A0A087Y740_POEFO Loading...

Inactive serine protease PAMR1

May play a role in regeneration of skeletal muscle.

AlphaFold DB , UniProt , Accession A0A087Y740, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 721 aa.

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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	K	29.9	Very low	27.9	Very low	260 Å²	260	160.8 Å²	160.8	100%	1.13	78%	0.78	S	S	*	*				0	130.3	0	-62.7	177.9	179.6	179.6	0	107.1
2	S	28.1	Very low	28	Very low	94 Å²	94	160.2 Å²	160.2	66%	0.657	77%	0.774	S	S	*	*			cis	-170.3	128.2	-11.7	-77	0	0	0	0	108.2
3	L	27	Very low	27.8	Very low	156 Å²	156	162.9 Å²	162.9	82%	0.817	77%	0.774	S	S	*	*			trans	57.3	168.6	159.3	-72.6	95.7	0	0	0	119.1
4	C	25.3	Very low	27.8	Very low	103 Å²	103	161.9 Å²	161.9	70%	0.696	78%	0.783	S	S	*	*			cis	172.9	168.3	-45.4	-99.9	0	0	0	0	109
5	L	29.7	Very low	27.6	Very low	136 Å²	136	155.8 Å²	155.8	71%	0.712	77%	0.769	S	S	*	*			trans	76	152.9	163.6	-55.9	127.8	0	0	0	116.8
6	W	25.5	Very low	27.4	Very low	234 Å²	234	155.8 Å²	155.8	89%	0.886	77%	0.772	S	S	*	*			cis	-179	170	-23.3	-109.1	15.9	0	0	0	107.2
7	D	28.5	Very low	27.5	Very low	100 Å²	100	156.2 Å²	156.2	54%	0.535	78%	0.777	S	S	.	*			cis	-147.9	174.6	-27.6	179.6	32.5	0	0	0	106.3	R9	D7-R9 IonicContact OD2-CZ 3.94Å; D7-R9 IonicContact OD2-NE 3.95Å; D7-R9 IonicContact OD2-NH2 3.03Å; D7-R9 PolarHBondContact OD2-NH2 2.93Å
8	R	28.4	Very low	27.5	Very low	213 Å²	213	156.2 Å²	156.2	80%	0.804	78%	0.779	S	S	*	*			trans	-68.2	161.1	173.2	-59	160.7	162.9	-177.8	-6.1	114.5
9	R	27.7	Very low	27.4	Very low	188 Å²	188	153.7 Å²	153.7	71%	0.709	78%	0.777	S	S	*	*				143.5	120.8	127.8	-83.2	177.1	-95.6	-157.4	-9.5	110.9	D7	D7-R9 IonicContact OD2-CZ 3.94Å; D7-R9 IonicContact OD2-NE 3.95Å; D7-R9 IonicContact OD2-NH2 3.03Å; D7-R9 PolarHBondContact OD2-NH2 2.93Å
10	D	28.3	Very low	27.5	Very low	139 Å²	139	155.1 Å²	155.1	74%	0.743	78%	0.781	S	S	*	*				115.1	135.4	75.9	-86.2	-20.8	0	0	0	106.3
11	V	28.6	Very low	27.6	Very low	146 Å²	146	153 Å²	153	89%	0.885	78%	0.775	S	S	*	*			trans	175	136.3	131.9	152.5	0	0	0	0	108.7
12	Q	29.2	Very low	27.5	Very low	153 Å²	153	145.2 Å²	145.2	72%	0.715	75%	0.754	S	S	*	*			trans	-106.9	170.2	-174.5	-166.9	177.3	23.9	0	0	109
13	Y	25.9	Very low	27.3	Very low	196 Å²	196	151.6 Å²	151.6	77%	0.769	76%	0.764	S	S	*	*			trans	77.2	107.7	173.7	-61.6	-94.3	0	0	0	118.9
14	V	27.8	Very low	27.1	Very low	148 Å²	148	149.4 Å²	149.4	90%	0.897	76%	0.76	S	S	*	*				-138	143.4	107.3	176.4	0	0	0	0	107.4
15	A	23.8	Very low	27	Very low	71 Å²	71	149.9 Å²	149.9	59%	0.587	77%	0.765	S	S	*	*			trans	-129.4	164	-177.3	0	0	0	0	0	112
16	L	25.5	Very low	26.8	Very low	155 Å²	155	150.1 Å²	150.1	81%	0.812	77%	0.767	S	S	*	*			trans	68.8	111.8	154.7	-70.5	153.7	0	0	0	119.4
17	L	27.8	Very low	26.7	Very low	163 Å²	163	148.2 Å²	148.2	85%	0.853	76%	0.761	S	S	*	*			trans	168.5	124.2	130.2	-88.6	155.8	0	0	0	105.7
18	L	28.6	Very low	26.5	Very low	156 Å²	156	155.1 Å²	155.1	82%	0.817	78%	0.779	S	S	*	*			cis	-137.2	143.7	30.2	-72.4	155	0	0	0	112.8
19	C	24.5	Very low	26.4	Very low	110 Å²	110	155 Å²	155	74%	0.743	78%	0.78	S	S	*	*			trans	-100.1	173.8	157.6	-75.8	0	0	0	0	110.5
20	Q	30	Very low	26.2	Very low	181 Å²	181	154.1 Å²	154.1	85%	0.846	79%	0.789	S	S	*	*			trans	119.9	133.3	149	-62.9	-157	-20.1	0	0	115
21	V	30.2	Very low	26.2	Very low	110 Å²	110	157.7 Å²	157.7	67%	0.667	79%	0.793	S	S	*	*			cis	-160.1	139.3	-0	112.7	0	0	0	0	114.1
22	S	26.9	Very low	26.1	Very low	98 Å²	98	157.5 Å²	157.5	69%	0.685	79%	0.787	S	S	*	*			trans	64.5	152	153.7	76.3	0	0	0	0	120.4
23	R	25.2	Very low	26.2	Very low	227 Å²	227	158.8 Å²	158.8	86%	0.857	79%	0.793	S	S	*	*			cis	-161.9	149.9	0.3	-129.2	175.1	-175.2	173.5	1.2	111.8
24	C	21.9	Very low	26.2	Very low	111 Å²	111	155.2 Å²	155.2	75%	0.75	80%	0.795	S	S	*	*			trans	60.6	121.2	146.6	-71.4	0	0	0	0	124.5
25	S	23.9	Very low	26.3	Very low	113 Å²	113	154.2 Å²	154.2	79%	0.79	79%	0.792	S	S	*	*			trans	100.7	118.2	130.6	-59.9	0	0	0	0	122.4
26	D	23.7	Very low	26.6	Very low	140 Å²	140	154 Å²	154	75%	0.749	80%	0.796	S	S	*	*			trans	62.2	117.1	146.2	-76.7	-1.1	0	0	0	125.2
27	Y	23.6	Very low	26.9	Very low	195 Å²	195	152.2 Å²	152.2	77%	0.765	79%	0.794	S	S	*	*			trans	40.1	117.6	139	-70.8	-85.1	0	0	0	121.9
28	R	24.3	Very low	27.2	Very low	244 Å²	244	152.9 Å²	152.9	92%	0.921	79%	0.793	S	S	*	*				-172.7	158.9	96.8	-98.8	173.5	-174.5	179.4	2.6	113.7
29	Y	26.7	Very low	27.2	Very low	212 Å²	212	157.5 Å²	157.5	83%	0.831	80%	0.8	S	S	*	*			trans	-73	150.2	-175	-91.6	-113.3	0	0	0	115
30	L	24.8	Very low	27.7	Very low	168 Å²	168	157.4 Å²	157.4	88%	0.88	80%	0.8	S	S	*	*				-156.4	160.5	127.6	-133	81.9	0	0	0	111.8
31	Y	27.1	Very low	27.8	Very low	214 Å²	214	155.2 Å²	155.2	84%	0.839	80%	0.799	S	S	*	*			trans	-65.1	155.4	-169.1	-84.9	-108.8	0	0	0	116.2
32	N	26.3	Very low	27.6	Very low	143 Å²	143	158.9 Å²	158.9	77%	0.765	81%	0.811	S	S	*	*			trans	-155.6	121.1	147.4	-103.3	-32.1	0	0	0	115.4
33	H	31.4	Very low	27.7	Very low	179 Å²	179	159.6 Å²	159.6	83%	0.829	82%	0.815	S	S	*	*			trans	32.4	137.7	151.4	-61.1	-49.5	0	0	0	126.4
34	C	26.1	Very low	27.8	Very low	121 Å²	121	161 Å²	161	82%	0.818	82%	0.82	S	S	*	*			trans	-73.8	161.4	167.4	-51.3	0	0	0	0	113.7
35	P	29.4	Very low	28.2	Very low	128 Å²	128	159.4 Å²	159.4	83%	0.831	82%	0.822	S	S	*	*			trans	-83.6	126.5	172	32.5	-33	0	0	0	113.8
36	G	30.8	Very low	28.5	Very low	66 Å²	66	158.8 Å²	158.8	68%	0.68	82%	0.817	S	S	*	*			trans	71.3	136.4	138	0	0	0	0	0	120.9
37	P	31.9	Very low	28.8	Very low	117 Å²	117	155.9 Å²	155.9	76%	0.76	81%	0.807	S	S	*	*	S	Bend	trans	-92.4	11.6	-178.1	37.2	-35.5	0	0	0	116.1	W39	P37-W39 PolarHBondContact O-N 3.34Å
38	E	34	Very low	29.3	Very low	177 Å²	177	154.5 Å²	154.5	83%	0.827	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	11.4	-167.3	-62.9	-167.6	171.8	0	0	116.4
39	W	29.3	Very low	29.9	Very low	253 Å²	253	151.1 Å²	151.1	96%	0.958	80%	0.796	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	14	177.3	-89.5	79.6	0	0	0	114.8	P37	P37-W39 PolarHBondContact O-N 3.34Å
40	S	33.2	Very low	30.1	Very low	109 Å²	109	147.8 Å²	147.8	76%	0.762	79%	0.792	S	S	*	*			trans	-108.4	67.9	-172.3	-64	0	0	0	0	113.5
41	V	32.1	Very low	30.5	Very low	135 Å²	135	144.8 Å²	144.8	82%	0.818	78%	0.781	S	S	*	*	S	Bend	trans	-119.2	-7.1	-177.5	-180	0	0	0	0	114.8
42	M	26.7	Very low	30.9	Very low	187 Å²	187	141 Å²	141	92%	0.921	77%	0.774	S	S	*	*	S	Bend	trans	-123.4	5.6	-176.6	-77.8	-164.5	153.5	0	0	117.8
43	C	29	Very low	31.2	Very low	112 Å²	112	143 Å²	143	76%	0.757	77%	0.771	S	S	*	*			trans	-135.1	84.2	176.7	-64.3	0	0	0	0	113.7
44	R	27.9	Very low	31.5	Very low	256 Å²	256	137.3 Å²	137.3	97%	0.966	75%	0.75	S	S	*	*			trans	-142.1	125.9	154.2	-99.5	-173.2	174.8	175.5	-0.6	108.9
45	G	30.6	Very low	31.9	Very low	78 Å²	78	138.1 Å²	138.1	80%	0.804	74%	0.74	S	S	*	*	S	Bend	trans	172.3	-68.1	179.5	0	0	0	0	0	113.4
46	C	29.2	Very low	32.3	Very low	101 Å²	101	134.1 Å²	134.1	68%	0.682	72%	0.715	S	S	*	*			trans	-147.4	116.6	-180	-82	0	0	0	0	111.8
47	C	31.4	Very low	32.5	Very low	78 Å²	78	135.1 Å²	135.1	53%	0.527	71%	0.709	S	S	.	*			trans	-134.4	85.6	158.7	-75.3	0	0	0	0	107.4
48	E	33.3	Very low	32.8	Very low	166 Å²	166	137.7 Å²	137.7	78%	0.776	72%	0.715	S	S	*	*			trans	-81.7	139.3	166.1	-72	-176.1	135.3	0	0	109.4
49	Y	36.3	Very low	33.3	Very low	173 Å²	173	136 Å²	136	68%	0.678	71%	0.708	S	S	*	*			trans	-95.1	112.3	-178.7	-65.3	-89.1	0	0	0	110.6	A66	Y49-A66 HydrophobicContact CD1-CB 4.22Å
50	D	32.3	Very low	33.9	Very low	142 Å²	142	126.1 Å²	126.1	76%	0.759	68%	0.684	S	S	*	*			trans	-80.2	128.1	168.4	-97.6	-35.1	0	0	0	111.5	I52	D50-I52 PolarHBondContact O-N 3.34Å
51	V	33	Very low	34.1	Very low	106 Å²	106	125.3 Å²	125.3	64%	0.642	67%	0.674	S	S	*	*			trans	-87.3	91.1	-173.9	-177.7	0	0	0	0	111.2
52	I	33.8	Very low	34.2	Very low	134 Å²	134	124.4 Å²	124.4	69%	0.687	66%	0.661	S	S	*	*			trans	-86.6	130.2	170.7	-55.1	179.2	0	0	0	109.9	D50	D50-I52 PolarHBondContact O-N 3.34Å
53	R	33.6	Very low	34.8	Very low	186 Å²	186	120.2 Å²	120.2	70%	0.702	65%	0.646	S	S	*	*			trans	-100.9	107.1	179.2	-60	-175.4	-175.4	-160.1	3.7	111.1
54	C	36.7	Very low	34.8	Very low	59 Å²	59	117.3 Å²	117.3	40%	0.399	64%	0.635	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.7	155.4	174.2	-64.9	0	0	0	0	112.2
55	K	35.2	Very low	35	Very low	138 Å²	138	115 Å²	115	60%	0.6	63%	0.628	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-132.5	131.7	177.3	-78.2	-172.5	174.3	-176	0	111	N97	K55-N97 PolarHBondContact O-ND2 3.05Å; K55-N97 PolarHBondContact O-OD1 3.1Å
56	C	38.3	Very low	34.9	Very low	44 Å²	44	114.1 Å²	114.1	30%	0.297	61%	0.613	S	S	.	*			trans	-66	131.1	173.8	-130.8	0	0	0	0	110.7	L58 Q59 G60	C56-L58 PolarHBondContact O-N 3.2Å; C56-L58 VanDerWaalsContact O-N 3.09Å; C56-Q59 PolarHBondContact O-N 3.41Å; C56-G60 PolarHBondContact O-N 3.1Å; C56-G60 VanDerWaalsContact O-N 3.15Å
57	P	34.9	Very low	35.1	Very low	87 Å²	87	115.8 Å²	115.8	57%	0.565	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-10.6	-163.3	26.5	-31.7	0	0	0	115	N97	P57-N97 WeakPolarHBondContact CD-ND2 3.27Å
58	L	39	Very low	35.1	Very low	171 Å²	171	116.7 Å²	116.7	90%	0.895	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.9	-4	179.4	-76.1	168.5	0	0	0	115.2	C56	C56-L58 PolarHBondContact O-N 3.2Å; C56-L58 VanDerWaalsContact O-N 3.09Å
59	Q	43.7	Very low	35.3	Very low	142 Å²	142	112.4 Å²	112.4	66%	0.664	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.9	-8.5	-176.3	-68	-172.4	-4.9	0	0	115.2	C56 T61	C56-Q59 PolarHBondContact O-N 3.41Å; Q59-T61 PolarHBondContact O-N 3.23Å; Q59-T61 PolarHBondContact O-OG1 2.88Å
60	G	40.8	Very low	35.4	Very low	45 Å²	45	108.1 Å²	108.1	46%	0.464	61%	0.607	S	S	.	*			trans	70.3	-8.1	167.2	0	0	0	0	0	117.1	C56	C56-G60 PolarHBondContact O-N 3.1Å; C56-G60 VanDerWaalsContact O-N 3.15Å
61	T	39.3	Very low	35.8	Very low	91 Å²	91	107.1 Å²	107.1	56%	0.558	59%	0.592	S	S	*	*			trans	-67.1	142.5	177.6	-7.5	0	0	0	0	111.7	Q59	Q59-T61 PolarHBondContact O-N 3.23Å; Q59-T61 PolarHBondContact O-OG1 2.88Å
62	Q	33.8	Very low	36.1	Very low	117 Å²	117	104.1 Å²	104.1	55%	0.547	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.8	133.7	-174	-175.8	179.4	-28.4	0	0	111
63	V	38	Very low	36.4	Very low	98 Å²	98	103.2 Å²	103.2	59%	0.594	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-140.5	135.8	179.1	-136.1	0	0	0	0	109.7
64	G	29.8	Very low	36.8	Very low	51 Å²	51	100.9 Å²	100.9	53%	0.526	59%	0.585	S	S	.	*			trans	-136.8	177.3	166.7	0	0	0	0	0	108.3
65	Y	32.5	Very low	37.1	Very low	208 Å²	208	103.2 Å²	103.2	82%	0.816	59%	0.593	S	S	*	*			cis	-171.3	163.6	0.1	28.1	-121.9	0	0	0	106.7
66	A	28.8	Very low	37.4	Very low	59 Å²	59	102.9 Å²	102.9	49%	0.488	59%	0.594	S	S	.	*			cis	-160.2	-177	-11	0	0	0	0	0	108.2	Y49	Y49-A66 HydrophobicContact CD1-CB 4.22Å
67	V	31.6	Very low	37.4	Very low	137 Å²	137	103.6 Å²	103.6	83%	0.83	60%	0.599	S	S	*	*			trans	-133.3	139.1	179.7	-178.3	0	0	0	0	110.1
68	P	32.7	Very low	37.5	Very low	96 Å²	96	104 Å²	104	62%	0.623	60%	0.596	S	S	*	*			trans	-79.1	152.2	-171.7	31.1	-36.9	0	0	0	114.8
69	C	37.2	Very low	37.3	Very low	76 Å²	76	100.8 Å²	100.8	51%	0.514	59%	0.586	S	S	.	*			trans	-124.7	149.7	163.5	68.9	0	0	0	0	111.2	C77	C69-C77 HydrophobicContact CB-CB 3.91Å; C69-C77 WeakPolarHBondContact CB-SG 3.44Å; C69-C77 WeakPolarHBondContact SG-CB 3.04Å; C69-C77 CovalentContact SG-SG 2.06Å; C69-C77 PolarHBondContact SG-SG 2.93Å
70	C	37.3	Very low	36.6	Very low	84 Å²	84	100.5 Å²	100.5	57%	0.568	60%	0.598	S	S	*	*			trans	-94.1	139.6	171.5	-69.1	0	0	0	0	109.9	C77	C70-C77 PolarHBondContact O-SG 3.03Å
71	R	41.7	Very low	36	Very low	121 Å²	121	105.6 Å²	105.6	46%	0.457	61%	0.613	S	S	.	*	B	Isolated β-bridge	trans	-88.5	143.9	174.5	-63.8	-172.6	-176.5	-130.8	13.8	111.1	N75 E76	R71-N75 WeakPolarHBondContact CD-O 3.03Å; R71-N75 WeakPolarHBondContact CD-OD1 3.46Å; R71-N75 PolarHBondContact NH1-O 2.71Å; R71-E76 CarbonylContact C-O 3.57Å; R71-E76 VanDerWaalsContact CA-O 3.3Å; R71-E76 WeakPolarHBondContact CA-O 3.21Å
72	N	39.9	Very low	35.5	Very low	43 Å²	43	108.6 Å²	108.6	23%	0.23	62%	0.624	C	S	.	*			trans	-78.1	176.6	170.6	70.3	20.4	0	0	0	111.3	I74 N75 E76 D78	N72-I74 PolarHBondContact O-N 2.85Å; N72-I74 PolarHBondContact OD1-N 2.82Å; N72-N75 PolarHBondContact O-N 3.47Å; N72-N75 PolarHBondContact OD1-N 2.04Å; N72-E76 PolarHBondContact N-O 3.36Å; N72-E76 PolarHBondContact OD1-N 3.36Å; N72-E76 PolarHBondContact OD1-O 2.73Å; N72-D78 HydrophobicContact CB-CB 4.01Å; N72-D78 PolarHBondContact ND2-OD2 2.83Å
73	A	39.1	Very low	35.1	Very low	115 Å²	115	110.5 Å²	110.5	95%	0.95	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-4.8	-177.4	0	0	0	0	0	115.2
74	I	43.2	Very low	34.5	Very low	137 Å²	137	111.8 Å²	111.8	70%	0.703	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.9	9.4	176.4	-20.4	178.8	0	0	0	111.6	N72	N72-I74 PolarHBondContact O-N 2.85Å; N72-I74 PolarHBondContact OD1-N 2.82Å
75	N	43	Very low	34.7	Very low	107 Å²	107	113 Å²	113	57%	0.572	66%	0.655	S	S	*	*	S	Bend	trans	71	18.7	177.5	-140.6	26.6	0	0	0	115.5	R71 N72	R71-N75 WeakPolarHBondContact CD-O 3.03Å; R71-N75 WeakPolarHBondContact CD-OD1 3.46Å; R71-N75 PolarHBondContact NH1-O 2.71Å; N72-N75 PolarHBondContact O-N 3.47Å; N72-N75 PolarHBondContact OD1-N 2.04Å
76	E	40.1	Very low	34.5	Very low	131 Å²	131	107.5 Å²	107.5	61%	0.612	65%	0.646	S	S	*	*			trans	-95.8	144.2	171.1	-63.3	-178.4	143.9	0	0	110.3	R71 N72 D78	R71-E76 CarbonylContact C-O 3.57Å; R71-E76 VanDerWaalsContact CA-O 3.3Å; R71-E76 WeakPolarHBondContact CA-O 3.21Å; N72-E76 PolarHBondContact N-O 3.36Å; N72-E76 PolarHBondContact OD1-N 3.36Å; N72-E76 PolarHBondContact OD1-O 2.73Å; E76-D78 PolarHBondContact O-N 3.36Å
77	C	39.7	Very low	34.4	Very low	60 Å²	60	108.6 Å²	108.6	41%	0.405	65%	0.65	S	S	.	*	B	Isolated β-bridge	trans	-79.1	118.7	171.7	-93.1	0	0	0	0	110	C69 C70	C69-C77 HydrophobicContact CB-CB 3.91Å; C69-C77 WeakPolarHBondContact CB-SG 3.44Å; C69-C77 WeakPolarHBondContact SG-CB 3.04Å; C69-C77 CovalentContact SG-SG 2.06Å; C69-C77 PolarHBondContact SG-SG 2.93Å; C70-C77 PolarHBondContact O-SG 3.03Å
78	D	36.2	Very low	34.3	Very low	95 Å²	95	109.9 Å²	109.9	51%	0.508	65%	0.651	S	S	.	*			trans	-117.4	124.6	-167.7	-151.9	-15.1	0	0	0	110.3	N72 E76	N72-D78 HydrophobicContact CB-CB 4.01Å; N72-D78 PolarHBondContact ND2-OD2 2.83Å; E76-D78 PolarHBondContact O-N 3.36Å
79	P	35.8	Very low	34.1	Very low	104 Å²	104	114.1 Å²	114.1	68%	0.675	66%	0.66	S	S	*	*			trans	-76.8	124.8	179.8	-8.8	25.3	0	0	0	111.3	I81	P79-I81 WeakPolarHBondContact O-CG1 3.34Å
80	C	28.2	Very low	34	Very low	135 Å²	135	117.1 Å²	117.1	91%	0.912	67%	0.666	S	S	*	*			trans	-62.8	142.3	-179.8	-58.7	0	0	0	0	113.8
81	I	28.1	Very low	33.5	Very low	153 Å²	153	120 Å²	120	79%	0.785	68%	0.676	S	S	*	*			trans	-140.6	146.3	179.1	0.4	172.2	0	0	0	107.4	P79	P79-I81 WeakPolarHBondContact O-CG1 3.34Å
82	I	28.7	Very low	32.9	Very low	153 Å²	153	120.2 Å²	120.2	79%	0.785	70%	0.695	S	S	*	*			cis	-134.1	150.5	11.3	-53.3	161.2	0	0	0	109
83	H	26	Very low	32.5	Very low	158 Å²	158	127.4 Å²	127.4	73%	0.731	72%	0.724	S	S	*	*			trans	-128.4	141.6	161.1	-145.3	-87.1	0	0	0	111	G85	H83-G85 PolarHBondContact O-N 3.29Å; H83-G85 VanDerWaalsContact O-N 3.14Å
84	P	25.8	Very low	32.1	Very low	124 Å²	124	133 Å²	133	81%	0.805	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	108	178.4	-10.5	27	0	0	0	109.5
85	G	33.7	Very low	31.5	Very low	77 Å²	77	130.5 Å²	130.5	79%	0.794	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	166.8	-28.4	-178.6	0	0	0	0	0	114.7	H83	H83-G85 PolarHBondContact O-N 3.29Å; H83-G85 VanDerWaalsContact O-N 3.14Å
86	C	26.9	Very low	31.2	Very low	93 Å²	93	133 Å²	133	63%	0.628	73%	0.727	S	S	*	*			trans	-87.5	127.3	178.7	-60.5	0	0	0	0	112
87	S	27.7	Very low	30.8	Very low	81 Å²	81	130.4 Å²	130.4	57%	0.566	72%	0.718	S	S	*	*			trans	-86	162.6	167.4	81.5	0	0	0	0	111.1	F89	S87-F89 PolarHBondContact O-N 3.16Å
88	I	29.8	Very low	30.3	Very low	164 Å²	164	128.9 Å²	128.9	84%	0.841	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	16.5	-159.4	-148.7	161.1	0	0	0	115.8
89	F	28.9	Very low	29.9	Very low	185 Å²	185	129.2 Å²	129.2	81%	0.811	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.9	-1.8	-172.7	-89.7	-77.3	0	0	0	117	S87	S87-F89 PolarHBondContact O-N 3.16Å
90	E	34.6	Very low	30.1	Very low	139 Å²	139	133.7 Å²	133.7	65%	0.65	72%	0.721	S	S	*	*	S	Bend	trans	-98.6	-21.2	-171	-71.4	-176	119.6	0	0	116.4	C92	E90-C92 PolarHBondContact O-N 2.69Å
91	N	27.3	Very low	30.3	Very low	145 Å²	145	129.2 Å²	129.2	78%	0.775	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	18.7	-172.6	-72.3	-9	0	0	0	115.9
92	C	28.9	Very low	30.5	Very low	126 Å²	126	128 Å²	128	85%	0.851	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.2	43.2	173.3	-92.5	0	0	0	0	113.9	E90 R94	E90-C92 PolarHBondContact O-N 2.69Å; C92-R94 PolarHBondContact O-N 2.81Å
93	K	31	Very low	30.7	Very low	193 Å²	193	128.7 Å²	128.7	84%	0.839	70%	0.7	S	S	*	*			trans	-85.1	86	160.1	-76.9	-166.5	176.8	-178.8	0	111.1	C95	K93-C95 PolarHBondContact O-N 2.83Å
94	R	30.1	Very low	31.1	Very low	234 Å²	234	126 Å²	126	88%	0.883	69%	0.691	S	S	*	*			trans	-55.5	126.5	167.7	-141.4	179.9	-170.3	-179.2	1.5	109	C92 N96	C92-R94 PolarHBondContact O-N 2.81Å; R94-N96 VanDerWaalsContact C-N 3.3Å; R94-N96 PolarHBondContact O-N 3.41Å
95	C	30.9	Very low	31.5	Very low	84 Å²	84	126.2 Å²	126.2	57%	0.568	69%	0.686	S	S	*	*			trans	-69.1	90.2	166.3	-176.5	0	0	0	0	109.3	K93 N97 G98	K93-C95 PolarHBondContact O-N 2.83Å; C95-N97 PolarHBondContact SG-N 2.82Å; C95-N97 VanDerWaalsContact SG-N 3.43Å; C95-G98 PolarHBondContact SG-N 3.04Å
96	N	37.7	Very low	31.6	Very low	159 Å²	159	130.5 Å²	130.5	85%	0.85	68%	0.683	S	S	*	*	S	Bend	trans	-90.9	86.8	138.5	-96	-0.4	0	0	0	105.9	R94	R94-N96 VanDerWaalsContact C-N 3.3Å; R94-N96 PolarHBondContact O-N 3.41Å
97	N	30.9	Very low	32	Very low	77 Å²	77	132.7 Å²	132.7	41%	0.412	68%	0.682	S	S	.	*	S	Bend	trans	64.7	52.1	174	-119.7	3.7	0	0	0	116.7	K55 P57 C95	K55-N97 PolarHBondContact O-ND2 3.05Å; K55-N97 PolarHBondContact O-OD1 3.1Å; P57-N97 WeakPolarHBondContact CD-ND2 3.27Å; C95-N97 PolarHBondContact SG-N 2.82Å; C95-N97 VanDerWaalsContact SG-N 3.43Å
98	G	28.4	Very low	32.4	Very low	28 Å²	28	134.2 Å²	134.2	29%	0.289	68%	0.682	S	S	.	*			trans	33.9	114.3	152.3	0	0	0	0	0	120.6	C95 W100	C95-G98 PolarHBondContact SG-N 3.04Å; G98-W100 PolarHBondContact O-NE1 2.85Å
99	T	29.5	Very low	32.6	Very low	102 Å²	102	134.2 Å²	134.2	63%	0.626	68%	0.684	S	S	*	*			trans	-113.6	134.6	159.1	21.4	0	0	0	0	110.5	E115	T99-E115 HydrophobicContact CG2-CB 4.44Å
100	W	38.1	Very low	32.9	Very low	197 Å²	197	127.8 Å²	127.8	75%	0.746	67%	0.67	S	S	*	*			trans	-111.3	170.9	-154	-62.2	84.8	0	0	0	113.9	G98	G98-W100 PolarHBondContact O-NE1 2.85Å
101	G	33.4	Very low	32.8	Very low	41 Å²	41	129.1 Å²	129.1	42%	0.423	67%	0.674	S	S	.	*			trans	-77.8	166.2	176.9	0	0	0	0	0	113.8	Q103	G101-Q103 PolarHBondContact O-N 3.46Å
102	P	31.5	Very low	33.5	Very low	129 Å²	129	127.8 Å²	127.8	84%	0.838	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	7.6	-164.6	-19.6	34	0	0	0	117.6
103	Q	34.5	Very low	34	Very low	166 Å²	166	126.1 Å²	126.1	78%	0.776	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.2	8.9	-176.5	-67.8	-164.7	-11.7	0	0	115.4	G101 N105	G101-Q103 PolarHBondContact O-N 3.46Å; Q103-N105 PolarHBondContact O-N 2.78Å; Q103-N105 PolarHBondContact O-ND2 2.98Å
104	D	33.9	Very low	34.8	Very low	102 Å²	102	120.4 Å²	120.4	55%	0.545	64%	0.636	S	S	.	*			trans	-78.9	84.6	-179	-67.8	-35.9	0	0	0	111.8	F106	D104-F106 PolarHBondContact O-N 2.95Å
105	N	34.8	Very low	35.6	Very low	128 Å²	128	116.4 Å²	116.4	68%	0.684	63%	0.627	S	S	*	*			trans	-81.9	104.5	-175.4	-65.1	-51.4	0	0	0	112.9	Q103	Q103-N105 PolarHBondContact O-N 2.78Å; Q103-N105 PolarHBondContact O-ND2 2.98Å
106	F	35.5	Very low	36.8	Very low	167 Å²	167	114.2 Å²	114.2	73%	0.732	61%	0.613	S	S	*	*			trans	-112.3	109.1	162	-76.2	-79.9	0	0	0	111.4	D104	D104-F106 PolarHBondContact O-N 2.95Å
107	F	34.8	Very low	38.2	Very low	139 Å²	139	113.1 Å²	113.1	61%	0.61	60%	0.597	S	S	*	*			trans	-101.5	109.6	-179.5	-174.9	-92.5	0	0	0	109.9	Y112	F107-Y112 HydrophobicContact CD2-CE1 4.29Å
108	I	36.6	Very low	39.8	Very low	113 Å²	113	112.2 Å²	112.2	58%	0.579	60%	0.595	S	S	*	*	B	Isolated β-bridge	trans	-123.2	125.3	173.6	-58.7	-178.8	0	0	0	108.5	G110 K111	I108-G110 PolarHBondContact O-N 3.04Å; I108-K111 PolarHBondContact O-N 2.9Å
109	N	32.5	Very low	41.6	Very low	165 Å²	165	112.3 Å²	112.3	88%	0.882	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	46.9	37.4	174	-63.7	-11.3	0	0	0	115.4	K111	N109-K111 PolarHBondContact O-N 2.79Å
110	G	35.7	Very low	43.7	Very low	49 Å²	49	108.7 Å²	108.7	51%	0.505	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	77	13.6	172.9	0	0	0	0	0	116.2	I108	I108-G110 PolarHBondContact O-N 3.04Å
111	K	33.8	Very low	44.9	Very low	168 Å²	168	101.9 Å²	101.9	73%	0.73	55%	0.553	S	S	*	*	B	Isolated β-bridge	trans	-135.9	138.4	172	-71.4	-175.4	178.1	177.7	0	111.8	I108 N109	I108-K111 PolarHBondContact O-N 2.9Å; N109-K111 PolarHBondContact O-N 2.79Å
112	Y	41.7	Very low	45.9	Very low	116 Å²	116	101.6 Å²	101.6	46%	0.455	55%	0.55	S	S	.	.			trans	-83.3	146.3	174	-59.7	-88.1	0	0	0	110.8	F107 G123	F107-Y112 HydrophobicContact CD2-CE1 4.29Å; Y112-G123 WeakPolarHBondContact CB-O 3.14Å; Y112-G123 WeakPolarHBondContact CD2-O 3.37Å
113	C	39.5	Very low	46.7	Very low	91 Å²	91	98 Å²	98	62%	0.615	54%	0.536	S	S	*	.			trans	-107.2	87.5	168.9	-87	0	0	0	0	109.9
114	A	47.1	Very low	47.7	Very low	74 Å²	74	94.3 Å²	94.3	61%	0.612	52%	0.522	S	S	*	.			trans	-138.3	142.9	170.6	0	0	0	0	0	109.8
115	E	47.5	Very low	49.1	Very low	149 Å²	149	91 Å²	91	70%	0.696	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-82.4	126	164.3	-68.5	-173.7	167.2	0	0	108.5	T99	T99-E115 HydrophobicContact CG2-CB 4.44Å
116	C	56.1	Low	50.5	Low	39 Å²	39	90.4 Å²	90.4	26%	0.264	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-75.6	153.6	178.6	-57.8	0	0	0	0	111.7	W120 C125	C116-W120 HydrophobicContact CB-CB 3.95Å; C116-W120 VanDerWaalsContact CB-O 3.31Å; C116-W120 WeakPolarHBondContact CB-O 3.05Å; C116-C125 WeakPolarHBondContact CA-SG 3.13Å; C116-C125 HydrophobicContact CB-CB 3.7Å; C116-C125 WeakPolarHBondContact CB-SG 3.36Å; C116-C125 WeakPolarHBondContact SG-CA 3.44Å; C116-C125 WeakPolarHBondContact SG-CB 3.35Å; C116-C125 CovalentContact SG-SG 2.04Å; C116-C125 PolarHBondContact SG-SG 3.36Å
117	R	66.2	Low	52.3	Low	135 Å²	135	88.6 Å²	88.6	51%	0.509	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-57.7	153.1	173	-65.1	179.6	-173.2	172	0.9	111.1	G119 W120 S143	R117-G119 PolarHBondContact O-N 2.79Å; R117-W120 HydrophobicContact CB-CG 4.44Å; R117-W120 WeakPolarHBondContact O-CB 3.13Å; R117-W120 PolarHBondContact O-N 3.31Å; R117-S143 PolarHBondContact NH1-O 2.97Å
118	P	65.9	Low	54.7	Low	59 Å²	59	82.9 Å²	82.9	38%	0.383	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	124.1	174.4	-28.9	37.3	0	0	0	112.6	V140 E142	P118-V140 HydrophobicContact CB-CB 3.85Å; P118-V140 HydrophobicContact CB-CG1 3.78Å; P118-V140 HydrophobicContact CB-CG2 4.5Å; P118-E142 WeakPolarHBondContact CD-OE2 3.19Å; P118-E142 WeakPolarHBondContact CG-OE2 3.45Å; P118-E142 PolarHBondContact O-N 3.45Å
119	G	64.3	Low	57	Low	29 Å²	29	78.8 Å²	78.8	30%	0.299	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.9	-13.1	-175.1	0	0	0	0	0	115.8	R117 C128 V140	R117-G119 PolarHBondContact O-N 2.79Å; G119-C128 VanDerWaalsContact O-CB 3.29Å; G119-C128 WeakPolarHBondContact O-CB 3.07Å; G119-V140 WeakPolarHBondContact CA-O 3.42Å; G119-V140 PolarHBondContact N-O 2.95Å
120	W	74.6	Confident	59.7	Low	27 Å²	27	72.8 Å²	72.8	10%	0.102	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	155.5	-173.9	-61.2	90.4	0	0	0	113.1	C116 R117 C125 K127 C128 L141 E142 P145 A148	C116-W120 HydrophobicContact CB-CB 3.95Å; C116-W120 VanDerWaalsContact CB-O 3.31Å; C116-W120 WeakPolarHBondContact CB-O 3.05Å; R117-W120 HydrophobicContact CB-CG 4.44Å; R117-W120 WeakPolarHBondContact O-CB 3.13Å; R117-W120 PolarHBondContact O-N 3.31Å; W120-C125 VanDerWaalsContact CE3-O 3.3Å; W120-K127 CarbonylContact C-O 3.25Å; W120-C128 HydrophobicContact CD2-CB 4.35Å; W120-C128 HydrophobicContact CE3-CB 3.96Å; W120-C128 HydrophobicContact CH2-CB 4.34Å; W120-C128 HydrophobicContact CZ3-CB 3.96Å; W120-L141 HydrophobicContact CH2-CD1 4.49Å; W120-L141 HydrophobicContact CZ2-CD1 3.6Å; W120-L141 HydrophobicContact CZ2-CG 4.42Å; W120-E142 PolarHBondContact NE1-O 3.48Å; W120-P145 HydrophobicContact CH2-CG 3.57Å; W120-P145 HydrophobicContact CZ2-CG 4.03Å; W120-P145 HydrophobicContact CZ3-CG 4.19Å; W120-A148 HydrophobicContact CH2-CB 3.99Å
121	S	63.8	Low	62.3	Low	54 Å²	54	74.6 Å²	74.6	38%	0.378	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	176.5	-169.6	69.5	0	0	0	0	111.1	C125 K127	S121-C125 CarbonylContact O-C 3.51Å; S121-C125 WeakPolarHBondContact O-CA 3.39Å; S121-K127 CarbonylContact C-O 3.53Å; S121-K127 WeakPolarHBondContact CA-O 3.36Å; S121-K127 PolarHBondContact N-O 2.52Å; S121-K127 WeakPolarHBondContact O-CB 3.25Å; S121-K127 PolarHBondContact O-N 3.33Å; S121-K127 VanDerWaalsContact O-O 3.11Å; S121-K127 PolarHBondContact OG-O 2.87Å
122	G	54.5	Low	65	Low	34 Å²	34	68.5 Å²	68.5	35%	0.351	41%	0.408	S	S	.	.	S	Bend	trans	86.4	157.2	-171.6	0	0	0	0	0	111.7	D124 C125	G122-D124 PolarHBondContact O-N 2.81Å; G122-D124 VanDerWaalsContact O-N 3.17Å; G122-C125 PolarHBondContact O-N 2.58Å
123	G	47.4	Very low	67.3	Low	53 Å²	53	71.7 Å²	71.7	55%	0.546	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-11.5	-179.1	0	0	0	0	0	114.2	Y112	Y112-G123 WeakPolarHBondContact CB-O 3.14Å; Y112-G123 WeakPolarHBondContact CD2-O 3.37Å
124	D	55	Low	69.5	Low	89 Å²	89	74 Å²	74	48%	0.476	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-6	174.2	51.2	7.2	0	0	0	112.8	G122 M126	G122-D124 PolarHBondContact O-N 2.81Å; G122-D124 VanDerWaalsContact O-N 3.17Å; D124-M126 HydrophobicContact CB-CB 4.44Å; D124-M126 HydrophobicContact CB-CG 4.36Å; D124-M126 PolarHBondContact O-N 3.21Å; D124-M126 VanDerWaalsContact O-N 3.13Å; D124-M126 PolarHBondContact OD1-N 2.88Å
125	C	63.8	Low	71.2	Confident	32 Å²	32	76.4 Å²	76.4	22%	0.216	41%	0.413	C	S	.	.	S	Bend	trans	52.9	22.5	-170.1	-61.3	0	0	0	0	115.3	C116 W120 S121 G122	C116-C125 WeakPolarHBondContact CA-SG 3.13Å; C116-C125 HydrophobicContact CB-CB 3.7Å; C116-C125 WeakPolarHBondContact CB-SG 3.36Å; C116-C125 WeakPolarHBondContact SG-CA 3.44Å; C116-C125 WeakPolarHBondContact SG-CB 3.35Å; C116-C125 CovalentContact SG-SG 2.04Å; C116-C125 PolarHBondContact SG-SG 3.36Å; W120-C125 VanDerWaalsContact CE3-O 3.3Å; S121-C125 CarbonylContact O-C 3.51Å; S121-C125 WeakPolarHBondContact O-CA 3.39Å; G122-C125 PolarHBondContact O-N 2.58Å
126	M	64.6	Low	73	Confident	117 Å²	117	75.7 Å²	75.7	58%	0.576	41%	0.409	S	S	*	.			trans	-101.9	4.2	-179.7	-68	-61.1	-66.9	0	0	113.4	D124 P145	D124-M126 HydrophobicContact CB-CB 4.44Å; D124-M126 HydrophobicContact CB-CG 4.36Å; D124-M126 PolarHBondContact O-N 3.21Å; D124-M126 VanDerWaalsContact O-N 3.13Å; D124-M126 PolarHBondContact OD1-N 2.88Å; M126-P145 HydrophobicContact CE-CB 4.33Å; M126-P145 HydrophobicContact CE-CG 4.08Å
127	K	72.6	Confident	74.4	Confident	128 Å²	128	75 Å²	75	56%	0.557	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.3	134.8	179.8	-54.2	-174	-176.9	-175.8	0	110.8	W120 S121	W120-K127 CarbonylContact C-O 3.25Å; S121-K127 CarbonylContact C-O 3.53Å; S121-K127 WeakPolarHBondContact CA-O 3.36Å; S121-K127 PolarHBondContact N-O 2.52Å; S121-K127 WeakPolarHBondContact O-CB 3.25Å; S121-K127 PolarHBondContact O-N 3.33Å; S121-K127 VanDerWaalsContact O-O 3.11Å; S121-K127 PolarHBondContact OG-O 2.87Å
128	C	85.2	Confident	75.2	Confident	20 Å²	20	74 Å²	74	14%	0.135	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	151.3	-179.5	49.2	0	0	0	0	109.8	G119 W120 L141 C150 W152	G119-C128 VanDerWaalsContact O-CB 3.29Å; G119-C128 WeakPolarHBondContact O-CB 3.07Å; W120-C128 HydrophobicContact CD2-CB 4.35Å; W120-C128 HydrophobicContact CE3-CB 3.96Å; W120-C128 HydrophobicContact CH2-CB 4.34Å; W120-C128 HydrophobicContact CZ3-CB 3.96Å; C128-L141 HydrophobicContact CB-CD1 4.44Å; C128-C150 HydrophobicContact CB-CB 3.63Å; C128-C150 WeakPolarHBondContact CB-SG 3.39Å; C128-C150 WeakPolarHBondContact SG-CA 3.36Å; C128-C150 WeakPolarHBondContact SG-CB 3.35Å; C128-C150 CovalentContact SG-SG 2.02Å; C128-C150 PolarHBondContact SG-SG 3.19Å; C128-W152 HydrophobicContact CB-CZ2 4.38Å
129	G	85.5	Confident	76.1	Confident	27 Å²	27	71.5 Å²	71.5	28%	0.278	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	118.1	-170	-174	0	0	0	0	0	114.3	E151	G129-E151 CarbonylContact C-O 3.55Å; G129-E151 WeakPolarHBondContact CA-O 3.39Å
130	G	88.5	Confident	77	Confident	39 Å²	39	71.3 Å²	71.3	40%	0.402	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	130.6	177.1	175.4	0	0	0	0	0	114.5	E151 W152 T153	G130-E151 PolarHBondContact N-O 2.8Å; G130-W152 CarbonylContact O-C 3.48Å; G130-W152 VanDerWaalsContact O-CA 3.28Å; G130-W152 WeakPolarHBondContact O-CA 3.22Å; G130-T153 PolarHBondContact O-N 2.78Å
131	V	90.1	Very high	77.3	Confident	87 Å²	87	70 Å²	70	53%	0.527	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	122.2	-179.7	-175.1	0	0	0	0	110.3	R133 T153	V131-R133 HydrophobicContact CG1-CG 4.35Å; V131-T153 CarbonylContact C-O 3.58Å; V131-T153 WeakPolarHBondContact CA-O 3.42Å
132	I	90.1	Very high	78	Confident	39 Å²	39	71.8 Å²	71.8	20%	0.2	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	109	-177.2	-53.2	176.4	0	0	0	109.4	K134 L139 T153 Q155 F233	I132-K134 HydrophobicContact CG2-CB 4.46Å; I132-K134 HydrophobicContact CG2-CG 4.39Å; I132-L139 HydrophobicContact CD1-CD2 3.92Å; I132-L139 HydrophobicContact CD1-CG 4.13Å; I132-T153 PolarHBondContact N-O 2.71Å; I132-Q155 PolarHBondContact O-N 2.8Å; I132-F233 HydrophobicContact CG2-CE1 4.18Å; I132-F233 HydrophobicContact CG2-CZ 3.65Å
133	R	91.5	Very high	78.9	Confident	183 Å²	183	73.1 Å²	73.1	69%	0.691	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	85.2	176	-67.8	-176.1	176.8	113.7	4.8	110.9	V131 Q155	V131-R133 HydrophobicContact CG1-CG 4.35Å; R133-Q155 WeakPolarHBondContact CA-O 3.5Å; R133-Q155 HydrophobicContact CG-CB 4.29Å
134	K	85.6	Confident	80.3	Confident	139 Å²	139	70.8 Å²	70.8	60%	0.604	36%	0.362	S	S	*	.			trans	-149.8	147.2	179.7	-66.3	-171.1	176.9	-178	0	110.2	I132 Q136 F233	I132-K134 HydrophobicContact CG2-CB 4.46Å; I132-K134 HydrophobicContact CG2-CG 4.39Å; K134-Q136 VanDerWaalsContact C-N 3.3Å; K134-Q136 WeakPolarHBondContact CB-O 3.04Å; K134-Q136 PolarHBondContact O-N 3.41Å; K134-F233 HydrophobicContact CB-CZ 4.43Å
135	R	82.8	Confident	81.4	Confident	125 Å²	125	68.1 Å²	68.1	47%	0.472	35%	0.35	S	S	.	.	S	Bend	trans	-68.2	-27.2	174.9	-57.3	-163.4	177.9	154.1	-2.1	113.4	E157 E235	R135-E157 IonicContact CZ-OE2 3.61Å; R135-E157 VanDerWaalsContact CZ-OE2 3.26Å; R135-E157 IonicContact NE-OE2 3.8Å; R135-E157 PolarHBondContact NE-OE2 3.1Å; R135-E157 IonicContact NH2-OE1 2.66Å; R135-E157 IonicContact NH2-OE2 3.45Å; R135-E157 PolarHBondContact NH2-OE2 2.99Å; R135-E235 HydrophobicContact CB-CB 4.26Å; R135-E235 WeakPolarHBondContact CB-OE2 3.05Å; R135-E235 VanDerWaalsContact CD-OE2 3.25Å; R135-E235 WeakPolarHBondContact CD-OE2 3.05Å; R135-E235 WeakPolarHBondContact CG-OE2 3.34Å; R135-E235 IonicContact NE-OE2 3.52Å; R135-E235 WeakPolarHBondContact O-CB 3.37Å; R135-E235 PolarHBondContact O-N 3.27Å
136	Q	84.9	Confident	82.3	Confident	135 Å²	135	70.2 Å²	70.2	63%	0.631	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.6	158.7	173.2	58.5	177.2	-12.8	0	0	110.6	K134 F233 Q234	K134-Q136 VanDerWaalsContact C-N 3.3Å; K134-Q136 WeakPolarHBondContact CB-O 3.04Å; K134-Q136 PolarHBondContact O-N 3.41Å; Q136-F233 WeakPolarHBondContact CA-O 3.5Å; Q136-Q234 HydrophobicContact CB-CB 4.45Å
137	G	84.8	Confident	83.3	Confident	24 Å²	24	70.5 Å²	70.5	25%	0.247	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.7	-162	177.2	0	0	0	0	0	113.1	T232 F233	G137-T232 WeakPolarHBondContact O-CA 3.49Å; G137-F233 VanDerWaalsContact C-CE1 3.44Å; G137-F233 PolarHBondContact N-O 2.86Å; G137-F233 PolarHBondContact O-N 3.24Å
138	H	83.5	Confident	84	Confident	115 Å²	115	64.8 Å²	64.8	53%	0.532	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	154.6	177.6	53.6	-102.9	0	0	0	110.6	F230 A231 T232	H138-F230 HydrophobicContact CB-CE1 4.45Å; H138-F230 HydrophobicContact CB-CE2 4.1Å; H138-F230 HydrophobicContact CB-CZ 3.83Å; H138-A231 CarbonylContact C-O 3.1Å; H138-A231 WeakPolarHBondContact CA-O 3.09Å; H138-A231 WeakPolarHBondContact CB-O 3.04Å; H138-T232 HydrophobicContact CB-CG2 4.36Å
139	L	85.1	Confident	84.3	Confident	6 Å²	6	70.2 Å²	70.2	3%	0.031	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	131.5	165.6	-61.1	103.1	0	0	0	107.7	I132 W152 I154 I164 F229 F230 A231 F233	I132-L139 HydrophobicContact CD1-CD2 3.92Å; I132-L139 HydrophobicContact CD1-CG 4.13Å; L139-W152 HydrophobicContact CD2-CB 3.68Å; L139-W152 HydrophobicContact CD2-CD2 3.75Å; L139-W152 HydrophobicContact CD2-CE3 4.34Å; L139-W152 HydrophobicContact CD2-CG 3.45Å; L139-W152 VanDerWaalsContact CD2-CG 3.45Å; L139-I154 HydrophobicContact CD1-CD1 3.77Å; L139-I154 HydrophobicContact CD1-CG1 4.44Å; L139-I164 HydrophobicContact CD1-CD1 4.27Å; L139-F229 HydrophobicContact CB-CE2 4.32Å; L139-F230 WeakPolarHBondContact O-CA 3.34Å; L139-A231 PolarHBondContact N-O 3.38Å; L139-A231 PolarHBondContact O-N 2.95Å; L139-F233 HydrophobicContact CD1-CD1 3.7Å; L139-F233 HydrophobicContact CD1-CE1 4.2Å
140	V	82.6	Confident	84.6	Confident	24 Å²	24	68.9 Å²	68.9	15%	0.145	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	137.7	173.7	-162.7	0	0	0	0	107.2	P118 G119 E142 F230	P118-V140 HydrophobicContact CB-CB 3.85Å; P118-V140 HydrophobicContact CB-CG1 3.78Å; P118-V140 HydrophobicContact CB-CG2 4.5Å; G119-V140 WeakPolarHBondContact CA-O 3.42Å; G119-V140 PolarHBondContact N-O 2.95Å; V140-E142 HydrophobicContact CG1-CG 3.9Å; V140-F230 HydrophobicContact CB-CD2 4.35Å; V140-F230 HydrophobicContact CG1-CD2 4.19Å; V140-F230 HydrophobicContact CG2-CD2 3.59Å; V140-F230 HydrophobicContact CG2-CE2 3.75Å
141	L	82.1	Confident	84.9	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.005	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	107.4	163.4	-173.2	72.9	0	0	0	107	W120 C128 W152 F218 G228 F229	W120-L141 HydrophobicContact CH2-CD1 4.49Å; W120-L141 HydrophobicContact CZ2-CD1 3.6Å; W120-L141 HydrophobicContact CZ2-CG 4.42Å; C128-L141 HydrophobicContact CB-CD1 4.44Å; L141-W152 HydrophobicContact CB-CH2 4.42Å; L141-W152 HydrophobicContact CD1-CH2 4.12Å; L141-W152 HydrophobicContact CD1-CZ2 4.35Å; L141-W152 HydrophobicContact CD2-CH2 4.36Å; L141-F218 HydrophobicContact CD2-CB 4.41Å; L141-F218 HydrophobicContact CD2-CD1 3.31Å; L141-F218 HydrophobicContact CD2-CD2 4.25Å; L141-F218 HydrophobicContact CD2-CE1 3.52Å; L141-F218 HydrophobicContact CD2-CE2 4.45Å; L141-F218 HydrophobicContact CD2-CG 3.71Å; L141-F218 HydrophobicContact CD2-CZ 4.1Å; L141-G228 CarbonylContact O-C 3.6Å; L141-G228 VanDerWaalsContact O-CA 3.31Å; L141-G228 WeakPolarHBondContact O-CA 3.15Å; L141-F229 HydrophobicContact CB-CD1 4.02Å; L141-F229 HydrophobicContact CB-CE1 3.8Å; L141-F229 HydrophobicContact CB-CZ 4.19Å; L141-F229 HydrophobicContact CD2-CD1 4.24Å; L141-F229 HydrophobicContact CD2-CE1 3.8Å; L141-F229 HydrophobicContact CG-CE1 4.46Å; L141-F229 PolarHBondContact N-O 3.23Å; L141-F229 PolarHBondContact O-N 3.12Å
142	E	77.4	Confident	85.1	Confident	91 Å²	91	67.1 Å²	67.1	43%	0.425	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	134.8	-179.1	-84.8	170.1	-156.8	0	0	112.2	P118 W120 V140 Y144 D227	P118-E142 WeakPolarHBondContact CD-OE2 3.19Å; P118-E142 WeakPolarHBondContact CG-OE2 3.45Å; P118-E142 PolarHBondContact O-N 3.45Å; W120-E142 PolarHBondContact NE1-O 3.48Å; V140-E142 HydrophobicContact CG1-CG 3.9Å; E142-Y144 PolarHBondContact O-N 2.78Å; E142-D227 CarbonylContact C-O 3.58Å; E142-D227 WeakPolarHBondContact CA-O 3.48Å
