trans	-110.1	120.7	172.5	-142.3	179.2	-177.6	170.1	-0.5	108.7
915	T	29.5	Very low	29.3	Very low	138 Å²	138	128.9 Å²	128.9	85%	0.847	70%	0.695	S	S	*	*			trans	67.4	84.4	168.4	64.3	0	0	0	0	118.6
916	S	29.3	Very low	29.3	Very low	110 Å²	110	124.6 Å²	124.6	77%	0.769	67%	0.674	S	S	*	*				-144.6	133	122.4	62	0	0	0	0	108.4	L918	S916-L918 VanDerWaalsContact C-N 3.29Å; S916-L918 PolarHBondContact O-N 3.27Å
917	N	29.2	Very low	29.2	Very low	169 Å²	169	124 Å²	124	90%	0.904	67%	0.67	S	S	*	*	S	Bend	trans	-70.4	86.1	173.7	-77.6	-24.1	0	0	0	108.4
918	L	29.7	Very low	29.1	Very low	161 Å²	161	127.3 Å²	127.3	84%	0.843	68%	0.677	S	S	*	*	S	Bend	trans	-171.8	103.6	155.5	-99.1	136	0	0	0	108.8	S916	S916-L918 VanDerWaalsContact C-N 3.29Å; S916-L918 PolarHBondContact O-N 3.27Å
919	A	28.3	Very low	29.1	Very low	99 Å²	99	124 Å²	124	82%	0.818	67%	0.667	S	S	*	*			trans	62.5	115.3	164.5	0	0	0	0	0	119.6
920	P	27.5	Very low	29.4	Very low	122 Å²	122	128.6 Å²	128.6	79%	0.792	69%	0.688	S	S	*	*			trans	-94.1	142.5	173.8	36.3	-29	0	0	0	111.7
921	K	29.1	Very low	29.5	Very low	203 Å²	203	133.1 Å²	133.1	88%	0.883	71%	0.709	S	S	*	*			trans	172.8	98.1	149	-100.3	165.3	-176.8	-175.9	0	110
922	L	29.9	Very low	29.5	Very low	142 Å²	142	136.4 Å²	136.4	74%	0.743	72%	0.718	S	S	*	*			trans	171.1	94.9	147.3	-93.7	152.6	0	0	0	107.5	E924	L922-E924 HydrophobicContact CD2-CG 4.43Å
923	N	30.1	Very low	29.5	Very low	113 Å²	113	134.4 Å²	134.4	60%	0.604	72%	0.72	S	S	*	*			trans	-91.6	101.9	164.6	-81.2	-16.8	0	0	0	106.5
924	E	30.6	Very low	29.4	Very low	91 Å²	91	133.3 Å²	133.3	43%	0.425	72%	0.715	S	S	.	*			trans	-92.2	131.3	168	-71.5	-174.1	170.1	0	0	109.5	L922 F926	L922-E924 HydrophobicContact CD2-CG 4.43Å; E924-F926 HydrophobicContact CB-CE2 3.88Å; E924-F926 HydrophobicContact CB-CZ 3.88Å; E924-F926 WeakPolarHBondContact OE2-CZ 3.26Å
925	T	30.8	Very low	29.3	Very low	86 Å²	86	128.7 Å²	128.7	53%	0.528	71%	0.707	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.1	120	178.7	-32	0	0	0	0	107.3
926	F	30.1	Very low	29.2	Very low	95 Å²	95	131.2 Å²	131.2	42%	0.417	71%	0.706	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.5	134.6	177.3	-55.9	-84.7	0	0	0	109.2	C909 L911 E924	C909-F926 PolarHBondContact N-O 2.88Å; C909-F926 PolarHBondContact O-N 3.23Å; L911-F926 HydrophobicContact CD1-CD2 4.48Å; L911-F926 HydrophobicContact CD1-CE2 3.8Å; E924-F926 HydrophobicContact CB-CE2 3.88Å; E924-F926 HydrophobicContact CB-CZ 3.88Å; E924-F926 WeakPolarHBondContact OE2-CZ 3.26Å