143	S	74.7	Confident	85.4	Confident	61 Å²	61	66.3 Å²	66.3	43%	0.427	32%	0.315	S	S	.	.	S	Bend	trans	44	65.5	172.3	-56.6	0	0	0	0	112.9	R117 D227	R117-S143 PolarHBondContact NH1-O 2.97Å; S143-D227 PolarHBondContact N-O 3.43Å
144	Y	76.6	Confident	85.5	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.016	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-65.7	149.2	-173.3	58.9	-87.8	0	0	0	112.6	E142 L171 E172 D180 F218 N225 F226	E142-Y144 PolarHBondContact O-N 2.78Å; Y144-L171 HydrophobicContact CD1-CD2 4.21Å; Y144-L171 HydrophobicContact CE1-CD2 3.56Å; Y144-E172 PolarHBondContact OH-N 2.85Å; Y144-D180 HydrophobicContact CE2-CB 4.37Å; Y144-D180 WeakPolarHBondContact CE2-OD2 3.34Å; Y144-D180 VanDerWaalsContact CZ-OD2 3.24Å; Y144-D180 PolarHBondContact OH-OD2 2.95Å; Y144-F218 HydrophobicContact CD1-CZ 4Å; Y144-F218 HydrophobicContact CD2-CE1 4.06Å; Y144-F218 AromaticContact CD2-CZ 3.71Å; Y144-F218 HydrophobicContact CD2-CZ 3.71Å; Y144-F218 HydrophobicContact CE1-CZ 4.31Å; Y144-F218 HydrophobicContact CE2-CZ 4.02Å; Y144-F218 AromaticContact CG-CE1 3.95Å; Y144-F218 HydrophobicContact CG-CE1 3.95Å; Y144-F218 AromaticContact CG-CZ 3.7Å; Y144-F218 HydrophobicContact CG-CZ 3.7Å; Y144-N225 HydrophobicContact CD2-CB 3.92Å; Y144-N225 HydrophobicContact CE2-CB 3.65Å; Y144-N225 VanDerWaalsContact O-CB 3.27Å; Y144-N225 WeakPolarHBondContact O-CB 3.45Å; Y144-N225 PolarHBondContact O-ND2 2.03Å; Y144-F226 WeakPolarHBondContact CD1-O 3.36Å; Y144-F226 HydrophobicContact CE1-CB 4.15Å; Y144-F226 WeakPolarHBondContact CE1-O 3.4Å; Y144-F226 VanDerWaalsContact CZ-N 3.3Å; Y144-F226 PolarHBondContact OH-N 2.83Å; Y144-F226 VanDerWaalsContact OH-N 3.16Å
145	P	78.4	Confident	85.9	Confident	34 Å²	34	53.8 Å²	53.8	22%	0.221	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-84.2	168.9	172.3	34.6	-32.1	0	0	0	111.7	W120 M126 A148 S220 N225	W120-P145 HydrophobicContact CH2-CG 3.57Å; W120-P145 HydrophobicContact CZ2-CG 4.03Å; W120-P145 HydrophobicContact CZ3-CG 4.19Å; M126-P145 HydrophobicContact CE-CB 4.33Å; M126-P145 HydrophobicContact CE-CG 4.08Å; P145-A148 HydrophobicContact CG-CB 4.12Å; P145-S220 PolarHBondContact O-OG 2.78Å; P145-N225 VanDerWaalsContact CA-ND2 3.29Å; P145-N225 WeakPolarHBondContact CA-ND2 3.03Å
146	N	82.3	Confident	86.3	Confident	76 Å²	76	48.2 Å²	48.2	41%	0.406	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	146.1	176	-46.2	40.6	0	0	0	109.2	A148 D221 G222 N225	N146-A148 PolarHBondContact O-N 3.29Å; N146-D221 CarbonylContact C-O 3.58Å; N146-D221 VanDerWaalsContact CA-O 3.25Å; N146-D221 WeakPolarHBondContact CA-O 3.31Å; N146-D221 WeakPolarHBondContact CB-O 3.42Å; N146-G222 PolarHBondContact ND2-O 2.88Å; N146-N225 PolarHBondContact N-ND2 2.88Å; N146-N225 VanDerWaalsContact N-ND2 3.13Å; N146-N225 PolarHBondContact OD1-ND2 3.27Å; N146-N225 PolarHBondContact OD1-OD1 3.01Å
147	N	85.9	Confident	86.4	Confident	122 Å²	122	46.7 Å²	46.7	65%	0.652	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.1	28.8	-179.9	-47.7	-79.6	0	0	0	114.2	S220 D221	N147-S220 WeakPolarHBondContact CA-O 3.15Å; N147-S220 PolarHBondContact N-OG 2.86Å; N147-D221 PolarHBondContact N-O 2.7Å
148	A	86.6	Confident	86.4	Confident	9 Å²	9	53.5 Å²	53.5	7%	0.074	26%	0.262	C	S	.	.			trans	-70.1	144.9	174.3	0	0	0	0	0	110.8	W120 P145 N146 F218 V219 S220	W120-A148 HydrophobicContact CH2-CB 3.99Å; P145-A148 HydrophobicContact CG-CB 4.12Å; N146-A148 PolarHBondContact O-N 3.29Å; A148-F218 HydrophobicContact CB-CE1 4.12Å; A148-V219 WeakPolarHBondContact O-CA 3.19Å; A148-S220 VanDerWaalsContact CB-OG 3.3Å; A148-S220 WeakPolarHBondContact CB-OG 3.21Å; A148-S220 PolarHBondContact N-OG 2.99Å; A148-S220 PolarHBondContact O-N 3.13Å
149	R	92.1	Very high	86.5	Confident	133 Å²	133	51.7 Å²	51.7	50%	0.502	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	116.2	169.5	-175.3	-178.5	178.8	90.4	6.1	109.5	E151 L217 F218	R149-E151 IonicContact CZ-OE1 2.81Å; R149-E151 IonicContact NE-OE1 2.69Å; R149-E151 PolarHBondContact NE-OE1 3.3Å; R149-E151 IonicContact NH2-OE1 3.34Å; R149-E151 PolarHBondContact NH2-OE1 3.13Å; R149-L217 HydrophobicContact CG-CD1 4.07Å; R149-F218 WeakPolarHBondContact CA-O 3.22Å
150	C	92.1	Very high	86.6	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	133.6	-178.2	-46.6	0	0	0	0	110.3	C128 W152 L217 F218	C128-C150 HydrophobicContact CB-CB 3.63Å; C128-C150 WeakPolarHBondContact CB-SG 3.39Å; C128-C150 WeakPolarHBondContact SG-CA 3.36Å; C128-C150 WeakPolarHBondContact SG-CB 3.35Å; C128-C150 CovalentContact SG-SG 2.02Å; C128-C150 PolarHBondContact SG-SG 3.19Å; C150-W152 HydrophobicContact CB-CE3 4.1Å; C150-W152 HydrophobicContact CB-CH2 3.23Å; C150-W152 HydrophobicContact CB-CZ2 3.85Å; C150-W152 HydrophobicContact CB-CZ3 3.37Å; C150-L217 WeakPolarHBondContact O-CA 3.36Å; C150-F218 HydrophobicContact CB-CB 4.17Å; C150-F218 PolarHBondContact N-O 3.28Å; C150-F218 PolarHBondContact O-N 2.69Å
151	E	93.8	Very high	87.1	Confident	73 Å²	73	52.7 Å²	52.7	34%	0.341	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	115.3	-179	-71.5	-179.3	-152.3	0	0	110.8	G129 G130 R149 H215 I216 L217	G129-E151 CarbonylContact C-O 3.55Å; G129-E151 WeakPolarHBondContact CA-O 3.39Å; G130-E151 PolarHBondContact N-O 2.8Å; R149-E151 IonicContact CZ-OE1 2.81Å; R149-E151 IonicContact NE-OE1 2.69Å; R149-E151 PolarHBondContact NE-OE1 3.3Å; R149-E151 IonicContact NH2-OE1 3.34Å; R149-E151 PolarHBondContact NH2-OE1 3.13Å; E151-H215 IonicContact OE2-CE1 2.97Å; E151-H215 IonicContact OE2-NE2 2.89Å; E151-I216 WeakPolarHBondContact CA-O 3.44Å; E151-L217 HydrophobicContact CG-CD1 3.69Å
152	W	94.4	Very high	87.6	Confident	15 Å²	15	52.6 Å²	52.6	6%	0.057	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	140.4	176.3	-60.6	-91.4	0	0	0	111.3	C128 G130 L139 L141 C150 H215 I216 F218 F229	C128-W152 HydrophobicContact CB-CZ2 4.38Å; G130-W152 CarbonylContact O-C 3.48Å; G130-W152 VanDerWaalsContact O-CA 3.28Å; G130-W152 WeakPolarHBondContact O-CA 3.22Å; L139-W152 HydrophobicContact CD2-CB 3.68Å; L139-W152 HydrophobicContact CD2-CD2 3.75Å; L139-W152 HydrophobicContact CD2-CE3 4.34Å; L139-W152 HydrophobicContact CD2-CG 3.45Å; L139-W152 VanDerWaalsContact CD2-CG 3.45Å; L141-W152 HydrophobicContact CB-CH2 4.42Å; L141-W152 HydrophobicContact CD1-CH2 4.12Å; L141-W152 HydrophobicContact CD1-CZ2 4.35Å; L141-W152 HydrophobicContact CD2-CH2 4.36Å; C150-W152 HydrophobicContact CB-CE3 4.1Å; C150-W152 HydrophobicContact CB-CH2 3.23Å; C150-W152 HydrophobicContact CB-CZ2 3.85Å; C150-W152 HydrophobicContact CB-CZ3 3.37Å; W152-H215 CarbonylContact O-C 3.48Å; W152-H215 WeakPolarHBondContact O-CA 3.47Å; W152-I216 HydrophobicContact CB-CB 4.46Å; W152-I216 HydrophobicContact CE3-CB 4.41Å; W152-I216 HydrophobicContact CE3-CG2 4.24Å; W152-I216 PolarHBondContact N-O 2.04Å; W152-I216 PolarHBondContact O-N 2.98Å; W152-F218 HydrophobicContact CH2-CB 4.47Å; W152-F218 HydrophobicContact CZ3-CB 3.94Å; W152-F229 HydrophobicContact CH2-CE1 4.41Å; W152-F229 AromaticContact CH2-CZ 3.96Å; W152-F229 HydrophobicContact CH2-CZ 3.96Å; W152-F229 HydrophobicContact CZ3-CE1 4.38Å; W152-F229 AromaticContact CZ3-CZ 3.79Å; W152-F229 HydrophobicContact CZ3-CZ 3.79Å
153	T	95.3	Very high	88.4	Confident	22 Å²	22	49.7 Å²	49.7	14%	0.135	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	112.1	169.4	-61.1	0	0	0	0	109.4	G130 V131 I132 D188 L214 H215	G130-T153 PolarHBondContact O-N 2.78Å; V131-T153 CarbonylContact C-O 3.58Å; V131-T153 WeakPolarHBondContact CA-O 3.42Å; I132-T153 PolarHBondContact N-O 2.71Å; T153-D188 HydrophobicContact CG2-CB 4.11Å; T153-D188 WeakPolarHBondContact CG2-O 3.5Å; T153-D188 PolarHBondContact OG1-O 2.86Å; T153-L214 CarbonylContact C-O 3.54Å; T153-L214 WeakPolarHBondContact CA-O 3.33Å; T153-H215 PolarHBondContact OG1-ND1 2.74Å
154	I	95.1	Very high	89.3	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	134.8	173.8	-47.8	172.2	0	0	0	108.1	L139 I162 I164 T213 L214 I216 F233	L139-I154 HydrophobicContact CD1-CD1 3.77Å; L139-I154 HydrophobicContact CD1-CG1 4.44Å; I154-I162 HydrophobicContact CB-CD1 4.12Å; I154-I162 HydrophobicContact CG2-CD1 3.85Å; I154-I162 HydrophobicContact CG2-CG2 4.48Å; I154-I164 HydrophobicContact CD1-CD1 4.19Å; I154-T213 VanDerWaalsContact O-CA 3.23Å; I154-T213 WeakPolarHBondContact O-CA 3.33Å; I154-L214 HydrophobicContact CB-CB 4.45Å; I154-L214 HydrophobicContact CD1-CB 4.48Å; I154-L214 PolarHBondContact N-O 2.87Å; I154-L214 PolarHBondContact O-N 3.49Å; I154-I216 HydrophobicContact CD1-CD1 3.49Å; I154-I216 VanDerWaalsContact CD1-CD1 3.49Å; I154-I216 HydrophobicContact CG1-CD1 3.64Å; I154-F233 HydrophobicContact CD1-CB 3.99Å; I154-F233 HydrophobicContact CD1-CD1 3.88Å; I154-F233 HydrophobicContact CD1-CD2 4.4Å; I154-F233 HydrophobicContact CD1-CE1 4.49Å; I154-F233 HydrophobicContact CD1-CG 3.83Å; I154-F233 HydrophobicContact CG2-CD1 4.49Å; I154-F233 HydrophobicContact CG2-CD2 3.58Å; I154-F233 HydrophobicContact CG2-CE1 4.47Å; I154-F233 HydrophobicContact CG2-CE2 3.56Å; I154-F233 HydrophobicContact CG2-CG 4.08Å; I154-F233 HydrophobicContact CG2-CZ 4.03Å
155	Q	93.8	Very high	90	Very high	60 Å²	60	52.6 Å²	52.6	28%	0.28	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	122.9	178.2	178.5	167.7	64	0	0	110.5	I132 R133 N212 T213	I132-Q155 PolarHBondContact O-N 2.8Å; R133-Q155 WeakPolarHBondContact CA-O 3.5Å; R133-Q155 HydrophobicContact CG-CB 4.29Å; Q155-N212 WeakPolarHBondContact CA-O 3.45Å; Q155-T213 HydrophobicContact CB-CG2 4.17Å; Q155-T213 HydrophobicContact CG-CG2 4.06Å
156	V	90.8	Very high	90.5	Very high	7 Å²	7	51.5 Å²	51.5	4%	0.042	24%	0.244	C	C	.	.			trans	-105.1	172.1	171.1	-60.9	0	0	0	0	110.6	F160 I162 N212 E235	V156-F160 HydrophobicContact CG2-CB 4.29Å; V156-F160 WeakPolarHBondContact CG2-O 3.36Å; V156-I162 HydrophobicContact CB-CG1 4.31Å; V156-I162 HydrophobicContact CG1-CD1 4.04Å; V156-I162 HydrophobicContact CG1-CG1 3.78Å; V156-I162 HydrophobicContact CG2-CD1 4.1Å; V156-I162 HydrophobicContact CG2-CG1 3.59Å; V156-N212 HydrophobicContact CG2-CB 3.91Å; V156-N212 PolarHBondContact N-O 3.18Å; V156-N212 PolarHBondContact O-ND2 2.04Å; V156-E235 HydrophobicContact CB-CG 4.42Å; V156-E235 HydrophobicContact CG1-CB 4.16Å
157	E	87.6	Confident	90.4	Very high	103 Å²	103	52.7 Å²	52.7	48%	0.481	25%	0.249	S	C	.	.			trans	-69	138	176.7	-68.8	173.6	150.5	0	0	110.4	R135 F160	R135-E157 IonicContact CZ-OE2 3.61Å; R135-E157 VanDerWaalsContact CZ-OE2 3.26Å; R135-E157 IonicContact NE-OE2 3.8Å; R135-E157 PolarHBondContact NE-OE2 3.1Å; R135-E157 IonicContact NH2-OE1 2.66Å; R135-E157 IonicContact NH2-OE2 3.45Å; R135-E157 PolarHBondContact NH2-OE2 2.99Å; E157-F160 HydrophobicContact CB-CD2 4.46Å; E157-F160 WeakPolarHBondContact O-CD2 3.38Å; E157-F160 PolarHBondContact O-N 3.26Å
158	K	84.9	Confident	90.3	Very high	168 Å²	168	50.8 Å²	50.8	73%	0.73	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	138.2	168.9	-69.5	-176.3	178.4	-175.4	0	108.2	N212	K158-N212 WeakPolarHBondContact CE-OD1 3.08Å; K158-N212 HydrophobicContact CG-CB 4.07Å; K158-N212 VanDerWaalsContact CG-CG 3.44Å; K158-N212 WeakPolarHBondContact CG-OD1 3.43Å
159	P	84.9	Confident	90.3	Very high	77 Å²	77	50.7 Å²	50.7	50%	0.5	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	cis	-100.8	13.5	13.8	39.1	-37.2	0	0	0	115.6	Y256	P159-Y256 WeakPolarHBondContact CB-OH 3.26Å; P159-Y256 HydrophobicContact CG-CE1 3.85Å; P159-Y256 HydrophobicContact CG-CE2 4.41Å; P159-Y256 WeakPolarHBondContact CG-OH 3.27Å
160	F	88	Confident	90.1	Very high	23 Å²	23	44.8 Å²	44.8	10%	0.101	21%	0.214	C	C	.	.			trans	-73.1	152.2	-168.6	-54	-67.6	0	0	0	113.9	V156 E157 N212 E235 L252 Y256	V156-F160 HydrophobicContact CG2-CB 4.29Å; V156-F160 WeakPolarHBondContact CG2-O 3.36Å; E157-F160 HydrophobicContact CB-CD2 4.46Å; E157-F160 WeakPolarHBondContact O-CD2 3.38Å; E157-F160 PolarHBondContact O-N 3.26Å; F160-N212 VanDerWaalsContact O-CA 3.24Å; F160-N212 WeakPolarHBondContact O-CA 3.48Å; F160-N212 VanDerWaalsContact O-CB 3.31Å; F160-N212 WeakPolarHBondContact O-CB 3.37Å; F160-E235 HydrophobicContact CB-CG 3.43Å; F160-E235 VanDerWaalsContact CB-CG 3.43Å; F160-E235 HydrophobicContact CD2-CG 4.05Å; F160-E235 HydrophobicContact CG-CG 3.76Å; F160-L252 HydrophobicContact CE2-CD1 4.27Å; F160-L252 HydrophobicContact CZ-CD1 3.99Å; F160-Y256 HydrophobicContact CD1-CD1 4.21Å; F160-Y256 HydrophobicContact CD1-CE1 4.12Å; F160-Y256 AromaticContact CE1-CD1 3.7Å; F160-Y256 HydrophobicContact CE1-CD1 3.7Å; F160-Y256 AromaticContact CE1-CE1 3.93Å; F160-Y256 HydrophobicContact CE1-CE1 3.93Å
161	T	91.5	Very high	90.1	Very high	27 Å²	27	44.9 Å²	44.9	17%	0.166	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	163.9	171.7	63.3	0	0	0	0	111.4	Q208 S209 N236	T161-Q208 PolarHBondContact OG1-NE2 2.92Å; T161-Q208 VanDerWaalsContact OG1-NE2 3.09Å; T161-S209 WeakPolarHBondContact CB-O 3.24Å; T161-S209 WeakPolarHBondContact CG2-O 3.41Å; T161-N236 PolarHBondContact O-N 2.04Å
162	I	93.6	Very high	90	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	129	-178.2	-49.5	176	0	0	0	109	I154 V156 Q208 S209 L214 F233	I154-I162 HydrophobicContact CB-CD1 4.12Å; I154-I162 HydrophobicContact CG2-CD1 3.85Å; I154-I162 HydrophobicContact CG2-CG2 4.48Å; V156-I162 HydrophobicContact CB-CG1 4.31Å; V156-I162 HydrophobicContact CG1-CD1 4.04Å; V156-I162 HydrophobicContact CG1-CG1 3.78Å; V156-I162 HydrophobicContact CG2-CD1 4.1Å; V156-I162 HydrophobicContact CG2-CG1 3.59Å; I162-Q208 WeakPolarHBondContact O-CA 3.31Å; I162-S209 PolarHBondContact N-OG 3.2Å; I162-S209 PolarHBondContact O-N 3.39Å; I162-S209 PolarHBondContact O-OG 3.47Å; I162-L214 HydrophobicContact CB-CD1 3.89Å; I162-L214 HydrophobicContact CB-CG 4.24Å; I162-L214 HydrophobicContact CD1-CB 4.44Å; I162-L214 HydrophobicContact CD1-CG 4.35Å; I162-L214 HydrophobicContact CG2-CD1 3.79Å; I162-F233 HydrophobicContact CG2-CB 4.11Å; I162-F233 HydrophobicContact CG2-CD2 4.4Å
163	E	93.1	Very high	89.9	Confident	30 Å²	30	47.9 Å²	47.9	14%	0.14	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	132.4	165.3	-171	-171	177.8	0	0	109.3	R165 A206 L207 F233 Q234	E163-R165 IonicContact OE1-CZ 4Å; E163-R165 IonicContact OE1-NE 3.15Å; E163-R165 PolarHBondContact OE1-NE 3.16Å; E163-R165 IonicContact OE1-NH2 2.78Å; E163-R165 PolarHBondContact OE1-NH2 2.6Å; E163-A206 HydrophobicContact CG-CB 4.24Å; E163-A206 VanDerWaalsContact OE1-CB 3.28Å; E163-A206 WeakPolarHBondContact OE1-CB 3.38Å; E163-L207 CarbonylContact C-O 3.56Å; E163-L207 WeakPolarHBondContact CA-O 3.45Å; E163-F233 CarbonylContact O-C 3.49Å; E163-F233 VanDerWaalsContact O-CA 3.22Å; E163-F233 WeakPolarHBondContact O-CA 3.24Å; E163-Q234 HydrophobicContact CB-CG 4.09Å; E163-Q234 PolarHBondContact N-O 3.01Å; E163-Q234 PolarHBondContact O-N 2.87Å; E163-Q234 PolarHBondContact OE2-NE2 3.26Å
164	I	93.6	Very high	89.7	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	136.8	176.1	-170.2	172.5	0	0	0	111	L139 I154 V184 L207 L214 I216 A231 T232 F233	L139-I164 HydrophobicContact CD1-CD1 4.27Å; I154-I164 HydrophobicContact CD1-CD1 4.19Å; I164-V184 HydrophobicContact CG2-CG1 4.29Å; I164-L207 HydrophobicContact CG2-CB 3.84Å; I164-L207 PolarHBondContact N-O 2.71Å; I164-L207 PolarHBondContact O-N 3.13Å; I164-L214 HydrophobicContact CB-CD1 4.17Å; I164-L214 HydrophobicContact CG2-CD1 3.83Å; I164-I216 HydrophobicContact CD1-CD1 4.5Å; I164-I216 HydrophobicContact CD1-CG1 4.31Å; I164-A231 HydrophobicContact CD1-CB 4.29Å; I164-A231 HydrophobicContact CG1-CB 4.22Å; I164-T232 CarbonylContact C-O 3.43Å; I164-T232 WeakPolarHBondContact CA-O 3.28Å; I164-T232 WeakPolarHBondContact CG1-O 3.35Å; I164-F233 HydrophobicContact CB-CB 4.35Å; I164-F233 HydrophobicContact CG1-CB 4.29Å
165	R	91.6	Very high	89.4	Confident	125 Å²	125	53.1 Å²	53.1	47%	0.472	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	129.1	-178.1	-65.3	-173.2	177.9	-153.3	1.5	111	E163 A206 A231 T232	E163-R165 IonicContact OE1-CZ 4Å; E163-R165 IonicContact OE1-NE 3.15Å; E163-R165 PolarHBondContact OE1-NE 3.16Å; E163-R165 IonicContact OE1-NH2 2.78Å; E163-R165 PolarHBondContact OE1-NH2 2.6Å; R165-A206 HydrophobicContact CG-CB 3.67Å; R165-A231 CarbonylContact O-C 3.44Å; R165-A231 WeakPolarHBondContact O-CA 3.39Å; R165-T232 PolarHBondContact N-O 3.45Å; R165-T232 PolarHBondContact O-N 3.39Å
166	F	89.3	Confident	89.2	Confident	11 Å²	11	53.6 Å²	53.6	5%	0.048	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	113.2	172.5	-71	-92.6	0	0	0	110.1	L169 V182 V184 F198 P204 F229 A231	F166-L169 HydrophobicContact CD1-CD1 4.11Å; F166-L169 HydrophobicContact CE1-CD1 4.39Å; F166-V182 HydrophobicContact CE1-CG1 3.78Å; F166-V182 HydrophobicContact CE1-CG2 4.14Å; F166-V182 HydrophobicContact CZ-CG1 3.88Å; F166-V182 HydrophobicContact CZ-CG2 4.03Å; F166-V184 HydrophobicContact CE2-CG2 4.03Å; F166-V184 HydrophobicContact CZ-CG2 4.05Å; F166-F198 HydrophobicContact CE2-CD2 4.38Å; F166-P204 HydrophobicContact CB-CG 4.46Å; F166-P204 HydrophobicContact CD2-CG 3.8Å; F166-P204 HydrophobicContact CG-CG 4.41Å; F166-F229 HydrophobicContact CD1-CB 4.44Å; F166-F229 HydrophobicContact CD1-CD2 4.2Å; F166-F229 AromaticContact CE1-CD2 3.78Å; F166-F229 HydrophobicContact CE1-CD2 3.78Å; F166-F229 HydrophobicContact CE1-CE2 4.23Å; F166-F229 HydrophobicContact CE1-CG 4.26Å; F166-A231 HydrophobicContact CD1-CB 3.85Å; F166-A231 HydrophobicContact CE1-CB 3.97Å; F166-A231 HydrophobicContact CG-CB 4.24Å; F166-A231 HydrophobicContact CZ-CB 4.45Å
167	M	81.3	Confident	89.3	Confident	100 Å²	100	54 Å²	54	49%	0.493	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-28.3	175.3	-50.1	-61.4	-70.2	0	0	111.4	R203 F230 T232	M167-R203 WeakPolarHBondContact O-CD 3.23Å; M167-R203 PolarHBondContact O-NH1 2.86Å; M167-F230 HydrophobicContact CB-CD1 3.84Å; M167-F230 HydrophobicContact CB-CE1 4.39Å; M167-F230 HydrophobicContact CG-CD1 3.88Å; M167-F230 HydrophobicContact CG-CE1 4.03Å; M167-F230 PolarHBondContact N-O 2.93Å; M167-T232 HydrophobicContact CG-CG2 4.32Å
168	M	82.8	Confident	89.5	Confident	82 Å²	82	57.1 Å²	57.1	40%	0.404	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	138.9	175.8	178.6	175.8	168	0	0	109.9	D227 F229 F230	M168-D227 HydrophobicContact CE-CB 3.51Å; M168-F229 WeakPolarHBondContact O-CA 3.25Å; M168-F229 WeakPolarHBondContact O-CB 3.15Å; M168-F230 HydrophobicContact CB-CB 4.11Å; M168-F230 PolarHBondContact N-O 3.32Å; M168-F230 PolarHBondContact O-N 3.41Å
169	L	86.7	Confident	89.9	Confident	8 Å²	8	53.3 Å²	53.3	4%	0.042	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	128	170.5	-164.7	74.6	0	0	0	106.4	F166 L171 V182 F198 G200 N201 N202 F229	F166-L169 HydrophobicContact CD1-CD1 4.11Å; F166-L169 HydrophobicContact CE1-CD1 4.39Å; L169-L171 HydrophobicContact CD1-CD1 3.89Å; L169-L171 HydrophobicContact CD1-CG 4.17Å; L169-L171 HydrophobicContact CG-CD1 4.42Å; L169-L171 HydrophobicContact CG-CG 4.35Å; L169-V182 HydrophobicContact CD1-CG1 3.74Å; L169-F198 HydrophobicContact CD2-CB 3.94Å; L169-G200 WeakPolarHBondContact CD2-O 3.28Å; L169-G200 WeakPolarHBondContact CG-O 3.46Å; L169-N201 WeakPolarHBondContact O-CA 3.39Å; L169-N202 WeakPolarHBondContact CD2-O 3.39Å; L169-F229 HydrophobicContact CD1-CB 3.95Å
170	S	88.6	Confident	90.3	Very high	9 Å²	9	49.7 Å²	49.7	6%	0.063	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	79.4	-178.6	-170	0	0	0	0	107.3	F226 D227 G228	S170-F226 WeakPolarHBondContact O-CB 3.38Å; S170-D227 PolarHBondContact OG-OD2 3.23Å; S170-G228 CarbonylContact C-O 3.57Å; S170-G228 WeakPolarHBondContact CA-O 3.45Å; S170-G228 PolarHBondContact N-O 2.92Å; S170-G228 WeakPolarHBondContact O-CA 3.45Å; S170-G228 PolarHBondContact O-N 2.7Å
171	L	91.5	Very high	90.7	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.01	24%	0.238	C	C	.	.			trans	-127.1	159.4	-176.1	-58.6	-175.8	0	0	0	109.9	Y144 L169 F173 D180 V182 G200 F218	Y144-L171 HydrophobicContact CD1-CD2 4.21Å; Y144-L171 HydrophobicContact CE1-CD2 3.56Å; L169-L171 HydrophobicContact CD1-CD1 3.89Å; L169-L171 HydrophobicContact CD1-CG 4.17Å; L169-L171 HydrophobicContact CG-CD1 4.42Å; L169-L171 HydrophobicContact CG-CG 4.35Å; L171-F173 PolarHBondContact O-N 3.01Å; L171-D180 HydrophobicContact CB-CB 4.17Å; L171-V182 HydrophobicContact CD1-CB 4.3Å; L171-V182 HydrophobicContact CD1-CG1 4.14Å; L171-G200 PolarHBondContact N-O 2.95Å; L171-G200 WeakPolarHBondContact O-CA 2.99Å; L171-G200 PolarHBondContact O-N 3.03Å; L171-F218 HydrophobicContact CD1-CD2 4.41Å; L171-F218 HydrophobicContact CD1-CE2 3.98Å; L171-F218 HydrophobicContact CD2-CD2 4.4Å; L171-F218 HydrophobicContact CD2-CE2 3.48Å; L171-F218 VanDerWaalsContact CD2-CE2 3.48Å; L171-F218 HydrophobicContact CD2-CZ 4.06Å; L171-F218 HydrophobicContact CG-CE2 4.37Å
172	E	91.7	Very high	90.9	Very high	18 Å²	18	48.2 Å²	48.2	8%	0.084	23%	0.23	C	C	.	.			trans	-58.9	132.9	173.8	-169	175.9	-155.7	0	0	111.1	Y144 Y179 D180 C199 G200 K224 F226	Y144-E172 PolarHBondContact OH-N 2.85Å; E172-Y179 HydrophobicContact CG-CD2 4.11Å; E172-Y179 WeakPolarHBondContact OE2-CD2 3.38Å; E172-D180 HydrophobicContact CB-CB 4.28Å; E172-D180 WeakPolarHBondContact CB-OD2 3.29Å; E172-D180 PolarHBondContact N-OD2 2.87Å; E172-C199 WeakPolarHBondContact O-CB 3.3Å; E172-G200 PolarHBondContact O-N 2.78Å; E172-K224 WeakPolarHBondContact OE1-CD 3.42Å; E172-K224 IonicContact OE1-NZ 2.73Å; E172-K224 PolarHBondContact OE1-NZ 2.76Å; E172-F226 HydrophobicContact CB-CD2 4.21Å; E172-F226 HydrophobicContact CB-CE2 3.87Å; E172-F226 HydrophobicContact CG-CE2 4.18Å
173	F	91.8	Very high	91	Very high	132 Å²	132	48.5 Å²	48.5	58%	0.579	23%	0.231	S	C	*	.			trans	-84.2	127	178.7	176.4	-102.2	0	0	0	112.2	L171 P175	L171-F173 PolarHBondContact O-N 3.01Å; F173-P175 HydrophobicContact CE1-CG 4.34Å
174	H	92	Very high	91.2	Very high	20 Å²	20	47 Å²	47	9%	0.093	23%	0.225	C	C	.	.			trans	-135	139.4	165.2	-178.4	-85.5	0	0	0	109.3	S176 C177 R178 Y179 C199	H174-S176 PolarHBondContact CE1-OG 2.86Å; H174-S176 PolarHBondContact ND1-N 2.84Å; H174-S176 PolarHBondContact ND1-OG 3.28Å; H174-S176 PolarHBondContact O-N 3.02Å; H174-C177 PolarHBondContact O-N 2.85Å; H174-R178 PolarHBondContact CE1-NE 2.84Å; H174-R178 PolarHBondContact CE1-NH2 2.74Å; H174-R178 VanDerWaalsContact CE1-NH2 3.34Å; H174-R178 PolarHBondContact NE2-NE 2.67Å; H174-R178 PolarHBondContact NE2-NH2 2.77Å; H174-Y179 HydrophobicContact CB-CD2 3.78Å; H174-Y179 HydrophobicContact CB-CE2 4.09Å; H174-Y179 HydrophobicContact CB-CG 4.28Å; H174-Y179 AromaticContact CD2-CE2 3.57Å; H174-Y179 AromaticContact CD2-CZ 3.62Å; H174-C199 PolarHBondContact O-SG 2.86Å
175	P	88.6	Confident	91.4	Very high	112 Å²	112	49 Å²	49	73%	0.727	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-24.3	-176.8	-30.1	36.2	0	0	0	116.1	F173	F173-P175 HydrophobicContact CE1-CG 4.34Å
176	S	89.9	Confident	91.6	Very high	70 Å²	70	44.7 Å²	44.7	49%	0.49	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.9	21.8	173.4	64.1	0	0	0	0	114.6	H174 R178	H174-S176 PolarHBondContact CE1-OG 2.86Å; H174-S176 PolarHBondContact ND1-N 2.84Å; H174-S176 PolarHBondContact ND1-OG 3.28Å; H174-S176 PolarHBondContact O-N 3.02Å; S176-R178 PolarHBondContact O-N 3.09Å
177	C	93.3	Very high	91.8	Very high	17 Å²	17	44.8 Å²	44.8	12%	0.115	22%	0.222	C	C	.	.			trans	45.5	63	176.7	-57	0	0	0	0	114.1	H174 F181 R197 C199	H174-C177 PolarHBondContact O-N 2.85Å; C177-F181 HydrophobicContact CB-CB 4.03Å; C177-R197 HydrophobicContact CB-CG 4.12Å; C177-R197 PolarHBondContact O-NH1 2.77Å; C177-C199 WeakPolarHBondContact CA-SG 3.19Å; C177-C199 HydrophobicContact CB-CB 3.63Å; C177-C199 WeakPolarHBondContact CB-SG 3.01Å; C177-C199 WeakPolarHBondContact SG-CB 3.43Å; C177-C199 PolarHBondContact SG-N 3.11Å; C177-C199 VanDerWaalsContact SG-N 3.36Å; C177-C199 CovalentContact SG-SG 2.04Å; C177-C199 PolarHBondContact SG-SG 2.98Å
178	R	91.6	Very high	92.4	Very high	167 Å²	167	44.9 Å²	44.9	63%	0.63	23%	0.225	S	C	*	.			trans	-102.5	-21.8	-179.5	-69.4	-170.1	-59.2	-179.6	-0.9	114.8	H174 S176	H174-R178 PolarHBondContact CE1-NE 2.84Å; H174-R178 PolarHBondContact CE1-NH2 2.74Å; H174-R178 VanDerWaalsContact CE1-NH2 3.34Å; H174-R178 PolarHBondContact NE2-NE 2.67Å; H174-R178 PolarHBondContact NE2-NH2 2.77Å; S176-R178 PolarHBondContact O-N 3.09Å
179	Y	92	Very high	92.8	Very high	89 Å²	89	42.9 Å²	42.9	35%	0.349	22%	0.219	S	C	.	.	S	Bend	trans	-84.2	-119.7	172.2	-50.5	-35.3	0	0	0	106.9	E172 H174 F181 D221	E172-Y179 HydrophobicContact CG-CD2 4.11Å; E172-Y179 WeakPolarHBondContact OE2-CD2 3.38Å; H174-Y179 HydrophobicContact CB-CD2 3.78Å; H174-Y179 HydrophobicContact CB-CE2 4.09Å; H174-Y179 HydrophobicContact CB-CG 4.28Å; H174-Y179 AromaticContact CD2-CE2 3.57Å; H174-Y179 AromaticContact CD2-CZ 3.62Å; Y179-F181 WeakPolarHBondContact O-CD1 3.44Å; Y179-D221 WeakPolarHBondContact CB-OD2 3.34Å; Y179-D221 VanDerWaalsContact CD1-OD2 3.27Å; Y179-D221 WeakPolarHBondContact CD1-OD2 3.29Å
180	D	94.8	Very high	93.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.231	C	C	.	.	S	Bend	trans	-71.2	133.6	174.7	-52.1	-29	0	0	0	112.4	Y144 L171 E172 C199 V219 S220 D221	Y144-D180 HydrophobicContact CE2-CB 4.37Å; Y144-D180 WeakPolarHBondContact CE2-OD2 3.34Å; Y144-D180 VanDerWaalsContact CZ-OD2 3.24Å; Y144-D180 PolarHBondContact OH-OD2 2.95Å; L171-D180 HydrophobicContact CB-CB 4.17Å; E172-D180 HydrophobicContact CB-CB 4.28Å; E172-D180 WeakPolarHBondContact CB-OD2 3.29Å; E172-D180 PolarHBondContact N-OD2 2.87Å; D180-C199 WeakPolarHBondContact O-CB 3.49Å; D180-V219 WeakPolarHBondContact CA-O 3.5Å; D180-S220 WeakPolarHBondContact OD1-CA 3.22Å; D180-S220 WeakPolarHBondContact OD1-CB 3.49Å; D180-D221 PolarHBondContact OD1-N 2.91Å
181	F	95.8	Very high	93.3	Very high	19 Å²	19	51.9 Å²	51.9	8%	0.083	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	151.4	174.2	67.3	-93.3	0	0	0	113.6	C177 Y179 E183 R197 F198 L217 F218 V219	C177-F181 HydrophobicContact CB-CB 4.03Å; Y179-F181 WeakPolarHBondContact O-CD1 3.44Å; F181-E183 HydrophobicContact CD2-CB 4.01Å; F181-E183 HydrophobicContact CE2-CB 4.06Å; F181-R197 HydrophobicContact CB-CG 3.92Å; F181-R197 HydrophobicContact CD2-CG 3.76Å; F181-R197 HydrophobicContact CG-CG 4Å; F181-F198 WeakPolarHBondContact CA-O 3.01Å; F181-L217 HydrophobicContact CE2-CD2 4.26Å; F181-F218 WeakPolarHBondContact O-CA 3.27Å; F181-F218 WeakPolarHBondContact O-CD2 3.21Å; F181-V219 HydrophobicContact CD1-CB 4.45Å; F181-V219 HydrophobicContact CE1-CB 3.89Å; F181-V219 HydrophobicContact CE1-CG1 4.39Å; F181-V219 HydrophobicContact CE1-CG2 4.31Å; F181-V219 HydrophobicContact CE2-CB 4.4Å; F181-V219 HydrophobicContact CE2-CG2 4.21Å; F181-V219 HydrophobicContact CZ-CB 3.87Å; F181-V219 HydrophobicContact CZ-CG2 3.78Å; F181-V219 PolarHBondContact N-O 3.02Å; F181-V219 PolarHBondContact O-N 3.01Å
182	V	96.3	Very high	93.5	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	135.6	162.6	66	0	0	0	0	109.6	F166 L169 L171 R197 F198 I216 L217 F218 F229	F166-V182 HydrophobicContact CE1-CG1 3.78Å; F166-V182 HydrophobicContact CE1-CG2 4.14Å; F166-V182 HydrophobicContact CZ-CG1 3.88Å; F166-V182 HydrophobicContact CZ-CG2 4.03Å; L169-V182 HydrophobicContact CD1-CG1 3.74Å; L171-V182 HydrophobicContact CD1-CB 4.3Å; L171-V182 HydrophobicContact CD1-CG1 4.14Å; V182-R197 CarbonylContact O-C 3.31Å; V182-R197 WeakPolarHBondContact O-CA 3.34Å; V182-F198 HydrophobicContact CG1-CB 4.13Å; V182-F198 HydrophobicContact CG1-CD2 4.45Å; V182-F198 PolarHBondContact N-O 2.68Å; V182-F198 PolarHBondContact O-N 3.27Å; V182-I216 HydrophobicContact CG2-CG2 3.72Å; V182-L217 CarbonylContact C-O 3.48Å; V182-L217 WeakPolarHBondContact CA-O 3.22Å; V182-F218 HydrophobicContact CB-CD2 4.32Å; V182-F229 HydrophobicContact CB-CE1 4.37Å; V182-F229 HydrophobicContact CG2-CE1 4.05Å; V182-F229 HydrophobicContact CG2-CE2 4.48Å; V182-F229 HydrophobicContact CG2-CZ 4.03Å
183	E	95.9	Very high	93.7	Very high	6 Å²	6	61.5 Å²	61.5	3%	0.028	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	129.7	-175.7	-175.9	177	85.5	0	0	110.1	F181 R185 V194 G196 R197 I216 L217	F181-E183 HydrophobicContact CD2-CB 4.01Å; F181-E183 HydrophobicContact CE2-CB 4.06Å; E183-R185 HydrophobicContact CG-CG 4.5Å; E183-R185 IonicContact OE1-CZ 2.77Å; E183-R185 IonicContact OE1-NE 3.09Å; E183-R185 PolarHBondContact OE1-NE 2.94Å; E183-R185 IonicContact OE1-NH2 2.71Å; E183-R185 PolarHBondContact OE1-NH2 2.87Å; E183-R185 IonicContact OE2-NH2 3.14Å; E183-V194 HydrophobicContact CG-CG1 3.87Å; E183-V194 HydrophobicContact CG-CG2 4.17Å; E183-G196 WeakPolarHBondContact CA-O 3.33Å; E183-R197 HydrophobicContact CB-CB 4.44Å; E183-R197 HydrophobicContact CB-CG 4.41Å; E183-R197 HydrophobicContact CG-CB 4.32Å; E183-R197 IonicContact OE2-CZ 3.21Å; E183-R197 IonicContact OE2-NE 2.85Å; E183-R197 PolarHBondContact OE2-NE 3.09Å; E183-R197 IonicContact OE2-NH2 2.71Å; E183-R197 PolarHBondContact OE2-NH2 3.44Å; E183-I216 WeakPolarHBondContact O-CA 3.38Å; E183-L217 HydrophobicContact CB-CB 4.47Å; E183-L217 PolarHBondContact N-O 2.02Å; E183-L217 PolarHBondContact O-N 2.8Å
184	V	97.2	Very high	93.9	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	130	-178.3	-176.1	0	0	0	0	109.3	I164 F166 I195 G196 L207 L214 I216	I164-V184 HydrophobicContact CG2-CG1 4.29Å; F166-V184 HydrophobicContact CE2-CG2 4.03Å; F166-V184 HydrophobicContact CZ-CG2 4.05Å; V184-I195 HydrophobicContact CG1-CD1 4.4Å; V184-I195 PolarHBondContact O-N 2.95Å; V184-G196 PolarHBondContact N-O 3.26Å; V184-G196 PolarHBondContact O-N 2.84Å; V184-L207 HydrophobicContact CB-CD1 4.09Å; V184-L207 HydrophobicContact CG1-CD1 4.29Å; V184-L207 HydrophobicContact CG2-CD1 4.12Å; V184-L214 HydrophobicContact CG1-CD2 4.16Å; V184-I216 HydrophobicContact CG2-CG1 4.41Å
185	R	97.1	Very high	94	Very high	43 Å²	43	59.8 Å²	59.8	16%	0.162	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	141.6	-174.9	-66.2	175.1	174.5	-105.8	8.3	112	E183 G187 I190 S192 R193 V194 L214 H215	E183-R185 HydrophobicContact CG-CG 4.5Å; E183-R185 IonicContact OE1-CZ 2.77Å; E183-R185 IonicContact OE1-NE 3.09Å; E183-R185 PolarHBondContact OE1-NE 2.94Å; E183-R185 IonicContact OE1-NH2 2.71Å; E183-R185 PolarHBondContact OE1-NH2 2.87Å; E183-R185 IonicContact OE2-NH2 3.14Å; R185-G187 PolarHBondContact O-N 3.38Å; R185-I190 PolarHBondContact NH1-O 3.03Å; R185-S192 WeakPolarHBondContact CD-O 3.42Å; R185-S192 PolarHBondContact NH1-O 2.91Å; R185-R193 CarbonylContact C-O 3.57Å; R185-R193 WeakPolarHBondContact CA-O 3.44Å; R185-V194 HydrophobicContact CG-CG2 4.02Å; R185-V194 VanDerWaalsContact CZ-CG2 3.41Å; R185-L214 WeakPolarHBondContact O-CD2 3.42Å; R185-H215 HydrophobicContact CB-CB 4.31Å; R185-H215 PolarHBondContact N-O 2.96Å; R185-H215 PolarHBondContact O-N 3.02Å
186	D	95.6	Very high	94.3	Very high	34 Å²	34	55 Å²	55	18%	0.182	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	96.9	-178.5	-159.9	11	0	0	0	110.8	S192 R193 I195 S209 S210	D186-S192 WeakPolarHBondContact O-CB 3.46Å; D186-R193 PolarHBondContact N-O 2.9Å; D186-I195 HydrophobicContact CB-CD1 3.69Å; D186-I195 HydrophobicContact CB-CG1 3.72Å; D186-S209 WeakPolarHBondContact OD1-CA 3.16Å; D186-S209 WeakPolarHBondContact OD1-CB 3.46Å; D186-S210 VanDerWaalsContact CG-OG 3.26Å; D186-S210 PolarHBondContact OD1-N 3.22Å; D186-S210 PolarHBondContact OD1-OG 2.64Å; D186-S210 VanDerWaalsContact OD2-CB 3.22Å; D186-S210 WeakPolarHBondContact OD2-CB 3.4Å; D186-S210 PolarHBondContact OD2-N 3.45Å; D186-S210 PolarHBondContact OD2-OG 2.99Å
187	G	94.3	Very high	94.5	Very high	13 Å²	13	56.6 Å²	56.6	13%	0.134	27%	0.269	C	S	.	.	S	Bend	trans	139.3	-160.9	-171.3	0	0	0	0	0	112.3	R185 S192 T213 L214 H215	R185-G187 PolarHBondContact O-N 3.38Å; G187-S192 WeakPolarHBondContact CA-OG 3.36Å; G187-T213 VanDerWaalsContact C-OG1 3.3Å; G187-T213 WeakPolarHBondContact CA-OG1 3.31Å; G187-T213 PolarHBondContact N-O 3.14Å; G187-T213 CarbonylContact O-C 3.58Å; G187-T213 VanDerWaalsContact O-C 3.25Å; G187-T213 WeakPolarHBondContact O-CB 3.44Å; G187-T213 PolarHBondContact O-OG1 3.31Å; G187-L214 CarbonylContact O-C 3.54Å; G187-L214 WeakPolarHBondContact O-CA 3.16Å; G187-L214 PolarHBondContact O-N 3.16Å; G187-H215 PolarHBondContact O-N 3.17Å; G187-H215 VanDerWaalsContact O-N 3.1Å
188	D	92.4	Very high	94.6	Very high	101 Å²	101	57.6 Å²	57.6	54%	0.54	27%	0.272	S	S	.	.	S	Bend	trans	-112.1	-4.1	-168.4	62.7	-9.7	0	0	0	114.9	T153 S192 T213	T153-D188 HydrophobicContact CG2-CB 4.11Å; T153-D188 WeakPolarHBondContact CG2-O 3.5Å; T153-D188 PolarHBondContact OG1-O 2.86Å; D188-S192 PolarHBondContact N-OG 3.21Å; D188-T213 HydrophobicContact CB-CG2 4.26Å
189	S	92.3	Very high	94.8	Very high	41 Å²	41	50.1 Å²	50.1	29%	0.287	25%	0.245	S	C	.	.	S	Bend	trans	-144.2	170.8	-171	66.7	0	0	0	0	114.5	N191 S192	S189-N191 PolarHBondContact O-N 2.89Å; S189-N191 VanDerWaalsContact O-N 3.16Å; S189-S192 PolarHBondContact N-OG 2.92Å; S189-S192 WeakPolarHBondContact O-CB 3.17Å; S189-S192 PolarHBondContact O-N 2.78Å; S189-S192 PolarHBondContact O-OG 2.94Å; S189-S192 VanDerWaalsContact O-OG 3.13Å
190	I	91.8	Very high	94.7	Very high	57 Å²	57	46 Å²	46	29%	0.292	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-19.4	175.3	-168.5	57	0	0	0	113.8	R185 S192 L217	R185-I190 PolarHBondContact NH1-O 3.03Å; I190-S192 VanDerWaalsContact C-N 3.33Å; I190-L217 HydrophobicContact CD1-CD2 3.75Å
191	N	93.6	Very high	94.3	Very high	149 Å²	149	51.1 Å²	51.1	80%	0.797	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-10.2	177	-65.3	-32.5	0	0	0	112.8	S189	S189-N191 PolarHBondContact O-N 2.89Å; S189-N191 VanDerWaalsContact O-N 3.16Å
192	S	95.4	Very high	93.9	Very high	18 Å²	18	56.6 Å²	56.6	13%	0.126	29%	0.287	C	S	.	.	S	Bend	trans	-66.8	153.1	178.7	-62.3	0	0	0	0	112.6	R185 D186 G187 D188 S189 I190 V194	R185-S192 WeakPolarHBondContact CD-O 3.42Å; R185-S192 PolarHBondContact NH1-O 2.91Å; D186-S192 WeakPolarHBondContact O-CB 3.46Å; G187-S192 WeakPolarHBondContact CA-OG 3.36Å; D188-S192 PolarHBondContact N-OG 3.21Å; S189-S192 PolarHBondContact N-OG 2.92Å; S189-S192 WeakPolarHBondContact O-CB 3.17Å; S189-S192 PolarHBondContact O-N 2.78Å; S189-S192 PolarHBondContact O-OG 2.94Å; S189-S192 VanDerWaalsContact O-OG 3.13Å; I190-S192 VanDerWaalsContact C-N 3.33Å; S192-V194 PolarHBondContact O-N 2.88Å
193	R	96	Very high	93.4	Very high	203 Å²	203	64.5 Å²	64.5	77%	0.766	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.5	128.3	-175.5	176.5	-177.4	176.2	179.1	0.5	111.2	R185 D186 I195	R185-R193 CarbonylContact C-O 3.57Å; R185-R193 WeakPolarHBondContact CA-O 3.44Å; D186-R193 PolarHBondContact N-O 2.9Å; R193-I195 PolarHBondContact O-N 2.87Å
194	V	96	Very high	93.2	Very high	58 Å²	58	65.7 Å²	65.7	35%	0.352	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	125.1	172.5	-178	0	0	0	0	110.4	E183 R185 S192	E183-V194 HydrophobicContact CG-CG1 3.87Å; E183-V194 HydrophobicContact CG-CG2 4.17Å; R185-V194 HydrophobicContact CG-CG2 4.02Å; R185-V194 VanDerWaalsContact CZ-CG2 3.41Å; S192-V194 PolarHBondContact O-N 2.88Å
195	I	94.8	Very high	92.9	Very high	59 Å²	59	69.6 Å²	69.6	30%	0.303	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-39	170.1	-50.2	177.3	0	0	0	109.6	V184 D186 R193 L207 L214	V184-I195 HydrophobicContact CG1-CD1 4.4Å; V184-I195 PolarHBondContact O-N 2.95Å; D186-I195 HydrophobicContact CB-CD1 3.69Å; D186-I195 HydrophobicContact CB-CG1 3.72Å; R193-I195 PolarHBondContact O-N 2.87Å; I195-L207 HydrophobicContact CG2-CB 4.44Å; I195-L207 HydrophobicContact CG2-CD2 4.18Å; I195-L214 HydrophobicContact CD1-CD2 3.68Å
196	G	93.5	Very high	92.5	Very high	12 Å²	12	69.6 Å²	69.6	12%	0.124	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.8	157.7	175.6	0	0	0	0	0	113.8	E183 V184	E183-G196 WeakPolarHBondContact CA-O 3.33Å; V184-G196 PolarHBondContact N-O 3.26Å; V184-G196 PolarHBondContact O-N 2.84Å
197	R	95.4	Very high	92.4	Very high	102 Å²	102	69.2 Å²	69.2	39%	0.385	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	133.4	174.1	179.9	-173.4	-74.1	-150.1	-2.9	108.6	C177 F181 V182 E183	C177-R197 HydrophobicContact CB-CG 4.12Å; C177-R197 PolarHBondContact O-NH1 2.77Å; F181-R197 HydrophobicContact CB-CG 3.92Å; F181-R197 HydrophobicContact CD2-CG 3.76Å; F181-R197 HydrophobicContact CG-CG 4Å; V182-R197 CarbonylContact O-C 3.31Å; V182-R197 WeakPolarHBondContact O-CA 3.34Å; E183-R197 HydrophobicContact CB-CB 4.44Å; E183-R197 HydrophobicContact CB-CG 4.41Å; E183-R197 HydrophobicContact CG-CB 4.32Å; E183-R197 IonicContact OE2-CZ 3.21Å; E183-R197 IonicContact OE2-NE 2.85Å; E183-R197 PolarHBondContact OE2-NE 3.09Å; E183-R197 IonicContact OE2-NH2 2.71Å; E183-R197 PolarHBondContact OE2-NH2 3.44Å
198	F	96.1	Very high	92.4	Very high	39 Å²	39	73.6 Å²	73.6	17%	0.171	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	147.2	-169.6	-46.7	-74.2	0	0	0	111.9	F166 L169 F181 V182 P204 L207	F166-F198 HydrophobicContact CE2-CD2 4.38Å; L169-F198 HydrophobicContact CD2-CB 3.94Å; F181-F198 WeakPolarHBondContact CA-O 3.01Å; V182-F198 HydrophobicContact CG1-CB 4.13Å; V182-F198 HydrophobicContact CG1-CD2 4.45Å; V182-F198 PolarHBondContact N-O 2.68Å; V182-F198 PolarHBondContact O-N 3.27Å; F198-P204 HydrophobicContact CD1-CB 3.75Å; F198-P204 HydrophobicContact CD1-CG 3.86Å; F198-P204 HydrophobicContact CD2-CG 4.16Å; F198-P204 HydrophobicContact CE1-CB 3.42Å; F198-P204 VanDerWaalsContact CE1-CB 3.42Å; F198-P204 HydrophobicContact CE1-CG 3.87Å; F198-P204 HydrophobicContact CE2-CB 4.47Å; F198-P204 HydrophobicContact CE2-CG 4.16Å; F198-P204 HydrophobicContact CG-CB 4.4Å; F198-P204 HydrophobicContact CG-CG 4Å; F198-P204 HydrophobicContact CZ-CB 3.81Å; F198-P204 HydrophobicContact CZ-CG 4Å; F198-L207 HydrophobicContact CE2-CD1 3.67Å; F198-L207 HydrophobicContact CZ-CD1 3.83Å; F198-L207 HydrophobicContact CZ-CD2 4.39Å
199	C	93.9	Very high	92.4	Very high	10 Å²	10	69 Å²	69	7%	0.068	36%	0.357	C	S	.	.			trans	-157	171.2	179.3	65	0	0	0	0	110	E172 H174 C177 D180	E172-C199 WeakPolarHBondContact O-CB 3.3Å; H174-C199 PolarHBondContact O-SG 2.86Å; C177-C199 WeakPolarHBondContact CA-SG 3.19Å; C177-C199 HydrophobicContact CB-CB 3.63Å; C177-C199 WeakPolarHBondContact CB-SG 3.01Å; C177-C199 WeakPolarHBondContact SG-CB 3.43Å; C177-C199 PolarHBondContact SG-N 3.11Å; C177-C199 VanDerWaalsContact SG-N 3.36Å; C177-C199 CovalentContact SG-SG 2.04Å; C177-C199 PolarHBondContact SG-SG 2.98Å; D180-C199 WeakPolarHBondContact O-CB 3.49Å
200	G	90.3	Very high	92.4	Very high	2 Å²	2	71.7 Å²	71.7	2%	0.021	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	-156.1	-170.6	0	0	0	0	0	112.9	L169 L171 E172	L169-G200 WeakPolarHBondContact CD2-O 3.28Å; L169-G200 WeakPolarHBondContact CG-O 3.46Å; L171-G200 PolarHBondContact N-O 2.95Å; L171-G200 WeakPolarHBondContact O-CA 2.99Å; L171-G200 PolarHBondContact O-N 3.03Å; E172-G200 PolarHBondContact O-N 2.78Å
201	N	87.6	Confident	92.4	Very high	108 Å²	108	70.3 Å²	70.3	58%	0.578	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	2.1	-172.2	-59.1	-5.1	0	0	0	113.8	L169	L169-N201 WeakPolarHBondContact O-CA 3.39Å
202	N	86	Confident	92.4	Very high	133 Å²	133	64.4 Å²	64.4	71%	0.711	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-85.9	117.7	-176.4	-72	-23.5	0	0	0	110.5	L169	L169-N202 WeakPolarHBondContact CD2-O 3.39Å
203	R	86.8	Confident	92.4	Very high	167 Å²	167	64.4 Å²	64.4	63%	0.63	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-78.8	127.9	-178.5	-62.2	180	-63.4	-155.6	-3.1	111	M167	M167-R203 WeakPolarHBondContact O-CD 3.23Å; M167-R203 PolarHBondContact O-NH1 2.86Å
204	P	90.8	Very high	92.4	Very high	31 Å²	31	54.7 Å²	54.7	20%	0.201	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-71.9	166.3	173.7	31.6	-36.4	0	0	0	112.2	F166 F198	F166-P204 HydrophobicContact CB-CG 4.46Å; F166-P204 HydrophobicContact CD2-CG 3.8Å; F166-P204 HydrophobicContact CG-CG 4.41Å; F198-P204 HydrophobicContact CD1-CB 3.75Å; F198-P204 HydrophobicContact CD1-CG 3.86Å; F198-P204 HydrophobicContact CD2-CG 4.16Å; F198-P204 HydrophobicContact CE1-CB 3.42Å; F198-P204 VanDerWaalsContact CE1-CB 3.42Å; F198-P204 HydrophobicContact CE1-CG 3.87Å; F198-P204 HydrophobicContact CE2-CB 4.47Å; F198-P204 HydrophobicContact CE2-CG 4.16Å; F198-P204 HydrophobicContact CG-CB 4.4Å; F198-P204 HydrophobicContact CG-CG 4Å; F198-P204 HydrophobicContact CZ-CB 3.81Å; F198-P204 HydrophobicContact CZ-CG 4Å
205	A	90.6	Very high	92.5	Very high	82 Å²	82	52.2 Å²	52.2	68%	0.678	29%	0.291	S	S	*	.	P	Polyproline II helix	trans	-63.5	164.6	165.9	0	0	0	0	0	111.3	L207	A205-L207 PolarHBondContact O-N 3.23Å
206	A	90.2	Very high	92.5	Very high	43 Å²	43	49.5 Å²	49.5	36%	0.355	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-57.7	136.7	174.2	0	0	0	0	0	111.1	E163 R165	E163-A206 HydrophobicContact CG-CB 4.24Å; E163-A206 VanDerWaalsContact OE1-CB 3.28Å; E163-A206 WeakPolarHBondContact OE1-CB 3.38Å; R165-A206 HydrophobicContact CG-CB 3.67Å
207	L	93.6	Very high	92.6	Very high	25 Å²	25	49.2 Å²	49.2	13%	0.131	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	142.3	178.1	-54	174.2	0	0	0	109.2	E163 I164 V184 I195 F198 A205	E163-L207 CarbonylContact C-O 3.56Å; E163-L207 WeakPolarHBondContact CA-O 3.45Å; I164-L207 HydrophobicContact CG2-CB 3.84Å; I164-L207 PolarHBondContact N-O 2.71Å; I164-L207 PolarHBondContact O-N 3.13Å; V184-L207 HydrophobicContact CB-CD1 4.09Å; V184-L207 HydrophobicContact CG1-CD1 4.29Å; V184-L207 HydrophobicContact CG2-CD1 4.12Å; I195-L207 HydrophobicContact CG2-CB 4.44Å; I195-L207 HydrophobicContact CG2-CD2 4.18Å; F198-L207 HydrophobicContact CE2-CD1 3.67Å; F198-L207 HydrophobicContact CZ-CD1 3.83Å; F198-L207 HydrophobicContact CZ-CD2 4.39Å; A205-L207 PolarHBondContact O-N 3.23Å
208	Q	92.6	Very high	92.7	Very high	105 Å²	105	44.4 Å²	44.4	49%	0.491	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	136.9	179.7	-170.7	178.4	-7	0	0	110.1	T161 I162 N236	T161-Q208 PolarHBondContact OG1-NE2 2.92Å; T161-Q208 VanDerWaalsContact OG1-NE2 3.09Å; I162-Q208 WeakPolarHBondContact O-CA 3.31Å; Q208-N236 PolarHBondContact NE2-ND2 2.83Å
209	S	94.4	Very high	92.6	Very high	5 Å²	5	44 Å²	44	4%	0.035	26%	0.256	C	S	.	.			trans	-77.6	156.4	172.8	63.7	0	0	0	0	112.2	T161 I162 D186 G211	T161-S209 WeakPolarHBondContact CB-O 3.24Å; T161-S209 WeakPolarHBondContact CG2-O 3.41Å; I162-S209 PolarHBondContact N-OG 3.2Å; I162-S209 PolarHBondContact O-N 3.39Å; I162-S209 PolarHBondContact O-OG 3.47Å; D186-S209 WeakPolarHBondContact OD1-CA 3.16Å; D186-S209 WeakPolarHBondContact OD1-CB 3.46Å; S209-G211 WeakPolarHBondContact CB-O 3.04Å; S209-G211 PolarHBondContact OG-O 3.03Å
210	S	92.1	Very high	92.6	Very high	97 Å²	97	43.9 Å²	43.9	68%	0.678	26%	0.255	S	S	*	.	S	Bend	trans	-84.8	-23.5	168.1	63	0	0	0	0	113	D186	D186-S210 VanDerWaalsContact CG-OG 3.26Å; D186-S210 PolarHBondContact OD1-N 3.22Å; D186-S210 PolarHBondContact OD1-OG 2.64Å; D186-S210 VanDerWaalsContact OD2-CB 3.22Å; D186-S210 WeakPolarHBondContact OD2-CB 3.4Å; D186-S210 PolarHBondContact OD2-N 3.45Å; D186-S210 PolarHBondContact OD2-OG 2.99Å
211	G	91.5	Very high	92.5	Very high	28 Å²	28	45.8 Å²	45.8	29%	0.289	27%	0.265	S	S	.	.	S	Bend	trans	-120.8	-169.8	178	0	0	0	0	0	113.8	S209 T213	S209-G211 WeakPolarHBondContact CB-O 3.04Å; S209-G211 PolarHBondContact OG-O 3.03Å; G211-T213 PolarHBondContact O-N 2.7Å
212	N	93.1	Very high	92.5	Very high	25 Å²	25	41.9 Å²	41.9	13%	0.134	25%	0.249	C	C	.	.	S	Bend	trans	-85	18	-177.9	76.3	-70.7	0	0	0	114.6	Q155 V156 K158 F160	Q155-N212 WeakPolarHBondContact CA-O 3.45Å; V156-N212 HydrophobicContact CG2-CB 3.91Å; V156-N212 PolarHBondContact N-O 3.18Å; V156-N212 PolarHBondContact O-ND2 2.04Å; K158-N212 WeakPolarHBondContact CE-OD1 3.08Å; K158-N212 HydrophobicContact CG-CB 4.07Å; K158-N212 VanDerWaalsContact CG-CG 3.44Å; K158-N212 WeakPolarHBondContact CG-OD1 3.43Å; F160-N212 VanDerWaalsContact O-CA 3.24Å; F160-N212 WeakPolarHBondContact O-CA 3.48Å; F160-N212 VanDerWaalsContact O-CB 3.31Å; F160-N212 WeakPolarHBondContact O-CB 3.37Å
213	T	95.6	Very high	92.2	Very high	18 Å²	18	44.1 Å²	44.1	11%	0.11	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	141.2	-175.5	52.1	0	0	0	0	112.4	I154 Q155 G187 D188 G211	I154-T213 VanDerWaalsContact O-CA 3.23Å; I154-T213 WeakPolarHBondContact O-CA 3.33Å; Q155-T213 HydrophobicContact CB-CG2 4.17Å; Q155-T213 HydrophobicContact CG-CG2 4.06Å; G187-T213 VanDerWaalsContact C-OG1 3.3Å; G187-T213 WeakPolarHBondContact CA-OG1 3.31Å; G187-T213 PolarHBondContact N-O 3.14Å; G187-T213 CarbonylContact O-C 3.58Å; G187-T213 VanDerWaalsContact O-C 3.25Å; G187-T213 WeakPolarHBondContact O-CB 3.44Å; G187-T213 PolarHBondContact O-OG1 3.31Å; D188-T213 HydrophobicContact CB-CG2 4.26Å; G211-T213 PolarHBondContact O-N 2.7Å
214	L	96.3	Very high	91.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	141.2	167.9	-77.6	176.2	0	0	0	109.7	T153 I154 I162 I164 V184 R185 G187 I195 I216	T153-L214 CarbonylContact C-O 3.54Å; T153-L214 WeakPolarHBondContact CA-O 3.33Å; I154-L214 HydrophobicContact CB-CB 4.45Å; I154-L214 HydrophobicContact CD1-CB 4.48Å; I154-L214 PolarHBondContact N-O 2.87Å; I154-L214 PolarHBondContact O-N 3.49Å; I162-L214 HydrophobicContact CB-CD1 3.89Å; I162-L214 HydrophobicContact CB-CG 4.24Å; I162-L214 HydrophobicContact CD1-CB 4.44Å; I162-L214 HydrophobicContact CD1-CG 4.35Å; I162-L214 HydrophobicContact CG2-CD1 3.79Å; I164-L214 HydrophobicContact CB-CD1 4.17Å; I164-L214 HydrophobicContact CG2-CD1 3.83Å; V184-L214 HydrophobicContact CG1-CD2 4.16Å; R185-L214 WeakPolarHBondContact O-CD2 3.42Å; G187-L214 CarbonylContact O-C 3.54Å; G187-L214 WeakPolarHBondContact O-CA 3.16Å; G187-L214 PolarHBondContact O-N 3.16Å; I195-L214 HydrophobicContact CD1-CD2 3.68Å; L214-I216 HydrophobicContact CB-CD1 4.21Å
215	H	96.5	Very high	90.9	Very high	6 Å²	6	43.7 Å²	43.7	3%	0.028	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.6	173.1	-176.3	84.7	0	0	0	109.8	E151 W152 T153 R185 G187	E151-H215 IonicContact OE2-CE1 2.97Å; E151-H215 IonicContact OE2-NE2 2.89Å; W152-H215 CarbonylContact O-C 3.48Å; W152-H215 WeakPolarHBondContact O-CA 3.47Å; T153-H215 PolarHBondContact OG1-ND1 2.74Å; R185-H215 HydrophobicContact CB-CB 4.31Å; R185-H215 PolarHBondContact N-O 2.96Å; R185-H215 PolarHBondContact O-N 3.02Å; G187-H215 PolarHBondContact O-N 3.17Å; G187-H215 VanDerWaalsContact O-N 3.1Å
216	I	96.3	Very high	90.6	Very high	1 Å²	1	44 Å²	44	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	120.4	-174.7	-56.8	90.4	0	0	0	108.5	E151 W152 I154 I164 V182 E183 V184 L214	E151-I216 WeakPolarHBondContact CA-O 3.44Å; W152-I216 HydrophobicContact CB-CB 4.46Å; W152-I216 HydrophobicContact CE3-CB 4.41Å; W152-I216 HydrophobicContact CE3-CG2 4.24Å; W152-I216 PolarHBondContact N-O 2.04Å; W152-I216 PolarHBondContact O-N 2.98Å; I154-I216 HydrophobicContact CD1-CD1 3.49Å; I154-I216 VanDerWaalsContact CD1-CD1 3.49Å; I154-I216 HydrophobicContact CG1-CD1 3.64Å; I164-I216 HydrophobicContact CD1-CD1 4.5Å; I164-I216 HydrophobicContact CD1-CG1 4.31Å; V182-I216 HydrophobicContact CG2-CG2 3.72Å; E183-I216 WeakPolarHBondContact O-CA 3.38Å; V184-I216 HydrophobicContact CG2-CG1 4.41Å; L214-I216 HydrophobicContact CB-CD1 4.21Å
217	L	95.8	Very high	90.1	Very high	7 Å²	7	46.1 Å²	46.1	4%	0.037	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130.4	174.3	170.1	67.3	0	0	0	109.2	R149 C150 E151 F181 V182 E183 I190 V219	R149-L217 HydrophobicContact CG-CD1 4.07Å; C150-L217 WeakPolarHBondContact O-CA 3.36Å; E151-L217 HydrophobicContact CG-CD1 3.69Å; F181-L217 HydrophobicContact CE2-CD2 4.26Å; V182-L217 CarbonylContact C-O 3.48Å; V182-L217 WeakPolarHBondContact CA-O 3.22Å; E183-L217 HydrophobicContact CB-CB 4.47Å; E183-L217 PolarHBondContact N-O 2.02Å; E183-L217 PolarHBondContact O-N 2.8Å; I190-L217 HydrophobicContact CD1-CD2 3.75Å; L217-V219 HydrophobicContact CD1-CG2 3.82Å; L217-V219 HydrophobicContact CD2-CG2 4.03Å; L217-V219 HydrophobicContact CG-CG2 3.9Å
218	F	95.8	Very high	89.7	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	138.4	162.8	175	-101.9	0	0	0	110.2	L141 Y144 A148 R149 C150 W152 L171 F181 V182 F229	L141-F218 HydrophobicContact CD2-CB 4.41Å; L141-F218 HydrophobicContact CD2-CD1 3.31Å; L141-F218 HydrophobicContact CD2-CD2 4.25Å; L141-F218 HydrophobicContact CD2-CE1 3.52Å; L141-F218 HydrophobicContact CD2-CE2 4.45Å; L141-F218 HydrophobicContact CD2-CG 3.71Å; L141-F218 HydrophobicContact CD2-CZ 4.1Å; Y144-F218 HydrophobicContact CD1-CZ 4Å; Y144-F218 HydrophobicContact CD2-CE1 4.06Å; Y144-F218 AromaticContact CD2-CZ 3.71Å; Y144-F218 HydrophobicContact CD2-CZ 3.71Å; Y144-F218 HydrophobicContact CE1-CZ 4.31Å; Y144-F218 HydrophobicContact CE2-CZ 4.02Å; Y144-F218 AromaticContact CG-CE1 3.95Å; Y144-F218 HydrophobicContact CG-CE1 3.95Å; Y144-F218 AromaticContact CG-CZ 3.7Å; Y144-F218 HydrophobicContact CG-CZ 3.7Å; A148-F218 HydrophobicContact CB-CE1 4.12Å; R149-F218 WeakPolarHBondContact CA-O 3.22Å; C150-F218 HydrophobicContact CB-CB 4.17Å; C150-F218 PolarHBondContact N-O 3.28Å; C150-F218 PolarHBondContact O-N 2.69Å; W152-F218 HydrophobicContact CH2-CB 4.47Å; W152-F218 HydrophobicContact CZ3-CB 3.94Å; L171-F218 HydrophobicContact CD1-CD2 4.41Å; L171-F218 HydrophobicContact CD1-CE2 3.98Å; L171-F218 HydrophobicContact CD2-CD2 4.4Å; L171-F218 HydrophobicContact CD2-CE2 3.48Å; L171-F218 VanDerWaalsContact CD2-CE2 3.48Å; L171-F218 HydrophobicContact CD2-CZ 4.06Å; L171-F218 HydrophobicContact CG-CE2 4.37Å; F181-F218 WeakPolarHBondContact O-CA 3.27Å; F181-F218 WeakPolarHBondContact O-CD2 3.21Å; V182-F218 HydrophobicContact CB-CD2 4.32Å; F218-F229 HydrophobicContact CB-CE1 4.09Å; F218-F229 HydrophobicContact CD2-CD1 4.39Å; F218-F229 HydrophobicContact CD2-CE1 4.03Å; F218-F229 HydrophobicContact CG-CE1 4.12Å
219	V	94.6	Very high	89.5	Confident	32 Å²	32	40.2 Å²	40.2	19%	0.194	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	137	173.4	-177.2	0	0	0	0	108.9	A148 D180 F181 L217	A148-V219 WeakPolarHBondContact O-CA 3.19Å; D180-V219 WeakPolarHBondContact CA-O 3.5Å; F181-V219 HydrophobicContact CD1-CB 4.45Å; F181-V219 HydrophobicContact CE1-CB 3.89Å; F181-V219 HydrophobicContact CE1-CG1 4.39Å; F181-V219 HydrophobicContact CE1-CG2 4.31Å; F181-V219 HydrophobicContact CE2-CB 4.4Å; F181-V219 HydrophobicContact CE2-CG2 4.21Å; F181-V219 HydrophobicContact CZ-CB 3.87Å; F181-V219 HydrophobicContact CZ-CG2 3.78Å; F181-V219 PolarHBondContact N-O 3.02Å; F181-V219 PolarHBondContact O-N 3.01Å; L217-V219 HydrophobicContact CD1-CG2 3.82Å; L217-V219 HydrophobicContact CD2-CG2 4.03Å; L217-V219 HydrophobicContact CG-CG2 3.9Å
220	S	93.3	Very high	89.2	Confident	6 Å²	6	43.1 Å²	43.1	4%	0.042	23%	0.227	C	C	.	.			trans	-117.3	160.8	165.2	63	0	0	0	0	112.4	P145 N147 A148 D180	P145-S220 PolarHBondContact O-OG 2.78Å; N147-S220 WeakPolarHBondContact CA-O 3.15Å; N147-S220 PolarHBondContact N-OG 2.86Å; A148-S220 VanDerWaalsContact CB-OG 3.3Å; A148-S220 WeakPolarHBondContact CB-OG 3.21Å; A148-S220 PolarHBondContact N-OG 2.99Å; A148-S220 PolarHBondContact O-N 3.13Å; D180-S220 WeakPolarHBondContact OD1-CA 3.22Å; D180-S220 WeakPolarHBondContact OD1-CB 3.49Å
221	D	90	Very high	88.9	Confident	43 Å²	43	38.6 Å²	38.6	23%	0.23	20%	0.195	C	C	.	.			trans	-99.6	-167.5	178.9	94.8	16.8	0	0	0	113.9	N146 N147 Y179 D180 Y223	N146-D221 CarbonylContact C-O 3.58Å; N146-D221 VanDerWaalsContact CA-O 3.25Å; N146-D221 WeakPolarHBondContact CA-O 3.31Å; N146-D221 WeakPolarHBondContact CB-O 3.42Å; N147-D221 PolarHBondContact N-O 2.7Å; Y179-D221 WeakPolarHBondContact CB-OD2 3.34Å; Y179-D221 VanDerWaalsContact CD1-OD2 3.27Å; Y179-D221 WeakPolarHBondContact CD1-OD2 3.29Å; D180-D221 PolarHBondContact OD1-N 2.91Å; D221-Y223 VanDerWaalsContact C-N 3.34Å; D221-Y223 PolarHBondContact O-N 3.33Å; D221-Y223 PolarHBondContact OD1-N 2.94Å
222	G	85.9	Confident	88.8	Confident	25 Å²	25	39.6 Å²	39.6	26%	0.258	20%	0.195	S	C	.	.	S	Bend	trans	-73.3	-10.1	-177	0	0	0	0	0	116.4	N146	N146-G222 PolarHBondContact ND2-O 2.88Å
223	Y	79.9	Confident	88.7	Confident	180 Å²	180	38.6 Å²	38.6	71%	0.706	19%	0.19	S	C	*	.	S	Bend	trans	-146	154.5	-171.6	-63	-85.5	0	0	0	113.7	D221	D221-Y223 VanDerWaalsContact C-N 3.34Å; D221-Y223 PolarHBondContact O-N 3.33Å; D221-Y223 PolarHBondContact OD1-N 2.94Å
224	K	73.2	Confident	88.4	Confident	139 Å²	139	40.9 Å²	40.9	60%	0.604	20%	0.199	S	C	*	.			trans	54.1	84.4	171.3	-59.6	169.3	179.1	175.4	0	117.1	E172 F226	E172-K224 WeakPolarHBondContact OE1-CD 3.42Å; E172-K224 IonicContact OE1-NZ 2.73Å; E172-K224 PolarHBondContact OE1-NZ 2.76Å; K224-F226 HydrophobicContact CB-CE2 4.39Å; K224-F226 WeakPolarHBondContact O-CD2 3.39Å; K224-F226 WeakPolarHBondContact O-CE2 3.35Å
225	N	78.5	Confident	88.1	Confident	51 Å²	51	41.2 Å²	41.2	27%	0.273	20%	0.201	S	C	.	.			trans	-94.6	160.4	178.1	-40	-3.2	0	0	0	111.7	Y144 P145 N146	Y144-N225 HydrophobicContact CD2-CB 3.92Å; Y144-N225 HydrophobicContact CE2-CB 3.65Å; Y144-N225 VanDerWaalsContact O-CB 3.27Å; Y144-N225 WeakPolarHBondContact O-CB 3.45Å; Y144-N225 PolarHBondContact O-ND2 2.03Å; P145-N225 VanDerWaalsContact CA-ND2 3.29Å; P145-N225 WeakPolarHBondContact CA-ND2 3.03Å; N146-N225 PolarHBondContact N-ND2 2.88Å; N146-N225 VanDerWaalsContact N-ND2 3.13Å; N146-N225 PolarHBondContact OD1-ND2 3.27Å; N146-N225 PolarHBondContact OD1-OD1 3.01Å
226	F	83.2	Confident	87.6	Confident	88 Å²	88	44.5 Å²	44.5	39%	0.386	22%	0.219	S	C	.	.			trans	-133.2	-171	-178.5	-67.4	-90.4	0	0	0	110.8	Y144 S170 E172 K224 G228	Y144-F226 WeakPolarHBondContact CD1-O 3.36Å; Y144-F226 HydrophobicContact CE1-CB 4.15Å; Y144-F226 WeakPolarHBondContact CE1-O 3.4Å; Y144-F226 VanDerWaalsContact CZ-N 3.3Å; Y144-F226 PolarHBondContact OH-N 2.83Å; Y144-F226 VanDerWaalsContact OH-N 3.16Å; S170-F226 WeakPolarHBondContact O-CB 3.38Å; E172-F226 HydrophobicContact CB-CD2 4.21Å; E172-F226 HydrophobicContact CB-CE2 3.87Å; E172-F226 HydrophobicContact CG-CE2 4.18Å; K224-F226 HydrophobicContact CB-CE2 4.39Å; K224-F226 WeakPolarHBondContact O-CD2 3.39Å; K224-F226 WeakPolarHBondContact O-CE2 3.35Å; F226-G228 PolarHBondContact O-N 3.36Å
227	D	79.3	Confident	87	Confident	88 Å²	88	45 Å²	45	47%	0.471	22%	0.223	S	C	.	.			trans	-69	-18.9	-171	-45.5	-62.5	0	0	0	113.9	E142 S143 M168 S170	E142-D227 CarbonylContact C-O 3.58Å; E142-D227 WeakPolarHBondContact CA-O 3.48Å; S143-D227 PolarHBondContact N-O 3.43Å; M168-D227 HydrophobicContact CE-CB 3.51Å; S170-D227 PolarHBondContact OG-OD2 3.23Å
228	G	86.8	Confident	86.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	96.2	-135	179.4	0	0	0	0	0	113.4	L141 S170 F226	L141-G228 CarbonylContact O-C 3.6Å; L141-G228 VanDerWaalsContact O-CA 3.31Å; L141-G228 WeakPolarHBondContact O-CA 3.15Å; S170-G228 CarbonylContact C-O 3.57Å; S170-G228 WeakPolarHBondContact CA-O 3.45Å; S170-G228 PolarHBondContact N-O 2.92Å; S170-G228 WeakPolarHBondContact O-CA 3.45Å; S170-G228 PolarHBondContact O-N 2.7Å; F226-G228 PolarHBondContact O-N 3.36Å
229	F	87.8	Confident	85.6	Confident	6 Å²	6	47.3 Å²	47.3	3%	0.026	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	155.1	-175.7	71.1	-94.6	0	0	0	114.5	L139 L141 W152 F166 M168 L169 V182 F218 A231	L139-F229 HydrophobicContact CB-CE2 4.32Å; L141-F229 HydrophobicContact CB-CD1 4.02Å; L141-F229 HydrophobicContact CB-CE1 3.8Å; L141-F229 HydrophobicContact CB-CZ 4.19Å; L141-F229 HydrophobicContact CD2-CD1 4.24Å; L141-F229 HydrophobicContact CD2-CE1 3.8Å; L141-F229 HydrophobicContact CG-CE1 4.46Å; L141-F229 PolarHBondContact N-O 3.23Å; L141-F229 PolarHBondContact O-N 3.12Å; W152-F229 HydrophobicContact CH2-CE1 4.41Å; W152-F229 AromaticContact CH2-CZ 3.96Å; W152-F229 HydrophobicContact CH2-CZ 3.96Å; W152-F229 HydrophobicContact CZ3-CE1 4.38Å; W152-F229 AromaticContact CZ3-CZ 3.79Å; W152-F229 HydrophobicContact CZ3-CZ 3.79Å; F166-F229 HydrophobicContact CD1-CB 4.44Å; F166-F229 HydrophobicContact CD1-CD2 4.2Å; F166-F229 AromaticContact CE1-CD2 3.78Å; F166-F229 HydrophobicContact CE1-CD2 3.78Å; F166-F229 HydrophobicContact CE1-CE2 4.23Å; F166-F229 HydrophobicContact CE1-CG 4.26Å; M168-F229 WeakPolarHBondContact O-CA 3.25Å; M168-F229 WeakPolarHBondContact O-CB 3.15Å; L169-F229 HydrophobicContact CD1-CB 3.95Å; V182-F229 HydrophobicContact CB-CE1 4.37Å; V182-F229 HydrophobicContact CG2-CE1 4.05Å; V182-F229 HydrophobicContact CG2-CE2 4.48Å; V182-F229 HydrophobicContact CG2-CZ 4.03Å; F218-F229 HydrophobicContact CB-CE1 4.09Å; F218-F229 HydrophobicContact CD2-CD1 4.39Å; F218-F229 HydrophobicContact CD2-CE1 4.03Å; F218-F229 HydrophobicContact CG-CE1 4.12Å; F229-A231 HydrophobicContact CD2-CB 4.46Å
230	F	87	Confident	84.8	Confident	66 Å²	66	47.9 Å²	47.9	29%	0.289	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	121.2	170.1	-177.3	-82.6	0	0	0	109.5	H138 L139 V140 M167 M168 T232	H138-F230 HydrophobicContact CB-CE1 4.45Å; H138-F230 HydrophobicContact CB-CE2 4.1Å; H138-F230 HydrophobicContact CB-CZ 3.83Å; L139-F230 WeakPolarHBondContact O-CA 3.34Å; V140-F230 HydrophobicContact CB-CD2 4.35Å; V140-F230 HydrophobicContact CG1-CD2 4.19Å; V140-F230 HydrophobicContact CG2-CD2 3.59Å; V140-F230 HydrophobicContact CG2-CE2 3.75Å; M167-F230 HydrophobicContact CB-CD1 3.84Å; M167-F230 HydrophobicContact CB-CE1 4.39Å; M167-F230 HydrophobicContact CG-CD1 3.88Å; M167-F230 HydrophobicContact CG-CE1 4.03Å; M167-F230 PolarHBondContact N-O 2.93Å; M168-F230 HydrophobicContact CB-CB 4.11Å; M168-F230 PolarHBondContact N-O 3.32Å; M168-F230 PolarHBondContact O-N 3.41Å; F230-T232 HydrophobicContact CE1-CG2 3.66Å; F230-T232 HydrophobicContact CZ-CG2 4.26Å
231	A	86.7	Confident	84	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.008	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	138	177	0	0	0	0	0	111.1	H138 L139 I164 R165 F166 F229	H138-A231 CarbonylContact C-O 3.1Å; H138-A231 WeakPolarHBondContact CA-O 3.09Å; H138-A231 WeakPolarHBondContact CB-O 3.04Å; L139-A231 PolarHBondContact N-O 3.38Å; L139-A231 PolarHBondContact O-N 2.95Å; I164-A231 HydrophobicContact CD1-CB 4.29Å; I164-A231 HydrophobicContact CG1-CB 4.22Å; R165-A231 CarbonylContact O-C 3.44Å; R165-A231 WeakPolarHBondContact O-CA 3.39Å; F166-A231 HydrophobicContact CD1-CB 3.85Å; F166-A231 HydrophobicContact CE1-CB 3.97Å; F166-A231 HydrophobicContact CG-CB 4.24Å; F166-A231 HydrophobicContact CZ-CB 4.45Å; F229-A231 HydrophobicContact CD2-CB 4.46Å
232	T	89.1	Confident	83.6	Confident	49 Å²	49	54.1 Å²	54.1	30%	0.301	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	147.1	168.1	53.9	0	0	0	0	109.9	G137 H138 I164 R165 M167 F230	G137-T232 WeakPolarHBondContact O-CA 3.49Å; H138-T232 HydrophobicContact CB-CG2 4.36Å; I164-T232 CarbonylContact C-O 3.43Å; I164-T232 WeakPolarHBondContact CA-O 3.28Å; I164-T232 WeakPolarHBondContact CG1-O 3.35Å; R165-T232 PolarHBondContact N-O 3.45Å; R165-T232 PolarHBondContact O-N 3.39Å; M167-T232 HydrophobicContact CG-CG2 4.32Å; F230-T232 HydrophobicContact CE1-CG2 3.66Å; F230-T232 HydrophobicContact CZ-CG2 4.26Å
233	F	91.3	Very high	83.5	Confident	5 Å²	5	53.8 Å²	53.8	2%	0.022	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	145.8	170.5	70.8	-91	0	0	0	110.6	I132 K134 Q136 G137 L139 I154 I162 E163 I164	I132-F233 HydrophobicContact CG2-CE1 4.18Å; I132-F233 HydrophobicContact CG2-CZ 3.65Å; K134-F233 HydrophobicContact CB-CZ 4.43Å; Q136-F233 WeakPolarHBondContact CA-O 3.5Å; G137-F233 VanDerWaalsContact C-CE1 3.44Å; G137-F233 PolarHBondContact N-O 2.86Å; G137-F233 PolarHBondContact O-N 3.24Å; L139-F233 HydrophobicContact CD1-CD1 3.7Å; L139-F233 HydrophobicContact CD1-CE1 4.2Å; I154-F233 HydrophobicContact CD1-CB 3.99Å; I154-F233 HydrophobicContact CD1-CD1 3.88Å; I154-F233 HydrophobicContact CD1-CD2 4.4Å; I154-F233 HydrophobicContact CD1-CE1 4.49Å; I154-F233 HydrophobicContact CD1-CG 3.83Å; I154-F233 HydrophobicContact CG2-CD1 4.49Å; I154-F233 HydrophobicContact CG2-CD2 3.58Å; I154-F233 HydrophobicContact CG2-CE1 4.47Å; I154-F233 HydrophobicContact CG2-CE2 3.56Å; I154-F233 HydrophobicContact CG2-CG 4.08Å; I154-F233 HydrophobicContact CG2-CZ 4.03Å; I162-F233 HydrophobicContact CG2-CB 4.11Å; I162-F233 HydrophobicContact CG2-CD2 4.4Å; E163-F233 CarbonylContact O-C 3.49Å; E163-F233 VanDerWaalsContact O-CA 3.22Å; E163-F233 WeakPolarHBondContact O-CA 3.24Å; I164-F233 HydrophobicContact CB-CB 4.35Å; I164-F233 HydrophobicContact CG1-CB 4.29Å
234	Q	89.8	Confident	83.9	Confident	65 Å²	65	46 Å²	46	30%	0.304	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	144.8	178	64.2	-175.5	12.2	0	0	111.2	Q136 E163	Q136-Q234 HydrophobicContact CB-CB 4.45Å; E163-Q234 HydrophobicContact CB-CG 4.09Å; E163-Q234 PolarHBondContact N-O 3.01Å; E163-Q234 PolarHBondContact O-N 2.87Å; E163-Q234 PolarHBondContact OE2-NE2 3.26Å
235	E	88.9	Confident	84.2	Confident	7 Å²	7	43 Å²	43	3%	0.033	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	128.7	166.4	-177.8	-168.7	103.4	0	0	109.5	R135 V156 F160 S237 S240	R135-E235 HydrophobicContact CB-CB 4.26Å; R135-E235 WeakPolarHBondContact CB-OE2 3.05Å; R135-E235 VanDerWaalsContact CD-OE2 3.25Å; R135-E235 WeakPolarHBondContact CD-OE2 3.05Å; R135-E235 WeakPolarHBondContact CG-OE2 3.34Å; R135-E235 IonicContact NE-OE2 3.52Å; R135-E235 WeakPolarHBondContact O-CB 3.37Å; R135-E235 PolarHBondContact O-N 3.27Å; V156-E235 HydrophobicContact CB-CG 4.42Å; V156-E235 HydrophobicContact CG1-CB 4.16Å; F160-E235 HydrophobicContact CB-CG 3.43Å; F160-E235 VanDerWaalsContact CB-CG 3.43Å; F160-E235 HydrophobicContact CD2-CG 4.05Å; F160-E235 HydrophobicContact CG-CG 3.76Å; E235-S237 PolarHBondContact O-N 3.1Å; E235-S237 VanDerWaalsContact O-N 3.09Å; E235-S237 WeakPolarHBondContact OE1-CB 3.42Å; E235-S237 PolarHBondContact OE1-OG 3.31Å; E235-S240 WeakPolarHBondContact O-CB 3.37Å
236	N	86	Confident	84.4	Confident	75 Å²	75	44.5 Å²	44.5	40%	0.401	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	84.8	174.7	-169.1	6.5	0	0	0	109.8	T161 Q208	T161-N236 PolarHBondContact O-N 2.04Å; Q208-N236 PolarHBondContact NE2-ND2 2.83Å
237	S	83.3	Confident	84.2	Confident	13 Å²	13	47.3 Å²	47.3	9%	0.091	27%	0.272	C	S	.	.	S	Bend	trans	-135	170.8	176.5	68.4	0	0	0	0	111.7	E235 C239 S240	E235-S237 PolarHBondContact O-N 3.1Å; E235-S237 VanDerWaalsContact O-N 3.09Å; E235-S237 WeakPolarHBondContact OE1-CB 3.42Å; E235-S237 PolarHBondContact OE1-OG 3.31Å; S237-C239 PolarHBondContact O-N 3.02Å; S237-C239 VanDerWaalsContact O-N 3.11Å; S237-S240 WeakPolarHBondContact O-CB 3.02Å; S237-S240 PolarHBondContact O-N 3.44Å; S237-S240 PolarHBondContact O-OG 2.85Å
238	A	79.6	Confident	84.4	Confident	31 Å²	31	43.7 Å²	43.7	26%	0.256	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-15.8	-173.9	0	0	0	0	0	114.8	L252 Y256 Y258	A238-L252 HydrophobicContact CB-CD2 4.1Å; A238-Y256 VanDerWaalsContact CB-O 3.31Å; A238-Y256 WeakPolarHBondContact CB-O 3.49Å; A238-Y258 HydrophobicContact CB-CD1 4.04Å
239	C	82.4	Confident	84.3	Confident	23 Å²	23	47.8 Å²	47.8	16%	0.155	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-5.8	173.1	-73.1	0	0	0	0	114	S237 S241 S242 C250 L252	S237-C239 PolarHBondContact O-N 3.02Å; S237-C239 VanDerWaalsContact O-N 3.11Å; C239-S241 PolarHBondContact O-N 3.3Å; C239-S242 PolarHBondContact O-N 3.49Å; C239-C250 WeakPolarHBondContact CA-SG 3.31Å; C239-C250 HydrophobicContact CB-CB 3.81Å; C239-C250 WeakPolarHBondContact CB-SG 3.49Å; C239-C250 VanDerWaalsContact SG-C 3.59Å; C239-C250 WeakPolarHBondContact SG-CB 3.44Å; C239-C250 CovalentContact SG-SG 2.04Å; C239-C250 PolarHBondContact SG-SG 3.05Å; C239-L252 HydrophobicContact CB-CD2 4.12Å; C239-L252 HydrophobicContact CB-CG 4.32Å
240	S	78.2	Confident	84.2	Confident	45 Å²	45	49.1 Å²	49.1	32%	0.315	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-28	-176.5	58.6	0	0	0	0	114.2	E235 S237 S242	E235-S240 WeakPolarHBondContact O-CB 3.37Å; S237-S240 WeakPolarHBondContact O-CB 3.02Å; S237-S240 PolarHBondContact O-N 3.44Å; S237-S240 PolarHBondContact O-OG 2.85Å; S240-S242 VanDerWaalsContact C-N 3.31Å; S240-S242 PolarHBondContact O-N 3.23Å
241	S	77	Confident	84	Confident	90 Å²	90	49.2 Å²	49.2	63%	0.629	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	6.8	177.8	62.1	0	0	0	0	114.4	C239	C239-S241 PolarHBondContact O-N 3.3Å
242	S	80.9	Confident	83.7	Confident	90 Å²	90	50.8 Å²	50.8	63%	0.629	30%	0.302	S	S	*	.			trans	47.1	60.4	-173	-63.7	0	0	0	0	112.9	C239 S240 C244	C239-S242 PolarHBondContact O-N 3.49Å; S240-S242 VanDerWaalsContact C-N 3.31Å; S240-S242 PolarHBondContact O-N 3.23Å; S242-C244 PolarHBondContact O-N 3.46Å; S242-C244 VanDerWaalsContact O-N 3.16Å
243	P	84.5	Confident	83.1	Confident	17 Å²	17	51 Å²	51	11%	0.11	30%	0.301	C	S	.	.			trans	-72.8	-8.4	-168	30.4	-38	0	0	0	115.3	Y258 R270	P243-Y258 HydrophobicContact CB-CD2 4.3Å; P243-Y258 HydrophobicContact CB-CE1 4.16Å; P243-Y258 HydrophobicContact CB-CE2 3.6Å; P243-Y258 HydrophobicContact CG-CD1 4.23Å; P243-Y258 HydrophobicContact CG-CD2 3.61Å; P243-Y258 HydrophobicContact CG-CE1 4.07Å; P243-Y258 HydrophobicContact CG-CE2 3.44Å; P243-Y258 VanDerWaalsContact CG-CE2 3.44Å; P243-Y258 HydrophobicContact CG-CG 4.02Å; P243-R270 WeakPolarHBondContact O-CD 3.21Å
244	C	87.6	Confident	82.1	Confident	17 Å²	17	57.9 Å²	57.9	12%	0.115	34%	0.344	C	S	.	.			trans	-90	132.4	179.5	-52.6	0	0	0	0	110.9	S242 G248 C250 C260	S242-C244 PolarHBondContact O-N 3.46Å; S242-C244 VanDerWaalsContact O-N 3.16Å; C244-G248 WeakPolarHBondContact CB-O 3.05Å; C244-C250 VanDerWaalsContact SG-CA 3.5Å; C244-C250 VanDerWaalsContact SG-CB 3.57Å; C244-C260 WeakPolarHBondContact CA-SG 3.28Å; C244-C260 HydrophobicContact CB-CB 3.81Å; C244-C260 WeakPolarHBondContact CB-SG 3.45Å; C244-C260 VanDerWaalsContact SG-CA 3.55Å; C244-C260 WeakPolarHBondContact SG-CB 3.45Å; C244-C260 CovalentContact SG-SG 2.03Å; C244-C260 PolarHBondContact SG-SG 3.21Å
245	L	81.3	Confident	80.9	Confident	75 Å²	75	58.7 Å²	58.7	39%	0.393	36%	0.357	S	S	.	.	S	Bend	trans	-90.1	168	178.5	-55.7	175.9	0	0	0	111	D247 G248 R270 C271 E272	L245-D247 VanDerWaalsContact C-N 3.32Å; L245-D247 PolarHBondContact O-N 3.38Å; L245-G248 PolarHBondContact O-N 3.49Å; L245-R270 VanDerWaalsContact CB-O 3.32Å; L245-R270 WeakPolarHBondContact CB-O 3.43Å; L245-R270 PolarHBondContact N-O 2.82Å; L245-C271 WeakPolarHBondContact O-CB 3.37Å; L245-E272 HydrophobicContact CD1-CB 4.08Å
246	H	80.9	Confident	79.9	Confident	84 Å²	84	64.9 Å²	64.9	39%	0.389	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	47.4	173.9	-58.9	-74.5	0	0	0	113.8	G248 Y266 C271	H246-G248 PolarHBondContact O-N 3.02Å; H246-G248 VanDerWaalsContact O-N 3.1Å; H246-Y266 HydrophobicContact CB-CD1 3.59Å; H246-Y266 HydrophobicContact CB-CD2 4.32Å; H246-Y266 HydrophobicContact CB-CE1 3.57Å; H246-Y266 HydrophobicContact CB-CE2 4.3Å; H246-Y266 HydrophobicContact CB-CG 3.99Å; H246-Y266 AromaticContact CD2-CD1 3.9Å; H246-Y266 AromaticContact CD2-CE1 4Å; H246-Y266 AromaticContact CG-CD1 3.61Å; H246-Y266 AromaticContact CG-CE1 3.4Å; H246-Y266 VanDerWaalsContact CG-CE1 3.4Å; H246-Y266 AromaticContact ND1-CE1 3.52Å; H246-C271 PolarHBondContact CD2-O 3.02Å; H246-C271 VanDerWaalsContact CD2-O 3.31Å
247	D	80.6	Confident	79.5	Confident	146 Å²	146	64.7 Å²	64.7	78%	0.781	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	25.5	-178.5	-58	-40.8	0	0	0	114.7	L245 L263	L245-D247 VanDerWaalsContact C-N 3.32Å; L245-D247 PolarHBondContact O-N 3.38Å; D247-L263 HydrophobicContact CB-CD1 3.79Å
248	G	83.4	Confident	79.6	Confident	13 Å²	13	68.1 Å²	68.1	13%	0.134	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-62.6	140.6	170.4	0	0	0	0	0	112.4	C244 L245 H246 A261	C244-G248 WeakPolarHBondContact CB-O 3.05Å; L245-G248 PolarHBondContact O-N 3.49Å; H246-G248 PolarHBondContact O-N 3.02Å; H246-G248 VanDerWaalsContact O-N 3.1Å; G248-A261 CarbonylContact C-O 3.46Å; G248-A261 WeakPolarHBondContact CA-O 3Å
249	T	84.7	Confident	80	Confident	86 Å²	86	70.7 Å²	70.7	53%	0.528	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	122.7	-178.9	-60.1	0	0	0	0	110.7	I251 C260 A261	T249-I251 HydrophobicContact CG2-CG1 4.35Å; T249-C260 WeakPolarHBondContact O-CA 3.43Å; T249-A261 PolarHBondContact N-O 3.39Å; T249-A261 PolarHBondContact O-N 3.28Å
250	C	85.4	Confident	80.3	Confident	34 Å²	34	70.5 Å²	70.5	23%	0.23	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	124	175.3	-166.3	0	0	0	0	111	C239 C244	C239-C250 WeakPolarHBondContact CA-SG 3.31Å; C239-C250 HydrophobicContact CB-CB 3.81Å; C239-C250 WeakPolarHBondContact CB-SG 3.49Å; C239-C250 VanDerWaalsContact SG-C 3.59Å; C239-C250 WeakPolarHBondContact SG-CB 3.44Å; C239-C250 CovalentContact SG-SG 2.04Å; C239-C250 PolarHBondContact SG-SG 3.05Å; C244-C250 VanDerWaalsContact SG-CA 3.5Å; C244-C250 VanDerWaalsContact SG-CB 3.57Å
251	I	82.7	Confident	80.7	Confident	67 Å²	67	70.4 Å²	70.4	34%	0.344	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	126.5	-179.6	-56.6	175.2	0	0	0	107.8	T249 Y258 H259 A261	T249-I251 HydrophobicContact CG2-CG1 4.35Å; I251-Y258 CarbonylContact O-C 3.53Å; I251-Y258 VanDerWaalsContact O-CA 3.24Å; I251-Y258 WeakPolarHBondContact O-CA 3.44Å; I251-H259 VanDerWaalsContact CG2-CE1 3.44Å; I251-H259 WeakPolarHBondContact CG2-CE1 3.4Å; I251-H259 PolarHBondContact N-O 3.2Å; I251-H259 PolarHBondContact O-N 2.75Å; I251-A261 HydrophobicContact CD1-CB 3.87Å
252	L	80.4	Confident	81.1	Confident	34 Å²	34	68.3 Å²	68.3	18%	0.178	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	132.2	176.4	-70.4	167.6	0	0	0	110.2	F160 A238 C239	F160-L252 HydrophobicContact CE2-CD1 4.27Å; F160-L252 HydrophobicContact CZ-CD1 3.99Å; A238-L252 HydrophobicContact CB-CD2 4.1Å; C239-L252 HydrophobicContact CB-CD2 4.12Å; C239-L252 HydrophobicContact CB-CG 4.32Å
253	D	77.3	Confident	81	Confident	55 Å²	55	68.4 Å²	68.4	29%	0.294	38%	0.379	S	S	.	.			trans	-86.4	165.5	168.8	-49.1	-53.2	0	0	0	110.8	S255 Y256 T257 H259	D253-S255 PolarHBondContact O-N 2.9Å; D253-Y256 PolarHBondContact O-N 3.06Å; D253-T257 WeakPolarHBondContact CB-OG1 3.32Å; D253-T257 PolarHBondContact N-O 3.38Å; D253-T257 WeakPolarHBondContact OD2-CB 3.1Å; D253-T257 PolarHBondContact OD2-OG1 2.97Å; D253-H259 IonicContact OD1-CE1 3.99Å; D253-H259 PolarHBondContact OD1-CE1 3.05Å; D253-H259 IonicContact OD1-CG 3.88Å; D253-H259 IonicContact OD1-ND1 2.7Å; D253-H259 PolarHBondContact OD1-ND1 2.77Å
254	T	68.4	Low	80.4	Confident	148 Å²	148	72.5 Å²	72.5	91%	0.908	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-9.7	177.5	49.5	0	0	0	0	114.9
255	S	65.1	Low	79.4	Confident	83 Å²	83	74 Å²	74	58%	0.58	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	16.2	-173.8	-54.9	0	0	0	0	114.4	D253 T257	D253-S255 PolarHBondContact O-N 2.9Å; S255-T257 PolarHBondContact O-N 3.33Å
256	Y	68.8	Low	79.2	Confident	137 Å²	137	74 Å²	74	54%	0.537	43%	0.428	S	S	.	.	S	Bend	trans	60.1	19.5	-167.6	-55.1	-104.6	0	0	0	114.1	P159 F160 A238 D253	P159-Y256 WeakPolarHBondContact CB-OH 3.26Å; P159-Y256 HydrophobicContact CG-CE1 3.85Å; P159-Y256 HydrophobicContact CG-CE2 4.41Å; P159-Y256 WeakPolarHBondContact CG-OH 3.27Å; F160-Y256 HydrophobicContact CD1-CD1 4.21Å; F160-Y256 HydrophobicContact CD1-CE1 4.12Å; F160-Y256 AromaticContact CE1-CD1 3.7Å; F160-Y256 HydrophobicContact CE1-CD1 3.7Å; F160-Y256 AromaticContact CE1-CE1 3.93Å; F160-Y256 HydrophobicContact CE1-CE1 3.93Å; A238-Y256 VanDerWaalsContact CB-O 3.31Å; A238-Y256 WeakPolarHBondContact CB-O 3.49Å; D253-Y256 PolarHBondContact O-N 3.06Å