927	S	27.3	Very low	29.1	Very low	63 Å²	63	131.7 Å²	131.7	44%	0.441	70%	0.7	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.3	120.2	175.7	-38.4	0	0	0	0	107.6
928	Y	28.9	Very low	29	Very low	180 Å²	180	131 Å²	131	71%	0.706	70%	0.696	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100.9	107.5	169.3	-110.1	-93.2	0	0	0	108.3	I907	I907-Y928 PolarHBondContact O-N 2.82Å
929	C	31.2	Very low	28.8	Very low	58 Å²	58	129.3 Å²	129.3	39%	0.392	69%	0.692	S	S	.	*			trans	-140.1	131.2	166.8	-51.5	0	0	0	0	107.2	C906	C906-C929 WeakPolarHBondContact CB-SG 3.43Å; C906-C929 WeakPolarHBondContact SG-CB 3.04Å; C906-C929 CovalentContact SG-SG 2.07Å; C906-C929 PolarHBondContact SG-SG 3.48Å
930	D	32.9	Very low	28.7	Very low	156 Å²	156	131 Å²	131	83%	0.834	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	31.6	87.8	170.5	-70.3	-18	0	0	0	117.9	K932	D930-K932 PolarHBondContact O-N 3Å
931	N	31.5	Very low	28.4	Very low	184 Å²	184	130.5 Å²	130.5	98%	0.984	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	45.1	20.5	160.1	-77	-14.1	0	0	0	118
932	K	27.8	Very low	28.3	Very low	179 Å²	179	128.6 Å²	128.6	78%	0.778	69%	0.685	S	S	*	*			trans	-135.6	108.3	177.6	-75.8	-176.7	177.4	176.7	0	109.9	D930 S934	D930-K932 PolarHBondContact O-N 3Å; K932-S934 PolarHBondContact O-N 3.48Å
933	V	28.4	Very low	28	Very low	123 Å²	123	128.4 Å²	128.4	75%	0.745	68%	0.683	S	S	*	*			trans	-76.2	112.8	167.3	179.3	0	0	0	0	107.9
934	S	26	Very low	27.8	Very low	102 Å²	102	129.8 Å²	129.8	71%	0.713	69%	0.691	S	S	*	*			trans	-108.3	114	166.4	75.9	0	0	0	0	109.9	K932	K932-S934 PolarHBondContact O-N 3.48Å
935	L	27.2	Very low	27.6	Very low	129 Å²	129	130.6 Å²	130.6	68%	0.675	70%	0.702	S	S	*	*			trans	-79.1	124.7	165.8	-118.9	90.7	0	0	0	108.6
936	K	28.2	Very low	27.5	Very low	191 Å²	191	131.8 Å²	131.8	83%	0.83	71%	0.71	S	S	*	*			trans	-114.8	94	171.7	-143.5	178	-172.4	179.9	0	108.6	N938	K936-N938 PolarHBondContact O-N 3.31Å
937	N	27.2	Very low	27.5	Very low	119 Å²	119	135.1 Å²	135.1	64%	0.636	73%	0.731	S	S	*	*			trans	-77.2	111.1	175	-75.5	-6.9	0	0	0	109.7	V939	N937-V939 PolarHBondContact O-N 3.06Å
938	N	27	Very low	27.5	Very low	155 Å²	155	135.4 Å²	135.4	83%	0.829	75%	0.745	S	S	*	*			trans	-90.2	93.7	164.6	-93.3	-3.7	0	0	0	108.8	K936	K936-N938 PolarHBondContact O-N 3.31Å
939	V	24	Very low	27.3	Very low	125 Å²	125	134.7 Å²	134.7	76%	0.758	75%	0.75	S	S	*	*			trans	-95.8	111.4	164.3	177.8	0	0	0	0	107.6	N937	N937-V939 PolarHBondContact O-N 3.06Å