257	T	78	Confident	79.1	Confident	71 Å²	71	74 Å²	74	44%	0.436	43%	0.434	S	S	.	.			trans	-95.6	171.2	170.3	54	0	0	0	0	110.8	D253 S255	D253-T257 WeakPolarHBondContact CB-OG1 3.32Å; D253-T257 PolarHBondContact N-O 3.38Å; D253-T257 WeakPolarHBondContact OD2-CB 3.1Å; D253-T257 PolarHBondContact OD2-OG1 2.97Å; S255-T257 PolarHBondContact O-N 3.33Å
258	Y	84.8	Confident	79.2	Confident	84 Å²	84	68.7 Å²	68.7	33%	0.329	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	154	175.4	75.2	-85.4	0	0	0	111.8	A238 P243 I251	A238-Y258 HydrophobicContact CB-CD1 4.04Å; P243-Y258 HydrophobicContact CB-CD2 4.3Å; P243-Y258 HydrophobicContact CB-CE1 4.16Å; P243-Y258 HydrophobicContact CB-CE2 3.6Å; P243-Y258 HydrophobicContact CG-CD1 4.23Å; P243-Y258 HydrophobicContact CG-CD2 3.61Å; P243-Y258 HydrophobicContact CG-CE1 4.07Å; P243-Y258 HydrophobicContact CG-CE2 3.44Å; P243-Y258 VanDerWaalsContact CG-CE2 3.44Å; P243-Y258 HydrophobicContact CG-CG 4.02Å; I251-Y258 CarbonylContact O-C 3.53Å; I251-Y258 VanDerWaalsContact O-CA 3.24Å; I251-Y258 WeakPolarHBondContact O-CA 3.44Å
259	H	87.9	Confident	79.1	Confident	85 Å²	85	76.7 Å²	76.7	39%	0.394	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	154.4	163.1	66.2	-91.6	0	0	0	110.6	I251 D253	I251-H259 VanDerWaalsContact CG2-CE1 3.44Å; I251-H259 WeakPolarHBondContact CG2-CE1 3.4Å; I251-H259 PolarHBondContact N-O 3.2Å; I251-H259 PolarHBondContact O-N 2.75Å; D253-H259 IonicContact OD1-CE1 3.99Å; D253-H259 PolarHBondContact OD1-CE1 3.05Å; D253-H259 IonicContact OD1-CG 3.88Å; D253-H259 IonicContact OD1-ND1 2.7Å; D253-H259 PolarHBondContact OD1-ND1 2.77Å
260	C	88.3	Confident	79.2	Confident	19 Å²	19	78.2 Å²	78.2	13%	0.128	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	125.3	-179.3	-64.7	0	0	0	0	111.1	C244 T249	C244-C260 WeakPolarHBondContact CA-SG 3.28Å; C244-C260 HydrophobicContact CB-CB 3.81Å; C244-C260 WeakPolarHBondContact CB-SG 3.45Å; C244-C260 VanDerWaalsContact SG-CA 3.55Å; C244-C260 WeakPolarHBondContact SG-CB 3.45Å; C244-C260 CovalentContact SG-SG 2.03Å; C244-C260 PolarHBondContact SG-SG 3.21Å; T249-C260 WeakPolarHBondContact O-CA 3.43Å
261	A	87.7	Confident	79.2	Confident	43 Å²	43	76.6 Å²	76.6	36%	0.355	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	113	166.7	0	0	0	0	0	109.3	G248 T249 I251	G248-A261 CarbonylContact C-O 3.46Å; G248-A261 WeakPolarHBondContact CA-O 3Å; T249-A261 PolarHBondContact N-O 3.39Å; T249-A261 PolarHBondContact O-N 3.28Å; I251-A261 HydrophobicContact CD1-CB 3.87Å
262	C	84.2	Confident	79.1	Confident	47 Å²	47	77 Å²	77	32%	0.318	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-86.6	145.2	-173.5	-55.7	0	0	0	0	112.9	Y266 C271	C262-Y266 WeakPolarHBondContact CB-O 3.49Å; C262-C271 WeakPolarHBondContact CA-SG 2.95Å; C262-C271 HydrophobicContact CB-CB 3.76Å; C262-C271 WeakPolarHBondContact CB-SG 3.15Å; C262-C271 WeakPolarHBondContact SG-CA 3.42Å; C262-C271 WeakPolarHBondContact SG-CB 3.31Å; C262-C271 CovalentContact SG-SG 2.04Å; C262-C271 PolarHBondContact SG-SG 3.36Å
263	L	78.8	Confident	78.9	Confident	91 Å²	91	79.3 Å²	79.3	48%	0.476	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-66.4	152.9	168.9	-69.7	172.9	0	0	0	110.8	D247 G265 Y266	D247-L263 HydrophobicContact CB-CD1 3.79Å; L263-G265 PolarHBondContact O-N 3.09Å; L263-Y266 HydrophobicContact CB-CD2 4.15Å; L263-Y266 PolarHBondContact O-N 2.89Å
264	A	71.4	Confident	78.4	Confident	104 Å²	104	80.5 Å²	80.5	86%	0.86	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	130.1	-176.6	0	0	0	0	0	111.8
265	G	67.6	Low	77.9	Confident	48 Å²	48	76.6 Å²	76.6	50%	0.495	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.3	-34.5	-174.8	0	0	0	0	0	113.8	L263 P275	L263-G265 PolarHBondContact O-N 3.09Å; G265-P275 VanDerWaalsContact O-CD 3.31Å; G265-P275 WeakPolarHBondContact O-CD 3.01Å
266	Y	78	Confident	77.2	Confident	76 Å²	76	79.4 Å²	79.4	30%	0.298	44%	0.442	S	S	.	.			trans	-85.7	140.7	-179.6	-60.1	-86.6	0	0	0	111.9	H246 C262 L263 N273 V274	H246-Y266 HydrophobicContact CB-CD1 3.59Å; H246-Y266 HydrophobicContact CB-CD2 4.32Å; H246-Y266 HydrophobicContact CB-CE1 3.57Å; H246-Y266 HydrophobicContact CB-CE2 4.3Å; H246-Y266 HydrophobicContact CB-CG 3.99Å; H246-Y266 AromaticContact CD2-CD1 3.9Å; H246-Y266 AromaticContact CD2-CE1 4Å; H246-Y266 AromaticContact CG-CD1 3.61Å; H246-Y266 AromaticContact CG-CE1 3.4Å; H246-Y266 VanDerWaalsContact CG-CE1 3.4Å; H246-Y266 AromaticContact ND1-CE1 3.52Å; C262-Y266 WeakPolarHBondContact CB-O 3.49Å; L263-Y266 HydrophobicContact CB-CD2 4.15Å; L263-Y266 PolarHBondContact O-N 2.89Å; Y266-N273 WeakPolarHBondContact CA-O 3.46Å; Y266-V274 HydrophobicContact CD1-CG2 4.17Å; Y266-V274 HydrophobicContact CE1-CB 4.42Å; Y266-V274 HydrophobicContact CE1-CG1 4.11Å; Y266-V274 HydrophobicContact CE1-CG2 3.93Å
267	T	78.4	Confident	76.4	Confident	84 Å²	84	78.7 Å²	78.7	52%	0.515	44%	0.444	S	S	.	.	B	Isolated β-bridge	trans	-136.6	172.7	178.3	63.5	0	0	0	0	111.6	C271 E272 N273	T267-C271 CarbonylContact O-C 3.46Å; T267-C271 WeakPolarHBondContact O-CA 3.3Å; T267-E272 PolarHBondContact O-N 2.89Å; T267-N273 PolarHBondContact N-O 2.92Å; T267-N273 VanDerWaalsContact O-CB 3.3Å; T267-N273 WeakPolarHBondContact O-CB 3.13Å; T267-N273 PolarHBondContact O-N 3.39Å; T267-N273 PolarHBondContact O-ND2 2.92Å; T267-N273 WeakPolarHBondContact OG1-CB 3.12Å
268	G	80.9	Confident	75.4	Confident	33 Å²	33	85.8 Å²	85.8	34%	0.34	46%	0.462	S	S	.	.	S	Bend	trans	105.2	172.4	-175.5	0	0	0	0	0	113.1	R270 C271 E272	G268-R270 VanDerWaalsContact C-N 3.31Å; G268-R270 PolarHBondContact O-N 3.48Å; G268-C271 PolarHBondContact O-N 2.95Å; G268-E272 VanDerWaalsContact CA-OE1 3.27Å; G268-E272 WeakPolarHBondContact CA-OE1 3.42Å
269	K	83.3	Confident	74.2	Confident	182 Å²	182	85.7 Å²	85.7	79%	0.791	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-23.3	-172.3	-75.8	-168.2	174.3	-172.6	0	113.8	E272	K269-E272 PolarHBondContact N-OE1 3.23Å; K269-E272 PolarHBondContact N-OE2 3.43Å; K269-E272 VanDerWaalsContact N-OE2 3.12Å
270	R	85.4	Confident	73.1	Confident	118 Å²	118	82 Å²	82	45%	0.445	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.4	22.2	175.7	-56.4	-178	-56	174.3	5.1	110.8	P243 L245 G268 E272	P243-R270 WeakPolarHBondContact O-CD 3.21Å; L245-R270 VanDerWaalsContact CB-O 3.32Å; L245-R270 WeakPolarHBondContact CB-O 3.43Å; L245-R270 PolarHBondContact N-O 2.82Å; G268-R270 VanDerWaalsContact C-N 3.31Å; G268-R270 PolarHBondContact O-N 3.48Å; R270-E272 VanDerWaalsContact C-OE2 3.24Å; R270-E272 VanDerWaalsContact CA-OE2 3.26Å; R270-E272 WeakPolarHBondContact CA-OE2 3.36Å; R270-E272 WeakPolarHBondContact CB-OE2 3.38Å; R270-E272 PolarHBondContact N-OE2 2.06Å; R270-E272 PolarHBondContact O-N 3.47Å
271	C	85.5	Confident	72.3	Confident	0 Å²	0	86.7 Å²	86.7	0%	0	48%	0.482	C	S	.	.	S	Bend	trans	63.5	24.7	-176.8	-43.1	0	0	0	0	114.6	L245 H246 C262 T267 G268 N273	L245-C271 WeakPolarHBondContact O-CB 3.37Å; H246-C271 PolarHBondContact CD2-O 3.02Å; H246-C271 VanDerWaalsContact CD2-O 3.31Å; C262-C271 WeakPolarHBondContact CA-SG 2.95Å; C262-C271 HydrophobicContact CB-CB 3.76Å; C262-C271 WeakPolarHBondContact CB-SG 3.15Å; C262-C271 WeakPolarHBondContact SG-CA 3.42Å; C262-C271 WeakPolarHBondContact SG-CB 3.31Å; C262-C271 CovalentContact SG-SG 2.04Å; C262-C271 PolarHBondContact SG-SG 3.36Å; T267-C271 CarbonylContact O-C 3.46Å; T267-C271 WeakPolarHBondContact O-CA 3.3Å; G268-C271 PolarHBondContact O-N 2.95Å; C271-N273 VanDerWaalsContact C-N 3.3Å; C271-N273 PolarHBondContact O-N 3.13Å
272	E	81.3	Confident	71.5	Confident	74 Å²	74	90 Å²	90	35%	0.346	49%	0.493	S	S	.	.			trans	-67.5	-17.4	-173.6	63.3	-84.1	-171.3	0	0	116.1	L245 T267 G268 K269 R270	L245-E272 HydrophobicContact CD1-CB 4.08Å; T267-E272 PolarHBondContact O-N 2.89Å; G268-E272 VanDerWaalsContact CA-OE1 3.27Å; G268-E272 WeakPolarHBondContact CA-OE1 3.42Å; K269-E272 PolarHBondContact N-OE1 3.23Å; K269-E272 PolarHBondContact N-OE2 3.43Å; K269-E272 VanDerWaalsContact N-OE2 3.12Å; R270-E272 VanDerWaalsContact C-OE2 3.24Å; R270-E272 VanDerWaalsContact CA-OE2 3.26Å; R270-E272 WeakPolarHBondContact CA-OE2 3.36Å; R270-E272 WeakPolarHBondContact CB-OE2 3.38Å; R270-E272 PolarHBondContact N-OE2 2.06Å; R270-E272 PolarHBondContact O-N 3.47Å
273	N	75.9	Confident	71.1	Confident	83 Å²	83	88.4 Å²	88.4	44%	0.444	48%	0.482	S	S	.	.	B	Isolated β-bridge	trans	-97.6	120.3	-175.9	-56.5	-42.2	0	0	0	110.8	Y266 T267 C271	Y266-N273 WeakPolarHBondContact CA-O 3.46Å; T267-N273 PolarHBondContact N-O 2.92Å; T267-N273 VanDerWaalsContact O-CB 3.3Å; T267-N273 WeakPolarHBondContact O-CB 3.13Å; T267-N273 PolarHBondContact O-N 3.39Å; T267-N273 PolarHBondContact O-ND2 2.92Å; T267-N273 WeakPolarHBondContact OG1-CB 3.12Å; C271-N273 VanDerWaalsContact C-N 3.3Å; C271-N273 PolarHBondContact O-N 3.13Å
274	V	66.4	Low	71.2	Confident	81 Å²	81	88.1 Å²	88.1	49%	0.491	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-98.1	137.9	176.9	-170.7	0	0	0	0	109.6	Y266	Y266-V274 HydrophobicContact CD1-CG2 4.17Å; Y266-V274 HydrophobicContact CE1-CB 4.42Å; Y266-V274 HydrophobicContact CE1-CG1 4.11Å; Y266-V274 HydrophobicContact CE1-CG2 3.93Å
275	P	57.3	Low	71.7	Confident	65 Å²	65	89 Å²	89	42%	0.422	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-73	133.9	175	29.6	-30.4	0	0	0	109.9	G265 E277	G265-P275 VanDerWaalsContact O-CD 3.31Å; G265-P275 WeakPolarHBondContact O-CD 3.01Å; P275-E277 PolarHBondContact O-N 3.27Å
276	V	51.8	Low	72.5	Confident	142 Å²	142	87 Å²	87	86%	0.861	45%	0.449	S	S	*	.			trans	-78.9	85.9	-178.1	-175.5	0	0	0	0	110.3
277	E	52.3	Low	72.9	Confident	122 Å²	122	89.2 Å²	89.2	57%	0.57	47%	0.47	S	S	*	.			trans	-69.6	131.9	165.9	-68.6	-171.1	170.4	0	0	110.6	P275 V279	P275-E277 PolarHBondContact O-N 3.27Å; E277-V279 VanDerWaalsContact C-N 3.3Å; E277-V279 HydrophobicContact CB-CG2 3.84Å; E277-V279 PolarHBondContact O-N 2.8Å
278	R	55.6	Low	73.2	Confident	220 Å²	220	88.3 Å²	88.3	83%	0.83	46%	0.462	S	S	*	.			trans	-81.6	76.7	175.2	-66.2	-172.9	-175.4	-172.3	2.7	110.3
279	V	59.8	Low	73.3	Confident	83 Å²	83	87.4 Å²	87.4	50%	0.503	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-85	134.3	-179.2	-172.9	0	0	0	0	111	E277 T281	E277-V279 VanDerWaalsContact C-N 3.3Å; E277-V279 HydrophobicContact CB-CG2 3.84Å; E277-V279 PolarHBondContact O-N 2.8Å; V279-T281 PolarHBondContact O-N 2.87Å
280	C	65.2	Low	73.2	Confident	7 Å²	7	81.2 Å²	81.2	5%	0.047	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-61.8	128.7	170.3	-72.3	0	0	0	0	110.7	C331 G335 W337	C280-C331 HydrophobicContact CB-CB 3.79Å; C280-C331 WeakPolarHBondContact CB-SG 3.4Å; C280-C331 VanDerWaalsContact SG-CA 3.52Å; C280-C331 WeakPolarHBondContact SG-CB 3.48Å; C280-C331 CovalentContact SG-SG 2.03Å; C280-C331 PolarHBondContact SG-SG 2.9Å; C280-G335 PolarHBondContact SG-O 3.43Å; C280-G335 VanDerWaalsContact SG-O 3.38Å; C280-W337 HydrophobicContact CB-CH2 4.25Å; C280-W337 HydrophobicContact CB-CZ2 3.58Å
281	T	71.6	Confident	72.9	Confident	117 Å²	117	76.9 Å²	76.9	72%	0.718	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-67.6	145.9	175.4	53.3	0	0	0	0	111.6	V279 P283 W337	V279-T281 PolarHBondContact O-N 2.87Å; T281-P283 WeakPolarHBondContact O-CD 3.14Å; T281-W337 PolarHBondContact O-NE1 3.15Å
282	L	71.1	Confident	72.3	Confident	112 Å²	112	81.4 Å²	81.4	59%	0.586	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-57.8	119.6	179.2	-176.8	71.3	0	0	0	110.2	F313	L282-F313 HydrophobicContact CD1-CD1 4.42Å; L282-F313 HydrophobicContact CD1-CE1 3.36Å; L282-F313 HydrophobicContact CD1-CE2 4.28Å; L282-F313 HydrophobicContact CD1-CZ 3.28Å
283	P	75.8	Confident	71.5	Confident	14 Å²	14	81 Å²	81	9%	0.091	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-66.9	143	179.1	26.8	-33.7	0	0	0	110.5	T281 H291 F313 F315 W337	T281-P283 WeakPolarHBondContact O-CD 3.14Å; P283-H291 PolarHBondContact O-CE1 3.32Å; P283-H291 PolarHBondContact O-ND1 2.86Å; P283-F313 HydrophobicContact CG-CD2 4.24Å; P283-F313 HydrophobicContact CG-CG 4.28Å; P283-F315 HydrophobicContact CB-CZ 4.13Å; P283-F315 HydrophobicContact CG-CZ 4.04Å; P283-W337 HydrophobicContact CG-CZ2 4.47Å
284	P	80.4	Confident	70.7	Confident	86 Å²	86	79.4 Å²	79.4	56%	0.558	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-61.2	158.7	-179.1	22.9	-31.7	0	0	0	112.2	Q341	P284-Q341 PolarHBondContact O-NE2 2.93Å
285	K	81.3	Confident	70	Confident	122 Å²	122	81.3 Å²	81.3	53%	0.53	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-71	137.3	173.2	-63.7	-173	176.4	-148.2	0	110	D290	K285-D290 WeakPolarHBondContact CD-OD1 3.46Å; K285-D290 WeakPolarHBondContact CE-OD1 3.1Å; K285-D290 IonicContact NZ-OD1 2.67Å; K285-D290 PolarHBondContact NZ-OD1 3.49Å; K285-D290 IonicContact NZ-OD2 3.13Å; K285-D290 PolarHBondContact NZ-OD2 3Å
286	P	85.9	Confident	69.6	Low	7 Å²	7	78.9 Å²	78.9	5%	0.045	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-71.1	145.4	175.8	29.8	-33.5	0	0	0	110.5	N288 G289 F315	P286-N288 PolarHBondContact O-N 3.04Å; P286-G289 CarbonylContact O-C 3.59Å; P286-G289 PolarHBondContact O-N 3.39Å; P286-G289 VanDerWaalsContact O-O 3.14Å; P286-F315 HydrophobicContact CG-CD1 4.01Å
287	V	85.3	Confident	69.1	Low	122 Å²	122	78.7 Å²	78.7	74%	0.739	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	124.1	-179.8	-171.6	0	0	0	0	110.1	C344	V287-C344 WeakPolarHBondContact O-CB 3.27Å
288	N	85.4	Confident	68.7	Low	65 Å²	65	79.4 Å²	79.4	35%	0.348	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.1	29.1	-167.9	-49.8	-87	0	0	0	115.3	P286 N318 Y321 C344	P286-N288 PolarHBondContact O-N 3.04Å; N288-N318 WeakPolarHBondContact O-CB 3.26Å; N288-N318 VanDerWaalsContact O-CG 3.28Å; N288-N318 PolarHBondContact O-N 3.04Å; N288-Y321 HydrophobicContact CB-CD1 4.04Å; N288-Y321 HydrophobicContact CB-CD2 3.74Å; N288-Y321 HydrophobicContact CB-CE1 3.94Å; N288-Y321 HydrophobicContact CB-CE2 3.59Å; N288-Y321 HydrophobicContact CB-CG 3.97Å; N288-Y321 PolarHBondContact OD1-OH 3.46Å; N288-Y321 VanDerWaalsContact OD1-OH 3.05Å; N288-C344 HydrophobicContact CB-CB 4.47Å
289	G	82.6	Confident	68.2	Low	13 Å²	13	75.6 Å²	75.6	13%	0.134	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	-168.9	173.1	0	0	0	0	0	113.3	P286 M316	P286-G289 CarbonylContact O-C 3.59Å; P286-G289 PolarHBondContact O-N 3.39Å; P286-G289 VanDerWaalsContact O-O 3.14Å; G289-M316 CarbonylContact C-O 3.36Å; G289-M316 WeakPolarHBondContact CA-O 2.9Å
290	D	81.8	Confident	67.3	Low	52 Å²	52	75 Å²	75	28%	0.278	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	-180	-178.4	-147.2	-28	0	0	0	110.8	K285 M316	K285-D290 WeakPolarHBondContact CD-OD1 3.46Å; K285-D290 WeakPolarHBondContact CE-OD1 3.1Å; K285-D290 IonicContact NZ-OD1 2.67Å; K285-D290 PolarHBondContact NZ-OD1 3.49Å; K285-D290 IonicContact NZ-OD2 3.13Å; K285-D290 PolarHBondContact NZ-OD2 3Å; D290-M316 HydrophobicContact CB-CG 3.98Å; D290-M316 HydrophobicContact CB-SD 4.26Å; D290-M316 PolarHBondContact N-O 3.31Å; D290-M316 WeakPolarHBondContact O-CG 3.3Å; D290-M316 PolarHBondContact O-N 2.95Å
291	H	79.1	Confident	66.4	Low	27 Å²	27	77.4 Å²	77.4	13%	0.125	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	146.2	171.1	57.8	-119.4	0	0	0	112	P283 F313 Y314 F315	P283-H291 PolarHBondContact O-CE1 3.32Å; P283-H291 PolarHBondContact O-ND1 2.86Å; H291-F313 HydrophobicContact CB-CD1 4.35Å; H291-F313 AromaticContact CD2-CD1 3.86Å; H291-F313 AromaticContact CD2-CE1 3.99Å; H291-Y314 CarbonylContact C-O 3.58Å; H291-Y314 VanDerWaalsContact CA-O 3.26Å; H291-Y314 WeakPolarHBondContact CA-O 3.5Å; H291-F315 HydrophobicContact CB-CD1 4.01Å; H291-F315 HydrophobicContact CB-CE1 4.1Å
292	L	72.2	Confident	65.3	Low	96 Å²	96	74.6 Å²	74.6	50%	0.503	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	139.2	170.5	-77.4	171.3	0	0	0	110.9	Y314 M316	L292-Y314 PolarHBondContact N-O 3.22Å; L292-Y314 PolarHBondContact O-N 2.72Å; L292-M316 HydrophobicContact CD1-CE 3.37Å; L292-M316 HydrophobicContact CD2-CE 4.37Å; L292-M316 HydrophobicContact CG-CE 3.59Å
293	L	64.5	Low	64.1	Low	66 Å²	66	70.8 Å²	70.8	35%	0.346	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	142.5	160.6	-74.9	160.1	0	0	0	109.6	Y295 L301 A303 F313	L293-Y295 HydrophobicContact CB-CE2 4.5Å; L293-L301 HydrophobicContact CD1-CD2 4.27Å; L293-A303 HydrophobicContact CD2-CB 4.13Å; L293-F313 HydrophobicContact CD2-CD1 4.18Å; L293-F313 HydrophobicContact CD2-CE1 3.3Å; L293-F313 HydrophobicContact CD2-CE2 4.38Å; L293-F313 HydrophobicContact CD2-CZ 3.41Å; L293-F313 VanDerWaalsContact CD2-CZ 3.41Å; L293-F313 HydrophobicContact CG-CD1 4.49Å; L293-F313 HydrophobicContact CG-CE1 3.77Å; L293-F313 HydrophobicContact CG-CZ 4.36Å
294	V	59.5	Low	62.3	Low	48 Å²	48	76.7 Å²	76.7	29%	0.291	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-90	126.4	176	-174.4	0	0	0	0	109.5	I302 A312 Y314	V294-I302 HydrophobicContact CB-CD1 4.31Å; V294-I302 HydrophobicContact CG1-CD1 3.89Å; V294-I302 WeakPolarHBondContact O-CG1 3.46Å; V294-A312 HydrophobicContact CG2-CB 4.37Å; V294-A312 WeakPolarHBondContact CG2-O 3.38Å; V294-Y314 HydrophobicContact CG2-CD2 3.4Å; V294-Y314 VanDerWaalsContact CG2-CD2 3.4Å; V294-Y314 HydrophobicContact CG2-CE2 3.43Å; V294-Y314 VanDerWaalsContact CG2-CE2 3.43Å
295	Y	51.8	Low	60.3	Low	122 Å²	122	78.6 Å²	78.6	48%	0.478	43%	0.426	S	S	.	.	B	Isolated β-bridge	trans	-94.1	145.6	169.9	-63.7	-102.2	0	0	0	109.2	L293 D299 V300 L301	L293-Y295 HydrophobicContact CB-CE2 4.5Å; Y295-D299 WeakPolarHBondContact CD1-O 3.4Å; Y295-V300 WeakPolarHBondContact CA-O 3.35Å; Y295-L301 HydrophobicContact CD1-CD2 4.23Å; Y295-L301 HydrophobicContact CD1-CG 4.14Å; Y295-L301 HydrophobicContact CE1-CD2 3.55Å; Y295-L301 HydrophobicContact CE1-CG 3.57Å; Y295-L301 HydrophobicContact CE2-CD2 4.46Å
296	G	47.7	Very low	58.3	Low	14 Å²	14	77.9 Å²	77.9	14%	0.144	43%	0.434	C	S	.	.			trans	-74.1	174.2	175.8	0	0	0	0	0	112.2	N298 D299 V300	G296-N298 PolarHBondContact O-N 3.39Å; G296-D299 PolarHBondContact O-N 3.42Å; G296-V300 PolarHBondContact N-O 3.03Å
297	P	43.2	Very low	56.3	Low	138 Å²	138	84.5 Å²	84.5	90%	0.896	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	1.6	179.4	25.7	-34.8	0	0	0	115.7
298	N	43.8	Very low	54.4	Low	136 Å²	136	84.1 Å²	84.1	73%	0.727	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.5	22.6	177.5	-62	-14.7	0	0	0	112.1	G296 V300	G296-N298 PolarHBondContact O-N 3.39Å; N298-V300 HydrophobicContact CB-CG2 4.18Å; N298-V300 PolarHBondContact O-N 2.96Å
299	D	45	Very low	52.5	Low	140 Å²	140	86.9 Å²	86.9	75%	0.749	48%	0.479	S	S	*	.	S	Bend	trans	54.8	18.8	-173.7	-71.3	-31.4	0	0	0	115.7	Y295 G296	Y295-D299 WeakPolarHBondContact CD1-O 3.4Å; G296-D299 PolarHBondContact O-N 3.42Å
300	V	39.6	Very low	51.1	Low	70 Å²	70	94.3 Å²	94.3	42%	0.424	50%	0.503	S	S	.	.			trans	-77.2	130.5	173.2	-179.1	0	0	0	0	110	Y295 G296 N298 I302	Y295-V300 WeakPolarHBondContact CA-O 3.35Å; G296-V300 PolarHBondContact N-O 3.03Å; N298-V300 HydrophobicContact CB-CG2 4.18Å; N298-V300 PolarHBondContact O-N 2.96Å; V300-I302 PolarHBondContact O-N 3.23Å; V300-I302 VanDerWaalsContact O-N 3.07Å
301	L	47	Very low	50.1	Low	58 Å²	58	94.3 Å²	94.3	30%	0.304	50%	0.501	S	S	.	.	B	Isolated β-bridge	trans	-58.9	106	166.8	-84.6	161	0	0	0	110	L293 Y295 A303 L304	L293-L301 HydrophobicContact CD1-CD2 4.27Å; Y295-L301 HydrophobicContact CD1-CD2 4.23Å; Y295-L301 HydrophobicContact CD1-CG 4.14Å; Y295-L301 HydrophobicContact CE1-CD2 3.55Å; Y295-L301 HydrophobicContact CE1-CG 3.57Å; Y295-L301 HydrophobicContact CE2-CD2 4.46Å; L301-A303 PolarHBondContact O-N 3.34Å; L301-L304 HydrophobicContact CB-CD1 4.4Å; L301-L304 HydrophobicContact CD1-CD1 4.02Å; L301-L304 PolarHBondContact O-N 3.02Å
302	I	48.8	Very low	49.6	Very low	58 Å²	58	93.5 Å²	93.5	30%	0.297	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-61.4	-15.5	177.2	-57.3	178.1	0	0	0	111.5	V294 V300 L304	V294-I302 HydrophobicContact CB-CD1 4.31Å; V294-I302 HydrophobicContact CG1-CD1 3.89Å; V294-I302 WeakPolarHBondContact O-CG1 3.46Å; V300-I302 PolarHBondContact O-N 3.23Å; V300-I302 VanDerWaalsContact O-N 3.07Å; I302-L304 PolarHBondContact O-N 2.93Å
303	A	44.6	Very low	49.7	Very low	33 Å²	33	89.3 Å²	89.3	27%	0.273	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-80.8	-1.7	178.8	0	0	0	0	0	115.8	L293 L301	L293-A303 HydrophobicContact CD2-CB 4.13Å; L301-A303 PolarHBondContact O-N 3.34Å
304	L	38.8	Very low	50.4	Low	138 Å²	138	90 Å²	90	72%	0.723	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-121.3	9.6	-177.4	-69.9	175.8	0	0	0	115	L301 I302	L301-L304 HydrophobicContact CB-CD1 4.4Å; L301-L304 HydrophobicContact CD1-CD1 4.02Å; L301-L304 PolarHBondContact O-N 3.02Å; I302-L304 PolarHBondContact O-N 2.93Å
305	Q	37.9	Very low	51.6	Low	126 Å²	126	88.4 Å²	88.4	59%	0.589	46%	0.464	S	S	*	.			trans	-94.6	128.6	168.2	-71.5	-173.1	-48.4	0	0	109.9	E307	Q305-E307 PolarHBondContact O-N 3Å
306	P	40.3	Very low	53.2	Low	107 Å²	107	86.6 Å²	86.6	70%	0.695	46%	0.461	S	S	*	.			trans	-77	29.1	-179.4	34.1	-37.2	0	0	0	113.1
307	E	44	Very low	55	Low	146 Å²	146	87.2 Å²	87.2	68%	0.682	46%	0.463	S	S	*	.	S	Bend	trans	-94.2	140.8	-179.2	-80.3	-67.4	160.7	0	0	110.7	Q305 N309	Q305-E307 PolarHBondContact O-N 3Å; E307-N309 PolarHBondContact O-N 3.42Å
308	P	45.1	Very low	57	Low	113 Å²	113	85 Å²	85	73%	0.734	44%	0.443	S	S	*	.	S	Bend	trans	-70.3	16.8	-165.2	-21.4	34.4	0	0	0	117.4
309	N	44.8	Very low	58.4	Low	123 Å²	123	85.5 Å²	85.5	66%	0.658	44%	0.441	S	S	*	.	S	Bend	trans	-128.6	98.9	-167.4	-91	-62.7	0	0	0	115.6	E307	E307-N309 PolarHBondContact O-N 3.42Å
310	R	54.9	Low	60.3	Low	170 Å²	170	80 Å²	80	64%	0.642	41%	0.414	S	S	*	.			trans	77.2	63.9	148.6	-52.4	-178.8	-176.2	-151.9	-2.7	118.1	A312	R310-A312 PolarHBondContact O-N 2.93Å
311	Q	60.4	Low	62.5	Low	51 Å²	51	78.2 Å²	78.2	24%	0.238	40%	0.4	C	S	.	.			trans	-56	125.2	146.6	-68.7	-175.4	-0.2	0	0	110	T330 C331 W337	Q311-T330 WeakPolarHBondContact O-CA 3.18Å; Q311-C331 HydrophobicContact CB-CB 4.14Å; Q311-C331 PolarHBondContact O-N 2.87Å; Q311-W337 HydrophobicContact CB-CH2 4.44Å
312	A	67.8	Low	64.4	Low	10 Å²	10	75.4 Å²	75.4	8%	0.083	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	138.1	180	0	0	0	0	0	111.3	V294 R310 R329 T330	V294-A312 HydrophobicContact CG2-CB 4.37Å; V294-A312 WeakPolarHBondContact CG2-O 3.38Å; R310-A312 PolarHBondContact O-N 2.93Å; A312-R329 CarbonylContact C-O 3.58Å; A312-R329 VanDerWaalsContact CA-O 3.22Å; A312-R329 WeakPolarHBondContact CA-O 3.39Å; A312-T330 HydrophobicContact CB-CG2 4.07Å
313	F	73.5	Confident	66.3	Low	9 Å²	9	73.5 Å²	73.5	4%	0.039	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	144.6	177.2	-75.8	-89.5	0	0	0	111	L282 P283 H291 L293 R328 R329 W337	L282-F313 HydrophobicContact CD1-CD1 4.42Å; L282-F313 HydrophobicContact CD1-CE1 3.36Å; L282-F313 HydrophobicContact CD1-CE2 4.28Å; L282-F313 HydrophobicContact CD1-CZ 3.28Å; P283-F313 HydrophobicContact CG-CD2 4.24Å; P283-F313 HydrophobicContact CG-CG 4.28Å; H291-F313 HydrophobicContact CB-CD1 4.35Å; H291-F313 AromaticContact CD2-CD1 3.86Å; H291-F313 AromaticContact CD2-CE1 3.99Å; L293-F313 HydrophobicContact CD2-CD1 4.18Å; L293-F313 HydrophobicContact CD2-CE1 3.3Å; L293-F313 HydrophobicContact CD2-CE2 4.38Å; L293-F313 HydrophobicContact CD2-CZ 3.41Å; L293-F313 VanDerWaalsContact CD2-CZ 3.41Å; L293-F313 HydrophobicContact CG-CD1 4.49Å; L293-F313 HydrophobicContact CG-CE1 3.77Å; L293-F313 HydrophobicContact CG-CZ 4.36Å; F313-R328 WeakPolarHBondContact O-CA 3.25Å; F313-R329 PolarHBondContact N-O 2.79Å; F313-R329 PolarHBondContact O-N 3.15Å; F313-W337 AromaticContact CD2-CH2 3.3Å; F313-W337 HydrophobicContact CD2-CH2 3.3Å; F313-W337 AromaticContact CD2-CZ2 3.85Å; F313-W337 HydrophobicContact CD2-CZ2 3.85Å; F313-W337 AromaticContact CD2-CZ3 3.78Å; F313-W337 HydrophobicContact CD2-CZ3 3.78Å; F313-W337 AromaticContact CE2-CH2 3.41Å; F313-W337 HydrophobicContact CE2-CH2 3.41Å; F313-W337 VanDerWaalsContact CE2-CH2 3.41Å; F313-W337 AromaticContact CE2-CZ2 3.73Å; F313-W337 HydrophobicContact CE2-CZ2 3.73Å; F313-W337 HydrophobicContact CE2-CZ3 4.33Å
314	Y	80.5	Confident	68.4	Low	80 Å²	80	72.5 Å²	72.5	31%	0.314	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	121.7	172.6	-78.4	-103.1	0	0	0	111.2	H291 L292 V294 K327 R328	H291-Y314 CarbonylContact C-O 3.58Å; H291-Y314 VanDerWaalsContact CA-O 3.26Å; H291-Y314 WeakPolarHBondContact CA-O 3.5Å; L292-Y314 PolarHBondContact N-O 3.22Å; L292-Y314 PolarHBondContact O-N 2.72Å; V294-Y314 HydrophobicContact CG2-CD2 3.4Å; V294-Y314 VanDerWaalsContact CG2-CD2 3.4Å; V294-Y314 HydrophobicContact CG2-CE2 3.43Å; V294-Y314 VanDerWaalsContact CG2-CE2 3.43Å; Y314-K327 CarbonylContact C-O 3.47Å; Y314-K327 VanDerWaalsContact CA-O 3.22Å; Y314-K327 WeakPolarHBondContact CA-O 2.96Å; Y314-K327 HydrophobicContact CD1-CG 4.47Å; Y314-R328 HydrophobicContact CD1-CB 4.44Å; Y314-R328 HydrophobicContact CE1-CB 4.15Å; Y314-R328 HydrophobicContact CE1-CG 4.34Å; Y314-R328 HydrophobicContact CE2-CG 4.01Å
315	F	84.3	Confident	70.5	Confident	15 Å²	15	68.4 Å²	68.4	7%	0.066	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	142.8	178.1	-67.3	-84.4	0	0	0	111.9	P283 P286 H291 L323 K327 R329 Q341 P342	P283-F315 HydrophobicContact CB-CZ 4.13Å; P283-F315 HydrophobicContact CG-CZ 4.04Å; P286-F315 HydrophobicContact CG-CD1 4.01Å; H291-F315 HydrophobicContact CB-CD1 4.01Å; H291-F315 HydrophobicContact CB-CE1 4.1Å; F315-L323 HydrophobicContact CB-CD1 4.01Å; F315-L323 HydrophobicContact CB-CD2 4.09Å; F315-K327 PolarHBondContact N-O 3.36Å; F315-R329 HydrophobicContact CE2-CB 4.21Å; F315-R329 HydrophobicContact CE2-CG 3.74Å; F315-Q341 HydrophobicContact CE1-CG 4.31Å; F315-Q341 HydrophobicContact CZ-CG 4.42Å; F315-P342 HydrophobicContact CB-CG 3.71Å; F315-P342 HydrophobicContact CD1-CG 4.14Å; F315-P342 HydrophobicContact CD2-CG 3.55Å; F315-P342 HydrophobicContact CE2-CG 4.21Å; F315-P342 HydrophobicContact CG-CG 3.51Å
316	M	84.4	Confident	72.6	Confident	84 Å²	84	66.9 Å²	66.9	41%	0.414	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	160.7	176.5	59.9	167.4	56.5	0	0	111.3	G289 D290 L292	G289-M316 CarbonylContact C-O 3.36Å; G289-M316 WeakPolarHBondContact CA-O 2.9Å; D290-M316 HydrophobicContact CB-CG 3.98Å; D290-M316 HydrophobicContact CB-SD 4.26Å; D290-M316 PolarHBondContact N-O 3.31Å; D290-M316 WeakPolarHBondContact O-CG 3.3Å; D290-M316 PolarHBondContact O-N 2.95Å; L292-M316 HydrophobicContact CD1-CE 3.37Å; L292-M316 HydrophobicContact CD2-CE 4.37Å; L292-M316 HydrophobicContact CG-CE 3.59Å
317	C	86.3	Confident	74.7	Confident	27 Å²	27	68.4 Å²	68.4	18%	0.182	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	153.4	178.2	-62.1	0	0	0	0	111.2	Y321 L323 C344	C317-Y321 WeakPolarHBondContact CB-O 3.49Å; C317-L323 WeakPolarHBondContact SG-CD1 3.38Å; C317-C344 VanDerWaalsContact CA-SG 3.54Å; C317-C344 HydrophobicContact CB-CB 3.81Å; C317-C344 WeakPolarHBondContact CB-SG 3.4Å; C317-C344 WeakPolarHBondContact SG-CA 3.37Å; C317-C344 WeakPolarHBondContact SG-CB 3.45Å; C317-C344 CovalentContact SG-SG 2.04Å; C317-C344 PolarHBondContact SG-SG 3.32Å
318	N	84.6	Confident	76.6	Confident	90 Å²	90	66.8 Å²	66.8	48%	0.481	34%	0.337	S	S	.	.			trans	-63.1	162.9	178.6	-68.6	-7.5	0	0	0	111.8	N288 S320 Y321	N288-N318 WeakPolarHBondContact O-CB 3.26Å; N288-N318 VanDerWaalsContact O-CG 3.28Å; N288-N318 PolarHBondContact O-N 3.04Å; N318-S320 PolarHBondContact O-N 3.34Å; N318-Y321 HydrophobicContact CB-CD2 4.19Å; N318-Y321 PolarHBondContact O-N 3.19Å
319	H	73.6	Confident	78.3	Confident	148 Å²	148	62.3 Å²	62.3	69%	0.685	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	14.7	-169.2	-154.7	-70.1	0	0	0	116.9
320	S	84.6	Confident	80	Confident	25 Å²	25	58.2 Å²	58.2	18%	0.175	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.5	16.1	173.4	-58.2	0	0	0	0	112.2	N318 R346 A347	N318-S320 PolarHBondContact O-N 3.34Å; S320-R346 WeakPolarHBondContact O-CA 3.04Å; S320-R346 VanDerWaalsContact O-CG 3.27Å; S320-R346 WeakPolarHBondContact O-CG 3.04Å; S320-A347 CarbonylContact C-O 3.54Å; S320-A347 VanDerWaalsContact C-O 3.31Å; S320-A347 PolarHBondContact O-N 2.98Å; S320-A347 VanDerWaalsContact O-N 3.12Å; S320-A347 VanDerWaalsContact O-O 3.09Å
321	Y	86.1	Confident	80.9	Confident	31 Å²	31	51.7 Å²	51.7	12%	0.122	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	144.3	-177.9	-63.4	-96.1	0	0	0	110.3	N288 C317 N318 C344 L345 R346 F404	N288-Y321 HydrophobicContact CB-CD1 4.04Å; N288-Y321 HydrophobicContact CB-CD2 3.74Å; N288-Y321 HydrophobicContact CB-CE1 3.94Å; N288-Y321 HydrophobicContact CB-CE2 3.59Å; N288-Y321 HydrophobicContact CB-CG 3.97Å; N288-Y321 PolarHBondContact OD1-OH 3.46Å; N288-Y321 VanDerWaalsContact OD1-OH 3.05Å; C317-Y321 WeakPolarHBondContact CB-O 3.49Å; N318-Y321 HydrophobicContact CB-CD2 4.19Å; N318-Y321 PolarHBondContact O-N 3.19Å; Y321-C344 HydrophobicContact CD1-CB 4.4Å; Y321-C344 HydrophobicContact CG-CB 4.45Å; Y321-L345 CarbonylContact C-O 3.57Å; Y321-L345 WeakPolarHBondContact CA-O 3.44Å; Y321-R346 HydrophobicContact CD1-CB 3.93Å; Y321-R346 HydrophobicContact CD1-CG 4.42Å; Y321-R346 HydrophobicContact CE1-CB 3.82Å; Y321-R346 HydrophobicContact CE1-CG 4.21Å; Y321-R346 PolarHBondContact OH-NE 2.91Å; Y321-R346 PolarHBondContact OH-NH2 2.87Å; Y321-F404 WeakPolarHBondContact O-CE1 3.05Å
322	A	87.3	Confident	81.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	150	173.1	0	0	0	0	0	109.9	C344 L345 A347 L400 F404	A322-C344 CarbonylContact O-C 3.42Å; A322-C344 WeakPolarHBondContact O-CA 3.4Å; A322-L345 PolarHBondContact N-O 3Å; A322-L345 PolarHBondContact O-N 3.18Å; A322-A347 HydrophobicContact CB-CB 3.65Å; A322-L400 HydrophobicContact CB-CD2 4.05Å; A322-F404 HydrophobicContact CB-CB 3.78Å; A322-F404 HydrophobicContact CB-CD1 3.58Å; A322-F404 HydrophobicContact CB-CD2 4.18Å; A322-F404 HydrophobicContact CB-CE1 4.09Å; A322-F404 HydrophobicContact CB-CG 3.6Å
323	L	88	Confident	81.7	Confident	17 Å²	17	59.3 Å²	59.3	9%	0.089	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	135.4	175	-162.4	76.1	0	0	0	110.1	F315 C317 K327 P342 S401	F315-L323 HydrophobicContact CB-CD1 4.01Å; F315-L323 HydrophobicContact CB-CD2 4.09Å; C317-L323 WeakPolarHBondContact SG-CD1 3.38Å; L323-K327 VanDerWaalsContact CD2-CA 3.47Å; L323-K327 HydrophobicContact CD2-CB 3.7Å; L323-P342 HydrophobicContact CD1-CB 3.81Å; L323-P342 HydrophobicContact CD1-CG 3.92Å; L323-P342 HydrophobicContact CD2-CB 4.15Å; L323-P342 HydrophobicContact CD2-CG 4.24Å; L323-P342 HydrophobicContact CG-CB 3.95Å; L323-P342 HydrophobicContact CG-CG 4.37Å; L323-S401 PolarHBondContact O-N 3.48Å
324	S	88.6	Confident	81.7	Confident	13 Å²	13	63.5 Å²	63.5	9%	0.091	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	122	170.8	179.5	0	0	0	0	108.7	P342 F343 Q399	S324-P342 WeakPolarHBondContact O-CA 3.46Å; S324-P342 WeakPolarHBondContact O-CB 3.49Å; S324-F343 PolarHBondContact N-O 3.01Å; S324-F343 PolarHBondContact O-N 2.74Å; S324-Q399 PolarHBondContact OG-O 3.41Å
325	G	83.9	Confident	81.2	Confident	52 Å²	52	61 Å²	61	54%	0.536	33%	0.332	S	S	.	.	S	Bend	trans	101.9	179.2	-168.1	0	0	0	0	0	113.1	K327	G325-K327 PolarHBondContact O-N 2.93Å
326	D	82.6	Confident	81	Confident	94 Å²	94	63.4 Å²	63.4	50%	0.503	35%	0.348	S	S	.	.			trans	-67.7	128.5	-173	-50.7	-60.8	0	0	0	112.5	R328 R329	D326-R328 PolarHBondContact O-N 3.02Å; D326-R329 IonicContact OD2-CZ 2.74Å; D326-R329 IonicContact OD2-NH1 2.69Å; D326-R329 PolarHBondContact OD2-NH1 2.99Å; D326-R329 IonicContact OD2-NH2 3.8Å; D326-R329 PolarHBondContact OD2-NH2 2.03Å
327	K	83.1	Confident	80.8	Confident	139 Å²	139	61.7 Å²	61.7	60%	0.604	34%	0.337	S	S	*	.	S	Bend	trans	-69.3	-15.8	176.5	71.2	179.9	179.8	-178.7	0	114.6	Y314 F315 L323 G325	Y314-K327 CarbonylContact C-O 3.47Å; Y314-K327 VanDerWaalsContact CA-O 3.22Å; Y314-K327 WeakPolarHBondContact CA-O 2.96Å; Y314-K327 HydrophobicContact CD1-CG 4.47Å; F315-K327 PolarHBondContact N-O 3.36Å; L323-K327 VanDerWaalsContact CD2-CA 3.47Å; L323-K327 HydrophobicContact CD2-CB 3.7Å; G325-K327 PolarHBondContact O-N 2.93Å
328	R	85.1	Confident	80.6	Confident	111 Å²	111	62.5 Å²	62.5	42%	0.419	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	133.3	-175.3	-175	-173.8	-177.1	175.4	5.6	110.1	F313 Y314 D326	F313-R328 WeakPolarHBondContact O-CA 3.25Å; Y314-R328 HydrophobicContact CD1-CB 4.44Å; Y314-R328 HydrophobicContact CE1-CB 4.15Å; Y314-R328 HydrophobicContact CE1-CG 4.34Å; Y314-R328 HydrophobicContact CE2-CG 4.01Å; D326-R328 PolarHBondContact O-N 3.02Å
329	R	80.4	Confident	80.5	Confident	19 Å²	19	60.1 Å²	60.1	7%	0.072	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	150.4	165.6	-69.6	-71.1	171.3	-126.6	-10.7	109.9	A312 F313 F315 D326 W337 S338 G339 K340	A312-R329 CarbonylContact C-O 3.58Å; A312-R329 VanDerWaalsContact CA-O 3.22Å; A312-R329 WeakPolarHBondContact CA-O 3.39Å; F313-R329 PolarHBondContact N-O 2.79Å; F313-R329 PolarHBondContact O-N 3.15Å; F315-R329 HydrophobicContact CE2-CB 4.21Å; F315-R329 HydrophobicContact CE2-CG 3.74Å; D326-R329 IonicContact OD2-CZ 2.74Å; D326-R329 IonicContact OD2-NH1 2.69Å; D326-R329 PolarHBondContact OD2-NH1 2.99Å; D326-R329 IonicContact OD2-NH2 3.8Å; D326-R329 PolarHBondContact OD2-NH2 2.03Å; R329-W337 HydrophobicContact CB-CE3 3.81Å; R329-W337 HydrophobicContact CB-CZ3 4.46Å; R329-S338 PolarHBondContact NH1-O 3.08Å; R329-S338 VanDerWaalsContact NH1-O 3.16Å; R329-G339 VanDerWaalsContact NE-C 3.33Å; R329-G339 PolarHBondContact NE-O 2.04Å; R329-K340 VanDerWaalsContact CZ-O 3.25Å; R329-K340 PolarHBondContact NE-O 2.88Å; R329-K340 PolarHBondContact NH2-O 3.05Å
330	T	80.1	Confident	81	Confident	37 Å²	37	62 Å²	62	23%	0.227	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	136.2	-179.4	52.2	0	0	0	0	109.4	Q311 A312 S338	Q311-T330 WeakPolarHBondContact O-CA 3.18Å; A312-T330 HydrophobicContact CB-CG2 4.07Å; T330-S338 PolarHBondContact N-OG 3.38Å; T330-S338 PolarHBondContact O-N 2.9Å; T330-S338 PolarHBondContact O-OG 2.71Å; T330-S338 WeakPolarHBondContact OG1-CB 3.27Å; T330-S338 PolarHBondContact OG1-OG 2.89Å
331	C	74.4	Confident	80.8	Confident	33 Å²	33	64.5 Å²	64.5	22%	0.223	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-69.7	135	175.1	179.4	0	0	0	0	109	C280 Q311 W337	C280-C331 HydrophobicContact CB-CB 3.79Å; C280-C331 WeakPolarHBondContact CB-SG 3.4Å; C280-C331 VanDerWaalsContact SG-CA 3.52Å; C280-C331 WeakPolarHBondContact SG-CB 3.48Å; C280-C331 CovalentContact SG-SG 2.03Å; C280-C331 PolarHBondContact SG-SG 2.9Å; Q311-C331 HydrophobicContact CB-CB 4.14Å; Q311-C331 PolarHBondContact O-N 2.87Å; C331-W337 HydrophobicContact CB-CE3 4.4Å; C331-W337 HydrophobicContact CB-CH2 3.85Å; C331-W337 HydrophobicContact CB-CZ2 4.46Å; C331-W337 HydrophobicContact CB-CZ3 3.88Å
332	Q	75.7	Confident	80.9	Confident	83 Å²	83	63.2 Å²	63.2	39%	0.388	35%	0.35	S	S	.	.			trans	-98.6	158.3	177.2	-66	-167.3	59.9	0	0	110.7	D334 G335 T336	Q332-D334 WeakPolarHBondContact CB-OD1 3.42Å; Q332-D334 PolarHBondContact O-N 2.78Å; Q332-D334 VanDerWaalsContact O-N 3.08Å; Q332-G335 PolarHBondContact O-N 3Å; Q332-T336 WeakPolarHBondContact CB-O 3.21Å; Q332-T336 PolarHBondContact N-O 2.77Å
333	P	69.7	Low	81	Confident	138 Å²	138	69.1 Å²	69.1	90%	0.896	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-14.7	180	-23.6	34.9	0	0	0	115.3	G335	P333-G335 VanDerWaalsContact C-N 3.31Å
334	D	73.3	Confident	81	Confident	97 Å²	97	69.1 Å²	69.1	52%	0.519	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-4.1	174.8	69.7	-12.1	0	0	0	113.5	Q332 T336	Q332-D334 WeakPolarHBondContact CB-OD1 3.42Å; Q332-D334 PolarHBondContact O-N 2.78Å; Q332-D334 VanDerWaalsContact O-N 3.08Å; D334-T336 VanDerWaalsContact CG-OG1 3.26Å; D334-T336 WeakPolarHBondContact OD1-CB 3.38Å; D334-T336 PolarHBondContact OD1-N 2.86Å; D334-T336 PolarHBondContact OD1-OG1 3.12Å; D334-T336 WeakPolarHBondContact OD2-CG2 3.03Å; D334-T336 PolarHBondContact OD2-OG1 2.86Å
335	G	68.8	Low	81	Confident	28 Å²	28	71.1 Å²	71.1	29%	0.289	39%	0.387	S	S	.	.	S	Bend	trans	87	8.8	-175.2	0	0	0	0	0	114.6	C280 Q332 P333	C280-G335 PolarHBondContact SG-O 3.43Å; C280-G335 VanDerWaalsContact SG-O 3.38Å; Q332-G335 PolarHBondContact O-N 3Å; P333-G335 VanDerWaalsContact C-N 3.31Å
336	T	80.1	Confident	81.2	Confident	65 Å²	65	74.4 Å²	74.4	40%	0.399	38%	0.383	S	S	.	.			trans	-103.5	160.8	179.5	76.2	0	0	0	0	113.2	Q332 D334	Q332-T336 WeakPolarHBondContact CB-O 3.21Å; Q332-T336 PolarHBondContact N-O 2.77Å; D334-T336 VanDerWaalsContact CG-OG1 3.26Å; D334-T336 WeakPolarHBondContact OD1-CB 3.38Å; D334-T336 PolarHBondContact OD1-N 2.86Å; D334-T336 PolarHBondContact OD1-OG1 3.12Å; D334-T336 WeakPolarHBondContact OD2-CG2 3.03Å; D334-T336 PolarHBondContact OD2-OG1 2.86Å
337	W	80.7	Confident	81.6	Confident	48 Å²	48	70 Å²	70	18%	0.182	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-88.3	144.4	174.1	-72.4	104.7	0	0	0	111.3	C280 T281 P283 Q311 F313 R329 C331 G339	C280-W337 HydrophobicContact CB-CH2 4.25Å; C280-W337 HydrophobicContact CB-CZ2 3.58Å; T281-W337 PolarHBondContact O-NE1 3.15Å; P283-W337 HydrophobicContact CG-CZ2 4.47Å; Q311-W337 HydrophobicContact CB-CH2 4.44Å; F313-W337 AromaticContact CD2-CH2 3.3Å; F313-W337 HydrophobicContact CD2-CH2 3.3Å; F313-W337 AromaticContact CD2-CZ2 3.85Å; F313-W337 HydrophobicContact CD2-CZ2 3.85Å; F313-W337 AromaticContact CD2-CZ3 3.78Å; F313-W337 HydrophobicContact CD2-CZ3 3.78Å; F313-W337 AromaticContact CE2-CH2 3.41Å; F313-W337 HydrophobicContact CE2-CH2 3.41Å; F313-W337 VanDerWaalsContact CE2-CH2 3.41Å; F313-W337 AromaticContact CE2-CZ2 3.73Å; F313-W337 HydrophobicContact CE2-CZ2 3.73Å; F313-W337 HydrophobicContact CE2-CZ3 4.33Å; R329-W337 HydrophobicContact CB-CE3 3.81Å; R329-W337 HydrophobicContact CB-CZ3 4.46Å; C331-W337 HydrophobicContact CB-CE3 4.4Å; C331-W337 HydrophobicContact CB-CH2 3.85Å; C331-W337 HydrophobicContact CB-CZ2 4.46Å; C331-W337 HydrophobicContact CB-CZ3 3.88Å; W337-G339 PolarHBondContact O-N 2.79Å
338	S	83	Confident	81.9	Confident	45 Å²	45	63.4 Å²	63.4	32%	0.315	33%	0.331	S	S	.	.	S	Bend	trans	-65.5	26	-179.4	58.9	0	0	0	0	117.3	R329 T330	R329-S338 PolarHBondContact NH1-O 3.08Å; R329-S338 VanDerWaalsContact NH1-O 3.16Å; T330-S338 PolarHBondContact N-OG 3.38Å; T330-S338 PolarHBondContact O-N 2.9Å; T330-S338 PolarHBondContact O-OG 2.71Å; T330-S338 WeakPolarHBondContact OG1-CB 3.27Å; T330-S338 PolarHBondContact OG1-OG 2.89Å
339	G	81.1	Confident	82.1	Confident	39 Å²	39	64.3 Å²	64.3	40%	0.402	33%	0.334	S	S	.	.	S	Bend	trans	153	-177.3	170.4	0	0	0	0	0	113.9	R329 W337	R329-G339 VanDerWaalsContact NE-C 3.33Å; R329-G339 PolarHBondContact NE-O 2.04Å; W337-G339 PolarHBondContact O-N 2.79Å
340	K	84.4	Confident	82.5	Confident	187 Å²	187	67 Å²	67	81%	0.813	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-70.6	150.2	-178	-62.7	-177.4	179.8	-179.8	0	112.1	R329	R329-K340 VanDerWaalsContact CZ-O 3.25Å; R329-K340 PolarHBondContact NE-O 2.88Å; R329-K340 PolarHBondContact NH2-O 3.05Å
341	Q	80.8	Confident	82.9	Confident	78 Å²	78	66 Å²	66	36%	0.364	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-62.2	131.8	176	-167.3	-171.1	9.9	0	0	110.6	P284 F315	P284-Q341 PolarHBondContact O-NE2 2.93Å; F315-Q341 HydrophobicContact CE1-CG 4.31Å; F315-Q341 HydrophobicContact CZ-CG 4.42Å
342	P	87.4	Confident	83.6	Confident	4 Å²	4	73.5 Å²	73.5	3%	0.026	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-74.7	160.5	175.6	33.5	-37.5	0	0	0	111.7	F315 L323 S324	F315-P342 HydrophobicContact CB-CG 3.71Å; F315-P342 HydrophobicContact CD1-CG 4.14Å; F315-P342 HydrophobicContact CD2-CG 3.55Å; F315-P342 HydrophobicContact CE2-CG 4.21Å; F315-P342 HydrophobicContact CG-CG 3.51Å; L323-P342 HydrophobicContact CD1-CB 3.81Å; L323-P342 HydrophobicContact CD1-CG 3.92Å; L323-P342 HydrophobicContact CD2-CB 4.15Å; L323-P342 HydrophobicContact CD2-CG 4.24Å; L323-P342 HydrophobicContact CG-CB 3.95Å; L323-P342 HydrophobicContact CG-CG 4.37Å; S324-P342 WeakPolarHBondContact O-CA 3.46Å; S324-P342 WeakPolarHBondContact O-CB 3.49Å
343	F	89.1	Confident	84.1	Confident	125 Å²	125	71.7 Å²	71.7	55%	0.548	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	147.6	-177.7	8.1	-88.8	0	0	0	112.2	S324	S324-F343 PolarHBondContact N-O 3.01Å; S324-F343 PolarHBondContact O-N 2.74Å
344	C	89	Confident	84.8	Confident	16 Å²	16	68.2 Å²	68.2	11%	0.108	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	108.1	178.4	-68	0	0	0	0	111.1	V287 N288 C317 Y321 A322	V287-C344 WeakPolarHBondContact O-CB 3.27Å; N288-C344 HydrophobicContact CB-CB 4.47Å; C317-C344 VanDerWaalsContact CA-SG 3.54Å; C317-C344 HydrophobicContact CB-CB 3.81Å; C317-C344 WeakPolarHBondContact CB-SG 3.4Å; C317-C344 WeakPolarHBondContact SG-CA 3.37Å; C317-C344 WeakPolarHBondContact SG-CB 3.45Å; C317-C344 CovalentContact SG-SG 2.04Å; C317-C344 PolarHBondContact SG-SG 3.32Å; Y321-C344 HydrophobicContact CD1-CB 4.4Å; Y321-C344 HydrophobicContact CG-CB 4.45Å; A322-C344 CarbonylContact O-C 3.42Å; A322-C344 WeakPolarHBondContact O-CA 3.4Å
345	L	89.4	Confident	85.3	Confident	55 Å²	55	72.8 Å²	72.8	29%	0.288	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	138	178.5	-61.4	-178.4	0	0	0	110.7	Y321 A322 A347 P398 L400	Y321-L345 CarbonylContact C-O 3.57Å; Y321-L345 WeakPolarHBondContact CA-O 3.44Å; A322-L345 PolarHBondContact N-O 3Å; A322-L345 PolarHBondContact O-N 3.18Å; L345-A347 PolarHBondContact O-N 3.27Å; L345-P398 HydrophobicContact CD1-CB 3.42Å; L345-P398 VanDerWaalsContact CD1-CB 3.42Å; L345-P398 HydrophobicContact CD1-CG 3.93Å; L345-L400 HydrophobicContact CB-CD2 4.44Å; L345-L400 HydrophobicContact CD1-CD2 4.32Å
346	R	87.6	Confident	86.1	Confident	122 Å²	122	72.9 Å²	72.9	46%	0.46	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	121.6	-178.4	-164.3	177.1	-70.7	-177	-1.5	110.6	S320 Y321 L407 K432	S320-R346 WeakPolarHBondContact O-CA 3.04Å; S320-R346 VanDerWaalsContact O-CG 3.27Å; S320-R346 WeakPolarHBondContact O-CG 3.04Å; Y321-R346 HydrophobicContact CD1-CB 3.93Å; Y321-R346 HydrophobicContact CD1-CG 4.42Å; Y321-R346 HydrophobicContact CE1-CB 3.82Å; Y321-R346 HydrophobicContact CE1-CG 4.21Å; Y321-R346 PolarHBondContact OH-NE 2.91Å; Y321-R346 PolarHBondContact OH-NH2 2.87Å; R346-L407 HydrophobicContact CG-CD2 4.4Å; R346-L407 WeakPolarHBondContact O-CD2 3.01Å; R346-K432 WeakPolarHBondContact CD-O 3.35Å; R346-K432 PolarHBondContact NH1-O 2.85Å; R346-K432 VanDerWaalsContact NH1-O 3.15Å
347	A	90.1	Very high	86.4	Confident	1 Å²	1	70.3 Å²	70.3	1%	0.008	34%	0.34	C	S	.	.			trans	-155.7	157.3	-170.6	0	0	0	0	0	110.2	S320 A322 L345 L400 F404 H405	S320-A347 CarbonylContact C-O 3.54Å; S320-A347 VanDerWaalsContact C-O 3.31Å; S320-A347 PolarHBondContact O-N 2.98Å; S320-A347 VanDerWaalsContact O-N 3.12Å; S320-A347 VanDerWaalsContact O-O 3.09Å; A322-A347 HydrophobicContact CB-CB 3.65Å; L345-A347 PolarHBondContact O-N 3.27Å; A347-L400 HydrophobicContact CB-CD1 4.1Å; A347-F404 HydrophobicContact CB-CB 4.49Å; A347-F404 HydrophobicContact CB-CD1 4.31Å; A347-H405 WeakPolarHBondContact CB-O 3.29Å
348	C	89.4	Confident	86.8	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	127	175.8	-57.9	0	0	0	0	110.5	F404 H405 C430 W436	C348-F404 WeakPolarHBondContact O-CA 3.34Å; C348-H405 PolarHBondContact N-O 3Å; C348-H405 PolarHBondContact O-N 3.26Å; C348-C430 HydrophobicContact CB-CB 3.75Å; C348-C430 WeakPolarHBondContact CB-SG 3.31Å; C348-C430 PolarHBondContact N-SG 2.99Å; C348-C430 WeakPolarHBondContact SG-CA 3.3Å; C348-C430 WeakPolarHBondContact SG-CB 3.2Å; C348-C430 CovalentContact SG-SG 2.03Å; C348-C430 PolarHBondContact SG-SG 2.65Å; C348-W436 HydrophobicContact CB-CD2 4.26Å; C348-W436 HydrophobicContact CB-CZ2 3.83Å
349	R	90.1	Very high	87.1	Confident	130 Å²	130	73.6 Å²	73.6	49%	0.491	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	140.2	168.4	178.3	177.7	-79.2	170.1	-9.5	110	G403 F404 W436	R349-G403 WeakPolarHBondContact CA-O 3.41Å; R349-F404 HydrophobicContact CB-CD1 4.06Å; R349-F404 HydrophobicContact CB-CE1 3.83Å; R349-F404 HydrophobicContact CB-CZ 4.31Å; R349-W436 PolarHBondContact O-NE1 3.42Å
350	E	89.1	Confident	87.6	Confident	77 Å²	77	78 Å²	78	36%	0.36	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-55.1	128.2	177.5	-168.8	155.7	-138.4	0	0	111.5	K352 G403 H405	E350-K352 PolarHBondContact O-N 3.11Å; E350-G403 WeakPolarHBondContact CB-O 3.5Å; E350-G403 PolarHBondContact N-O 2.96Å; E350-H405 WeakPolarHBondContact CA-NE2 3.28Å; E350-H405 VanDerWaalsContact CB-NE2 3.31Å; E350-H405 WeakPolarHBondContact CB-NE2 3.43Å; E350-H405 VanDerWaalsContact CG-NE2 3.34Å; E350-H405 WeakPolarHBondContact CG-NE2 3.5Å; E350-H405 IonicContact OE1-CE1 3.59Å; E350-H405 IonicContact OE1-NE2 3.02Å
351	P	88.4	Confident	87.8	Confident	15 Å²	15	73.2 Å²	73.2	10%	0.097	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-67.9	122.1	180	-25.8	39.3	0	0	0	112	V353 Q359 I411 Y413 W436	P351-V353 PolarHBondContact O-N 3.28Å; P351-Q359 PolarHBondContact O-NE2 2.93Å; P351-Q359 VanDerWaalsContact O-NE2 3.11Å; P351-I411 HydrophobicContact CG-CD1 4.35Å; P351-Y413 WeakPolarHBondContact CG-OH 3.38Å; P351-W436 HydrophobicContact CG-CD2 4.02Å; P351-W436 HydrophobicContact CG-CG 3.98Å; P351-W436 HydrophobicContact CG-CZ2 4.33Å; P351-W436 VanDerWaalsContact CG-NE1 3.34Å
352	K	88.3	Confident	88.1	Confident	190 Å²	190	71.7 Å²	71.7	83%	0.826	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-62.7	123.2	167	-65.7	-170.7	176.5	-171.5	0	109.5	E350 H440	E350-K352 PolarHBondContact O-N 3.11Å; K352-H440 PolarHBondContact O-NE2 3.03Å
353	V	86.3	Confident	87.7	Confident	46 Å²	46	75.8 Å²	75.8	28%	0.279	36%	0.362	S	S	.	.			trans	-129.2	167.3	173.6	-60.2	0	0	0	0	109.9	P351 V357 Q359 Y413	P351-V353 PolarHBondContact O-N 3.28Å; V353-V357 HydrophobicContact CB-CB 3.93Å; V353-V357 HydrophobicContact CB-CG1 4.27Å; V353-V357 HydrophobicContact CB-CG2 4.19Å; V353-V357 HydrophobicContact CG1-CG1 4.38Å; V353-V357 HydrophobicContact CG2-CB 3.89Å; V353-V357 HydrophobicContact CG2-CG1 4.27Å; V353-Q359 HydrophobicContact CG2-CG 4.17Å; V353-Y413 HydrophobicContact CG1-CD1 4.39Å; V353-Y413 HydrophobicContact CG1-CE1 3.93Å
354	S	84.8	Confident	87.2	Confident	64 Å²	64	71.9 Å²	71.9	45%	0.448	35%	0.349	S	S	.	.			trans	-73	154.1	170.3	179.4	0	0	0	0	111.1	L356 V357	S354-L356 PolarHBondContact O-N 3.23Å; S354-L356 PolarHBondContact OG-N 2.91Å; S354-V357 WeakPolarHBondContact O-CB 3.46Å; S354-V357 PolarHBondContact O-N 3.37Å
355	E	83.7	Confident	86.4	Confident	193 Å²	193	77.6 Å²	77.6	90%	0.902	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-22.9	170	-60.1	175.3	168.8	0	0	113.6	V357	E355-V357 PolarHBondContact O-N 3.3Å
356	L	84.4	Confident	84.9	Confident	31 Å²	31	80.8 Å²	80.8	16%	0.162	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-7.8	174.4	-61.9	177.1	0	0	0	114	S354 C415 A416 Y420 C443	S354-L356 PolarHBondContact O-N 3.23Å; S354-L356 PolarHBondContact OG-N 2.91Å; L356-C415 CarbonylContact O-C 3.55Å; L356-C415 WeakPolarHBondContact O-CA 3.37Å; L356-A416 PolarHBondContact O-N 3.3Å; L356-Y420 HydrophobicContact CD1-CD1 4.03Å; L356-Y420 HydrophobicContact CD1-CE1 3.53Å; L356-Y420 HydrophobicContact CD2-CD1 4.5Å; L356-Y420 HydrophobicContact CD2-CE1 3.84Å; L356-Y420 HydrophobicContact CD2-CE2 4.07Å; L356-Y420 HydrophobicContact CG-CE1 4.26Å; L356-C443 HydrophobicContact CB-CB 4.07Å
357	V	87.6	Confident	83.5	Confident	11 Å²	11	78.7 Å²	78.7	7%	0.067	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	113.8	-178.6	-172.5	0	0	0	0	109.2	V353 S354 E355 Y413 V441 C443	V353-V357 HydrophobicContact CB-CB 3.93Å; V353-V357 HydrophobicContact CB-CG1 4.27Å; V353-V357 HydrophobicContact CB-CG2 4.19Å; V353-V357 HydrophobicContact CG1-CG1 4.38Å; V353-V357 HydrophobicContact CG2-CB 3.89Å; V353-V357 HydrophobicContact CG2-CG1 4.27Å; S354-V357 WeakPolarHBondContact O-CB 3.46Å; S354-V357 PolarHBondContact O-N 3.37Å; E355-V357 PolarHBondContact O-N 3.3Å; V357-Y413 HydrophobicContact CG1-CD1 3.69Å; V357-Y413 HydrophobicContact CG1-CG 4.4Å; V357-V441 HydrophobicContact CG1-CG1 4.1Å; V357-C443 HydrophobicContact CG2-CB 4.28Å
358	K	88.6	Confident	81.8	Confident	101 Å²	101	82.2 Å²	82.2	44%	0.439	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	140.5	169	-67.1	167.3	174.8	163.5	0	109	Y413 E414 A416	K358-Y413 WeakPolarHBondContact O-CA 3.43Å; K358-E414 HydrophobicContact CB-CG 3.65Å; K358-E414 HydrophobicContact CD-CG 4.09Å; K358-E414 WeakPolarHBondContact CD-OE1 3.41Å; K358-E414 HydrophobicContact CG-CG 4.47Å; K358-E414 PolarHBondContact N-O 2.94Å; K358-E414 PolarHBondContact O-N 3.32Å; K358-E414 VanDerWaalsContact O-N 3.16Å; K358-A416 PolarHBondContact NZ-O 3.29Å
359	Q	89.9	Confident	80.1	Confident	61 Å²	61	93.9 Å²	93.9	29%	0.285	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	135	177.9	-61.3	-165.4	13.4	0	0	110.6	P351 V353 I411 Y413	P351-Q359 PolarHBondContact O-NE2 2.93Å; P351-Q359 VanDerWaalsContact O-NE2 3.11Å; V353-Q359 HydrophobicContact CG2-CG 4.17Å; Q359-I411 HydrophobicContact CB-CG2 3.95Å; Q359-I411 HydrophobicContact CG-CG2 4.24Å; Q359-Y413 HydrophobicContact CG-CD1 3.94Å; Q359-Y413 HydrophobicContact CG-CE1 3.84Å
360	K	90.5	Very high	77.9	Confident	130 Å²	130	94.1 Å²	94.1	57%	0.565	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.4	107.5	171.5	-173.8	-178.8	-177.8	-176.3	0	109.4	L362 I411 E412	K360-L362 HydrophobicContact CD-CD2 4.44Å; K360-L362 HydrophobicContact CG-CD2 4.28Å; K360-I411 WeakPolarHBondContact O-CA 3.46Å; K360-E412 HydrophobicContact CB-CB 4.37Å; K360-E412 PolarHBondContact N-O 3.16Å; K360-E412 PolarHBondContact O-N 3.16Å
361	I	89.3	Confident	76.2	Confident	88 Å²	88	94.4 Å²	94.4	45%	0.451	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	123.5	178.9	-57	160.5	0	0	0	108.7	T409 I411	I361-T409 HydrophobicContact CG2-CG2 3.75Å; I361-I411 HydrophobicContact CG1-CG1 4.26Å
362	L	86.9	Confident	74.6	Confident	45 Å²	45	100.1 Å²	100.1	24%	0.236	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	140.6	173.3	-56.1	179.3	0	0	0	110.2	K360 T409 H410 E412	K360-L362 HydrophobicContact CD-CD2 4.44Å; K360-L362 HydrophobicContact CG-CD2 4.28Å; L362-T409 WeakPolarHBondContact O-CG2 3.4Å; L362-H410 HydrophobicContact CB-CB 4.2Å; L362-H410 HydrophobicContact CD1-CB 4.49Å; L362-H410 PolarHBondContact N-O 3.47Å; L362-H410 PolarHBondContact O-N 3.14Å; L362-E412 HydrophobicContact CD1-CG 4.14Å; L362-E412 WeakPolarHBondContact CD1-OE1 3.48Å
363	P	79.7	Confident	72.8	Confident	91 Å²	91	95.5 Å²	95.5	59%	0.591	49%	0.494	S	S	*	.			trans	-60.3	157	-177	25.7	-35.1	0	0	0	112.4	Q365	P363-Q365 PolarHBondContact O-N 3.09Å
364	P	78.8	Confident	71.1	Confident	42 Å²	42	98 Å²	98	27%	0.273	50%	0.503	S	S	.	.			trans	-64.6	109.6	-177.4	26.6	-34.3	0	0	0	111.5	L397 H406 L407 Y408	P364-L397 HydrophobicContact CG-CD1 3.96Å; P364-H406 HydrophobicContact CG-CB 4.41Å; P364-L407 WeakPolarHBondContact CB-O 3Å; P364-Y408 WeakPolarHBondContact CA-O 3.34Å
365	Q	70.9	Confident	69.5	Low	137 Å²	137	102.9 Å²	102.9	64%	0.64	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-88.7	117.4	172.1	-67.5	-166.6	-2.7	0	0	109.2	P363 P367 Y408	P363-Q365 PolarHBondContact O-N 3.09Å; Q365-P367 WeakPolarHBondContact O-CD 3.38Å; Q365-Y408 WeakPolarHBondContact O-CB 3.36Å
366	V	59.7	Low	67.9	Low	122 Å²	122	99 Å²	99	74%	0.739	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-64.3	124.8	174.5	-176.4	0	0	0	0	108.3	S368	V366-S368 PolarHBondContact O-N 3.01Å
367	P	57.7	Low	66.3	Low	78 Å²	78	102.7 Å²	102.7	51%	0.506	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-56.4	125.3	176.8	-25	34	0	0	0	110.6	Q365 R369 Y408	Q365-P367 WeakPolarHBondContact O-CD 3.38Å; P367-R369 PolarHBondContact O-N 2.8Å; P367-Y408 HydrophobicContact CG-CD1 3.85Å; P367-Y408 HydrophobicContact CG-CE1 3.85Å; P367-Y408 HydrophobicContact CG-CG 4.48Å
368	S	54.2	Low	64.5	Low	74 Å²	74	105.3 Å²	105.3	52%	0.517	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-55.2	130.8	176.5	118.7	0	0	0	0	109.1	V366 K370	V366-S368 PolarHBondContact O-N 3.01Å; S368-K370 CarbonylContact O-C 3.53Å; S368-K370 PolarHBondContact O-N 3.06Å; S368-K370 PolarHBondContact OG-N 2.86Å; S368-K370 PolarHBondContact OG-O 3.07Å
369	R	53.1	Low	62.7	Low	245 Å²	245	105.1 Å²	105.1	93%	0.925	55%	0.546	S	S	*	.	S	Bend	trans	-57.7	-17.1	-179.4	-77.2	-174.2	175.4	-176.2	-1.2	113.9	P367 T371	P367-R369 PolarHBondContact O-N 2.8Å; R369-T371 PolarHBondContact O-N 2.94Å
370	K	44.2	Very low	61	Low	136 Å²	136	106.2 Å²	106.2	59%	0.591	57%	0.565	S	S	*	*			trans	-80.2	94.7	169.8	-62.7	-175.2	179.7	-175.5	0	109.4	S368	S368-K370 CarbonylContact O-C 3.53Å; S368-K370 PolarHBondContact O-N 3.06Å; S368-K370 PolarHBondContact OG-N 2.86Å; S368-K370 PolarHBondContact OG-O 3.07Å
371	T	53.2	Low	59	Low	82 Å²	82	104.2 Å²	104.2	50%	0.503	56%	0.563	S	S	.	*			trans	-61.3	160.7	163.4	66.1	0	0	0	0	109.7	R369 V373 H374 R375	R369-T371 PolarHBondContact O-N 2.94Å; T371-V373 PolarHBondContact O-N 2.99Å; T371-H374 PolarHBondContact O-N 2.82Å; T371-H374 WeakPolarHBondContact OG1-CB 3.33Å; T371-H374 PolarHBondContact OG1-N 3.29Å; T371-R375 PolarHBondContact O-N 2.83Å
372	I	54	Low	56.9	Low	136 Å²	136	108.2 Å²	108.2	70%	0.697	59%	0.586	S	S	*	*	H	α-helix	trans	-57.1	-41.6	175.6	-65.4	171.4	0	0	0	110	H374 R375 L376	I372-H374 PolarHBondContact O-N 3.04Å; I372-R375 WeakPolarHBondContact O-CB 3.22Å; I372-R375 PolarHBondContact O-N 2.77Å; I372-R375 VanDerWaalsContact O-N 3.11Å; I372-L376 HydrophobicContact CG2-CD1 3.93Å; I372-L376 HydrophobicContact CG2-CG 4.49Å; I372-L376 WeakPolarHBondContact O-CG 3.41Å; I372-L376 PolarHBondContact O-N 3.27Å
373	V	51.3	Low	54.9	Low	93 Å²	93	113.6 Å²	113.6	56%	0.564	61%	0.61	S	S	*	*	H	α-helix	trans	-58.5	-44.7	173.1	-176.2	0	0	0	0	111.8	T371 R375 L376 L377	T371-V373 PolarHBondContact O-N 2.99Å; V373-R375 VanDerWaalsContact C-N 3.28Å; V373-R375 PolarHBondContact O-N 2.97Å; V373-L376 PolarHBondContact O-N 2.96Å; V373-L377 HydrophobicContact CG1-CD1 3.81Å; V373-L377 HydrophobicContact CG1-CG 4.39Å; V373-L377 WeakPolarHBondContact O-CB 3.32Å; V373-L377 WeakPolarHBondContact O-CG 3.22Å; V373-L377 PolarHBondContact O-N 3.04Å
374	H	51.7	Low	53.1	Low	99 Å²	99	119.4 Å²	119.4	46%	0.458	63%	0.626	S	S	.	*	H	α-helix	trans	-66.9	-29.9	176.7	-154.5	-43.7	0	0	0	112.3	T371 I372 S378	T371-H374 PolarHBondContact O-N 2.82Å; T371-H374 WeakPolarHBondContact OG1-CB 3.33Å; T371-H374 PolarHBondContact OG1-N 3.29Å; I372-H374 PolarHBondContact O-N 3.04Å; H374-S378 PolarHBondContact ND1-OG 2.84Å; H374-S378 VanDerWaalsContact O-CB 3.25Å; H374-S378 WeakPolarHBondContact O-CB 3.5Å; H374-S378 PolarHBondContact O-N 2.8Å; H374-S378 PolarHBondContact O-OG 2.78Å
375	R	49.7	Very low	51	Low	165 Å²	165	125.3 Å²	125.3	62%	0.623	65%	0.654	S	S	*	*	H	α-helix	trans	-72.7	-38.5	175.6	-154.9	-177.5	-69.3	-170.5	-1.9	111.4	T371 I372 V373 S379	T371-R375 PolarHBondContact O-N 2.83Å; I372-R375 WeakPolarHBondContact O-CB 3.22Å; I372-R375 PolarHBondContact O-N 2.77Å; I372-R375 VanDerWaalsContact O-N 3.11Å; V373-R375 VanDerWaalsContact C-N 3.28Å; V373-R375 PolarHBondContact O-N 2.97Å; R375-S379 PolarHBondContact O-N 3.29Å; R375-S379 PolarHBondContact O-OG 3.32Å
376	L	51.3	Low	49.2	Very low	113 Å²	113	126.8 Å²	126.8	59%	0.592	66%	0.661	S	S	*	*	H	α-helix	trans	-70.8	-39.9	174.8	-69.7	165.2	0	0	0	112.9	I372 V373 S379	I372-L376 HydrophobicContact CG2-CD1 3.93Å; I372-L376 HydrophobicContact CG2-CG 4.49Å; I372-L376 WeakPolarHBondContact O-CG 3.41Å; I372-L376 PolarHBondContact O-N 3.27Å; V373-L376 PolarHBondContact O-N 2.96Å; L376-S379 WeakPolarHBondContact CA-OG 3.46Å; L376-S379 PolarHBondContact O-N 3.41Å; L376-S379 PolarHBondContact O-OG 3.22Å
377	L	50.9	Low	47.8	Very low	107 Å²	107	126.7 Å²	126.7	56%	0.56	67%	0.666	S	S	*	*	H	α-helix	trans	-68.7	-38.6	174.5	-73.5	167.3	0	0	0	111.8	V373 S379 A380 V381	V373-L377 HydrophobicContact CG1-CD1 3.81Å; V373-L377 HydrophobicContact CG1-CG 4.39Å; V373-L377 WeakPolarHBondContact O-CB 3.32Å; V373-L377 WeakPolarHBondContact O-CG 3.22Å; V373-L377 PolarHBondContact O-N 3.04Å; L377-S379 VanDerWaalsContact C-N 3.25Å; L377-S379 PolarHBondContact O-N 2.96Å; L377-A380 PolarHBondContact O-N 3.11Å; L377-V381 PolarHBondContact O-N 3.49Å
378	S	48.5	Very low	46.5	Very low	67 Å²	67	132 Å²	132	47%	0.469	68%	0.681	S	S	.	*	H	α-helix	trans	-68.9	-17.8	175.6	-68.2	0	0	0	0	114.1	H374	H374-S378 PolarHBondContact ND1-OG 2.84Å; H374-S378 VanDerWaalsContact O-CB 3.25Å; H374-S378 WeakPolarHBondContact O-CB 3.5Å; H374-S378 PolarHBondContact O-N 2.8Å; H374-S378 PolarHBondContact O-OG 2.78Å
379	S	51.8	Low	45.5	Very low	97 Å²	97	130.9 Å²	130.9	68%	0.678	68%	0.681	S	S	*	*	H	α-helix	trans	-79.9	-16.5	167.3	38.1	0	0	0	0	113.8	R375 L376 L377	R375-S379 PolarHBondContact O-N 3.29Å; R375-S379 PolarHBondContact O-OG 3.32Å; L376-S379 WeakPolarHBondContact CA-OG 3.46Å; L376-S379 PolarHBondContact O-N 3.41Å; L376-S379 PolarHBondContact O-OG 3.22Å; L377-S379 VanDerWaalsContact C-N 3.25Å; L377-S379 PolarHBondContact O-N 2.96Å
380	A	53.6	Low	44.7	Very low	83 Å²	83	125.9 Å²	125.9	69%	0.686	68%	0.68	S	S	*	*	H	α-helix	trans	-94.3	-17.9	178.1	0	0	0	0	0	113.7	L377	L377-A380 PolarHBondContact O-N 3.11Å
381	V	49.3	Very low	44.2	Very low	88 Å²	88	125.5 Å²	125.5	53%	0.533	69%	0.689	S	S	.	*	S	Bend	trans	-121.6	102.9	-179.3	-177.9	0	0	0	0	110.2	L377 Q383	L377-V381 PolarHBondContact O-N 3.49Å; V381-Q383 HydrophobicContact CG1-CB 4.43Å; V381-Q383 HydrophobicContact CG1-CG 4.27Å; V381-Q383 PolarHBondContact O-N 2.73Å
382	N	45.3	Very low	43.6	Very low	173 Å²	173	131.1 Å²	131.1	93%	0.925	71%	0.707	S	S	*	*			trans	-81.7	60.6	-174.1	-156.4	9.8	0	0	0	112.4
383	Q	43.5	Very low	42.8	Very low	158 Å²	158	129.8 Å²	129.8	74%	0.738	71%	0.71	S	S	*	*			trans	-113.1	122.2	174.9	-75.4	-170.6	-12	0	0	111.9	V381 L385	V381-Q383 HydrophobicContact CG1-CB 4.43Å; V381-Q383 HydrophobicContact CG1-CG 4.27Å; V381-Q383 PolarHBondContact O-N 2.73Å; Q383-L385 PolarHBondContact O-N 2.77Å
384	K	42.3	Very low	42.4	Very low	213 Å²	213	130.6 Å²	130.6	93%	0.926	72%	0.719	S	S	*	*			trans	-64.5	96.7	174.7	-74	177	174.6	175.1	0	110.6
385	L	35.2	Very low	42.6	Very low	166 Å²	166	130.7 Å²	130.7	87%	0.869	73%	0.729	S	S	*	*			trans	-89.7	124.2	162.3	-135	78.3	0	0	0	109.7	Q383	Q383-L385 PolarHBondContact O-N 2.77Å
386	Q	32.7	Very low	42.9	Very low	168 Å²	168	129.7 Å²	129.7	79%	0.785	74%	0.741	S	S	*	*			trans	-59.6	141.2	-175.4	-72.7	170.5	-27.5	0	0	112.4	F388	Q386-F388 PolarHBondContact O-N 3.16Å; Q386-F388 VanDerWaalsContact O-N 3.09Å
387	S	30.4	Very low	43.7	Very low	119 Å²	119	128.2 Å²	128.2	83%	0.832	73%	0.733	S	S	*	*			trans	-74.8	94.4	175.9	54.2	0	0	0	0	111.2	G389	S387-G389 PolarHBondContact O-N 3.46Å
388	F	30.6	Very low	44.7	Very low	191 Å²	191	126.2 Å²	126.2	84%	0.838	73%	0.727	S	S	*	*			trans	-65.8	116.1	159.1	-81.3	-87.9	0	0	0	108.9	Q386	Q386-F388 PolarHBondContact O-N 3.16Å; Q386-F388 VanDerWaalsContact O-N 3.09Å
389	G	33.3	Very low	46.1	Very low	49 Å²	49	131.1 Å²	131.1	51%	0.505	74%	0.742	S	S	.	*			trans	-62.8	161	177.7	0	0	0	0	0	112.7	S387 T391	S387-G389 PolarHBondContact O-N 3.46Å; G389-T391 PolarHBondContact O-N 2.88Å
390	P	34.9	Very low	47.5	Very low	141 Å²	141	128.1 Å²	128.1	92%	0.916	72%	0.718	S	S	*	*			trans	-65.1	103.8	-177.8	27.8	-34	0	0	0	110.2
391	T	35	Very low	48.8	Very low	127 Å²	127	126.2 Å²	126.2	78%	0.779	70%	0.7	S	S	*	*			trans	-87	132.8	176.5	13	0	0	0	0	110.6	G389	G389-T391 PolarHBondContact O-N 2.88Å
392	K	39.3	Very low	50.4	Low	200 Å²	200	131.5 Å²	131.5	87%	0.87	72%	0.719	S	S	*	*	S	Bend	trans	81.9	139.3	169.9	-58.1	-178	176.9	-177.8	0	116.6
393	S	38.2	Very low	52.3	Low	109 Å²	109	124.4 Å²	124.4	76%	0.762	69%	0.687	S	S	*	*			trans	-53.1	160.9	174.9	37.7	0	0	0	0	113.2
394	S	43.3	Very low	54.4	Low	109 Å²	109	118.9 Å²	118.9	76%	0.762	66%	0.66	S	S	*	*			trans	-44.4	127.1	172.3	-61.6	0	0	0	0	110.8	V396	S394-V396 PolarHBondContact O-N 2.03Å
395	P	54.9	Low	56.6	Low	102 Å²	102	109.6 Å²	109.6	66%	0.662	62%	0.62	S	S	*	*			trans	-61.4	127	178.5	25.3	-33.1	0	0	0	108.9	L397	P395-L397 PolarHBondContact O-N 2.9Å
396	V	57.7	Low	59.2	Low	144 Å²	144	103.9 Å²	103.9	87%	0.873	59%	0.589	S	S	*	*			trans	-62.5	103.8	170.6	179.6	0	0	0	0	107	S394	S394-V396 PolarHBondContact O-N 2.03Å
397	L	67.9	Low	61.9	Low	82 Å²	82	98.2 Å²	98.2	43%	0.429	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-69.9	131	-177.6	-73.1	171.7	0	0	0	109.2	P364 P395	P364-L397 HydrophobicContact CG-CD1 3.96Å; P395-L397 PolarHBondContact O-N 2.9Å
398	P	71.9	Confident	64.6	Low	65 Å²	65	95.5 Å²	95.5	42%	0.422	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-59.1	139.9	176.6	-24.4	34	0	0	0	111.5	L345 L400 H406	L345-P398 HydrophobicContact CD1-CB 3.42Å; L345-P398 VanDerWaalsContact CD1-CB 3.42Å; L345-P398 HydrophobicContact CD1-CG 3.93Å; P398-L400 PolarHBondContact O-N 3.48Å; P398-H406 PolarHBondContact O-CE1 3.18Å
399	Q	76.4	Confident	67.4	Low	170 Å²	170	86.7 Å²	86.7	79%	0.794	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-64.7	121	179.6	-170.6	174.7	1.8	0	0	110.9	S324	S324-Q399 PolarHBondContact OG-O 3.41Å
400	L	81.3	Confident	70.2	Confident	33 Å²	33	85.9 Å²	85.9	17%	0.173	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-97.4	152.5	175.1	-58.8	-175.1	0	0	0	111.3	A322 L345 A347 P398 F404	A322-L400 HydrophobicContact CB-CD2 4.05Å; L345-L400 HydrophobicContact CB-CD2 4.44Å; L345-L400 HydrophobicContact CD1-CD2 4.32Å; A347-L400 HydrophobicContact CB-CD1 4.1Å; P398-L400 PolarHBondContact O-N 3.48Å; L400-F404 HydrophobicContact CD1-CB 4.39Å
401	S	81.8	Confident	72.9	Confident	44 Å²	44	79.1 Å²	79.1	31%	0.308	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-59.4	144.3	163.9	56.1	0	0	0	0	112.2	L323 F404	L323-S401 PolarHBondContact O-N 3.48Å; S401-F404 PolarHBondContact O-N 2.88Å; S401-F404 VanDerWaalsContact OG-CD2 3.29Å; S401-F404 WeakPolarHBondContact OG-CD2 3.4Å
402	Q	82.1	Confident	75.6	Confident	199 Å²	199	75.9 Å²	75.9	93%	0.93	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	142.6	175	-170.7	177.7	5.8	0	0	112.4
403	G	85	Confident	78	Confident	24 Å²	24	67.1 Å²	67.1	25%	0.247	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	20.1	-176.9	0	0	0	0	0	114.7	R349 E350	R349-G403 WeakPolarHBondContact CA-O 3.41Å; E350-G403 WeakPolarHBondContact CB-O 3.5Å; E350-G403 PolarHBondContact N-O 2.96Å
404	F	88.1	Confident	80.6	Confident	42 Å²	42	67.5 Å²	67.5	18%	0.184	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	147.3	172.9	-73.1	-98.3	0	0	0	111.8	Y321 A322 A347 C348 R349 L400 S401	Y321-F404 WeakPolarHBondContact O-CE1 3.05Å; A322-F404 HydrophobicContact CB-CB 3.78Å; A322-F404 HydrophobicContact CB-CD1 3.58Å; A322-F404 HydrophobicContact CB-CD2 4.18Å; A322-F404 HydrophobicContact CB-CE1 4.09Å; A322-F404 HydrophobicContact CB-CG 3.6Å; A347-F404 HydrophobicContact CB-CB 4.49Å; A347-F404 HydrophobicContact CB-CD1 4.31Å; C348-F404 WeakPolarHBondContact O-CA 3.34Å; R349-F404 HydrophobicContact CB-CD1 4.06Å; R349-F404 HydrophobicContact CB-CE1 3.83Å; R349-F404 HydrophobicContact CB-CZ 4.31Å; L400-F404 HydrophobicContact CD1-CB 4.39Å; S401-F404 PolarHBondContact O-N 2.88Å; S401-F404 VanDerWaalsContact OG-CD2 3.29Å; S401-F404 WeakPolarHBondContact OG-CD2 3.4Å
405	H	89.2	Confident	82.8	Confident	18 Å²	18	63.3 Å²	63.3	8%	0.083	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	149.3	-177.6	-48.9	-93.6	0	0	0	111.4	A347 C348 E350 T409 W436	A347-H405 WeakPolarHBondContact CB-O 3.29Å; C348-H405 PolarHBondContact N-O 3Å; C348-H405 PolarHBondContact O-N 3.26Å; E350-H405 WeakPolarHBondContact CA-NE2 3.28Å; E350-H405 VanDerWaalsContact CB-NE2 3.31Å; E350-H405 WeakPolarHBondContact CB-NE2 3.43Å; E350-H405 VanDerWaalsContact CG-NE2 3.34Å; E350-H405 WeakPolarHBondContact CG-NE2 3.5Å; E350-H405 IonicContact OE1-CE1 3.59Å; E350-H405 IonicContact OE1-NE2 3.02Å; H405-T409 HydrophobicContact CB-CG2 3.84Å; H405-W436 HydrophobicContact CB-CH2 4.24Å; H405-W436 HydrophobicContact CB-CZ2 4.15Å; H405-W436 AromaticContact CD2-CZ2 3.62Å; H405-W436 AromaticContact CG-CZ2 4Å
406	H	89.3	Confident	84.3	Confident	45 Å²	45	60.1 Å²	60.1	21%	0.208	32%	0.317	C	S	.	.			trans	-66.1	159.2	176.7	-68.1	-79.3	0	0	0	112.5	P364 P398 Y408 T409 C430	P364-H406 HydrophobicContact CG-CB 4.41Å; P398-H406 PolarHBondContact O-CE1 3.18Å; H406-Y408 PolarHBondContact O-N 3Å; H406-T409 VanDerWaalsContact O-CB 3.3Å; H406-T409 WeakPolarHBondContact O-CB 3.48Å; H406-T409 PolarHBondContact O-N 3.49Å; H406-T409 VanDerWaalsContact O-N 3.13Å; H406-T409 PolarHBondContact O-OG1 3.33Å; H406-C430 WeakPolarHBondContact O-CB 3.41Å; H406-C430 PolarHBondContact O-SG 2.69Å; H406-C430 VanDerWaalsContact O-SG 3.41Å
407	L	89	Confident	85.5	Confident	49 Å²	49	55.5 Å²	55.5	26%	0.257	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	138.7	170.1	-52.5	-178.7	0	0	0	109.8	R346 P364 T409 L431	R346-L407 HydrophobicContact CG-CD2 4.4Å; R346-L407 WeakPolarHBondContact O-CD2 3.01Å; P364-L407 WeakPolarHBondContact CB-O 3Å; L407-T409 PolarHBondContact O-N 2.87Å; L407-L431 WeakPolarHBondContact CD2-O 3.46Å
408	Y	88.2	Confident	86.3	Confident	63 Å²	63	57.4 Å²	57.4	25%	0.247	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	8.2	-173.9	-36.4	-77	0	0	0	116.7	P364 Q365 P367 H406 H410 C430 K432	P364-Y408 WeakPolarHBondContact CA-O 3.34Å; Q365-Y408 WeakPolarHBondContact O-CB 3.36Å; P367-Y408 HydrophobicContact CG-CD1 3.85Å; P367-Y408 HydrophobicContact CG-CE1 3.85Å; P367-Y408 HydrophobicContact CG-CG 4.48Å; H406-Y408 PolarHBondContact O-N 3Å; Y408-H410 PolarHBondContact O-CE1 3.13Å; Y408-H410 PolarHBondContact O-N 2.79Å; Y408-H410 PolarHBondContact O-ND1 3.31Å; Y408-C430 WeakPolarHBondContact CA-O 3.34Å; Y408-C430 PolarHBondContact N-O 3.29Å; Y408-K432 HydrophobicContact CE1-CG 4.22Å; Y408-K432 WeakPolarHBondContact OH-CE 3.33Å; Y408-K432 VanDerWaalsContact OH-CG 3.27Å; Y408-K432 WeakPolarHBondContact OH-CG 3.36Å
409	T	89.4	Confident	86.9	Confident	6 Å²	6	55.8 Å²	55.8	4%	0.037	28%	0.283	C	S	.	.			trans	-57.5	138.6	160.4	-67.3	0	0	0	0	109.1	I361 L362 H405 H406 L407 T429 C430 W436	I361-T409 HydrophobicContact CG2-CG2 3.75Å; L362-T409 WeakPolarHBondContact O-CG2 3.4Å; H405-T409 HydrophobicContact CB-CG2 3.84Å; H406-T409 VanDerWaalsContact O-CB 3.3Å; H406-T409 WeakPolarHBondContact O-CB 3.48Å; H406-T409 PolarHBondContact O-N 3.49Å; H406-T409 VanDerWaalsContact O-N 3.13Å; H406-T409 PolarHBondContact O-OG1 3.33Å; L407-T409 PolarHBondContact O-N 2.87Å; T409-T429 WeakPolarHBondContact O-CA 3.35Å; T409-C430 PolarHBondContact O-N 2.92Å; T409-W436 HydrophobicContact CG2-CH2 4.26Å; T409-W436 WeakPolarHBondContact O-CZ3 3.49Å
410	H	90.5	Very high	87.5	Confident	31 Å²	31	49 Å²	49	14%	0.144	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	144.9	174.5	-60.2	70.6	0	0	0	109.3	L362 Y408 R427 R428 T429	L362-H410 HydrophobicContact CB-CB 4.2Å; L362-H410 HydrophobicContact CD1-CB 4.49Å; L362-H410 PolarHBondContact N-O 3.47Å; L362-H410 PolarHBondContact O-N 3.14Å; Y408-H410 PolarHBondContact O-CE1 3.13Å; Y408-H410 PolarHBondContact O-N 2.79Å; Y408-H410 PolarHBondContact O-ND1 3.31Å; H410-R427 HydrophobicContact CB-CG 4.45Å; H410-R428 CarbonylContact C-O 3.56Å; H410-R428 WeakPolarHBondContact CA-O 3.25Å; H410-T429 PolarHBondContact CD2-OG1 2.8Å; H410-T429 WeakPolarHBondContact NE2-CG2 3.37Å; H410-T429 PolarHBondContact NE2-OG1 3.25Å
411	I	91.4	Very high	87.7	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	123.7	167.4	-58.5	175.3	0	0	0	107.1	P351 Q359 K360 I361 Y413 R427 R428 W436	P351-I411 HydrophobicContact CG-CD1 4.35Å; Q359-I411 HydrophobicContact CB-CG2 3.95Å; Q359-I411 HydrophobicContact CG-CG2 4.24Å; K360-I411 WeakPolarHBondContact O-CA 3.46Å; I361-I411 HydrophobicContact CG1-CG1 4.26Å; I411-Y413 HydrophobicContact CB-CE2 3.84Å; I411-Y413 HydrophobicContact CG2-CD1 4.26Å; I411-Y413 HydrophobicContact CG2-CD2 4.19Å; I411-Y413 HydrophobicContact CG2-CE1 3.76Å; I411-Y413 HydrophobicContact CG2-CE2 3.63Å; I411-Y413 HydrophobicContact CG2-CG 4.47Å; I411-Y413 VanDerWaalsContact CG2-CZ 3.41Å; I411-Y413 WeakPolarHBondContact O-CE2 3.38Å; I411-R427 CarbonylContact O-C 3.43Å; I411-R427 WeakPolarHBondContact O-CA 3.44Å; I411-R428 PolarHBondContact N-O 3.43Å; I411-R428 PolarHBondContact O-N 3.1Å; I411-W436 HydrophobicContact CB-CZ3 4.41Å; I411-W436 HydrophobicContact CD1-CH2 3.35Å; I411-W436 HydrophobicContact CD1-CZ2 3.59Å; I411-W436 HydrophobicContact CD1-CZ3 3.94Å; I411-W436 HydrophobicContact CG1-CH2 3.57Å; I411-W436 HydrophobicContact CG1-CZ2 4.32Å; I411-W436 HydrophobicContact CG1-CZ3 3.85Å
412	E	92.2	Very high	87.8	Confident	59 Å²	59	53.9 Å²	53.9	28%	0.276	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	140.1	169.1	-70.1	176.2	167.4	0	0	108.7	K360 L362 R427	K360-E412 HydrophobicContact CB-CB 4.37Å; K360-E412 PolarHBondContact N-O 3.16Å; K360-E412 PolarHBondContact O-N 3.16Å; L362-E412 HydrophobicContact CD1-CG 4.14Å; L362-E412 WeakPolarHBondContact CD1-OE1 3.48Å; E412-R427 HydrophobicContact CG-CB 4.11Å; E412-R427 HydrophobicContact CG-CG 3.69Å; E412-R427 WeakPolarHBondContact OE1-CD 3.27Å; E412-R427 IonicContact OE1-NH1 2.82Å; E412-R427 PolarHBondContact OE1-NH1 3.19Å
413	Y	91	Very high	88	Confident	15 Å²	15	49.2 Å²	49.2	6%	0.059	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	133	-174.3	-59.5	-93.8	0	0	0	110.2	P351 V353 V357 K358 Q359 I411 A426 R428 V441	P351-Y413 WeakPolarHBondContact CG-OH 3.38Å; V353-Y413 HydrophobicContact CG1-CD1 4.39Å; V353-Y413 HydrophobicContact CG1-CE1 3.93Å; V357-Y413 HydrophobicContact CG1-CD1 3.69Å; V357-Y413 HydrophobicContact CG1-CG 4.4Å; K358-Y413 WeakPolarHBondContact O-CA 3.43Å; Q359-Y413 HydrophobicContact CG-CD1 3.94Å; Q359-Y413 HydrophobicContact CG-CE1 3.84Å; I411-Y413 HydrophobicContact CB-CE2 3.84Å; I411-Y413 HydrophobicContact CG2-CD1 4.26Å; I411-Y413 HydrophobicContact CG2-CD2 4.19Å; I411-Y413 HydrophobicContact CG2-CE1 3.76Å; I411-Y413 HydrophobicContact CG2-CE2 3.63Å; I411-Y413 HydrophobicContact CG2-CG 4.47Å; I411-Y413 VanDerWaalsContact CG2-CZ 3.41Å; I411-Y413 WeakPolarHBondContact O-CE2 3.38Å; Y413-A426 PolarHBondContact N-O 3.32Å; Y413-R428 HydrophobicContact CD2-CG 4.33Å; Y413-R428 HydrophobicContact CE2-CB 3.9Å; Y413-R428 HydrophobicContact CE2-CG 3.6Å; Y413-V441 HydrophobicContact CD1-CB 4.19Å; Y413-V441 HydrophobicContact CD1-CG1 4.31Å; Y413-V441 HydrophobicContact CD1-CG2 4.27Å; Y413-V441 HydrophobicContact CD2-CG2 3.89Å; Y413-V441 HydrophobicContact CE2-CG2 4.28Å; Y413-V441 HydrophobicContact CG-CB 4.2Å; Y413-V441 HydrophobicContact CG-CG1 4.14Å; Y413-V441 HydrophobicContact CG-CG2 3.9Å
414	E	90.9	Very high	88.1	Confident	117 Å²	117	50.3 Å²	50.3	55%	0.547	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	152.1	172.3	66.8	-176.8	-161.8	0	0	109.2	K358	K358-E414 HydrophobicContact CB-CG 3.65Å; K358-E414 HydrophobicContact CD-CG 4.09Å; K358-E414 WeakPolarHBondContact CD-OE1 3.41Å; K358-E414 HydrophobicContact CG-CG 4.47Å; K358-E414 PolarHBondContact N-O 2.94Å; K358-E414 PolarHBondContact O-N 3.32Å; K358-E414 VanDerWaalsContact O-N 3.16Å
415	C	90.1	Very high	88.2	Confident	21 Å²	21	49.9 Å²	49.9	14%	0.142	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	150.3	171.5	-61.6	0	0	0	0	110.6	L356 S417 H422 C443	L356-C415 CarbonylContact O-C 3.55Å; L356-C415 WeakPolarHBondContact O-CA 3.37Å; C415-S417 PolarHBondContact O-N 3.24Å; C415-S417 VanDerWaalsContact O-N 3.1Å; C415-H422 VanDerWaalsContact SG-CA 3.57Å; C415-H422 PolarHBondContact SG-N 3.08Å; C415-C443 WeakPolarHBondContact CA-SG 3.42Å; C415-C443 HydrophobicContact CB-CB 3.92Å; C415-C443 WeakPolarHBondContact CB-SG 3.46Å; C415-C443 WeakPolarHBondContact SG-CB 3.27Å; C415-C443 CovalentContact SG-SG 2.04Å; C415-C443 PolarHBondContact SG-SG 3.04Å