940	T	27.8	Very low	27.3	Very low	136 Å²	136	142.4 Å²	142.4	83%	0.834	77%	0.772	S	S	*	*			trans	-91.5	110.4	164.2	43.5	0	0	0	0	109.6
941	T	21.3	Very low	27	Very low	110 Å²	110	141.3 Å²	141.3	68%	0.675	77%	0.767	S	S	*	*			trans	-43.2	133.3	164.2	40	0	0	0	0	115.9
942	I	26	Very low	27	Very low	164 Å²	164	141.3 Å²	141.3	84%	0.841	76%	0.76	S	S	*	*			trans	-145.2	85.2	142.2	-57.2	-178.3	0	0	0	104.4
943	I	23.8	Very low	27	Very low	137 Å²	137	138.6 Å²	138.6	70%	0.703	75%	0.754	S	S	*	*				37.4	99.1	103.5	-50	176.7	0	0	0	112.4
944	D	26.2	Very low	27.2	Very low	142 Å²	142	140 Å²	140	76%	0.759	76%	0.757	S	S	*	*				-160.1	147.1	107.8	-123.6	-23	0	0	0	113.4
945	T	25.4	Very low	27.4	Very low	108 Å²	108	142.4 Å²	142.4	66%	0.663	76%	0.762	S	S	*	*			trans	-50.4	148.5	-174.2	56	0	0	0	0	114.5
946	T	28.9	Very low	27.5	Very low	112 Å²	112	149.7 Å²	149.7	69%	0.687	79%	0.789	S	S	*	*				-179	141	66.6	37.9	0	0	0	0	111.1
947	N	30	Very low	27.5	Very low	164 Å²	164	147.7 Å²	147.7	88%	0.877	79%	0.787	S	S	*	*			trans	66.8	125.9	150.6	-56.3	-15.8	0	0	0	118.9
948	G	28.1	Very low	27.5	Very low	70 Å²	70	149.2 Å²	149.2	72%	0.722	80%	0.795	S	S	*	*			cis	-179.8	148.8	2.7	0	0	0	0	0	111.1
949	M	25.1	Very low	27.5	Very low	164 Å²	164	148.8 Å²	148.8	81%	0.808	79%	0.793	S	S	*	*			trans	29.9	124.4	149.1	-55.1	-179.1	79.3	0	0	118.2
950	Y	30.5	Very low	27.8	Very low	220 Å²	220	150.2 Å²	150.2	86%	0.863	80%	0.795	S	S	*	*				-159.3	137.9	78.1	-102.3	-90.1	0	0	0	113.4
951	N	26.5	Very low	27.7	Very low	134 Å²	134	151.1 Å²	151.1	72%	0.717	79%	0.793	S	S	*	*			trans	-59.2	147.8	168.3	-86.5	-31.7	0	0	0	113.4
952	H	32	Very low	28.2	Very low	184 Å²	184	153.9 Å²	153.9	85%	0.852	80%	0.801	S	S	*	*				-162.7	123.2	115.6	-112.7	-69.3	0	0	0	113.3
953	N	27.2	Very low	28.3	Very low	122 Å²	122	153.1 Å²	153.1	65%	0.652	80%	0.798	S	S	*	*			trans	-62.1	147.7	167.6	-62.1	-35	0	0	0	111.9
954	N	33.7	Very low	28.7	Very low	151 Å²	151	154.4 Å²	154.4	81%	0.807	81%	0.805	S	S	*	*				171.9	141.7	105.3	-89.2	-23.6	0	0	0	112.1
955	N	29.9	Very low	28.9	Very low	153 Å²	153	155.4 Å²	155.4	82%	0.818	81%	0.809	S	S	*	*			trans	-51.4	137.7	-176.4	-61.2	-36.6	0	0	0	115.9
956	F	29.6	Very low	29.2	Very low	283 Å²	283	159.7 Å²	159.7	100%	1.241	82%	0.822	S	S	*	*				-152.7	0	125.9	-108.8	-76.1	0	0	0	110

Retrieved 956 of 956 residues in 884.8 ms (Link to these results)

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