416	A	85.8	Confident	88.1	Confident	35 Å²	35	51.3 Å²	51.3	29%	0.289	27%	0.272	S	S	.	.	S	Bend	trans	-59.2	-28.3	-173.7	0	0	0	0	0	113.9	L356 K358	L356-A416 PolarHBondContact O-N 3.3Å; K358-A416 PolarHBondContact NZ-O 3.29Å
417	S	84.6	Confident	88.2	Confident	48 Å²	48	55.9 Å²	55.9	34%	0.336	29%	0.288	S	S	.	.	S	Bend	trans	-150.9	158.6	179.9	177.9	0	0	0	0	111.8	C415 Y419 Y420	C415-S417 PolarHBondContact O-N 3.24Å; C415-S417 VanDerWaalsContact O-N 3.1Å; S417-Y419 PolarHBondContact O-N 2.9Å; S417-Y419 VanDerWaalsContact O-N 3.08Å; S417-Y419 VanDerWaalsContact OG-CD2 3.25Å; S417-Y419 WeakPolarHBondContact OG-CD2 3.37Å; S417-Y420 PolarHBondContact O-N 2.77Å; S417-Y420 VanDerWaalsContact O-N 3.14Å
418	Q	83.8	Confident	88.3	Confident	121 Å²	121	54.9 Å²	54.9	57%	0.565	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-11.1	177.5	65.1	170.5	-8	0	0	115.7
419	Y	85.6	Confident	88.5	Confident	32 Å²	32	53.1 Å²	53.1	13%	0.125	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-1	175.7	-55.3	-56	0	0	0	113.3	S417 P445 V446 I571 E573 L576	S417-Y419 PolarHBondContact O-N 2.9Å; S417-Y419 VanDerWaalsContact O-N 3.08Å; S417-Y419 VanDerWaalsContact OG-CD2 3.25Å; S417-Y419 WeakPolarHBondContact OG-CD2 3.37Å; Y419-P445 WeakPolarHBondContact O-CA 3.48Å; Y419-V446 PolarHBondContact O-N 2.93Å; Y419-I571 HydrophobicContact CG-CG2 4.44Å; Y419-E573 WeakPolarHBondContact OH-CB 3.3Å; Y419-L576 HydrophobicContact CD1-CD1 4.21Å; Y419-L576 HydrophobicContact CD1-CD2 3.74Å; Y419-L576 HydrophobicContact CD1-CG 4.5Å; Y419-L576 HydrophobicContact CE1-CD1 4.44Å; Y419-L576 HydrophobicContact CG-CD2 4.02Å
420	Y	88.1	Confident	88.6	Confident	28 Å²	28	52.9 Å²	52.9	11%	0.11	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	136.9	179.2	-66.2	-93.4	0	0	0	110.9	L356 S417 S444 P445 Q495 I571	L356-Y420 HydrophobicContact CD1-CD1 4.03Å; L356-Y420 HydrophobicContact CD1-CE1 3.53Å; L356-Y420 HydrophobicContact CD2-CD1 4.5Å; L356-Y420 HydrophobicContact CD2-CE1 3.84Å; L356-Y420 HydrophobicContact CD2-CE2 4.07Å; L356-Y420 HydrophobicContact CG-CE1 4.26Å; S417-Y420 PolarHBondContact O-N 2.77Å; S417-Y420 VanDerWaalsContact O-N 3.14Å; Y420-S444 CarbonylContact C-O 3.49Å; Y420-S444 WeakPolarHBondContact CA-O 3.49Å; Y420-P445 HydrophobicContact CD1-CG 4.33Å; Y420-P445 HydrophobicContact CE1-CG 4.01Å; Y420-Q495 PolarHBondContact OH-NE2 2.88Å; Y420-I571 HydrophobicContact CE2-CB 4.23Å; Y420-I571 HydrophobicContact CE2-CG2 4.34Å
421	H	85.1	Confident	88.5	Confident	93 Å²	93	54.8 Å²	54.8	43%	0.431	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	138.6	173.4	-171.4	-98.4	0	0	0	111	F423 C443 S444 V446	H421-F423 HydrophobicContact CB-CE2 4.07Å; H421-F423 AromaticContact ND1-CE2 3.48Å; H421-F423 WeakPolarHBondContact ND1-CE2 3.49Å; H421-F423 AromaticContact ND1-CZ 3.62Å; H421-F423 WeakPolarHBondContact O-CD2 3.43Å; H421-C443 WeakPolarHBondContact O-CA 3.45Å; H421-S444 PolarHBondContact N-O 2.59Å; H421-S444 PolarHBondContact O-N 3.19Å; H421-S444 VanDerWaalsContact O-N 3.16Å; H421-V446 HydrophobicContact CB-CG2 3.98Å
422	H	84.4	Confident	88.2	Confident	86 Å²	86	61.5 Å²	61.5	40%	0.398	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	142.5	177.9	73.5	-27	0	0	0	112.4	C415	C415-H422 VanDerWaalsContact SG-CA 3.57Å; C415-H422 PolarHBondContact SG-N 3.08Å
423	F	85.9	Confident	87.9	Confident	101 Å²	101	62.4 Å²	62.4	44%	0.443	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	145.3	172.6	-68.2	-97.8	0	0	0	109.5	H421 V441 S442 S444	H421-F423 HydrophobicContact CB-CE2 4.07Å; H421-F423 AromaticContact ND1-CE2 3.48Å; H421-F423 WeakPolarHBondContact ND1-CE2 3.49Å; H421-F423 AromaticContact ND1-CZ 3.62Å; H421-F423 WeakPolarHBondContact O-CD2 3.43Å; F423-V441 VanDerWaalsContact O-CA 3.3Å; F423-V441 WeakPolarHBondContact O-CA 3.48Å; F423-S442 PolarHBondContact N-O 3.23Å; F423-S442 PolarHBondContact O-N 2.92Å; F423-S444 WeakPolarHBondContact CE2-OG 3.39Å
424	G	87.8	Confident	87.6	Confident	47 Å²	47	61.9 Å²	61.9	49%	0.485	32%	0.324	S	S	.	.	S	Bend	trans	96.9	-145.1	-177.8	0	0	0	0	0	113.4	H440	G424-H440 WeakPolarHBondContact CA-O 3.49Å
425	S	89.3	Confident	87.5	Confident	32 Å²	32	63 Å²	63	22%	0.224	33%	0.327	C	S	.	.			trans	-103.1	110	-175	-63.6	0	0	0	0	112.1	R427 G438 R439 V441	S425-R427 PolarHBondContact O-N 3.42Å; S425-G438 VanDerWaalsContact OG-CA 3.28Å; S425-G438 WeakPolarHBondContact OG-CA 3.47Å; S425-R439 PolarHBondContact OG-N 2.82Å; S425-V441 WeakPolarHBondContact O-CG2 3.41Å
426	A	88.3	Confident	87.6	Confident	48 Å²	48	63.6 Å²	63.6	40%	0.397	33%	0.326	S	S	.	.	S	Bend	trans	-53.2	-25.3	178.7	0	0	0	0	0	114.5	Y413	Y413-A426 PolarHBondContact N-O 3.32Å
427	R	91.3	Very high	87.9	Confident	142 Å²	142	63.4 Å²	63.4	54%	0.536	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	138.7	168.6	-171.3	170.9	70.2	-166	0.5	111.2	H410 I411 E412 S425	H410-R427 HydrophobicContact CB-CG 4.45Å; I411-R427 CarbonylContact O-C 3.43Å; I411-R427 WeakPolarHBondContact O-CA 3.44Å; E412-R427 HydrophobicContact CG-CB 4.11Å; E412-R427 HydrophobicContact CG-CG 3.69Å; E412-R427 WeakPolarHBondContact OE1-CD 3.27Å; E412-R427 IonicContact OE1-NH1 2.82Å; E412-R427 PolarHBondContact OE1-NH1 3.19Å; S425-R427 PolarHBondContact O-N 3.42Å
428	R	91.7	Very high	88.1	Confident	28 Å²	28	63.4 Å²	63.4	11%	0.106	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	144.5	175.4	-55.3	-178.7	74.3	-173.8	11.4	110.3	H410 I411 Y413 W436 S437 G438 R439	H410-R428 CarbonylContact C-O 3.56Å; H410-R428 WeakPolarHBondContact CA-O 3.25Å; I411-R428 PolarHBondContact N-O 3.43Å; I411-R428 PolarHBondContact O-N 3.1Å; Y413-R428 HydrophobicContact CD2-CG 4.33Å; Y413-R428 HydrophobicContact CE2-CB 3.9Å; Y413-R428 HydrophobicContact CE2-CG 3.6Å; R428-W436 HydrophobicContact CB-CE3 3.95Å; R428-S437 WeakPolarHBondContact CB-O 3.33Å; R428-S437 WeakPolarHBondContact CG-O 3.47Å; R428-S437 PolarHBondContact NE-O 2.91Å; R428-S437 PolarHBondContact NH2-O 3.31Å; R428-G438 PolarHBondContact NH2-O 3.21Å; R428-G438 VanDerWaalsContact NH2-O 3.11Å; R428-R439 WeakPolarHBondContact CD-O 3.41Å; R428-R439 PolarHBondContact NE-O 3.24Å
429	T	91.5	Very high	88.3	Confident	26 Å²	26	67.2 Å²	67.2	16%	0.16	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	136.3	-178.2	-51.8	0	0	0	0	109.7	T409 H410 L431 W436 S437	T409-T429 WeakPolarHBondContact O-CA 3.35Å; H410-T429 PolarHBondContact CD2-OG1 2.8Å; H410-T429 WeakPolarHBondContact NE2-CG2 3.37Å; H410-T429 PolarHBondContact NE2-OG1 3.25Å; T429-L431 PolarHBondContact O-N 3.17Å; T429-W436 VanDerWaalsContact C-CE3 3.41Å; T429-W436 WeakPolarHBondContact O-CA 3.46Å; T429-S437 PolarHBondContact N-OG 3.01Å; T429-S437 PolarHBondContact O-N 2.89Å; T429-S437 PolarHBondContact O-OG 2.86Å
430	C	91.4	Very high	88.3	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-71.4	113	171.1	179	0	0	0	0	110	C348 H406 Y408 T409 W436	C348-C430 HydrophobicContact CB-CB 3.75Å; C348-C430 WeakPolarHBondContact CB-SG 3.31Å; C348-C430 PolarHBondContact N-SG 2.99Å; C348-C430 WeakPolarHBondContact SG-CA 3.3Å; C348-C430 WeakPolarHBondContact SG-CB 3.2Å; C348-C430 CovalentContact SG-SG 2.03Å; C348-C430 PolarHBondContact SG-SG 2.65Å; H406-C430 WeakPolarHBondContact O-CB 3.41Å; H406-C430 PolarHBondContact O-SG 2.69Å; H406-C430 VanDerWaalsContact O-SG 3.41Å; Y408-C430 WeakPolarHBondContact CA-O 3.34Å; Y408-C430 PolarHBondContact N-O 3.29Å; T409-C430 PolarHBondContact O-N 2.92Å; C430-W436 HydrophobicContact CB-CE3 4.28Å; C430-W436 HydrophobicContact CB-CH2 4.03Å; C430-W436 HydrophobicContact CB-CZ2 4.39Å; C430-W436 HydrophobicContact CB-CZ3 3.99Å; C430-W436 VanDerWaalsContact N-CZ3 3.34Å
431	L	89	Confident	88.4	Confident	72 Å²	72	69.7 Å²	69.7	38%	0.377	35%	0.353	S	S	.	.			trans	-85.1	162.2	-175.7	-59.8	176.8	0	0	0	112	L407 T429 T433 G434 K435	L407-L431 WeakPolarHBondContact CD2-O 3.46Å; T429-L431 PolarHBondContact O-N 3.17Å; L431-T433 PolarHBondContact O-N 3.33Å; L431-G434 PolarHBondContact O-N 3.11Å; L431-K435 WeakPolarHBondContact CB-O 3.48Å; L431-K435 PolarHBondContact N-O 2.85Å
432	K	85.7	Confident	88.6	Confident	141 Å²	141	68 Å²	68	61%	0.613	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-17	171.5	-72.8	-173.8	177	-178.8	0	114.9	R346 Y408 G434	R346-K432 WeakPolarHBondContact CD-O 3.35Å; R346-K432 PolarHBondContact NH1-O 2.85Å; R346-K432 VanDerWaalsContact NH1-O 3.15Å; Y408-K432 HydrophobicContact CE1-CG 4.22Å; Y408-K432 WeakPolarHBondContact OH-CE 3.33Å; Y408-K432 VanDerWaalsContact OH-CG 3.27Å; Y408-K432 WeakPolarHBondContact OH-CG 3.36Å; K432-G434 VanDerWaalsContact C-N 3.34Å
433	T	85.1	Confident	88.8	Confident	77 Å²	77	64.6 Å²	64.6	47%	0.472	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-10.7	176.3	53.6	0	0	0	0	113.6	L431 K435	L431-T433 PolarHBondContact O-N 3.33Å; T433-K435 VanDerWaalsContact C-N 3.27Å; T433-K435 PolarHBondContact OG1-N 3.3Å
434	G	84.9	Confident	88.9	Confident	5 Å²	5	62 Å²	62	5%	0.052	33%	0.333	C	S	.	.	S	Bend	trans	74.5	17.4	-169.3	0	0	0	0	0	113.4	L431 K432	L431-G434 PolarHBondContact O-N 3.11Å; K432-G434 VanDerWaalsContact C-N 3.34Å
435	K	89.4	Confident	88.9	Confident	139 Å²	139	61.2 Å²	61.2	60%	0.604	32%	0.319	S	S	*	.	S	Bend	trans	-118.2	151.3	174.8	-62	-174.6	178.7	-177.3	0	110.8	L431 T433	L431-K435 WeakPolarHBondContact CB-O 3.48Å; L431-K435 PolarHBondContact N-O 2.85Å; T433-K435 VanDerWaalsContact C-N 3.27Å; T433-K435 PolarHBondContact OG1-N 3.3Å
436	W	91	Very high	88.9	Confident	34 Å²	34	61.1 Å²	61.1	13%	0.129	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-76	138.6	173.6	-68.5	98.5	0	0	0	111.8	C348 R349 P351 H405 T409 I411 R428 T429 C430	C348-W436 HydrophobicContact CB-CD2 4.26Å; C348-W436 HydrophobicContact CB-CZ2 3.83Å; R349-W436 PolarHBondContact O-NE1 3.42Å; P351-W436 HydrophobicContact CG-CD2 4.02Å; P351-W436 HydrophobicContact CG-CG 3.98Å; P351-W436 HydrophobicContact CG-CZ2 4.33Å; P351-W436 VanDerWaalsContact CG-NE1 3.34Å; H405-W436 HydrophobicContact CB-CH2 4.24Å; H405-W436 HydrophobicContact CB-CZ2 4.15Å; H405-W436 AromaticContact CD2-CZ2 3.62Å; H405-W436 AromaticContact CG-CZ2 4Å; T409-W436 HydrophobicContact CG2-CH2 4.26Å; T409-W436 WeakPolarHBondContact O-CZ3 3.49Å; I411-W436 HydrophobicContact CB-CZ3 4.41Å; I411-W436 HydrophobicContact CD1-CH2 3.35Å; I411-W436 HydrophobicContact CD1-CZ2 3.59Å; I411-W436 HydrophobicContact CD1-CZ3 3.94Å; I411-W436 HydrophobicContact CG1-CH2 3.57Å; I411-W436 HydrophobicContact CG1-CZ2 4.32Å; I411-W436 HydrophobicContact CG1-CZ3 3.85Å; R428-W436 HydrophobicContact CB-CE3 3.95Å; T429-W436 VanDerWaalsContact C-CE3 3.41Å; T429-W436 WeakPolarHBondContact O-CA 3.46Å; C430-W436 HydrophobicContact CB-CE3 4.28Å; C430-W436 HydrophobicContact CB-CH2 4.03Å; C430-W436 HydrophobicContact CB-CZ2 4.39Å; C430-W436 HydrophobicContact CB-CZ3 3.99Å; C430-W436 VanDerWaalsContact N-CZ3 3.34Å
437	S	91.4	Very high	89	Confident	31 Å²	31	60.8 Å²	60.8	22%	0.217	31%	0.311	C	S	.	.			trans	-68.5	165.2	168.2	67.4	0	0	0	0	112.1	R428 T429	R428-S437 WeakPolarHBondContact CB-O 3.33Å; R428-S437 WeakPolarHBondContact CG-O 3.47Å; R428-S437 PolarHBondContact NE-O 2.91Å; R428-S437 PolarHBondContact NH2-O 3.31Å; T429-S437 PolarHBondContact N-OG 3.01Å; T429-S437 PolarHBondContact O-N 2.89Å; T429-S437 PolarHBondContact O-OG 2.86Å
438	G	88.8	Confident	88.9	Confident	48 Å²	48	54 Å²	54	50%	0.495	29%	0.286	S	S	.	.	S	Bend	trans	69.4	179.6	174.6	0	0	0	0	0	114.7	S425 R428	S425-G438 VanDerWaalsContact OG-CA 3.28Å; S425-G438 WeakPolarHBondContact OG-CA 3.47Å; R428-G438 PolarHBondContact NH2-O 3.21Å; R428-G438 VanDerWaalsContact NH2-O 3.11Å
439	R	88.4	Confident	88.7	Confident	201 Å²	201	56 Å²	56	76%	0.758	30%	0.295	S	S	*	.			trans	-82.4	160.2	179.3	-61.8	-175.4	-175.9	-176.8	2.2	110.7	S425 R428	S425-R439 PolarHBondContact OG-N 2.82Å; R428-R439 WeakPolarHBondContact CD-O 3.41Å; R428-R439 PolarHBondContact NE-O 3.24Å
440	H	86.9	Confident	88.4	Confident	107 Å²	107	56.3 Å²	56.3	50%	0.495	29%	0.294	S	S	.	.			trans	-61.9	153.3	170.9	-177.3	-87	0	0	0	110.3	K352 G424	K352-H440 PolarHBondContact O-NE2 3.03Å; G424-H440 WeakPolarHBondContact CA-O 3.49Å
441	V	88.8	Confident	87.6	Confident	5 Å²	5	60.6 Å²	60.6	3%	0.03	32%	0.32	C	S	.	.			trans	-112.5	128.5	-173.4	-178.6	0	0	0	0	110.8	V357 Y413 F423 S425	V357-V441 HydrophobicContact CG1-CG1 4.1Å; Y413-V441 HydrophobicContact CD1-CB 4.19Å; Y413-V441 HydrophobicContact CD1-CG1 4.31Å; Y413-V441 HydrophobicContact CD1-CG2 4.27Å; Y413-V441 HydrophobicContact CD2-CG2 3.89Å; Y413-V441 HydrophobicContact CE2-CG2 4.28Å; Y413-V441 HydrophobicContact CG-CB 4.2Å; Y413-V441 HydrophobicContact CG-CG1 4.14Å; Y413-V441 HydrophobicContact CG-CG2 3.9Å; F423-V441 VanDerWaalsContact O-CA 3.3Å; F423-V441 WeakPolarHBondContact O-CA 3.48Å; S425-V441 WeakPolarHBondContact O-CG2 3.41Å
442	S	90.4	Very high	87	Confident	58 Å²	58	62 Å²	62	41%	0.406	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	159.5	173.5	58.8	0	0	0	0	110.7	F423	F423-S442 PolarHBondContact N-O 3.23Å; F423-S442 PolarHBondContact O-N 2.92Å
443	C	89	Confident	87	Confident	14 Å²	14	57.3 Å²	57.3	10%	0.095	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	125.1	175.1	-72.1	0	0	0	0	108.6	L356 V357 C415 H421	L356-C443 HydrophobicContact CB-CB 4.07Å; V357-C443 HydrophobicContact CG2-CB 4.28Å; C415-C443 WeakPolarHBondContact CA-SG 3.42Å; C415-C443 HydrophobicContact CB-CB 3.92Å; C415-C443 WeakPolarHBondContact CB-SG 3.46Å; C415-C443 WeakPolarHBondContact SG-CB 3.27Å; C415-C443 CovalentContact SG-SG 2.04Å; C415-C443 PolarHBondContact SG-SG 3.04Å; H421-C443 WeakPolarHBondContact O-CA 3.45Å
444	S	87.1	Confident	87	Confident	48 Å²	48	56.3 Å²	56.3	34%	0.336	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	155.4	173.5	71.6	0	0	0	0	110.4	Y420 H421 F423	Y420-S444 CarbonylContact C-O 3.49Å; Y420-S444 WeakPolarHBondContact CA-O 3.49Å; H421-S444 PolarHBondContact N-O 2.59Å; H421-S444 PolarHBondContact O-N 3.19Å; H421-S444 VanDerWaalsContact O-N 3.16Å; F423-S444 WeakPolarHBondContact CE2-OG 3.39Å
445	P	88.6	Confident	86.8	Confident	30 Å²	30	60.5 Å²	60.5	20%	0.195	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	147.9	176.4	-19.5	29.9	0	0	0	112	Y419 Y420 Q495 I571 P577	Y419-P445 WeakPolarHBondContact O-CA 3.48Å; Y420-P445 HydrophobicContact CD1-CG 4.33Å; Y420-P445 HydrophobicContact CE1-CG 4.01Å; P445-Q495 VanDerWaalsContact CG-CD 3.48Å; P445-Q495 HydrophobicContact CG-CG 3.63Å; P445-I571 HydrophobicContact CB-CG1 4.18Å; P445-I571 HydrophobicContact CG-CG1 4.04Å; P445-P577 HydrophobicContact CB-CG 3.87Å
446	V	88.7	Confident	86.5	Confident	30 Å²	30	61.7 Å²	61.7	18%	0.182	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-83	126.7	165.5	-177.7	0	0	0	0	108.2	Y419 H421 K449	Y419-V446 PolarHBondContact O-N 2.93Å; H421-V446 HydrophobicContact CB-CG2 3.98Å; V446-K449 HydrophobicContact CG1-CB 3.91Å; V446-K449 HydrophobicContact CG1-CD 4.19Å
447	C	90.4	Very high	86.1	Confident	41 Å²	41	65.2 Å²	65.2	28%	0.277	35%	0.347	S	S	.	.	S	Bend	trans	-85.4	158.4	172.6	68.6	0	0	0	0	111.8	K449 P577 C579	C447-K449 PolarHBondContact O-N 3.29Å; C447-P577 CarbonylContact C-O 3.58Å; C447-P577 WeakPolarHBondContact CA-O 3.33Å; C447-P577 HydrophobicContact CB-CB 4.35Å; C447-P577 HydrophobicContact CB-CG 4.14Å; C447-C579 HydrophobicContact CB-CB 4.01Å; C447-C579 WeakPolarHBondContact CB-SG 3.48Å; C447-C579 PolarHBondContact O-SG 2.89Å; C447-C579 VanDerWaalsContact O-SG 3.37Å; C447-C579 WeakPolarHBondContact SG-CA 3.49Å; C447-C579 WeakPolarHBondContact SG-CB 3.32Å; C447-C579 CovalentContact SG-SG 2.04Å; C447-C579 PolarHBondContact SG-SG 2.03Å
448	G	88.4	Confident	85.8	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	35%	0.346	C	S	.	.	S	Bend	trans	66	9.8	166.5	0	0	0	0	0	116.2	H450 P577 W683	G448-H450 PolarHBondContact O-N 3.02Å; G448-P577 PolarHBondContact N-O 3.5Å; G448-W683 VanDerWaalsContact CA-O 3.29Å; G448-W683 WeakPolarHBondContact CA-O 3.4Å; G448-W683 WeakPolarHBondContact O-CB 2.89Å; G448-W683 VanDerWaalsContact O-CD1 3.27Å; G448-W683 PolarHBondContact O-N 2.81Å
449	K	87.1	Confident	85.5	Confident	69 Å²	69	66.4 Å²	66.4	30%	0.3	34%	0.339	S	S	.	.			trans	-94	90.5	-175.7	-173.4	179.6	176.2	-178.5	0	111.8	V446 C447 V451 L576 L682	V446-K449 HydrophobicContact CG1-CB 3.91Å; V446-K449 HydrophobicContact CG1-CD 4.19Å; C447-K449 PolarHBondContact O-N 3.29Å; K449-V451 HydrophobicContact CD-CG2 4.36Å; K449-V451 HydrophobicContact CG-CG2 3.98Å; K449-L576 VanDerWaalsContact O-CD1 3.29Å; K449-L576 WeakPolarHBondContact O-CD1 3.21Å; K449-L682 HydrophobicContact CB-CD2 4.44Å
450	H	86.3	Confident	85.3	Confident	32 Å²	32	61.6 Å²	61.6	15%	0.148	33%	0.325	C	S	.	.			trans	-95.7	107.1	171.7	-160.2	-46.2	0	0	0	110.3	G448 N452 F453 W465	G448-H450 PolarHBondContact O-N 3.02Å; H450-N452 WeakPolarHBondContact CE1-CA 3.5Å; H450-N452 PolarHBondContact CE1-N 3.14Å; H450-N452 PolarHBondContact NE2-O 2.97Å; H450-F453 WeakPolarHBondContact CE1-CA 3.19Å; H450-F453 WeakPolarHBondContact CE1-CB 3.49Å; H450-F453 PolarHBondContact CE1-N 3.02Å; H450-F453 PolarHBondContact ND1-N 3.27Å; H450-F453 WeakPolarHBondContact NE2-CA 3.43Å; H450-F453 PolarHBondContact NE2-N 3.36Å; H450-W465 HydrophobicContact CB-CH2 3.82Å; H450-W465 HydrophobicContact CB-CZ3 4.08Å; H450-W465 AromaticContact CD2-CH2 3.85Å
451	V	74.3	Confident	85.3	Confident	90 Å²	90	57 Å²	57	55%	0.545	31%	0.306	S	S	.	.	S	Bend	trans	-84.7	-31.2	-172.5	-174.1	0	0	0	0	112.7	K449	K449-V451 HydrophobicContact CD-CG2 4.36Å; K449-V451 HydrophobicContact CG-CG2 3.98Å
452	N	77.6	Confident	85.3	Confident	103 Å²	103	58.3 Å²	58.3	55%	0.551	31%	0.311	S	S	*	.	S	Bend	trans	-113.7	36.3	-170.5	-57	-14	0	0	0	112.5	H450 E573	H450-N452 WeakPolarHBondContact CE1-CA 3.5Å; H450-N452 PolarHBondContact CE1-N 3.14Å; H450-N452 PolarHBondContact NE2-O 2.97Å; N452-E573 PolarHBondContact ND2-OE1 3.03Å
453	F	84.9	Confident	85.4	Confident	42 Å²	42	55.8 Å²	55.8	18%	0.184	29%	0.293	C	S	.	.			trans	-84.5	128	177.7	-178.5	-104.6	0	0	0	110.2	H450 P455 P458 A461 W463 L594 W683	H450-F453 WeakPolarHBondContact CE1-CA 3.19Å; H450-F453 WeakPolarHBondContact CE1-CB 3.49Å; H450-F453 PolarHBondContact CE1-N 3.02Å; H450-F453 PolarHBondContact ND1-N 3.27Å; H450-F453 WeakPolarHBondContact NE2-CA 3.43Å; H450-F453 PolarHBondContact NE2-N 3.36Å; F453-P455 HydrophobicContact CD1-CG 3.93Å; F453-P455 HydrophobicContact CE1-CB 3.99Å; F453-P455 HydrophobicContact CE1-CG 3.87Å; F453-P458 HydrophobicContact CE2-CB 4.22Å; F453-P458 HydrophobicContact CZ-CB 4.13Å; F453-A461 HydrophobicContact CD2-CB 3.92Å; F453-A461 HydrophobicContact CE2-CB 4.04Å; F453-W463 HydrophobicContact CD2-CH2 4.19Å; F453-W463 AromaticContact CE2-CH2 3.54Å; F453-W463 HydrophobicContact CE2-CH2 3.54Å; F453-W463 AromaticContact CE2-CZ2 3.9Å; F453-W463 HydrophobicContact CE2-CZ2 3.9Å; F453-W463 HydrophobicContact CE2-CZ3 4.39Å; F453-W463 HydrophobicContact CZ-CH2 4.28Å; F453-L594 HydrophobicContact CZ-CD1 4Å; F453-W683 HydrophobicContact CB-CZ2 4.19Å; F453-W683 AromaticContact CD1-CH2 3.93Å; F453-W683 HydrophobicContact CD1-CH2 3.93Å; F453-W683 AromaticContact CD1-CZ2 3.58Å; F453-W683 HydrophobicContact CD1-CZ2 3.58Å; F453-W683 HydrophobicContact CD2-CH2 4.04Å; F453-W683 HydrophobicContact CD2-CZ2 4.05Å; F453-W683 AromaticContact CE1-CH2 3.76Å; F453-W683 HydrophobicContact CE1-CH2 3.76Å; F453-W683 AromaticContact CE1-CZ2 3.89Å; F453-W683 HydrophobicContact CE1-CZ2 3.89Å; F453-W683 AromaticContact CE2-CH2 3.9Å; F453-W683 HydrophobicContact CE2-CH2 3.9Å; F453-W683 HydrophobicContact CE2-CZ2 4.35Å; F453-W683 HydrophobicContact CG-CH2 4.06Å; F453-W683 AromaticContact CG-CZ2 3.66Å; F453-W683 HydrophobicContact CG-CZ2 3.66Å; F453-W683 AromaticContact CZ-CH2 3.76Å; F453-W683 HydrophobicContact CZ-CH2 3.76Å; F453-W683 HydrophobicContact CZ-CZ2 4.27Å
454	D	84.4	Confident	85.5	Confident	56 Å²	56	55.3 Å²	55.3	30%	0.299	29%	0.29	S	S	.	.			trans	-104	106.1	173.3	-178.8	-1.1	0	0	0	109	Q456 R457	D454-Q456 PolarHBondContact O-N 2.85Å; D454-Q456 VanDerWaalsContact O-N 3.14Å; D454-Q456 WeakPolarHBondContact OD1-CB 2.75Å; D454-Q456 PolarHBondContact OD1-N 3.13Å; D454-R457 CarbonylContact O-C 3.48Å; D454-R457 PolarHBondContact O-N 3.32Å; D454-R457 IonicContact OD2-CZ 3.44Å; D454-R457 IonicContact OD2-NE 3.27Å; D454-R457 PolarHBondContact OD2-NE 3.1Å; D454-R457 IonicContact OD2-NH2 3.71Å; D454-R457 PolarHBondContact OD2-NH2 2.81Å
455	P	81.4	Confident	85.9	Confident	92 Å²	92	53 Å²	53	60%	0.597	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-15.5	-179.7	-21.2	32.6	0	0	0	114.6	F453	F453-P455 HydrophobicContact CD1-CG 3.93Å; F453-P455 HydrophobicContact CE1-CB 3.99Å; F453-P455 HydrophobicContact CE1-CG 3.87Å
456	Q	81.9	Confident	86.3	Confident	165 Å²	165	51.7 Å²	51.7	77%	0.771	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-18.6	179.4	-60.9	-64.6	-46	0	0	112.8	D454	D454-Q456 PolarHBondContact O-N 2.85Å; D454-Q456 VanDerWaalsContact O-N 3.14Å; D454-Q456 WeakPolarHBondContact OD1-CB 2.75Å; D454-Q456 PolarHBondContact OD1-N 3.13Å
457	R	83.6	Confident	86.6	Confident	108 Å²	108	50.2 Å²	50.2	41%	0.408	26%	0.256	S	S	.	.			trans	-139.9	61.2	-179.3	-67.7	178.3	-62.6	134.8	16.6	111.1	D454 E459 E460	D454-R457 CarbonylContact O-C 3.48Å; D454-R457 PolarHBondContact O-N 3.32Å; D454-R457 IonicContact OD2-CZ 3.44Å; D454-R457 IonicContact OD2-NE 3.27Å; D454-R457 PolarHBondContact OD2-NE 3.1Å; D454-R457 IonicContact OD2-NH2 3.71Å; D454-R457 PolarHBondContact OD2-NH2 2.81Å; R457-E459 VanDerWaalsContact C-OE2 3.27Å; R457-E459 WeakPolarHBondContact CA-OE2 3.32Å; R457-E459 WeakPolarHBondContact CB-OE1 3.32Å; R457-E459 PolarHBondContact O-N 3.19Å; R457-E460 HydrophobicContact CB-CB 4.46Å; R457-E460 HydrophobicContact CB-CG 4.48Å; R457-E460 IonicContact CZ-OE1 3.79Å; R457-E460 IonicContact CZ-OE2 3.47Å; R457-E460 IonicContact NH1-OE1 2.85Å; R457-E460 PolarHBondContact NH1-OE1 2.87Å; R457-E460 IonicContact NH1-OE2 2.69Å; R457-E460 PolarHBondContact NH1-OE2 3.18Å; R457-E460 IonicContact NH2-OE2 3.91Å; R457-E460 PolarHBondContact O-N 3.33Å; R457-E460 VanDerWaalsContact O-N 3.12Å
458	P	84.1	Confident	86.8	Confident	29 Å²	29	48.3 Å²	48.3	19%	0.188	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-58.7	-26.9	-178.7	26.7	-36.5	0	0	0	113.2	F453 E460 A461 V614	F453-P458 HydrophobicContact CE2-CB 4.22Å; F453-P458 HydrophobicContact CZ-CB 4.13Å; P458-E460 VanDerWaalsContact C-N 3.3Å; P458-E460 PolarHBondContact O-N 3.2Å; P458-A461 WeakPolarHBondContact O-CB 3.4Å; P458-A461 PolarHBondContact O-N 3.42Å; P458-A461 VanDerWaalsContact O-N 3.09Å; P458-V614 HydrophobicContact CB-CG1 4Å; P458-V614 HydrophobicContact CB-CG2 4.3Å; P458-V614 HydrophobicContact CG-CG1 4.32Å
459	E	82.6	Confident	87.1	Confident	75 Å²	75	48.3 Å²	48.3	35%	0.35	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-71	-19.3	178.2	71.8	-67.7	161.1	0	0	114.3	R457 V614	R457-E459 VanDerWaalsContact C-OE2 3.27Å; R457-E459 WeakPolarHBondContact CA-OE2 3.32Å; R457-E459 WeakPolarHBondContact CB-OE1 3.32Å; R457-E459 PolarHBondContact O-N 3.19Å; E459-V614 HydrophobicContact CB-CG1 4.08Å
460	E	85.7	Confident	87.4	Confident	100 Å²	100	45.9 Å²	45.9	47%	0.467	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-85	-12.2	168.4	-71.6	-173.1	-156	0	0	112.8	R457 P458 H526	R457-E460 HydrophobicContact CB-CB 4.46Å; R457-E460 HydrophobicContact CB-CG 4.48Å; R457-E460 IonicContact CZ-OE1 3.79Å; R457-E460 IonicContact CZ-OE2 3.47Å; R457-E460 IonicContact NH1-OE1 2.85Å; R457-E460 PolarHBondContact NH1-OE1 2.87Å; R457-E460 IonicContact NH1-OE2 2.69Å; R457-E460 PolarHBondContact NH1-OE2 3.18Å; R457-E460 IonicContact NH2-OE2 3.91Å; R457-E460 PolarHBondContact O-N 3.33Å; R457-E460 VanDerWaalsContact O-N 3.12Å; P458-E460 VanDerWaalsContact C-N 3.3Å; P458-E460 PolarHBondContact O-N 3.2Å; E460-H526 PolarHBondContact O-CE1 3.22Å
461	A	86.4	Confident	87.7	Confident	11 Å²	11	47.4 Å²	47.4	9%	0.091	24%	0.236	C	C	.	.			trans	-67.7	143.7	-172.1	0	0	0	0	0	113.3	F453 P458 W463 H526	F453-A461 HydrophobicContact CD2-CB 3.92Å; F453-A461 HydrophobicContact CE2-CB 4.04Å; P458-A461 WeakPolarHBondContact O-CB 3.4Å; P458-A461 PolarHBondContact O-N 3.42Å; P458-A461 VanDerWaalsContact O-N 3.09Å; A461-W463 HydrophobicContact CB-CZ2 4.1Å; A461-H526 PolarHBondContact O-CE1 2.88Å
462	H	88.4	Confident	88.3	Confident	32 Å²	32	46.7 Å²	46.7	15%	0.148	22%	0.224	C	C	.	.			trans	-94.7	115.6	169.7	-177.8	-60.4	0	0	0	110	P464 K574	H462-P464 WeakPolarHBondContact O-CD 3.4Å; H462-K574 PolarHBondContact CE1-O 3.17Å
463	W	91.7	Very high	87.9	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.015	22%	0.219	C	C	.	.			trans	-86.3	100.8	-177.1	-60.8	97	0	0	0	112.4	F453 A461 W465 L466 L594 T596 V614 V666 W683	F453-W463 HydrophobicContact CD2-CH2 4.19Å; F453-W463 AromaticContact CE2-CH2 3.54Å; F453-W463 HydrophobicContact CE2-CH2 3.54Å; F453-W463 AromaticContact CE2-CZ2 3.9Å; F453-W463 HydrophobicContact CE2-CZ2 3.9Å; F453-W463 HydrophobicContact CE2-CZ3 4.39Å; F453-W463 HydrophobicContact CZ-CH2 4.28Å; A461-W463 HydrophobicContact CB-CZ2 4.1Å; W463-W465 VanDerWaalsContact C-N 3.27Å; W463-W465 AromaticContact CE3-CZ2 3.8Å; W463-W465 HydrophobicContact CE3-CZ2 3.8Å; W463-W465 HydrophobicContact CZ3-CZ2 4.05Å; W463-W465 PolarHBondContact O-N 3.01Å; W463-L466 HydrophobicContact CB-CB 3.64Å; W463-L466 HydrophobicContact CB-CD2 4.12Å; W463-L466 HydrophobicContact CG-CD2 4.49Å; W463-L466 PolarHBondContact O-N 2.7Å; W463-L594 HydrophobicContact CH2-CD1 4.33Å; W463-T596 HydrophobicContact CD2-CG2 3.98Å; W463-T596 HydrophobicContact CE3-CG2 4.24Å; W463-T596 HydrophobicContact CG-CG2 4.19Å; W463-V614 HydrophobicContact CZ2-CB 4.49Å; W463-V614 HydrophobicContact CZ2-CG2 3.85Å; W463-V666 HydrophobicContact CZ3-CG2 4.17Å; W463-W683 HydrophobicContact CH2-CH2 4.09Å; W463-W683 HydrophobicContact CH2-CZ3 4Å; W463-W683 HydrophobicContact CZ3-CE3 4.23Å; W463-W683 HydrophobicContact CZ3-CH2 4.01Å; W463-W683 AromaticContact CZ3-CZ3 3.62Å; W463-W683 HydrophobicContact CZ3-CZ3 3.62Å
464	P	92.9	Very high	86.8	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.032	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-17.9	-164.2	-19.7	35.6	0	0	0	114.8	H462 K574 V575 L576	H462-P464 WeakPolarHBondContact O-CD 3.4Å; P464-K574 WeakPolarHBondContact CA-O 3.48Å; P464-V575 VanDerWaalsContact O-CA 3.29Å; P464-V575 WeakPolarHBondContact O-CA 3.31Å; P464-L576 CarbonylContact C-O 3.56Å; P464-L576 HydrophobicContact CB-CB 3.97Å; P464-L576 HydrophobicContact CB-CD1 4.3Å; P464-L576 HydrophobicContact CB-CG 4.35Å; P464-L576 PolarHBondContact O-N 3.16Å
465	W	95.3	Very high	85.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-11	178	43.9	75	0	0	0	113.2	H450 W463 A467 L492 L576 L578 W683	H450-W465 HydrophobicContact CB-CH2 3.82Å; H450-W465 HydrophobicContact CB-CZ3 4.08Å; H450-W465 AromaticContact CD2-CH2 3.85Å; W463-W465 VanDerWaalsContact C-N 3.27Å; W463-W465 AromaticContact CE3-CZ2 3.8Å; W463-W465 HydrophobicContact CE3-CZ2 3.8Å; W463-W465 HydrophobicContact CZ3-CZ2 4.05Å; W463-W465 PolarHBondContact O-N 3.01Å; W465-A467 PolarHBondContact O-N 2.69Å; W465-L492 WeakPolarHBondContact O-CB 3.46Å; W465-L492 PolarHBondContact O-N 2.04Å; W465-L576 WeakPolarHBondContact CA-O 3.4Å; W465-L576 VanDerWaalsContact CB-O 3.32Å; W465-L576 WeakPolarHBondContact CB-O 3.47Å; W465-L576 PolarHBondContact N-O 3.39Å; W465-L578 HydrophobicContact CB-CB 3.69Å; W465-L578 HydrophobicContact CD2-CB 4.06Å; W465-L578 HydrophobicContact CD2-CD1 3.78Å; W465-L578 HydrophobicContact CD2-CD2 4.4Å; W465-L578 HydrophobicContact CD2-CG 4.31Å; W465-L578 HydrophobicContact CE3-CB 4.44Å; W465-L578 HydrophobicContact CE3-CD1 4Å; W465-L578 HydrophobicContact CG-CB 3.72Å; W465-L578 HydrophobicContact CG-CD1 4.23Å; W465-L578 HydrophobicContact CG-CD2 4.07Å; W465-L578 HydrophobicContact CG-CG 4.24Å; W465-L578 HydrophobicContact CH2-CD1 4.3Å; W465-L578 HydrophobicContact CZ2-CD1 4.11Å; W465-L578 HydrophobicContact CZ3-CD1 4.25Å; W465-W683 HydrophobicContact CH2-CB 3.51Å; W465-W683 AromaticContact CH2-CD2 3.7Å; W465-W683 HydrophobicContact CH2-CD2 3.7Å; W465-W683 HydrophobicContact CH2-CE3 4.07Å; W465-W683 AromaticContact CH2-CG 3.46Å; W465-W683 HydrophobicContact CH2-CG 3.46Å; W465-W683 VanDerWaalsContact CH2-CG 3.46Å; W465-W683 HydrophobicContact CZ2-CB 4.06Å; W465-W683 HydrophobicContact CZ2-CD2 4Å; W465-W683 AromaticContact CZ2-CE3 3.87Å; W465-W683 HydrophobicContact CZ2-CE3 3.87Å; W465-W683 HydrophobicContact CZ2-CG 4.12Å; W465-W683 HydrophobicContact CZ3-CB 4.09Å; W465-W683 HydrophobicContact CZ3-CG 4.31Å
466	L	95.6	Very high	83.7	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	129.7	-175.2	-168.6	66.6	0	0	0	109.9	W463 T596 W598 A612 I664	W463-L466 HydrophobicContact CB-CB 3.64Å; W463-L466 HydrophobicContact CB-CD2 4.12Å; W463-L466 HydrophobicContact CG-CD2 4.49Å; W463-L466 PolarHBondContact O-N 2.7Å; L466-T596 HydrophobicContact CD1-CG2 4.27Å; L466-T596 HydrophobicContact CD2-CG2 4.42Å; L466-W598 HydrophobicContact CB-CH2 4.16Å; L466-W598 HydrophobicContact CB-CZ3 4.38Å; L466-W598 HydrophobicContact CD2-CD2 4.45Å; L466-W598 HydrophobicContact CD2-CE3 4.12Å; L466-W598 HydrophobicContact CD2-CH2 3.6Å; L466-W598 HydrophobicContact CD2-CZ2 3.98Å; L466-W598 HydrophobicContact CD2-CZ3 3.69Å; L466-W598 HydrophobicContact CG-CE3 4.27Å; L466-W598 HydrophobicContact CG-CH2 3.69Å; L466-W598 HydrophobicContact CG-CZ3 3.54Å; L466-A612 HydrophobicContact CD2-CB 3.82Å; L466-I664 HydrophobicContact CD1-CD1 3.64Å; L466-I664 HydrophobicContact CD1-CG1 3.75Å
467	A	96.1	Very high	81.9	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	131.2	-176.8	0	0	0	0	0	110.8	W465 I469 S489 G490 L498 V521 V522 V523	W465-A467 PolarHBondContact O-N 2.69Å; A467-I469 HydrophobicContact CB-CD1 4.43Å; A467-S489 CarbonylContact O-C 3.58Å; A467-S489 VanDerWaalsContact O-CA 3.29Å; A467-S489 WeakPolarHBondContact O-CA 3.36Å; A467-G490 PolarHBondContact N-O 3.34Å; A467-G490 PolarHBondContact O-N 2.97Å; A467-L498 HydrophobicContact CB-CD2 3.13Å; A467-V521 HydrophobicContact CB-CG1 4.29Å; A467-V522 CarbonylContact C-O 3.53Å; A467-V522 WeakPolarHBondContact CA-O 3.32Å; A467-V523 HydrophobicContact CB-CG1 3.67Å
468	A	94.8	Very high	80.2	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	123.4	174.4	0	0	0	0	0	109.1	Y470 L486 V522 K525 W598	A468-Y470 HydrophobicContact CB-CD2 4.29Å; A468-Y470 HydrophobicContact CB-CE2 3.63Å; A468-L486 HydrophobicContact CB-CD1 3.67Å; A468-V522 HydrophobicContact CB-CB 4.33Å; A468-V522 PolarHBondContact N-O 3.24Å; A468-V522 PolarHBondContact O-N 3.08Å; A468-K525 HydrophobicContact CB-CD 3.99Å; A468-W598 HydrophobicContact CB-CE3 3.75Å; A468-W598 HydrophobicContact CB-CH2 4.48Å; A468-W598 HydrophobicContact CB-CZ3 3.67Å
469	I	94.9	Very high	78.3	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	113.2	-179.9	-48.1	-57.2	0	0	0	108.2	A467 I487 C488 V500 I519 V521 I563	A467-I469 HydrophobicContact CB-CD1 4.43Å; I469-I487 HydrophobicContact CB-CG1 4.49Å; I469-I487 HydrophobicContact CG2-CD1 4.18Å; I469-I487 HydrophobicContact CG2-CG1 4.28Å; I469-I487 WeakPolarHBondContact O-CG1 3.05Å; I469-I487 PolarHBondContact O-N 3.26Å; I469-C488 HydrophobicContact CB-CB 4.4Å; I469-C488 WeakPolarHBondContact CB-O 3.37Å; I469-C488 PolarHBondContact N-O 3.09Å; I469-C488 PolarHBondContact O-N 2.71Å; I469-V500 HydrophobicContact CG1-CG2 4.21Å; I469-I519 HydrophobicContact CG2-CG2 4.02Å; I469-V521 HydrophobicContact CD1-CG1 4.14Å; I469-V521 HydrophobicContact CD1-CG2 3.99Å; I469-I563 HydrophobicContact CD1-CD1 4.01Å; I469-I563 HydrophobicContact CG2-CD1 4.41Å
470	Y	93.1	Very high	76.5	Confident	19 Å²	19	71.1 Å²	71.1	8%	0.075	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	139.1	177.5	-67.5	-99.9	0	0	0	110.4	A468 W484 Q485 L486 I519 K520 V522 K525 R528	A468-Y470 HydrophobicContact CB-CD2 4.29Å; A468-Y470 HydrophobicContact CB-CE2 3.63Å; Y470-W484 HydrophobicContact CD1-CB 4.21Å; Y470-Q485 CarbonylContact C-O 3.49Å; Y470-Q485 VanDerWaalsContact CA-O 3.22Å; Y470-Q485 WeakPolarHBondContact CA-O 3.41Å; Y470-L486 HydrophobicContact CD1-CB 4.03Å; Y470-L486 HydrophobicContact CD1-CD1 4.36Å; Y470-L486 HydrophobicContact CD2-CD1 4.1Å; Y470-L486 HydrophobicContact CE1-CB 3.77Å; Y470-L486 HydrophobicContact CE1-CD1 4.12Å; Y470-L486 HydrophobicContact CE2-CD1 3.85Å; Y470-L486 HydrophobicContact CG-CD1 4.34Å; Y470-I519 WeakPolarHBondContact O-CA 3.18Å; Y470-K520 PolarHBondContact N-O 2.91Å; Y470-K520 PolarHBondContact O-N 3.14Å; Y470-V522 HydrophobicContact CD2-CG2 3.87Å; Y470-V522 HydrophobicContact CE2-CB 4.23Å; Y470-V522 HydrophobicContact CE2-CG2 3.72Å; Y470-K525 VanDerWaalsContact OH-CE 3.28Å; Y470-K525 WeakPolarHBondContact OH-CE 3.48Å; Y470-R528 PolarHBondContact OH-O 2.93Å
471	R	91.1	Very high	74.7	Confident	63 Å²	63	72.2 Å²	72.2	24%	0.238	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.7	172.8	-174.3	173.9	176	167.3	0.9	110.2	Q485 I487 T506 E507 V514 T518 I519	R471-Q485 PolarHBondContact N-O 2.87Å; R471-Q485 PolarHBondContact O-N 3.37Å; R471-I487 HydrophobicContact CB-CD1 3.77Å; R471-I487 HydrophobicContact CB-CG1 3.98Å; R471-I487 HydrophobicContact CB-CG2 3.84Å; R471-T506 PolarHBondContact NH1-O 3.5Å; R471-E507 IonicContact NH2-OE1 3.56Å; R471-V514 VanDerWaalsContact NH2-CG1 3.29Å; R471-T518 CarbonylContact C-O 3.19Å; R471-T518 VanDerWaalsContact CA-O 3.3Å; R471-T518 WeakPolarHBondContact CA-O 3.42Å; R471-I519 HydrophobicContact CB-CD1 3.99Å; R471-I519 HydrophobicContact CG-CD1 4.07Å
472	R	87.9	Confident	73.2	Confident	76 Å²	76	74.2 Å²	74.2	29%	0.287	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	127.2	173.3	-176.9	171.1	56.6	153.8	-3	109.9	W484 A517 T518	R472-W484 HydrophobicContact CB-CD2 4.16Å; R472-W484 HydrophobicContact CB-CE3 3.85Å; R472-W484 HydrophobicContact CB-CH2 4.05Å; R472-W484 HydrophobicContact CB-CZ2 4.34Å; R472-W484 HydrophobicContact CB-CZ3 3.79Å; R472-A517 PolarHBondContact NH2-O 2.85Å; R472-A517 VanDerWaalsContact NH2-O 3.13Å; R472-T518 PolarHBondContact N-O 3.3Å
473	S	70	Confident	72.7	Confident	64 Å²	64	79 Å²	79	45%	0.448	40%	0.403	S	S	.	.			trans	-81	125.6	175	-170.5	0	0	0	0	110.6
474	L	61.8	Low	72.4	Confident	123 Å²	123	83.6 Å²	83.6	64%	0.644	42%	0.42	S	S	*	.			trans	-99.3	54.6	175.3	-64.5	176.5	0	0	0	110.7	E476 T518	L474-E476 PolarHBondContact O-N 3.29Å; L474-T518 HydrophobicContact CD1-CG2 3.94Å; L474-T518 HydrophobicContact CG-CG2 4.45Å
475	K	55.8	Low	72.2	Confident	172 Å²	172	88.6 Å²	88.6	75%	0.748	44%	0.443	S	S	*	.			trans	-80.1	111.5	169.8	-77.3	-172.7	175.4	-177.1	0	109.3	T477	K475-T477 PolarHBondContact O-N 3.07Å
476	E	44.1	Very low	71.9	Confident	202 Å²	202	88.7 Å²	88.7	94%	0.944	44%	0.444	S	S	*	.			trans	-68.7	75.8	168.4	-68.6	-175	145.2	0	0	110.5	L474	L474-E476 PolarHBondContact O-N 3.29Å
477	T	43.5	Very low	71.7	Confident	101 Å²	101	90.4 Å²	90.4	62%	0.62	45%	0.453	S	S	*	.			trans	-124.6	115.5	162.4	50.4	0	0	0	0	107.7	K475	K475-T477 PolarHBondContact O-N 3.07Å
478	E	48.2	Very low	71.5	Confident	186 Å²	186	91 Å²	91	87%	0.869	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	142.3	179.2	-60.7	-179.2	133.9	0	0	111
479	T	45.1	Very low	71.5	Confident	144 Å²	144	91.1 Å²	91.1	88%	0.883	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.9	11.5	169.6	77.3	0	0	0	0	120.8
480	K	44.9	Very low	71.5	Confident	190 Å²	190	91.1 Å²	91.1	83%	0.826	46%	0.457	S	S	*	.	S	Bend	trans	-128.8	138.5	159.2	-74.5	-169.6	177.6	-177.9	0	113.3
481	V	47.2	Very low	71.7	Confident	124 Å²	124	90.2 Å²	90.2	75%	0.752	45%	0.454	S	S	*	.			trans	-62.7	138.6	176	178.3	0	0	0	0	109.2	D483	V481-D483 PolarHBondContact O-N 3.19Å
482	S	55.3	Low	72	Confident	53 Å²	53	87.2 Å²	87.2	37%	0.371	44%	0.442	S	S	.	.			trans	-73.7	90.6	-179	61.8	0	0	0	0	111.3
483	D	76.8	Confident	72.4	Confident	131 Å²	131	84.3 Å²	84.3	70%	0.701	43%	0.433	S	S	*	.			trans	-69.3	151.9	179.6	-74.7	-33.6	0	0	0	113.2	V481	V481-D483 PolarHBondContact O-N 3.19Å
484	W	86	Confident	73.5	Confident	101 Å²	101	83.2 Å²	83.2	38%	0.383	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	113.6	175.1	-72.2	94.5	0	0	0	109.9	Y470 R472 T518 K520	Y470-W484 HydrophobicContact CD1-CB 4.21Å; R472-W484 HydrophobicContact CB-CD2 4.16Å; R472-W484 HydrophobicContact CB-CE3 3.85Å; R472-W484 HydrophobicContact CB-CH2 4.05Å; R472-W484 HydrophobicContact CB-CZ2 4.34Å; R472-W484 HydrophobicContact CB-CZ3 3.79Å; W484-T518 WeakPolarHBondContact CZ3-O 3.31Å; W484-K520 HydrophobicContact CD2-CB 4.17Å; W484-K520 HydrophobicContact CD2-CD 4.16Å; W484-K520 HydrophobicContact CE3-CB 3.61Å; W484-K520 HydrophobicContact CE3-CD 4.39Å; W484-K520 HydrophobicContact CG-CD 4.4Å; W484-K520 HydrophobicContact CH2-CB 3.8Å; W484-K520 HydrophobicContact CZ2-CB 4.33Å; W484-K520 HydrophobicContact CZ3-CB 3.41Å; W484-K520 VanDerWaalsContact CZ3-CB 3.41Å
485	Q	88.4	Confident	74.9	Confident	111 Å²	111	78.5 Å²	78.5	52%	0.519	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	132.2	177.7	-175.7	173.4	-5.9	0	0	110.4	Y470 R471 I487	Y470-Q485 CarbonylContact C-O 3.49Å; Y470-Q485 VanDerWaalsContact CA-O 3.22Å; Y470-Q485 WeakPolarHBondContact CA-O 3.41Å; R471-Q485 PolarHBondContact N-O 2.87Å; R471-Q485 PolarHBondContact O-N 3.37Å; Q485-I487 PolarHBondContact O-N 2.77Å
486	L	89.6	Confident	76.8	Confident	2 Å²	2	75.9 Å²	75.9	1%	0.01	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	126.4	168.9	-175	67.2	0	0	0	108.7	A468 Y470 W598	A468-L486 HydrophobicContact CB-CD1 3.67Å; Y470-L486 HydrophobicContact CD1-CB 4.03Å; Y470-L486 HydrophobicContact CD1-CD1 4.36Å; Y470-L486 HydrophobicContact CD2-CD1 4.1Å; Y470-L486 HydrophobicContact CE1-CB 3.77Å; Y470-L486 HydrophobicContact CE1-CD1 4.12Å; Y470-L486 HydrophobicContact CE2-CD1 3.85Å; Y470-L486 HydrophobicContact CG-CD1 4.34Å; L486-W598 HydrophobicContact CD2-CB 3.51Å; L486-W598 HydrophobicContact CD2-CG 4.32Å
487	I	90.8	Very high	79.3	Confident	37 Å²	37	66.5 Å²	66.5	19%	0.19	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	-36.5	-177.5	51	153	0	0	0	113.3	I469 R471 Q485 C504 I519 P600	I469-I487 HydrophobicContact CB-CG1 4.49Å; I469-I487 HydrophobicContact CG2-CD1 4.18Å; I469-I487 HydrophobicContact CG2-CG1 4.28Å; I469-I487 WeakPolarHBondContact O-CG1 3.05Å; I469-I487 PolarHBondContact O-N 3.26Å; R471-I487 HydrophobicContact CB-CD1 3.77Å; R471-I487 HydrophobicContact CB-CG1 3.98Å; R471-I487 HydrophobicContact CB-CG2 3.84Å; Q485-I487 PolarHBondContact O-N 2.77Å; I487-C504 HydrophobicContact CD1-CB 4.47Å; I487-C504 WeakPolarHBondContact CD1-O 3.29Å; I487-I519 HydrophobicContact CD1-CD1 4.42Å; I487-P600 WeakPolarHBondContact O-CG 3.41Å
488	C	92.1	Very high	81.8	Confident	11 Å²	11	61.7 Å²	61.7	7%	0.074	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	164	-175.4	-72.7	0	0	0	0	112.2	I469 V500 C504	I469-C488 HydrophobicContact CB-CB 4.4Å; I469-C488 WeakPolarHBondContact CB-O 3.37Å; I469-C488 PolarHBondContact N-O 3.09Å; I469-C488 PolarHBondContact O-N 2.71Å; C488-V500 HydrophobicContact CB-CG2 4.42Å; C488-C504 HydrophobicContact CB-CB 3.69Å; C488-C504 WeakPolarHBondContact CB-SG 3.33Å; C488-C504 WeakPolarHBondContact SG-CB 3.24Å; C488-C504 CovalentContact SG-SG 2.02Å; C488-C504 PolarHBondContact SG-SG 2.81Å
489	S	94.4	Very high	84.2	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	148.3	163.2	-82.4	0	0	0	0	111.1	A467 G597 W598	A467-S489 CarbonylContact O-C 3.58Å; A467-S489 VanDerWaalsContact O-CA 3.29Å; A467-S489 WeakPolarHBondContact O-CA 3.36Å; S489-G597 WeakPolarHBondContact OG-CA 3.48Å; S489-W598 VanDerWaalsContact OG-CE3 3.27Å; S489-W598 PolarHBondContact OG-N 2.85Å; S489-W598 VanDerWaalsContact OG-N 3.14Å
490	G	95.9	Very high	86.7	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	177.8	174.9	0	0	0	0	0	112.5	A467 V499	A467-G490 PolarHBondContact N-O 3.34Å; A467-G490 PolarHBondContact O-N 2.97Å; G490-V499 WeakPolarHBondContact CA-O 3.33Å
491	A	97.4	Very high	89.1	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	125.8	-177.9	0	0	0	0	0	112	V493 L498 V499 L578 I664 L685	A491-V493 PolarHBondContact O-N 3.16Å; A491-L498 CarbonylContact O-C 3.58Å; A491-L498 WeakPolarHBondContact O-CA 3.26Å; A491-L498 WeakPolarHBondContact O-CB 3.37Å; A491-V499 PolarHBondContact N-O 3.13Å; A491-V499 PolarHBondContact O-N 2.84Å; A491-L578 HydrophobicContact CB-CD2 4.28Å; A491-I664 HydrophobicContact CB-CD1 3.98Å; A491-I664 HydrophobicContact CB-CG2 4.18Å; A491-L685 HydrophobicContact CB-CD1 4Å; A491-L685 HydrophobicContact CB-CD2 3.91Å
492	L	97.3	Very high	91.5	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	116.9	167.6	-173.4	72.3	0	0	0	109.2	W465 N494 L498 L565 A569 V575 P577 L578	W465-L492 WeakPolarHBondContact O-CB 3.46Å; W465-L492 PolarHBondContact O-N 2.04Å; L492-N494 WeakPolarHBondContact CD1-O 3.13Å; L492-N494 WeakPolarHBondContact CG-O 3.47Å; L492-L498 HydrophobicContact CB-CD2 4.41Å; L492-L498 HydrophobicContact CD1-CD2 4.24Å; L492-L498 HydrophobicContact CD1-CG 4Å; L492-L565 HydrophobicContact CD1-CD1 4.43Å; L492-A569 HydrophobicContact CD1-CB 4.33Å; L492-A569 HydrophobicContact CD2-CB 4.19Å; L492-V575 HydrophobicContact CD2-CG1 3.7Å; L492-P577 CarbonylContact O-C 3.51Å; L492-P577 WeakPolarHBondContact O-CA 3.5Å; L492-L578 PolarHBondContact O-N 2.85Å
493	V	95.5	Very high	93.2	Very high	16 Å²	16	32 Å²	32	10%	0.097	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-21	-178.7	-64.1	0	0	0	0	113.1	A491 S497 V499 P577 L580 I720	A491-V493 PolarHBondContact O-N 3.16Å; V493-S497 WeakPolarHBondContact CG2-O 3.29Å; V493-S497 PolarHBondContact N-O 2.88Å; V493-V499 HydrophobicContact CG1-CB 4.27Å; V493-V499 HydrophobicContact CG1-CG2 3.7Å; V493-V499 HydrophobicContact CG2-CG2 4.02Å; V493-P577 VanDerWaalsContact O-CB 3.31Å; V493-P577 WeakPolarHBondContact O-CB 3.3Å; V493-L580 HydrophobicContact CG1-CD2 3.92Å; V493-I720 HydrophobicContact CG2-CG2 4.17Å
494	N	92.6	Very high	94	Very high	41 Å²	41	26 Å²	26	22%	0.219	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	-174.2	166.5	74.6	33.2	0	0	0	110.6	L492 R496 S497 I720	L492-N494 WeakPolarHBondContact CD1-O 3.13Å; L492-N494 WeakPolarHBondContact CG-O 3.47Å; N494-R496 PolarHBondContact O-N 2.86Å; N494-R496 WeakPolarHBondContact OD1-CA 3.2Å; N494-R496 PolarHBondContact OD1-N 2.94Å; N494-S497 PolarHBondContact N-O 3.45Å; N494-S497 PolarHBondContact ND2-OG 2.8Å; N494-S497 WeakPolarHBondContact OD1-CB 3.48Å; N494-S497 PolarHBondContact OD1-N 3.38Å; N494-S497 PolarHBondContact OD1-OG 3.22Å; N494-I720 PolarHBondContact ND2-O 3.12Å
495	Q	92.8	Very high	94.4	Very high	23 Å²	23	21.2 Å²	21.2	11%	0.107	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-5.2	-178.7	-82.5	179.8	-51.1	0	0	116.3	Y420 P445 K568 A569 I571	Y420-Q495 PolarHBondContact OH-NE2 2.88Å; P445-Q495 VanDerWaalsContact CG-CD 3.48Å; P445-Q495 HydrophobicContact CG-CG 3.63Å; Q495-K568 HydrophobicContact CB-CG 3.99Å; Q495-A569 PolarHBondContact NE2-O 3.33Å; Q495-A569 PolarHBondContact O-N 3.49Å; Q495-I571 HydrophobicContact CG-CD1 3.83Å; Q495-I571 HydrophobicContact CG-CG1 3.53Å; Q495-I571 VanDerWaalsContact NE2-CG1 3.32Å
496	R	95.1	Very high	94.6	Very high	117 Å²	117	16 Å²	16	44%	0.442	8%	0.077	S	C	.	.	T	Hydrogen-bonded Turn	trans	-142	4.1	-173.6	-68.6	-169.2	166	-75.1	4.4	114.2	N494 L565 L566 K568	N494-R496 PolarHBondContact O-N 2.86Å; N494-R496 WeakPolarHBondContact OD1-CA 3.2Å; N494-R496 PolarHBondContact OD1-N 2.94Å; R496-L565 PolarHBondContact NH1-O 3.33Å; R496-L565 WeakPolarHBondContact O-CB 3.44Å; R496-L565 PolarHBondContact O-N 2.75Å; R496-L566 PolarHBondContact NH1-O 3.45Å; R496-K568 HydrophobicContact CG-CG 4.44Å
497	S	96.8	Very high	94.5	Very high	5 Å²	5	20 Å²	20	4%	0.035	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	137.7	-170.7	-53.7	0	0	0	0	111.4	V493 N494 I563 I720	V493-S497 WeakPolarHBondContact CG2-O 3.29Å; V493-S497 PolarHBondContact N-O 2.88Å; N494-S497 PolarHBondContact N-O 3.45Å; N494-S497 PolarHBondContact ND2-OG 2.8Å; N494-S497 WeakPolarHBondContact OD1-CB 3.48Å; N494-S497 PolarHBondContact OD1-N 3.38Å; N494-S497 PolarHBondContact OD1-OG 3.22Å; S497-I563 WeakPolarHBondContact CA-O 3.34Å; S497-I720 VanDerWaalsContact CB-CG2 3.45Å
498	L	96.7	Very high	94.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	152.8	171.7	-51.3	98.5	0	0	0	110.7	A467 A491 L492 V521 V523 V562 I563 L565	A467-L498 HydrophobicContact CB-CD2 3.13Å; A491-L498 CarbonylContact O-C 3.58Å; A491-L498 WeakPolarHBondContact O-CA 3.26Å; A491-L498 WeakPolarHBondContact O-CB 3.37Å; L492-L498 HydrophobicContact CB-CD2 4.41Å; L492-L498 HydrophobicContact CD1-CD2 4.24Å; L492-L498 HydrophobicContact CD1-CG 4Å; L498-V521 HydrophobicContact CD1-CG1 3.92Å; L498-V521 HydrophobicContact CD1-CG2 4.39Å; L498-V521 HydrophobicContact CD2-CG1 3.69Å; L498-V521 HydrophobicContact CG-CG1 4.49Å; L498-V523 HydrophobicContact CD2-CG1 4.23Å; L498-V562 CarbonylContact O-C 3.56Å; L498-V562 WeakPolarHBondContact O-CA 3.26Å; L498-I563 HydrophobicContact CB-CB 4.44Å; L498-I563 HydrophobicContact CD1-CB 4.25Å; L498-I563 HydrophobicContact CD1-CG2 4.27Å; L498-I563 PolarHBondContact N-O 3.49Å; L498-I563 PolarHBondContact O-N 3.27Å; L498-L565 HydrophobicContact CD1-CD1 3.72Å; L498-L565 HydrophobicContact CD1-CD2 3.6Å; L498-L565 HydrophobicContact CD1-CG 3.57Å
499	V	97.7	Very high	93.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	135.2	169	178.4	0	0	0	0	108.2	G490 A491 V493 I560 L685 L688 I716	G490-V499 WeakPolarHBondContact CA-O 3.33Å; A491-V499 PolarHBondContact N-O 3.13Å; A491-V499 PolarHBondContact O-N 2.84Å; V493-V499 HydrophobicContact CG1-CB 4.27Å; V493-V499 HydrophobicContact CG1-CG2 3.7Å; V493-V499 HydrophobicContact CG2-CG2 4.02Å; V499-I560 HydrophobicContact CG1-CD1 3.76Å; V499-I560 HydrophobicContact CG1-CG1 3.88Å; V499-L685 HydrophobicContact CB-CD2 4.13Å; V499-L685 HydrophobicContact CG1-CD2 4.13Å; V499-L688 HydrophobicContact CG1-CD1 3.74Å; V499-L688 HydrophobicContact CG1-CD2 4.16Å; V499-L688 HydrophobicContact CG1-CG 4.46Å; V499-I716 HydrophobicContact CG1-CD1 4.46Å; V499-I716 HydrophobicContact CG2-CD1 4.24Å; V499-I716 HydrophobicContact CG2-CG1 4.36Å; V499-I716 HydrophobicContact CG2-CG2 3.77Å
500	V	97	Very high	93.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	159.7	-178.5	65.3	0	0	0	0	108.7	I469 C488 C504 V505 A561 I563	I469-V500 HydrophobicContact CG1-CG2 4.21Å; C488-V500 HydrophobicContact CB-CG2 4.42Å; V500-C504 HydrophobicContact CG2-CB 3.83Å; V500-V505 HydrophobicContact CG1-CG1 4.03Å; V500-A561 HydrophobicContact CG1-CB 4.12Å; V500-A561 PolarHBondContact N-O 3.46Å; V500-A561 PolarHBondContact O-N 3.25Å; V500-I563 HydrophobicContact CG1-CD1 3.87Å; V500-I563 HydrophobicContact CG1-CG1 3.92Å
501	A	96.1	Very high	92.9	Very high	5 Å²	5	38.3 Å²	38.3	4%	0.041	20%	0.195	C	C	.	.			trans	-61.1	146.8	168.8	0	0	0	0	0	110.7	H503 C504	A501-H503 VanDerWaalsContact CB-CE1 3.49Å; A501-H503 WeakPolarHBondContact CB-CE1 3.44Å; A501-C504 WeakPolarHBondContact O-CB 3.48Å
502	A	96.3	Very high	92.6	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.231	C	C	.	.	S	Bend	trans	-67.5	-40.5	-178.8	0	0	0	0	0	111.9	C504 V505 T506 V547 Y551 D559 A561	A502-C504 PolarHBondContact O-N 3.18Å; A502-C504 VanDerWaalsContact O-N 3.08Å; A502-V505 CarbonylContact O-C 3.4Å; A502-V505 VanDerWaalsContact O-CG2 3.29Å; A502-V505 WeakPolarHBondContact O-CG2 3.37Å; A502-V505 PolarHBondContact O-N 2.8Å; A502-T506 PolarHBondContact O-N 2.87Å; A502-T506 VanDerWaalsContact O-N 3.12Å; A502-V547 HydrophobicContact CB-CG1 3.88Å; A502-Y551 HydrophobicContact CB-CD1 3.75Å; A502-Y551 HydrophobicContact CB-CD2 3.68Å; A502-Y551 HydrophobicContact CB-CE1 3.84Å; A502-Y551 HydrophobicContact CB-CE2 3.77Å; A502-Y551 HydrophobicContact CB-CG 3.66Å; A502-D559 WeakPolarHBondContact CA-OD1 3.39Å; A502-D559 WeakPolarHBondContact CB-OD1 3.19Å; A502-D559 PolarHBondContact N-OD1 2.83Å; A502-A561 HydrophobicContact CB-CB 4.42Å
503	H	92.6	Very high	92.4	Very high	68 Å²	68	50 Å²	50	32%	0.315	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-28.9	-179.7	73.6	-103.9	0	0	0	113.2	A501 V505 Y551 L556 D559	A501-H503 VanDerWaalsContact CB-CE1 3.49Å; A501-H503 WeakPolarHBondContact CB-CE1 3.44Å; H503-V505 VanDerWaalsContact C-N 3.28Å; H503-V505 PolarHBondContact O-N 3.25Å; H503-Y551 WeakPolarHBondContact CA-OH 3.44Å; H503-Y551 WeakPolarHBondContact CB-OH 3.34Å; H503-L556 HydrophobicContact CB-CD2 4.2Å; H503-D559 IonicContact CE1-OD2 2.74Å; H503-D559 IonicContact CG-OD1 3.96Å; H503-D559 IonicContact CG-OD2 2.87Å; H503-D559 PolarHBondContact N-OD1 3.24Å; H503-D559 IonicContact ND1-OD1 3.78Å; H503-D559 PolarHBondContact ND1-OD1 2.66Å; H503-D559 IonicContact ND1-OD2 3.53Å; H503-D559 PolarHBondContact ND1-OD2 2.93Å
504	C	92.3	Very high	92.3	Very high	7 Å²	7	49.9 Å²	49.9	5%	0.047	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-33.3	174	-61.8	0	0	0	0	113.1	I487 C488 V500 A501 A502	I487-C504 HydrophobicContact CD1-CB 4.47Å; I487-C504 WeakPolarHBondContact CD1-O 3.29Å; C488-C504 HydrophobicContact CB-CB 3.69Å; C488-C504 WeakPolarHBondContact CB-SG 3.33Å; C488-C504 WeakPolarHBondContact SG-CB 3.24Å; C488-C504 CovalentContact SG-SG 2.02Å; C488-C504 PolarHBondContact SG-SG 2.81Å; V500-C504 HydrophobicContact CG2-CB 3.83Å; A501-C504 WeakPolarHBondContact O-CB 3.48Å; A502-C504 PolarHBondContact O-N 3.18Å; A502-C504 VanDerWaalsContact O-N 3.08Å
505	V	94.1	Very high	92.3	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	6.1	-172	-64	0	0	0	0	113.5	V500 A502 H503 P513 V514 I545 V547 A561 I563	V500-V505 HydrophobicContact CG1-CG1 4.03Å; A502-V505 CarbonylContact O-C 3.4Å; A502-V505 VanDerWaalsContact O-CG2 3.29Å; A502-V505 WeakPolarHBondContact O-CG2 3.37Å; A502-V505 PolarHBondContact O-N 2.8Å; H503-V505 VanDerWaalsContact C-N 3.28Å; H503-V505 PolarHBondContact O-N 3.25Å; V505-P513 CarbonylContact O-C 3.55Å; V505-P513 VanDerWaalsContact O-CA 3.29Å; V505-P513 WeakPolarHBondContact O-CA 3.45Å; V505-V514 WeakPolarHBondContact O-CG2 3.47Å; V505-V514 PolarHBondContact O-N 2.9Å; V505-I545 HydrophobicContact CB-CD1 4.37Å; V505-I545 HydrophobicContact CB-CG2 3.96Å; V505-I545 HydrophobicContact CG1-CD1 4.48Å; V505-I545 HydrophobicContact CG1-CG2 4.45Å; V505-I545 HydrophobicContact CG2-CG2 3.72Å; V505-V547 HydrophobicContact CG2-CG2 4.17Å; V505-A561 HydrophobicContact CG2-CB 3.49Å; V505-A561 VanDerWaalsContact CG2-CB 3.49Å; V505-I563 HydrophobicContact CG1-CD1 3.96Å; V505-I563 HydrophobicContact CG1-CG1 4.33Å
506	T	93.7	Very high	92.3	Very high	2 Å²	2	54 Å²	54	1%	0.012	27%	0.272	C	S	.	.	S	Bend	trans	-108.9	-173.8	169.2	70.1	0	0	0	0	111.8	R471 A502 K510 Y512 V547 Y551	R471-T506 PolarHBondContact NH1-O 3.5Å; A502-T506 PolarHBondContact O-N 2.87Å; A502-T506 VanDerWaalsContact O-N 3.12Å; T506-K510 WeakPolarHBondContact CB-O 3.38Å; T506-K510 PolarHBondContact OG1-O 2.81Å; T506-K510 VanDerWaalsContact OG1-O 3.13Å; T506-Y512 WeakPolarHBondContact CB-O 3.29Å; T506-Y512 WeakPolarHBondContact CG2-O 3.18Å; T506-V547 HydrophobicContact CG2-CG1 4.38Å; T506-V547 HydrophobicContact CG2-CG2 3.91Å; T506-Y551 HydrophobicContact CG2-CD1 4.37Å; T506-Y551 HydrophobicContact CG2-CE1 3.9Å
507	E	87.9	Confident	92.1	Very high	85 Å²	85	51.2 Å²	51.2	40%	0.397	27%	0.274	S	S	.	.			trans	-102.1	156.9	163.7	-76.6	172.5	-175.8	0	0	109.6	R471 G509 K510 V514	R471-E507 IonicContact NH2-OE1 3.56Å; E507-G509 PolarHBondContact O-N 3.28Å; E507-K510 HydrophobicContact CB-CB 4.26Å; E507-K510 HydrophobicContact CB-CD 3.95Å; E507-K510 HydrophobicContact CB-CG 4.11Å; E507-K510 PolarHBondContact O-N 3.47Å; E507-K510 WeakPolarHBondContact OE2-CE 3.37Å; E507-K510 IonicContact OE2-NZ 2.69Å; E507-K510 PolarHBondContact OE2-NZ 3.02Å; E507-V514 HydrophobicContact CG-CG1 4.21Å
508	L	83.8	Confident	91.9	Very high	182 Å²	182	51.6 Å²	51.6	95%	0.953	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	126.1	178.1	-65.5	171.1	0	0	0	110.4	K510	L508-K510 VanDerWaalsContact C-N 3.28Å; L508-K510 PolarHBondContact O-N 2.78Å
509	G	82	Confident	91.8	Very high	45 Å²	45	51.9 Å²	51.9	46%	0.464	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	71	11.2	-177.2	0	0	0	0	0	115.7	E507	E507-G509 PolarHBondContact O-N 3.28Å
510	K	86.8	Confident	91.5	Very high	106 Å²	106	54 Å²	54	46%	0.461	29%	0.286	S	S	.	.			trans	-116.7	142.2	178.1	-57.3	-165.3	-169.4	166.9	0	112.4	T506 E507 L508	T506-K510 WeakPolarHBondContact CB-O 3.38Å; T506-K510 PolarHBondContact OG1-O 2.81Å; T506-K510 VanDerWaalsContact OG1-O 3.13Å; E507-K510 HydrophobicContact CB-CB 4.26Å; E507-K510 HydrophobicContact CB-CD 3.95Å; E507-K510 HydrophobicContact CB-CG 4.11Å; E507-K510 PolarHBondContact O-N 3.47Å; E507-K510 WeakPolarHBondContact OE2-CE 3.37Å; E507-K510 IonicContact OE2-NZ 2.69Å; E507-K510 PolarHBondContact OE2-NZ 3.02Å; L508-K510 VanDerWaalsContact C-N 3.28Å; L508-K510 PolarHBondContact O-N 2.78Å
511	M	87.3	Confident	91.5	Very high	102 Å²	102	54 Å²	54	50%	0.502	29%	0.286	S	S	.	.			trans	-89.4	-15.9	176.6	-64	165.7	170.8	0	0	113.5	P553	M511-P553 HydrophobicContact CG-CG 4.17Å
512	Y	89.4	Confident	91.4	Very high	191 Å²	191	53.7 Å²	53.7	75%	0.749	28%	0.284	S	S	*	.	S	Bend	trans	-87.9	141.6	-177.7	-59.1	-70.5	0	0	0	111.8	T506	T506-Y512 WeakPolarHBondContact CB-O 3.29Å; T506-Y512 WeakPolarHBondContact CG2-O 3.18Å
513	P	93.5	Very high	91.3	Very high	55 Å²	55	53.7 Å²	53.7	36%	0.357	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-67.7	153.6	176.8	28.4	-34.5	0	0	0	112	V505 I545 V547	V505-P513 CarbonylContact O-C 3.55Å; V505-P513 VanDerWaalsContact O-CA 3.29Å; V505-P513 WeakPolarHBondContact O-CA 3.45Å; P513-I545 HydrophobicContact CB-CB 3.88Å; P513-I545 HydrophobicContact CB-CG2 3.74Å; P513-V547 HydrophobicContact CB-CG2 3.97Å; P513-V547 HydrophobicContact CG-CG2 4.42Å
514	V	93.1	Very high	91.3	Very high	14 Å²	14	50.5 Å²	50.5	9%	0.085	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-70.2	161.9	170.3	-57.6	0	0	0	0	111.6	R471 V505 E507 T516 I519 I545	R471-V514 VanDerWaalsContact NH2-CG1 3.29Å; V505-V514 WeakPolarHBondContact O-CG2 3.47Å; V505-V514 PolarHBondContact O-N 2.9Å; E507-V514 HydrophobicContact CG-CG1 4.21Å; V514-T516 PolarHBondContact O-N 2.8Å; V514-I519 HydrophobicContact CG2-CD1 3.77Å; V514-I519 HydrophobicContact CG2-CG1 3.58Å; V514-I545 HydrophobicContact CG2-CD1 4.42Å
515	D	92.4	Very high	91.2	Very high	102 Å²	102	50.3 Å²	50.3	55%	0.545	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-59.3	135.1	176.1	178.2	-88.8	0	0	0	112	A517 T518	D515-A517 VanDerWaalsContact C-N 3.26Å; D515-A517 PolarHBondContact O-N 2.82Å; D515-A517 WeakPolarHBondContact OD1-CA 3.38Å; D515-A517 VanDerWaalsContact OD1-CB 3.25Å; D515-A517 WeakPolarHBondContact OD1-CB 3.44Å; D515-A517 PolarHBondContact OD1-N 2.94Å; D515-T518 HydrophobicContact CB-CG2 4.14Å; D515-T518 WeakPolarHBondContact O-CB 3.43Å; D515-T518 PolarHBondContact O-N 2.91Å; D515-T518 PolarHBondContact O-OG1 2.77Å
516	T	93.7	Very high	90.8	Very high	49 Å²	49	51.2 Å²	51.2	30%	0.301	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-66	-25.1	-172.9	58.6	0	0	0	0	113.4	V514 T518 I519 V542 I545	V514-T516 PolarHBondContact O-N 2.8Å; T516-T518 PolarHBondContact O-N 3.39Å; T516-I519 PolarHBondContact O-N 3.14Å; T516-V542 HydrophobicContact CG2-CG1 3.87Å; T516-I545 HydrophobicContact CG2-CD1 4.46Å; T516-I545 HydrophobicContact CG2-CG1 4.3Å
517	A	90.6	Very high	90.6	Very high	58 Å²	58	53.1 Å²	53.1	48%	0.479	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-80	-2.1	174	0	0	0	0	0	113.1	R472 D515	R472-A517 PolarHBondContact NH2-O 2.85Å; R472-A517 VanDerWaalsContact NH2-O 3.13Å; D515-A517 VanDerWaalsContact C-N 3.26Å; D515-A517 PolarHBondContact O-N 2.82Å; D515-A517 WeakPolarHBondContact OD1-CA 3.38Å; D515-A517 VanDerWaalsContact OD1-CB 3.25Å; D515-A517 WeakPolarHBondContact OD1-CB 3.44Å; D515-A517 PolarHBondContact OD1-N 2.94Å
518	T	92.1	Very high	90.4	Very high	12 Å²	12	50.9 Å²	50.9	7%	0.074	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-94.1	-5.3	168.2	72.2	0	0	0	0	113.3	R471 R472 L474 W484 D515 T516	R471-T518 CarbonylContact C-O 3.19Å; R471-T518 VanDerWaalsContact CA-O 3.3Å; R471-T518 WeakPolarHBondContact CA-O 3.42Å; R472-T518 PolarHBondContact N-O 3.3Å; L474-T518 HydrophobicContact CD1-CG2 3.94Å; L474-T518 HydrophobicContact CG-CG2 4.45Å; W484-T518 WeakPolarHBondContact CZ3-O 3.31Å; D515-T518 HydrophobicContact CB-CG2 4.14Å; D515-T518 WeakPolarHBondContact O-CB 3.43Å; D515-T518 PolarHBondContact O-N 2.91Å; D515-T518 PolarHBondContact O-OG1 2.77Å; T516-T518 PolarHBondContact O-N 3.39Å
519	I	94.4	Very high	90.4	Very high	6 Å²	6	44.5 Å²	44.5	3%	0.031	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	132.1	178.6	-60.7	-63.5	0	0	0	111.6	I469 Y470 R471 I487 V514 T516 V521 V542 I545	I469-I519 HydrophobicContact CG2-CG2 4.02Å; Y470-I519 WeakPolarHBondContact O-CA 3.18Å; R471-I519 HydrophobicContact CB-CD1 3.99Å; R471-I519 HydrophobicContact CG-CD1 4.07Å; I487-I519 HydrophobicContact CD1-CD1 4.42Å; V514-I519 HydrophobicContact CG2-CD1 3.77Å; V514-I519 HydrophobicContact CG2-CG1 3.58Å; T516-I519 PolarHBondContact O-N 3.14Å; I519-V521 HydrophobicContact CG2-CG2 4.39Å; I519-V542 HydrophobicContact CB-CG2 4.17Å; I519-V542 HydrophobicContact CG2-CG2 3.78Å; I519-I545 HydrophobicContact CG1-CD1 4.08Å
520	K	92.8	Very high	90.1	Very high	44 Å²	44	43.7 Å²	43.7	19%	0.191	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	126.7	172.9	169.7	-165.2	174.4	-155.3	0	108.2	Y470 W484 V522 D530 H539	Y470-K520 PolarHBondContact N-O 2.91Å; Y470-K520 PolarHBondContact O-N 3.14Å; W484-K520 HydrophobicContact CD2-CB 4.17Å; W484-K520 HydrophobicContact CD2-CD 4.16Å; W484-K520 HydrophobicContact CE3-CB 3.61Å; W484-K520 HydrophobicContact CE3-CD 4.39Å; W484-K520 HydrophobicContact CG-CD 4.4Å; W484-K520 HydrophobicContact CH2-CB 3.8Å; W484-K520 HydrophobicContact CZ2-CB 4.33Å; W484-K520 HydrophobicContact CZ3-CB 3.41Å; W484-K520 VanDerWaalsContact CZ3-CB 3.41Å; K520-V522 HydrophobicContact CD-CG2 4.32Å; K520-V522 HydrophobicContact CG-CG2 4.21Å; K520-D530 IonicContact NZ-OD2 3.56Å; K520-D530 PolarHBondContact NZ-OD2 3.41Å; K520-H539 VanDerWaalsContact CE-ND1 3.35Å; K520-H539 WeakPolarHBondContact CE-ND1 3.11Å
521	V	95.8	Very high	89.5	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	137.9	175.8	-179	0	0	0	0	109.5	A467 I469 L498 I519 V523 H539 L540 V542 I563 L565	A467-V521 HydrophobicContact CB-CG1 4.29Å; I469-V521 HydrophobicContact CD1-CG1 4.14Å; I469-V521 HydrophobicContact CD1-CG2 3.99Å; L498-V521 HydrophobicContact CD1-CG1 3.92Å; L498-V521 HydrophobicContact CD1-CG2 4.39Å; L498-V521 HydrophobicContact CD2-CG1 3.69Å; L498-V521 HydrophobicContact CG-CG1 4.49Å; I519-V521 HydrophobicContact CG2-CG2 4.39Å; V521-V523 HydrophobicContact CG1-CG1 4.23Å; V521-H539 WeakPolarHBondContact O-CA 3.36Å; V521-L540 PolarHBondContact N-O 3.2Å; V521-L540 PolarHBondContact O-N 2.84Å; V521-V542 HydrophobicContact CG2-CG2 3.88Å; V521-I563 HydrophobicContact CG2-CD1 4.41Å; V521-I563 HydrophobicContact CG2-CG2 4.18Å; V521-L565 HydrophobicContact CB-CD2 4.12Å; V521-L565 HydrophobicContact CG1-CD2 4.38Å; V521-L565 HydrophobicContact CG2-CD2 4.1Å
522	V	94.8	Very high	88.9	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	125	174.9	-169.2	0	0	0	0	110.2	A467 A468 Y470 K520 K525 P537 Q538 H539	A467-V522 CarbonylContact C-O 3.53Å; A467-V522 WeakPolarHBondContact CA-O 3.32Å; A468-V522 HydrophobicContact CB-CB 4.33Å; A468-V522 PolarHBondContact N-O 3.24Å; A468-V522 PolarHBondContact O-N 3.08Å; Y470-V522 HydrophobicContact CD2-CG2 3.87Å; Y470-V522 HydrophobicContact CE2-CB 4.23Å; Y470-V522 HydrophobicContact CE2-CG2 3.72Å; K520-V522 HydrophobicContact CD-CG2 4.32Å; K520-V522 HydrophobicContact CG-CG2 4.21Å; V522-K525 HydrophobicContact CG1-CD 4.32Å; V522-P537 HydrophobicContact CG1-CB 3.71Å; V522-Q538 WeakPolarHBondContact CA-O 3.5Å; V522-H539 VanDerWaalsContact CG2-ND1 3.3Å; V522-H539 WeakPolarHBondContact CG2-ND1 3.31Å
523	V	95	Very high	88	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	159.7	178.1	-57	0	0	0	0	111.6	A467 L498 V521 P537 Q538 L540 V575	A467-V523 HydrophobicContact CB-CG1 3.67Å; L498-V523 HydrophobicContact CD2-CG1 4.23Å; V521-V523 HydrophobicContact CG1-CG1 4.23Å; V523-P537 CarbonylContact O-C 3.52Å; V523-P537 WeakPolarHBondContact O-CA 3.06Å; V523-Q538 HydrophobicContact CG2-CB 3.94Å; V523-Q538 PolarHBondContact N-O 3.44Å; V523-Q538 VanDerWaalsContact N-O 3.07Å; V523-Q538 PolarHBondContact O-N 2.04Å; V523-L540 HydrophobicContact CG1-CD1 4.42Å; V523-L540 HydrophobicContact CG2-CD1 3.69Å; V523-V575 HydrophobicContact CG2-CG1 3.93Å; V523-V575 HydrophobicContact CG2-CG2 4.11Å
524	G	91.7	Very high	86.4	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.219	C	C	.	.	S	Bend	trans	73.7	31.3	-178	0	0	0	0	0	113.5	G536 K574 V575	G524-G536 CarbonylContact O-C 3.49Å; G524-G536 VanDerWaalsContact O-C 3.31Å; G524-K574 WeakPolarHBondContact CA-O 3.07Å; G524-V575 VanDerWaalsContact CA-CG2 3.43Å
525	K	89.6	Confident	84.9	Confident	3 Å²	3	52.6 Å²	52.6	1%	0.013	26%	0.259	C	S	.	.			trans	-105.5	141.9	-176.9	-178.4	177.7	179.9	66.4	0	108.9	A468 Y470 V522 Y527 R528 D529 D530 P537 W598	A468-K525 HydrophobicContact CB-CD 3.99Å; Y470-K525 VanDerWaalsContact OH-CE 3.28Å; Y470-K525 WeakPolarHBondContact OH-CE 3.48Å; V522-K525 HydrophobicContact CG1-CD 4.32Å; K525-Y527 WeakPolarHBondContact CE-O 3.19Å; K525-Y527 WeakPolarHBondContact CG-O 3.49Å; K525-Y527 PolarHBondContact NZ-O 2.99Å; K525-R528 WeakPolarHBondContact CE-O 3.44Å; K525-R528 PolarHBondContact NZ-O 2.81Å; K525-D529 PolarHBondContact NZ-O 3.07Å; K525-D530 IonicContact NZ-OD1 3.08Å; K525-D530 PolarHBondContact NZ-OD1 3.42Å; K525-P537 HydrophobicContact CB-CG 4.48Å; K525-W598 HydrophobicContact CB-CH2 4.04Å; K525-W598 HydrophobicContact CB-CZ2 4.01Å; K525-W598 HydrophobicContact CD-CH2 4.42Å; K525-W598 HydrophobicContact CD-CZ2 4.25Å; K525-W598 HydrophobicContact CG-CH2 4.34Å; K525-W598 HydrophobicContact CG-CZ2 3.94Å; K525-W598 WeakPolarHBondContact O-CZ2 3.39Å
526	H	87.2	Confident	84.1	Confident	20 Å²	20	48.4 Å²	48.4	9%	0.093	24%	0.24	C	C	.	.			trans	-113.9	-52.9	174.1	-172.7	56.6	0	0	0	110.7	E460 A461 W598 K611 A612	E460-H526 PolarHBondContact O-CE1 3.22Å; A461-H526 PolarHBondContact O-CE1 2.88Å; H526-W598 PolarHBondContact O-NE1 3.38Å; H526-K611 WeakPolarHBondContact NE2-CD 3.12Å; H526-K611 VanDerWaalsContact NE2-CE 3.35Å; H526-K611 WeakPolarHBondContact NE2-CE 3.11Å; H526-K611 PolarHBondContact NE2-NZ 3.37Å; H526-K611 WeakPolarHBondContact O-CA 2.96Å; H526-A612 PolarHBondContact O-N 3.1Å; H526-A612 VanDerWaalsContact O-N 3.13Å
527	Y	87.9	Confident	83.9	Confident	41 Å²	41	47.3 Å²	47.3	16%	0.161	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-86.1	150.1	176.7	-57.8	-76.4	0	0	0	112.7	K525 D529 R532 E533 E610 K611	K525-Y527 WeakPolarHBondContact CE-O 3.19Å; K525-Y527 WeakPolarHBondContact CG-O 3.49Å; K525-Y527 PolarHBondContact NZ-O 2.99Å; Y527-D529 VanDerWaalsContact C-N 3.29Å; Y527-D529 PolarHBondContact O-N 3.25Å; Y527-R532 HydrophobicContact CD2-CG 4.27Å; Y527-E533 HydrophobicContact CD2-CG 4.24Å; Y527-E610 CarbonylContact C-O 3.51Å; Y527-E610 VanDerWaalsContact CA-O 3.31Å; Y527-E610 WeakPolarHBondContact CA-O 2.96Å; Y527-K611 HydrophobicContact CD1-CG 3.65Å; Y527-K611 HydrophobicContact CE1-CD 4.14Å; Y527-K611 VanDerWaalsContact CE1-CE 3.46Å; Y527-K611 HydrophobicContact CE1-CG 3.61Å
528	R	85.3	Confident	84	Confident	39 Å²	39	46.2 Å²	46.2	15%	0.147	22%	0.218	C	C	.	.	S	Bend	trans	-62.1	-33.3	175.6	-178.9	-177.4	159.4	92	-6.1	112.5	Y470 K525 S599 P600 E610	Y470-R528 PolarHBondContact OH-O 2.93Å; K525-R528 WeakPolarHBondContact CE-O 3.44Å; K525-R528 PolarHBondContact NZ-O 2.81Å; R528-S599 PolarHBondContact NH1-O 3.45Å; R528-P600 PolarHBondContact NH1-O 3.43Å; R528-P600 PolarHBondContact NH2-O 2.81Å; R528-E610 HydrophobicContact CB-CB 4.21Å; R528-E610 HydrophobicContact CB-CG 4.22Å; R528-E610 WeakPolarHBondContact CD-OE2 3.2Å; R528-E610 PolarHBondContact N-O 3.4Å; R528-E610 IonicContact NE-OE2 2.7Å
529	D	82.8	Confident	84.1	Confident	47 Å²	47	50.4 Å²	50.4	25%	0.251	24%	0.237	S	C	.	.			trans	-74.2	136.5	171.7	-171.1	1.9	0	0	0	111.4	K525 Y527 H531 L608	K525-D529 PolarHBondContact NZ-O 3.07Å; Y527-D529 VanDerWaalsContact C-N 3.29Å; Y527-D529 PolarHBondContact O-N 3.25Å; D529-H531 IonicContact OD1-CD2 2.91Å; D529-H531 PolarHBondContact OD1-CD2 3.17Å; D529-H531 VanDerWaalsContact OD1-CD2 3.27Å; D529-H531 IonicContact OD1-CG 2.81Å; D529-H531 PolarHBondContact OD1-N 2.76Å; D529-L608 HydrophobicContact CB-CD2 4.47Å; D529-L608 WeakPolarHBondContact OD2-CD2 3.47Å
530	D	75.3	Confident	84.1	Confident	29 Å²	29	50.6 Å²	50.6	16%	0.155	24%	0.238	C	C	.	.	S	Bend	trans	-77.5	-30.6	172.9	-83.4	-9.7	0	0	0	111.3	K520 K525 R532 H539	K520-D530 IonicContact NZ-OD2 3.56Å; K520-D530 PolarHBondContact NZ-OD2 3.41Å; K525-D530 IonicContact NZ-OD1 3.08Å; K525-D530 PolarHBondContact NZ-OD1 3.42Å; D530-R532 VanDerWaalsContact C-N 3.35Å; D530-R532 PolarHBondContact O-N 3.05Å; D530-H539 IonicContact OD1-CE1 3.21Å; D530-H539 IonicContact OD2-CE1 3.46Å; D530-H539 PolarHBondContact OD2-CE1 2.87Å; D530-H539 IonicContact OD2-ND1 3.27Å
531	H	74.5	Confident	84.1	Confident	157 Å²	157	55.5 Å²	55.5	73%	0.727	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-19.6	-171.5	-64.3	-67.9	0	0	0	114.6	D529 E533	D529-H531 IonicContact OD1-CD2 2.91Å; D529-H531 PolarHBondContact OD1-CD2 3.17Å; D529-H531 VanDerWaalsContact OD1-CD2 3.27Å; D529-H531 IonicContact OD1-CG 2.81Å; D529-H531 PolarHBondContact OD1-N 2.76Å; H531-E533 PolarHBondContact O-N 3.03Å
532	R	75	Confident	84.2	Confident	92 Å²	92	56.1 Å²	56.1	35%	0.347	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-29	-178	-169.5	170.2	-179.2	-175.4	1	113.5	Y527 D530 L608 E609	Y527-R532 HydrophobicContact CD2-CG 4.27Å; D530-R532 VanDerWaalsContact C-N 3.35Å; D530-R532 PolarHBondContact O-N 3.05Å; R532-L608 PolarHBondContact NH1-O 3.22Å; R532-E609 VanDerWaalsContact CZ-CD 3.49Å; R532-E609 IonicContact CZ-OE1 3.18Å; R532-E609 IonicContact CZ-OE2 3.16Å; R532-E609 IonicContact NH1-OE1 3.12Å; R532-E609 PolarHBondContact NH1-OE1 3.38Å; R532-E609 VanDerWaalsContact NH1-OE1 3.12Å; R532-E609 IonicContact NH1-OE2 2.71Å; R532-E609 PolarHBondContact NH1-OE2 2.88Å; R532-E609 IonicContact NH2-OE1 2.91Å; R532-E609 PolarHBondContact NH2-OE1 3.29Å; R532-E609 IonicContact NH2-OE2 2.75Å; R532-E609 PolarHBondContact NH2-OE2 3.42Å
533	E	70.3	Confident	84.2	Confident	37 Å²	37	58.7 Å²	58.7	17%	0.173	28%	0.277	C	S	.	.			trans	-113.9	83.8	-178.9	-74.2	-155.6	-168.6	0	0	112.9	Y527 H531 K535 G536 P537 K574	Y527-E533 HydrophobicContact CD2-CG 4.24Å; H531-E533 PolarHBondContact O-N 3.03Å; E533-K535 PolarHBondContact O-N 2.82Å; E533-G536 PolarHBondContact O-N 3.37Å; E533-P537 HydrophobicContact CB-CG 4.21Å; E533-P537 WeakPolarHBondContact O-CD 3.43Å; E533-K574 IonicContact OE1-NZ 2.82Å; E533-K574 PolarHBondContact OE1-NZ 2.71Å; E533-K574 IonicContact OE2-NZ 3.23Å; E533-K574 PolarHBondContact OE2-NZ 3.3Å
534	N	59.1	Low	84.3	Confident	155 Å²	155	61 Å²	61	83%	0.829	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-14.4	178	-78.3	-37.1	0	0	0	116.1
535	K	63.5	Low	84.5	Confident	214 Å²	214	62 Å²	62	93%	0.93	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.1	39.8	-176.9	-66.1	-172.6	178.7	174.4	0	114	E533	E533-K535 PolarHBondContact O-N 2.82Å
536	G	74.5	Confident	84.9	Confident	13 Å²	13	63 Å²	63	13%	0.134	31%	0.308	C	S	.	.	S	Bend	trans	-124.6	-63.6	176.1	0	0	0	0	0	113.7	G524 E533	G524-G536 CarbonylContact O-C 3.49Å; G524-G536 VanDerWaalsContact O-C 3.31Å; E533-G536 PolarHBondContact O-N 3.37Å
537	P	89.8	Confident	85.4	Confident	26 Å²	26	63.1 Å²	63.1	17%	0.169	31%	0.31	C	S	.	.			trans	-63.4	141.9	-174.9	-24	34.8	0	0	0	113.4	V522 V523 K525 E533	V522-P537 HydrophobicContact CG1-CB 3.71Å; V523-P537 CarbonylContact O-C 3.52Å; V523-P537 WeakPolarHBondContact O-CA 3.06Å; K525-P537 HydrophobicContact CB-CG 4.48Å; E533-P537 HydrophobicContact CB-CG 4.21Å; E533-P537 WeakPolarHBondContact O-CD 3.43Å
538	Q	93.6	Very high	85.9	Confident	35 Å²	35	62.3 Å²	62.3	16%	0.164	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	111.1	171.6	-60.1	-179.5	46	0	0	108.5	V522 V523 L540 R570	V522-Q538 WeakPolarHBondContact CA-O 3.5Å; V523-Q538 HydrophobicContact CG2-CB 3.94Å; V523-Q538 PolarHBondContact N-O 3.44Å; V523-Q538 VanDerWaalsContact N-O 3.07Å; V523-Q538 PolarHBondContact O-N 2.04Å; Q538-L540 HydrophobicContact CB-CD2 4.3Å; Q538-L540 HydrophobicContact CB-CG 4.38Å; Q538-R570 PolarHBondContact NE2-O 3.03Å
539	H	92.9	Very high	86.4	Confident	101 Å²	101	65.4 Å²	65.4	47%	0.468	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	122.5	170.9	-48	-60.9	0	0	0	109.2	K520 V521 V522 D530	K520-H539 VanDerWaalsContact CE-ND1 3.35Å; K520-H539 WeakPolarHBondContact CE-ND1 3.11Å; V521-H539 WeakPolarHBondContact O-CA 3.36Å; V522-H539 VanDerWaalsContact CG2-ND1 3.3Å; V522-H539 WeakPolarHBondContact CG2-ND1 3.31Å; D530-H539 IonicContact OD1-CE1 3.21Å; D530-H539 IonicContact OD2-CE1 3.46Å; D530-H539 PolarHBondContact OD2-CE1 2.87Å; D530-H539 IonicContact OD2-ND1 3.27Å
540	L	95.1	Very high	87	Confident	10 Å²	10	68.4 Å²	68.4	5%	0.052	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130.3	-173	-56.2	174.1	0	0	0	109.2	V521 V523 Q538 L565 D567 A569	V521-L540 PolarHBondContact N-O 3.2Å; V521-L540 PolarHBondContact O-N 2.84Å; V523-L540 HydrophobicContact CG1-CD1 4.42Å; V523-L540 HydrophobicContact CG2-CD1 3.69Å; Q538-L540 HydrophobicContact CB-CD2 4.3Å; Q538-L540 HydrophobicContact CB-CG 4.38Å; L540-L565 HydrophobicContact CB-CD1 4.19Å; L540-L565 HydrophobicContact CB-CD2 3.85Å; L540-L565 HydrophobicContact CD1-CD1 3.62Å; L540-L565 HydrophobicContact CG-CD1 4.5Å; L540-D567 HydrophobicContact CB-CB 4.45Å; L540-D567 HydrophobicContact CD2-CB 3.84Å; L540-A569 HydrophobicContact CD1-CB 3.87Å
541	R	93.6	Very high	87.9	Confident	147 Å²	147	67.4 Å²	67.4	56%	0.555	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	145	177.2	-62.7	171.3	-65.5	161.7	3.3	111	L565 L566 D567	R541-L565 WeakPolarHBondContact O-CA 3.42Å; R541-L566 HydrophobicContact CB-CB 4.31Å; R541-L566 HydrophobicContact CB-CD2 4.48Å; R541-L566 PolarHBondContact O-N 2.87Å; R541-D567 VanDerWaalsContact CB-OD2 3.26Å; R541-D567 WeakPolarHBondContact CB-OD2 3.27Å; R541-D567 WeakPolarHBondContact CG-OD2 3.05Å; R541-D567 IonicContact CZ-OD1 2.72Å; R541-D567 IonicContact CZ-OD2 3.95Å; R541-D567 PolarHBondContact N-OD2 2.86Å; R541-D567 IonicContact NE-OD1 3Å; R541-D567 IonicContact NE-OD2 3.31Å; R541-D567 PolarHBondContact NE-OD2 3.08Å; R541-D567 IonicContact NH2-OD1 2.61Å; R541-D567 PolarHBondContact NH2-OD1 2.72Å; R541-D567 IonicContact NH2-OD2 3.16Å
542	V	96.3	Very high	88.8	Confident	12 Å²	12	62.3 Å²	62.3	7%	0.073	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	139.5	174.4	179.8	0	0	0	0	109.9	T516 I519 V521 I545 I563	T516-V542 HydrophobicContact CG2-CG1 3.87Å; I519-V542 HydrophobicContact CB-CG2 4.17Å; I519-V542 HydrophobicContact CG2-CG2 3.78Å; V521-V542 HydrophobicContact CG2-CG2 3.88Å; V542-I545 HydrophobicContact CG1-CD1 4.38Å; V542-I545 HydrophobicContact CG1-CG1 3.79Å; V542-I563 HydrophobicContact CB-CG2 4.28Å; V542-I563 HydrophobicContact CG1-CG2 3.8Å; V542-I563 HydrophobicContact CG2-CG2 3.61Å
543	S	95.8	Very high	89.6	Confident	55 Å²	55	58.8 Å²	58.8	39%	0.385	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-37.6	170.1	60.8	0	0	0	0	112.1	K564	S543-K564 PolarHBondContact N-O 2.9Å; S543-K564 WeakPolarHBondContact OG-CB 2.93Å; S543-K564 PolarHBondContact OG-O 2.63Å
544	S	96.5	Very high	90.3	Very high	48 Å²	48	63.9 Å²	63.9	34%	0.336	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	157.5	178.1	42.9	0	0	0	0	110.7	K564	S544-K564 PolarHBondContact N-O 2.88Å; S544-K564 PolarHBondContact O-N 2.81Å; S544-K564 WeakPolarHBondContact OG-CB 3.34Å; S544-K564 WeakPolarHBondContact OG-CD 3.44Å
545	I	97.1	Very high	91.7	Very high	21 Å²	21	59.3 Å²	59.3	11%	0.108	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	126.8	175.6	-58.3	170.8	0	0	0	106.6	V505 P513 V514 T516 I519 V542 V547 I563	V505-I545 HydrophobicContact CB-CD1 4.37Å; V505-I545 HydrophobicContact CB-CG2 3.96Å; V505-I545 HydrophobicContact CG1-CD1 4.48Å; V505-I545 HydrophobicContact CG1-CG2 4.45Å; V505-I545 HydrophobicContact CG2-CG2 3.72Å; P513-I545 HydrophobicContact CB-CB 3.88Å; P513-I545 HydrophobicContact CB-CG2 3.74Å; V514-I545 HydrophobicContact CG2-CD1 4.42Å; T516-I545 HydrophobicContact CG2-CD1 4.46Å; T516-I545 HydrophobicContact CG2-CG1 4.3Å; I519-I545 HydrophobicContact CG1-CD1 4.08Å; V542-I545 HydrophobicContact CG1-CD1 4.38Å; V542-I545 HydrophobicContact CG1-CG1 3.79Å; I545-V547 HydrophobicContact CG2-CG2 4.41Å; I545-I563 HydrophobicContact CG1-CG1 4.48Å
546	A	97.5	Very high	92.9	Very high	25 Å²	25	50.7 Å²	50.7	21%	0.207	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	115.7	172.6	0	0	0	0	0	108.4	A561 V562 W715	A546-A561 CarbonylContact O-C 3.45Å; A546-A561 WeakPolarHBondContact O-CA 3.39Å; A546-A561 WeakPolarHBondContact O-CB 3.01Å; A546-V562 PolarHBondContact N-O 3.3Å; A546-V562 PolarHBondContact O-N 2.89Å; A546-W715 HydrophobicContact CB-CZ2 4.34Å; A546-W715 WeakPolarHBondContact O-CH2 3.36Å
547	V	97.6	Very high	93.7	Very high	22 Å²	22	51.1 Å²	51.1	13%	0.133	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	146.4	172.1	176.8	0	0	0	0	108.4	A502 V505 T506 P513 I545 Y551 A561	A502-V547 HydrophobicContact CB-CG1 3.88Å; V505-V547 HydrophobicContact CG2-CG2 4.17Å; T506-V547 HydrophobicContact CG2-CG1 4.38Å; T506-V547 HydrophobicContact CG2-CG2 3.91Å; P513-V547 HydrophobicContact CB-CG2 3.97Å; P513-V547 HydrophobicContact CG-CG2 4.42Å; I545-V547 HydrophobicContact CG2-CG2 4.41Å; V547-Y551 HydrophobicContact CG1-CD1 3.65Å; V547-Y551 HydrophobicContact CG1-CG 4.02Å; V547-A561 HydrophobicContact CG2-CB 4.24Å
548	H	97.2	Very high	94	Very high	24 Å²	24	50 Å²	50	11%	0.111	26%	0.264	C	S	.	.			trans	-61.1	133.7	177.8	-167.4	-100.8	0	0	0	111.3	N550 Y551 S558 I560 F712 W715	H548-N550 PolarHBondContact ND1-N 3.1Å; H548-N550 PolarHBondContact O-N 3.04Å; H548-N550 VanDerWaalsContact O-N 3.14Å; H548-Y551 VanDerWaalsContact O-CB 3.27Å; H548-Y551 WeakPolarHBondContact O-CB 3.38Å; H548-Y551 PolarHBondContact O-N 2.84Å; H548-S558 WeakPolarHBondContact ND1-CB 3.25Å; H548-I560 HydrophobicContact CB-CG2 3.76Å; H548-I560 WeakPolarHBondContact CB-O 3.5Å; H548-I560 PolarHBondContact N-O 2.82Å; H548-F712 AromaticContact CD2-CD1 3.7Å; H548-F712 AromaticContact CD2-CE1 3.99Å; H548-F712 AromaticContact CE1-CE1 3.69Å; H548-F712 AromaticContact ND1-CE1 3.89Å; H548-F712 AromaticContact NE2-CD1 3.66Å; H548-F712 AromaticContact NE2-CE1 3.79Å; H548-W715 HydrophobicContact CB-CH2 4.22Å; H548-W715 HydrophobicContact CB-CZ2 4.23Å; H548-W715 AromaticContact CD2-CD1 3.89Å; H548-W715 AromaticContact CD2-CD2 3.53Å; H548-W715 AromaticContact CD2-CE2 3.69Å; H548-W715 AromaticContact CD2-CE3 3.93Å; H548-W715 AromaticContact CD2-CG 3.71Å; H548-W715 AromaticContact CD2-NE1 3.88Å
549	P	95.9	Very high	94.1	Very high	103 Å²	103	48.3 Å²	48.3	67%	0.669	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-27	-176.7	-27.3	35.8	0	0	0	115.1
550	N	95.4	Very high	94.3	Very high	110 Å²	110	43.5 Å²	43.5	59%	0.588	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.6	9.1	179.2	-55.7	-5.5	0	0	0	113.1	H548 D552	H548-N550 PolarHBondContact ND1-N 3.1Å; H548-N550 PolarHBondContact O-N 3.04Å; H548-N550 VanDerWaalsContact O-N 3.14Å; N550-D552 PolarHBondContact O-N 3.16Å
551	Y	95.8	Very high	94.4	Very high	8 Å²	8	43 Å²	43	3%	0.031	23%	0.231	C	C	.	.			trans	-61.5	118.3	179.9	170.2	-123.9	0	0	0	111.3	A502 H503 T506 V547 H548 P553 L556 D557 D559	A502-Y551 HydrophobicContact CB-CD1 3.75Å; A502-Y551 HydrophobicContact CB-CD2 3.68Å; A502-Y551 HydrophobicContact CB-CE1 3.84Å; A502-Y551 HydrophobicContact CB-CE2 3.77Å; A502-Y551 HydrophobicContact CB-CG 3.66Å; H503-Y551 WeakPolarHBondContact CA-OH 3.44Å; H503-Y551 WeakPolarHBondContact CB-OH 3.34Å; T506-Y551 HydrophobicContact CG2-CD1 4.37Å; T506-Y551 HydrophobicContact CG2-CE1 3.9Å; V547-Y551 HydrophobicContact CG1-CD1 3.65Å; V547-Y551 HydrophobicContact CG1-CG 4.02Å; H548-Y551 VanDerWaalsContact O-CB 3.27Å; H548-Y551 WeakPolarHBondContact O-CB 3.38Å; H548-Y551 PolarHBondContact O-N 2.84Å; Y551-P553 HydrophobicContact CE1-CB 4.05Å; Y551-L556 HydrophobicContact CE2-CD2 4.05Å; Y551-D557 WeakPolarHBondContact CA-O 3.25Å; Y551-D559 HydrophobicContact CD2-CB 4.13Å; Y551-D559 HydrophobicContact CE2-CB 3.94Å
552	D	92.8	Very high	94.7	Very high	50 Å²	50	36 Å²	36	27%	0.267	21%	0.205	S	C	.	.			trans	-104.1	111.7	175.5	-169.8	-42	0	0	0	110.2	N550 H554 I555 L556 D557	N550-D552 PolarHBondContact O-N 3.16Å; D552-H554 PolarHBondContact O-N 3.3Å; D552-H554 WeakPolarHBondContact OD1-CA 3.49Å; D552-H554 VanDerWaalsContact OD1-CB 3.3Å; D552-H554 WeakPolarHBondContact OD1-CB 3.29Å; D552-H554 IonicContact OD1-CD2 2.77Å; D552-H554 IonicContact OD1-CG 2.65Å; D552-H554 PolarHBondContact OD1-N 2.66Å; D552-I555 HydrophobicContact CB-CG1 3.82Å; D552-I555 PolarHBondContact OD1-N 3.23Å; D552-L556 WeakPolarHBondContact O-CA 3.34Å; D552-L556 PolarHBondContact O-N 2.97Å; D552-D557 PolarHBondContact N-O 2.97Å
553	P	90.6	Very high	94.7	Very high	19 Å²	19	35.5 Å²	35.5	12%	0.123	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	0.7	-177.3	34	-37.5	0	0	0	114.3	M511 Y551	M511-P553 HydrophobicContact CG-CG 4.17Å; Y551-P553 HydrophobicContact CE1-CB 4.05Å
554	H	86.4	Confident	94.8	Very high	144 Å²	144	36 Å²	36	67%	0.667	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-38.3	177.6	-60.3	-66.5	0	0	0	113	D552	D552-H554 PolarHBondContact O-N 3.3Å; D552-H554 WeakPolarHBondContact OD1-CA 3.49Å; D552-H554 VanDerWaalsContact OD1-CB 3.3Å; D552-H554 WeakPolarHBondContact OD1-CB 3.29Å; D552-H554 IonicContact OD1-CD2 2.77Å; D552-H554 IonicContact OD1-CG 2.65Å; D552-H554 PolarHBondContact OD1-N 2.66Å
555	I	87.3	Confident	94.8	Very high	58 Å²	58	33.9 Å²	33.9	30%	0.297	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-4.6	176	61.3	166.4	0	0	0	113.6	D552 D557	D552-I555 HydrophobicContact CB-CG1 3.82Å; D552-I555 PolarHBondContact OD1-N 3.23Å; I555-D557 HydrophobicContact CD1-CB 3.86Å; I555-D557 HydrophobicContact CG1-CB 4.05Å; I555-D557 PolarHBondContact O-N 3.02Å
556	L	89.2	Confident	94.6	Very high	34 Å²	34	37 Å²	37	18%	0.178	20%	0.198	C	C	.	.			trans	57.9	26.7	-176.8	-58.5	171.6	0	0	0	113.9	H503 Y551 D552 D559 F691	H503-L556 HydrophobicContact CB-CD2 4.2Å; Y551-L556 HydrophobicContact CE2-CD2 4.05Å; D552-L556 WeakPolarHBondContact O-CA 3.34Å; D552-L556 PolarHBondContact O-N 2.97Å; L556-D559 HydrophobicContact CB-CB 4.36Å; L556-D559 VanDerWaalsContact O-CB 3.26Å; L556-D559 WeakPolarHBondContact O-CB 3.47Å; L556-F691 HydrophobicContact CB-CD1 3.86Å; L556-F691 HydrophobicContact CB-CE1 4.09Å; L556-F691 HydrophobicContact CD1-CB 3.8Å; L556-F691 HydrophobicContact CD1-CD1 3.64Å; L556-F691 HydrophobicContact CD1-CG 4.04Å; L556-F691 HydrophobicContact CG-CD1 4.36Å
557	D	92.5	Very high	94.4	Very high	22 Å²	22	38 Å²	38	12%	0.118	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	144.8	167	-176.9	69.4	0	0	0	110.3	Y551 D552 I555 D559 T639 N641 M642	Y551-D557 WeakPolarHBondContact CA-O 3.25Å; D552-D557 PolarHBondContact N-O 2.97Å; I555-D557 HydrophobicContact CD1-CB 3.86Å; I555-D557 HydrophobicContact CG1-CB 4.05Å; I555-D557 PolarHBondContact O-N 3.02Å; D557-D559 PolarHBondContact O-N 3.46Å; D557-T639 HydrophobicContact CB-CG2 4.28Å; D557-T639 WeakPolarHBondContact OD1-CB 3.39Å; D557-T639 PolarHBondContact OD1-OG1 2.79Å; D557-N641 WeakPolarHBondContact OD1-CB 2.99Å; D557-N641 PolarHBondContact OD1-ND2 3.12Å; D557-N641 PolarHBondContact OD2-ND2 2.85Å; D557-M642 HydrophobicContact CB-CE 4.19Å
558	S	95.1	Very high	94.2	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.014	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	33.4	-179.9	-59.5	0	0	0	0	113.6	H548 I560	H548-S558 WeakPolarHBondContact ND1-CB 3.25Å; S558-I560 PolarHBondContact O-N 3.39Å
559	D	96.1	Very high	94	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.207	C	C	.	.			trans	-71.1	73.2	-179.4	-179.7	27.5	0	0	0	112.2	A502 H503 Y551 L556 D557 S690 T707	A502-D559 WeakPolarHBondContact CA-OD1 3.39Å; A502-D559 WeakPolarHBondContact CB-OD1 3.19Å; A502-D559 PolarHBondContact N-OD1 2.83Å; H503-D559 IonicContact CE1-OD2 2.74Å; H503-D559 IonicContact CG-OD1 3.96Å; H503-D559 IonicContact CG-OD2 2.87Å; H503-D559 PolarHBondContact N-OD1 3.24Å; H503-D559 IonicContact ND1-OD1 3.78Å; H503-D559 PolarHBondContact ND1-OD1 2.66Å; H503-D559 IonicContact ND1-OD2 3.53Å; H503-D559 PolarHBondContact ND1-OD2 2.93Å; Y551-D559 HydrophobicContact CD2-CB 4.13Å; Y551-D559 HydrophobicContact CE2-CB 3.94Å; L556-D559 HydrophobicContact CB-CB 4.36Å; L556-D559 VanDerWaalsContact O-CB 3.26Å; L556-D559 WeakPolarHBondContact O-CB 3.47Å; D557-D559 PolarHBondContact O-N 3.46Å; D559-S690 WeakPolarHBondContact OD2-CB 3.34Å; D559-S690 PolarHBondContact OD2-OG 2.81Å; D559-T707 WeakPolarHBondContact O-CB 3.3Å; D559-T707 PolarHBondContact O-OG1 3.45Å
560	I	97.1	Very high	93.8	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.211	C	C	.	.			trans	-146.8	140.7	-179.9	-168	165.9	0	0	0	112.5	V499 H548 S558 L688 T707 V709 F712 W715 I716	V499-I560 HydrophobicContact CG1-CD1 3.76Å; V499-I560 HydrophobicContact CG1-CG1 3.88Å; H548-I560 HydrophobicContact CB-CG2 3.76Å; H548-I560 WeakPolarHBondContact CB-O 3.5Å; H548-I560 PolarHBondContact N-O 2.82Å; S558-I560 PolarHBondContact O-N 3.39Å; I560-L688 HydrophobicContact CB-CD1 4.24Å; I560-L688 HydrophobicContact CD1-CD1 3.84Å; I560-L688 HydrophobicContact CG1-CD1 3.67Å; I560-T707 HydrophobicContact CB-CG2 4.18Å; I560-V709 HydrophobicContact CD1-CG2 4.36Å; I560-F712 HydrophobicContact CD1-CB 3.91Å; I560-F712 HydrophobicContact CD1-CD2 4.31Å; I560-F712 HydrophobicContact CD1-CG 4.24Å; I560-F712 HydrophobicContact CG2-CB 4.3Å; I560-F712 HydrophobicContact CG2-CD1 3.83Å; I560-F712 HydrophobicContact CG2-CD2 4.11Å; I560-F712 HydrophobicContact CG2-CE1 4.2Å; I560-F712 HydrophobicContact CG2-CE2 4.47Å; I560-F712 HydrophobicContact CG2-CG 3.79Å; I560-W715 HydrophobicContact CG1-CZ3 4.38Å; I560-W715 HydrophobicContact CG2-CE3 4.5Å; I560-W715 HydrophobicContact CG2-CZ3 4.09Å; I560-I716 HydrophobicContact CD1-CD1 3.8Å; I560-I716 HydrophobicContact CD1-CG1 4.2Å
561	A	97.9	Very high	93.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	151.2	175.3	0	0	0	0	0	112.1	V500 A502 V505 A546 V547	V500-A561 HydrophobicContact CG1-CB 4.12Å; V500-A561 PolarHBondContact N-O 3.46Å; V500-A561 PolarHBondContact O-N 3.25Å; A502-A561 HydrophobicContact CB-CB 4.42Å; V505-A561 HydrophobicContact CG2-CB 3.49Å; V505-A561 VanDerWaalsContact CG2-CB 3.49Å; A546-A561 CarbonylContact O-C 3.45Å; A546-A561 WeakPolarHBondContact O-CA 3.39Å; A546-A561 WeakPolarHBondContact O-CB 3.01Å; V547-A561 HydrophobicContact CG2-CB 4.24Å
562	V	98.2	Very high	93.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	119.5	171.7	178.5	0	0	0	0	109.6	L498 A546 W715 I716 N719 I720	L498-V562 CarbonylContact O-C 3.56Å; L498-V562 WeakPolarHBondContact O-CA 3.26Å; A546-V562 PolarHBondContact N-O 3.3Å; A546-V562 PolarHBondContact O-N 2.89Å; V562-W715 HydrophobicContact CG2-CE3 4.39Å; V562-W715 HydrophobicContact CG2-CH2 4.04Å; V562-W715 HydrophobicContact CG2-CZ3 3.71Å; V562-I716 HydrophobicContact CG2-CG1 4.42Å; V562-I716 HydrophobicContact CG2-CG2 4.32Å; V562-N719 HydrophobicContact CB-CB 4.19Å; V562-N719 HydrophobicContact CG1-CB 4.29Å; V562-N719 HydrophobicContact CG2-CB 4.06Å; V562-I720 HydrophobicContact CG1-CG2 3.91Å
563	I	97.9	Very high	93	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	117.5	170.3	-58.7	179.6	0	0	0	108.4	I469 S497 L498 V500 V505 V521 V542 I545	I469-I563 HydrophobicContact CD1-CD1 4.01Å; I469-I563 HydrophobicContact CG2-CD1 4.41Å; S497-I563 WeakPolarHBondContact CA-O 3.34Å; L498-I563 HydrophobicContact CB-CB 4.44Å; L498-I563 HydrophobicContact CD1-CB 4.25Å; L498-I563 HydrophobicContact CD1-CG2 4.27Å; L498-I563 PolarHBondContact N-O 3.49Å; L498-I563 PolarHBondContact O-N 3.27Å; V500-I563 HydrophobicContact CG1-CD1 3.87Å; V500-I563 HydrophobicContact CG1-CG1 3.92Å; V505-I563 HydrophobicContact CG1-CD1 3.96Å; V505-I563 HydrophobicContact CG1-CG1 4.33Å; V521-I563 HydrophobicContact CG2-CD1 4.41Å; V521-I563 HydrophobicContact CG2-CG2 4.18Å; V542-I563 HydrophobicContact CB-CG2 4.28Å; V542-I563 HydrophobicContact CG1-CG2 3.8Å; V542-I563 HydrophobicContact CG2-CG2 3.61Å; I545-I563 HydrophobicContact CG1-CG1 4.48Å
564	K	97.1	Very high	92.9	Very high	65 Å²	65	46.9 Å²	46.9	28%	0.283	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	134.1	169.4	-69	177.5	174.6	175.4	0	109.7	S543 S544 N719	S543-K564 PolarHBondContact N-O 2.9Å; S543-K564 WeakPolarHBondContact OG-CB 2.93Å; S543-K564 PolarHBondContact OG-O 2.63Å; S544-K564 PolarHBondContact N-O 2.88Å; S544-K564 PolarHBondContact O-N 2.81Å; S544-K564 WeakPolarHBondContact OG-CB 3.34Å; S544-K564 WeakPolarHBondContact OG-CD 3.44Å; K564-N719 WeakPolarHBondContact CE-O 3.34Å
565	L	95.9	Very high	93.2	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.026	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	135.2	179.9	-62.3	174	0	0	0	111.9	L492 R496 L498 V521 L540 R541 D567	L492-L565 HydrophobicContact CD1-CD1 4.43Å; R496-L565 PolarHBondContact NH1-O 3.33Å; R496-L565 WeakPolarHBondContact O-CB 3.44Å; R496-L565 PolarHBondContact O-N 2.75Å; L498-L565 HydrophobicContact CD1-CD1 3.72Å; L498-L565 HydrophobicContact CD1-CD2 3.6Å; L498-L565 HydrophobicContact CD1-CG 3.57Å; V521-L565 HydrophobicContact CB-CD2 4.12Å; V521-L565 HydrophobicContact CG1-CD2 4.38Å; V521-L565 HydrophobicContact CG2-CD2 4.1Å; L540-L565 HydrophobicContact CB-CD1 4.19Å; L540-L565 HydrophobicContact CB-CD2 3.85Å; L540-L565 HydrophobicContact CD1-CD1 3.62Å; L540-L565 HydrophobicContact CG-CD1 4.5Å; R541-L565 WeakPolarHBondContact O-CA 3.42Å; L565-D567 WeakPolarHBondContact CB-O 3.3Å
566	L	94	Very high	93.5	Very high	87 Å²	87	37.6 Å²	37.6	46%	0.455	18%	0.176	S	C	.	.	S	Bend	trans	-70	-47.1	168	-176.1	60.8	0	0	0	110.4	R496 R541	R496-L566 PolarHBondContact NH1-O 3.45Å; R541-L566 HydrophobicContact CB-CB 4.31Å; R541-L566 HydrophobicContact CB-CD2 4.48Å; R541-L566 PolarHBondContact O-N 2.87Å
567	D	93.5	Very high	93.8	Very high	44 Å²	44	36.2 Å²	36.2	24%	0.235	17%	0.168	C	C	.	.	S	Bend	trans	-87.2	136.6	-179.2	-57.5	-52.6	0	0	0	111.2	L540 R541 L565	L540-D567 HydrophobicContact CB-CB 4.45Å; L540-D567 HydrophobicContact CD2-CB 3.84Å; R541-D567 VanDerWaalsContact CB-OD2 3.26Å; R541-D567 WeakPolarHBondContact CB-OD2 3.27Å; R541-D567 WeakPolarHBondContact CG-OD2 3.05Å; R541-D567 IonicContact CZ-OD1 2.72Å; R541-D567 IonicContact CZ-OD2 3.95Å; R541-D567 PolarHBondContact N-OD2 2.86Å; R541-D567 IonicContact NE-OD1 3Å; R541-D567 IonicContact NE-OD2 3.31Å; R541-D567 PolarHBondContact NE-OD2 3.08Å; R541-D567 IonicContact NH2-OD1 2.61Å; R541-D567 PolarHBondContact NH2-OD1 2.72Å; R541-D567 IonicContact NH2-OD2 3.16Å; L565-D567 WeakPolarHBondContact CB-O 3.3Å
568	K	91.6	Very high	93.9	Very high	92 Å²	92	35.2 Å²	35.2	40%	0.4	16%	0.163	S	C	.	.	P	Polyproline II helix	trans	-82.4	122.4	-178	-171.2	-177.6	176.2	-179.2	0	110.8	Q495 R496 R570	Q495-K568 HydrophobicContact CB-CG 3.99Å; R496-K568 HydrophobicContact CG-CG 4.44Å; K568-R570 PolarHBondContact O-N 3.08Å
569	A	92.9	Very high	93.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-61.2	127.9	174.2	0	0	0	0	0	111.2	L492 Q495 L540 I571 V575	L492-A569 HydrophobicContact CD1-CB 4.33Å; L492-A569 HydrophobicContact CD2-CB 4.19Å; Q495-A569 PolarHBondContact NE2-O 3.33Å; Q495-A569 PolarHBondContact O-N 3.49Å; L540-A569 HydrophobicContact CD1-CB 3.87Å; A569-I571 PolarHBondContact O-N 3.3Å; A569-V575 HydrophobicContact CB-CG1 4.39Å
570	R	92.1	Very high	93.5	Very high	197 Å²	197	36.9 Å²	36.9	74%	0.743	17%	0.172	S	C	*	.			trans	-84.1	112.4	178.7	-51.5	179.2	-164.1	-177.6	5.9	108.3	Q538 K568	Q538-R570 PolarHBondContact NE2-O 3.03Å; K568-R570 PolarHBondContact O-N 3.08Å
571	I	91.8	Very high	92.7	Very high	20 Å²	20	37 Å²	37	10%	0.103	17%	0.174	C	C	.	.			trans	-77.3	134.5	-177.2	-60.2	-57.5	0	0	0	110.7	Y419 Y420 P445 Q495 A569 V575 L576	Y419-I571 HydrophobicContact CG-CG2 4.44Å; Y420-I571 HydrophobicContact CE2-CB 4.23Å; Y420-I571 HydrophobicContact CE2-CG2 4.34Å; P445-I571 HydrophobicContact CB-CG1 4.18Å; P445-I571 HydrophobicContact CG-CG1 4.04Å; Q495-I571 HydrophobicContact CG-CD1 3.83Å; Q495-I571 HydrophobicContact CG-CG1 3.53Å; Q495-I571 VanDerWaalsContact NE2-CG1 3.32Å; A569-I571 PolarHBondContact O-N 3.3Å; I571-V575 VanDerWaalsContact CA-O 3.29Å; I571-V575 WeakPolarHBondContact CA-O 3.44Å; I571-V575 HydrophobicContact CD1-CG1 4.28Å; I571-V575 WeakPolarHBondContact CD1-O 3.18Å; I571-V575 WeakPolarHBondContact CG2-O 3.45Å; I571-L576 HydrophobicContact CG2-CD2 3.59Å
572	G	88.7	Confident	91.3	Very high	20 Å²	20	41.2 Å²	41.2	21%	0.206	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-169.3	-167.9	-179.3	0	0	0	0	0	110.2	K574 V575 L576	G572-K574 VanDerWaalsContact C-N 3.33Å; G572-K574 PolarHBondContact O-N 3.37Å; G572-V575 PolarHBondContact N-O 3.05Å; G572-V575 CarbonylContact O-C 3.31Å; G572-V575 PolarHBondContact O-N 3.31Å; G572-V575 VanDerWaalsContact O-N 3.11Å; G572-L576 WeakPolarHBondContact O-CG 3.37Å
573	E	86.6	Confident	89.5	Confident	119 Å²	119	45.6 Å²	45.6	56%	0.556	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-42.4	-176.9	-170.9	172.7	-177	0	0	113.4	Y419 N452	Y419-E573 WeakPolarHBondContact OH-CB 3.3Å; N452-E573 PolarHBondContact ND2-OE1 3.03Å
574	K	88.9	Confident	87.5	Confident	76 Å²	76	49.5 Å²	49.5	33%	0.33	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-10.4	177.7	-67.7	-165.1	174.7	-153	0	114.9	H462 P464 G524 E533 G572	H462-K574 PolarHBondContact CE1-O 3.17Å; P464-K574 WeakPolarHBondContact CA-O 3.48Å; G524-K574 WeakPolarHBondContact CA-O 3.07Å; E533-K574 IonicContact OE1-NZ 2.82Å; E533-K574 PolarHBondContact OE1-NZ 2.71Å; E533-K574 IonicContact OE2-NZ 3.23Å; E533-K574 PolarHBondContact OE2-NZ 3.3Å; G572-K574 VanDerWaalsContact C-N 3.33Å; G572-K574 PolarHBondContact O-N 3.37Å
575	V	93	Very high	85.4	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.012	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-139.9	105.3	-174.6	-178.4	0	0	0	0	110.7	P464 L492 V523 G524 A569 I571 G572	P464-V575 VanDerWaalsContact O-CA 3.29Å; P464-V575 WeakPolarHBondContact O-CA 3.31Å; L492-V575 HydrophobicContact CD2-CG1 3.7Å; V523-V575 HydrophobicContact CG2-CG1 3.93Å; V523-V575 HydrophobicContact CG2-CG2 4.11Å; G524-V575 VanDerWaalsContact CA-CG2 3.43Å; A569-V575 HydrophobicContact CB-CG1 4.39Å; I571-V575 VanDerWaalsContact CA-O 3.29Å; I571-V575 WeakPolarHBondContact CA-O 3.44Å; I571-V575 HydrophobicContact CD1-CG1 4.28Å; I571-V575 WeakPolarHBondContact CD1-O 3.18Å; I571-V575 WeakPolarHBondContact CG2-O 3.45Å; G572-V575 PolarHBondContact N-O 3.05Å; G572-V575 CarbonylContact O-C 3.31Å; G572-V575 PolarHBondContact O-N 3.31Å; G572-V575 VanDerWaalsContact O-N 3.11Å
576	L	93.2	Very high	83.4	Confident	5 Å²	5	55.4 Å²	55.4	3%	0.026	27%	0.266	C	S	.	.			trans	-137.3	147.5	177.8	-68.8	160.3	0	0	0	109.2	Y419 K449 P464 W465 I571 G572	Y419-L576 HydrophobicContact CD1-CD1 4.21Å; Y419-L576 HydrophobicContact CD1-CD2 3.74Å; Y419-L576 HydrophobicContact CD1-CG 4.5Å; Y419-L576 HydrophobicContact CE1-CD1 4.44Å; Y419-L576 HydrophobicContact CG-CD2 4.02Å; K449-L576 VanDerWaalsContact O-CD1 3.29Å; K449-L576 WeakPolarHBondContact O-CD1 3.21Å; P464-L576 CarbonylContact C-O 3.56Å; P464-L576 HydrophobicContact CB-CB 3.97Å; P464-L576 HydrophobicContact CB-CD1 4.3Å; P464-L576 HydrophobicContact CB-CG 4.35Å; P464-L576 PolarHBondContact O-N 3.16Å; W465-L576 WeakPolarHBondContact CA-O 3.4Å; W465-L576 VanDerWaalsContact CB-O 3.32Å; W465-L576 WeakPolarHBondContact CB-O 3.47Å; W465-L576 PolarHBondContact N-O 3.39Å; I571-L576 HydrophobicContact CG2-CD2 3.59Å; G572-L576 WeakPolarHBondContact O-CG 3.37Å
577	P	95.2	Very high	81.6	Confident	4 Å²	4	52.8 Å²	52.8	3%	0.026	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-72.4	151.3	172.8	26.7	-26.4	0	0	0	111.5	P445 C447 G448 L492 V493	P445-P577 HydrophobicContact CB-CG 3.87Å; C447-P577 CarbonylContact C-O 3.58Å; C447-P577 WeakPolarHBondContact CA-O 3.33Å; C447-P577 HydrophobicContact CB-CB 4.35Å; C447-P577 HydrophobicContact CB-CG 4.14Å; G448-P577 PolarHBondContact N-O 3.5Å; L492-P577 CarbonylContact O-C 3.51Å; L492-P577 WeakPolarHBondContact O-CA 3.5Å; V493-P577 VanDerWaalsContact O-CB 3.31Å; V493-P577 WeakPolarHBondContact O-CB 3.3Å
578	L	94.8	Very high	79.6	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.005	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-87.7	145.9	167.8	-171.2	54	0	0	0	109.7	W465 A491 L492 I664 V666 W683 L685	W465-L578 HydrophobicContact CB-CB 3.69Å; W465-L578 HydrophobicContact CD2-CB 4.06Å; W465-L578 HydrophobicContact CD2-CD1 3.78Å; W465-L578 HydrophobicContact CD2-CD2 4.4Å; W465-L578 HydrophobicContact CD2-CG 4.31Å; W465-L578 HydrophobicContact CE3-CB 4.44Å; W465-L578 HydrophobicContact CE3-CD1 4Å; W465-L578 HydrophobicContact CG-CB 3.72Å; W465-L578 HydrophobicContact CG-CD1 4.23Å; W465-L578 HydrophobicContact CG-CD2 4.07Å; W465-L578 HydrophobicContact CG-CG 4.24Å; W465-L578 HydrophobicContact CH2-CD1 4.3Å; W465-L578 HydrophobicContact CZ2-CD1 4.11Å; W465-L578 HydrophobicContact CZ3-CD1 4.25Å; A491-L578 HydrophobicContact CB-CD2 4.28Å; L492-L578 PolarHBondContact O-N 2.85Å; L578-I664 HydrophobicContact CD2-CD1 4.43Å; L578-V666 HydrophobicContact CD2-CG1 3.58Å; L578-W683 HydrophobicContact CD1-CB 3.81Å; L578-W683 WeakPolarHBondContact CD1-O 3.12Å; L578-L685 HydrophobicContact CD2-CB 3.62Å; L578-L685 HydrophobicContact CD2-CD1 4Å; L578-L685 HydrophobicContact CD2-CG 4.36Å; L578-L685 HydrophobicContact CG-CB 4.02Å
579	C	92.6	Very high	77.7	Confident	11 Å²	11	57.4 Å²	57.4	7%	0.074	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	147.9	173.7	-57.4	0	0	0	0	110.1	C447 R684 L685	C447-C579 HydrophobicContact CB-CB 4.01Å; C447-C579 WeakPolarHBondContact CB-SG 3.48Å; C447-C579 PolarHBondContact O-SG 2.89Å; C447-C579 VanDerWaalsContact O-SG 3.37Å; C447-C579 WeakPolarHBondContact SG-CA 3.49Å; C447-C579 WeakPolarHBondContact SG-CB 3.32Å; C447-C579 CovalentContact SG-SG 2.04Å; C447-C579 PolarHBondContact SG-SG 2.03Å; C579-R684 HydrophobicContact CB-CG 4.28Å; C579-R684 CarbonylContact O-C 3.55Å; C579-R684 VanDerWaalsContact O-CA 3.31Å; C579-R684 WeakPolarHBondContact O-CA 3.28Å; C579-L685 PolarHBondContact O-N 2.67Å
580	L	90.8	Very high	76.1	Confident	26 Å²	26	58.1 Å²	58.1	14%	0.136	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	153.3	165.9	-61.2	176.3	0	0	0	109.7	V493 L685 V709 K713 I716 E717	V493-L580 HydrophobicContact CG1-CD2 3.92Å; L580-L685 HydrophobicContact CD2-CD2 4.36Å; L580-V709 HydrophobicContact CD2-CG1 4.11Å; L580-K713 HydrophobicContact CD1-CG 4.46Å; L580-I716 HydrophobicContact CD1-CB 4.32Å; L580-I716 HydrophobicContact CD1-CG2 3.86Å; L580-I716 HydrophobicContact CD2-CD1 4.24Å; L580-I716 HydrophobicContact CD2-CG2 4.43Å; L580-E717 HydrophobicContact CD1-CG 4.37Å
581	S	80	Confident	75.2	Confident	4 Å²	4	55.4 Å²	55.4	3%	0.028	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-62.2	143.8	170	-164.3	0	0	0	0	110.8
582	E	68.3	Low	74.8	Confident	87 Å²	87	58 Å²	58	41%	0.407	30%	0.301	S	S	.	.			trans	-91.4	-41.1	-178.5	-82.1	-170.6	-169.2	0	0	113.9	K679 K713	E582-K679 IonicContact OE1-NZ 3.26Å; E582-K679 PolarHBondContact OE1-NZ 3.47Å; E582-K679 IonicContact OE2-NZ 3.54Å; E582-K679 PolarHBondContact OE2-NZ 2.86Å; E582-K713 PolarHBondContact O-NZ 3.28Å
583	N	61.7	Low	74.8	Confident	93 Å²	93	57 Å²	57	50%	0.497	29%	0.291	S	S	.	.			trans	-147.3	160.1	-174.4	-73.9	-4	0	0	0	112.1	E585	N583-E585 VanDerWaalsContact C-N 3.29Å; N583-E585 PolarHBondContact O-N 3.27Å
584	D	55.8	Low	75	Confident	82 Å²	82	52 Å²	52	44%	0.439	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-30.4	171	-58.2	-67.8	0	0	0	114	E586 E587 V588 R708	D584-E586 PolarHBondContact O-N 2.8Å; D584-E587 WeakPolarHBondContact O-CB 3.31Å; D584-E587 PolarHBondContact O-N 3.22Å; D584-V588 PolarHBondContact O-N 2.99Å; D584-R708 IonicContact OD1-CZ 3.93Å; D584-R708 VanDerWaalsContact OD1-CZ 3.27Å; D584-R708 IonicContact OD1-NH1 2.75Å; D584-R708 PolarHBondContact OD1-NH1 3.42Å; D584-R708 VanDerWaalsContact OD1-NH1 3.08Å; D584-R708 IonicContact OD1-NH2 3.99Å; D584-R708 PolarHBondContact OD1-NH2 3.44Å
585	E	51.3	Low	75.1	Confident	142 Å²	142	48.4 Å²	48.4	66%	0.664	25%	0.253	S	S	*	.	H	α-helix	trans	-62.1	-26.1	-176	-62.5	-179	152.3	0	0	113.8	N583 E587 T589	N583-E585 VanDerWaalsContact C-N 3.29Å; N583-E585 PolarHBondContact O-N 3.27Å; E585-E587 VanDerWaalsContact C-N 3.33Å; E585-T589 WeakPolarHBondContact O-CG2 3.37Å; E585-T589 PolarHBondContact O-N 2.97Å; E585-T589 PolarHBondContact O-OG1 2.82Å
586	E	54.7	Low	75.1	Confident	52 Å²	52	48.3 Å²	48.3	24%	0.243	25%	0.252	C	S	.	.	H	α-helix	trans	-74.7	-24.1	177.4	-65.7	-164	126.7	0	0	112.7	D584 T589 S590 R684	D584-E586 PolarHBondContact O-N 2.8Å; E586-T589 WeakPolarHBondContact CA-OG1 3.25Å; E586-T589 PolarHBondContact O-OG1 2.74Å; E586-S590 WeakPolarHBondContact O-CB 3.42Å; E586-S590 PolarHBondContact O-OG 2.87Å; E586-R684 VanDerWaalsContact CD-NH2 3.31Å; E586-R684 IonicContact OE1-CZ 3.53Å; E586-R684 IonicContact OE1-NH1 2.75Å; E586-R684 PolarHBondContact OE1-NH1 3.06Å; E586-R684 IonicContact OE1-NH2 3.88Å; E586-R684 PolarHBondContact OE1-NH2 2.9Å; E586-R684 IonicContact OE2-CZ 3.33Å; E586-R684 IonicContact OE2-NE 3.64Å; E586-R684 PolarHBondContact OE2-NE 2.87Å; E586-R684 IonicContact OE2-NH1 3.88Å; E586-R684 PolarHBondContact OE2-NH1 2.88Å; E586-R684 IonicContact OE2-NH2 2.73Å; E586-R684 PolarHBondContact OE2-NH2 2.82Å; E586-R684 VanDerWaalsContact OE2-NH2 3.09Å
587	E	56.5	Low	75.1	Confident	31 Å²	31	48.1 Å²	48.1	15%	0.145	25%	0.251	C	S	.	.	H	α-helix	trans	-78.4	-46.2	175.1	-173.1	173.9	-179.7	0	0	110.3	D584 E585 T589 S590 L619 L686 R708	D584-E587 WeakPolarHBondContact O-CB 3.31Å; D584-E587 PolarHBondContact O-N 3.22Å; E585-E587 VanDerWaalsContact C-N 3.33Å; E587-T589 PolarHBondContact O-N 3.38Å; E587-S590 PolarHBondContact O-N 2.9Å; E587-L619 HydrophobicContact CG-CD1 4.38Å; E587-L686 HydrophobicContact CB-CD1 4.22Å; E587-L686 HydrophobicContact CG-CD1 4.03Å; E587-R708 IonicContact OE1-NE 3.19Å; E587-R708 PolarHBondContact OE1-NE 3.09Å; E587-R708 VanDerWaalsContact OE1-NE 3.14Å; E587-R708 IonicContact OE2-CZ 3.33Å; E587-R708 IonicContact OE2-NE 2.77Å; E587-R708 PolarHBondContact OE2-NE 3.44Å; E587-R708 IonicContact OE2-NH2 2.76Å; E587-R708 PolarHBondContact OE2-NH2 3.2Å
588	V	50.5	Low	74.9	Confident	127 Å²	127	48 Å²	48	77%	0.77	25%	0.25	S	C	*	.	H	α-helix	trans	-60.5	-26.7	176.2	-179.9	0	0	0	0	112.8	D584	D584-V588 PolarHBondContact O-N 2.99Å
589	T	51.8	Low	74.4	Confident	107 Å²	107	48.7 Å²	48.7	66%	0.656	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-3.8	177.6	49.8	0	0	0	0	114.6	E585 E586 E587	E585-T589 WeakPolarHBondContact O-CG2 3.37Å; E585-T589 PolarHBondContact O-N 2.97Å; E585-T589 PolarHBondContact O-OG1 2.82Å; E586-T589 WeakPolarHBondContact CA-OG1 3.25Å; E586-T589 PolarHBondContact O-OG1 2.74Å; E587-T589 PolarHBondContact O-N 3.38Å
590	S	60.2	Low	74	Confident	15 Å²	15	49.6 Å²	49.6	11%	0.105	26%	0.26	C	S	.	.			trans	-122.4	94	-172.1	-57.9	0	0	0	0	111.5	E586 E587 Q592 L619 L667	E586-S590 WeakPolarHBondContact O-CB 3.42Å; E586-S590 PolarHBondContact O-OG 2.87Å; E587-S590 PolarHBondContact O-N 2.9Å; S590-Q592 PolarHBondContact O-N 3.15Å; S590-L619 VanDerWaalsContact O-CD1 3.31Å; S590-L619 WeakPolarHBondContact O-CD1 3.4Å; S590-L667 VanDerWaalsContact CB-CD1 3.47Å
591	E	72	Confident	73.5	Confident	139 Å²	139	54.8 Å²	54.8	65%	0.65	29%	0.288	S	S	*	.	S	Bend	trans	-66.3	-6.8	-179.7	-62.9	-177.6	-178.5	0	0	114.8	H618 L619	E591-H618 WeakPolarHBondContact O-CA 3.29Å; E591-H618 PolarHBondContact O-ND1 3.09Å; E591-L619 PolarHBondContact O-N 2.86Å; E591-L619 VanDerWaalsContact O-N 3.09Å
592	Q	84.3	Confident	73.2	Confident	74 Å²	74	59.6 Å²	59.6	35%	0.346	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	145.9	-170	-63.7	172.8	19.4	0	0	112.1	S590 L616 V617 Y651	S590-Q592 PolarHBondContact O-N 3.15Å; Q592-L616 HydrophobicContact CB-CD1 4.36Å; Q592-V617 WeakPolarHBondContact CA-O 3.4Å; Q592-Y651 PolarHBondContact NE2-OH 3.45Å; Q592-Y651 VanDerWaalsContact NE2-OH 3.13Å
593	G	88.4	Confident	73.5	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	169.5	173.9	0	0	0	0	0	112.4	V617	G593-V617 PolarHBondContact N-O 2.92Å; G593-V617 PolarHBondContact O-N 2.87Å
594	L	90.4	Very high	73.9	Confident	15 Å²	15	59.1 Å²	59.1	8%	0.079	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	121.8	176	-74.9	163.7	0	0	0	109.7	F453 W463 V614 G615 L616 V666 W683	F453-L594 HydrophobicContact CZ-CD1 4Å; W463-L594 HydrophobicContact CH2-CD1 4.33Å; L594-V614 HydrophobicContact CD2-CG2 4.16Å; L594-G615 WeakPolarHBondContact CA-O 3.45Å; L594-L616 HydrophobicContact CD2-CB 4.34Å; L594-L616 HydrophobicContact CD2-CD1 3.93Å; L594-L616 HydrophobicContact CG-CD1 4.26Å; L594-V666 HydrophobicContact CB-CG2 4.12Å; L594-V666 PolarHBondContact N-O 2.86Å; L594-V666 WeakPolarHBondContact O-CG2 3.48Å; L594-V666 PolarHBondContact O-N 2.99Å; L594-W683 HydrophobicContact CD1-CH2 3.8Å; L594-W683 HydrophobicContact CD1-CZ3 3.85Å
595	V	92.1	Very high	74.7	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	135.9	173.1	61.3	0	0	0	0	109.8	V614 G615 V617 I656 P658 I664 L665 V689 Y706	V595-V614 VanDerWaalsContact O-CA 3.28Å; V595-V614 WeakPolarHBondContact O-CA 3.29Å; V595-G615 PolarHBondContact N-O 2.94Å; V595-G615 PolarHBondContact O-N 2.88Å; V595-V617 HydrophobicContact CG1-CG1 3.71Å; V595-I656 HydrophobicContact CG1-CD1 4.46Å; V595-I656 HydrophobicContact CG1-CG2 3.85Å; V595-I656 HydrophobicContact CG2-CD1 4.3Å; V595-P658 HydrophobicContact CG1-CG 4.06Å; V595-P658 HydrophobicContact CG2-CB 4.48Å; V595-I664 WeakPolarHBondContact CA-O 3.49Å; V595-L665 HydrophobicContact CB-CD1 4.26Å; V595-V689 HydrophobicContact CG2-CG2 3.98Å; V595-Y706 HydrophobicContact CB-CE1 4.38Å; V595-Y706 HydrophobicContact CG2-CE1 3.88Å
596	T	92.9	Very high	75.8	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	143.6	178.2	-175.3	0	0	0	0	113	W463 L466 R613 I664	W463-T596 HydrophobicContact CD2-CG2 3.98Å; W463-T596 HydrophobicContact CE3-CG2 4.24Å; W463-T596 HydrophobicContact CG-CG2 4.19Å; L466-T596 HydrophobicContact CD1-CG2 4.27Å; L466-T596 HydrophobicContact CD2-CG2 4.42Å; T596-R613 VanDerWaalsContact CA-O 3.28Å; T596-R613 WeakPolarHBondContact CA-O 3.34Å; T596-R613 WeakPolarHBondContact CB-O 3.33Å; T596-R613 PolarHBondContact OG1-O 3.2Å; T596-I664 HydrophobicContact CG2-CG1 4.03Å; T596-I664 PolarHBondContact N-O 3.22Å; T596-I664 PolarHBondContact O-N 2.86Å
597	G	92.5	Very high	76.8	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.3	176.8	-177.5	0	0	0	0	0	112.6	S489 R613	S489-G597 WeakPolarHBondContact OG-CA 3.48Å; G597-R613 PolarHBondContact N-O 2.83Å; G597-R613 PolarHBondContact O-N 2.82Å
598	W	90.6	Very high	77.7	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.008	34%	0.342	C	S	.	.			trans	-112.2	130.6	168.6	-70	-76.3	0	0	0	109.4	L466 A468 L486 S489 K525 H526 A612	L466-W598 HydrophobicContact CB-CH2 4.16Å; L466-W598 HydrophobicContact CB-CZ3 4.38Å; L466-W598 HydrophobicContact CD2-CD2 4.45Å; L466-W598 HydrophobicContact CD2-CE3 4.12Å; L466-W598 HydrophobicContact CD2-CH2 3.6Å; L466-W598 HydrophobicContact CD2-CZ2 3.98Å; L466-W598 HydrophobicContact CD2-CZ3 3.69Å; L466-W598 HydrophobicContact CG-CE3 4.27Å; L466-W598 HydrophobicContact CG-CH2 3.69Å; L466-W598 HydrophobicContact CG-CZ3 3.54Å; A468-W598 HydrophobicContact CB-CE3 3.75Å; A468-W598 HydrophobicContact CB-CH2 4.48Å; A468-W598 HydrophobicContact CB-CZ3 3.67Å; L486-W598 HydrophobicContact CD2-CB 3.51Å; L486-W598 HydrophobicContact CD2-CG 4.32Å; S489-W598 VanDerWaalsContact OG-CE3 3.27Å; S489-W598 PolarHBondContact OG-N 2.85Å; S489-W598 VanDerWaalsContact OG-N 3.14Å; K525-W598 HydrophobicContact CB-CH2 4.04Å; K525-W598 HydrophobicContact CB-CZ2 4.01Å; K525-W598 HydrophobicContact CD-CH2 4.42Å; K525-W598 HydrophobicContact CD-CZ2 4.25Å; K525-W598 HydrophobicContact CG-CH2 4.34Å; K525-W598 HydrophobicContact CG-CZ2 3.94Å; K525-W598 WeakPolarHBondContact O-CZ2 3.39Å; H526-W598 PolarHBondContact O-NE1 3.38Å; W598-A612 HydrophobicContact CD2-CB 4.43Å; W598-A612 HydrophobicContact CZ2-CB 4.07Å; W598-A612 VanDerWaalsContact NE1-N 3.16Å
599	S	85.8	Confident	79.1	Confident	15 Å²	15	58.7 Å²	58.7	11%	0.105	33%	0.33	C	S	.	.			trans	-57.6	132.3	176.9	171.6	0	0	0	0	109.8	R528 L601	R528-S599 PolarHBondContact NH1-O 3.45Å; S599-L601 VanDerWaalsContact C-N 3.29Å; S599-L601 WeakPolarHBondContact CB-O 3.15Å; S599-L601 PolarHBondContact O-N 3.04Å; S599-L601 PolarHBondContact OG-N 2.96Å; S599-L601 PolarHBondContact OG-O 2.9Å
600	P	83.1	Confident	80.7	Confident	30 Å²	30	53.8 Å²	53.8	20%	0.195	30%	0.299	C	S	.	.	S	Bend	trans	-60.9	-40.5	174.3	-24.2	35.4	0	0	0	111.6	I487 R528 D660	I487-P600 WeakPolarHBondContact O-CG 3.41Å; R528-P600 PolarHBondContact NH1-O 3.43Å; R528-P600 PolarHBondContact NH2-O 2.81Å; P600-D660 WeakPolarHBondContact CD-O 3.35Å
601	L	79.8	Confident	82	Confident	136 Å²	136	56.1 Å²	56.1	71%	0.712	31%	0.308	S	S	*	.	S	Bend	trans	-80.9	133.8	173.9	-60.8	176.4	0	0	0	110.3	S599	S599-L601 VanDerWaalsContact C-N 3.29Å; S599-L601 WeakPolarHBondContact CB-O 3.15Å; S599-L601 PolarHBondContact O-N 3.04Å; S599-L601 PolarHBondContact OG-N 2.96Å; S599-L601 PolarHBondContact OG-O 2.9Å
602	Q	75.1	Confident	82.8	Confident	104 Å²	104	49.8 Å²	49.8	49%	0.486	28%	0.279	S	S	.	.			trans	-79.7	134	178.7	-175.3	171.9	11	0	0	110.9	S604 G607	Q602-S604 PolarHBondContact O-N 3.15Å; Q602-G607 PolarHBondContact NE2-O 2.81Å
603	D	73.8	Confident	83.1	Confident	49 Å²	49	48.5 Å²	48.5	26%	0.262	27%	0.271	S	S	.	.			trans	-74.8	115.7	171.9	-164	-39.6	0	0	0	110.8	S605 L606 G607 E610 R613	D603-S605 PolarHBondContact O-N 3.26Å; D603-S605 WeakPolarHBondContact OD1-CB 3.32Å; D603-S605 PolarHBondContact OD1-N 3.08Å; D603-S605 PolarHBondContact OD1-OG 3.39Å; D603-L606 HydrophobicContact CB-CB 4.21Å; D603-L606 HydrophobicContact CB-CD1 4.16Å; D603-L606 HydrophobicContact CB-CG 4.29Å; D603-L606 PolarHBondContact O-N 3.12Å; D603-G607 PolarHBondContact O-N 2.84Å; D603-E610 PolarHBondContact N-OE2 3.04Å; D603-R613 IonicContact OD2-NH2 3.5Å; D603-R613 PolarHBondContact OD2-NH2 3.14Å
604	S	71.1	Confident	83.2	Confident	122 Å²	122	48.8 Å²	48.8	85%	0.853	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-18.6	-178.6	-62.7	0	0	0	0	113.2	Q602	Q602-S604 PolarHBondContact O-N 3.15Å
605	S	71.9	Confident	83.1	Confident	101 Å²	101	48.2 Å²	48.2	71%	0.706	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-29.9	176.3	73.3	0	0	0	0	113	D603	D603-S605 PolarHBondContact O-N 3.26Å; D603-S605 WeakPolarHBondContact OD1-CB 3.32Å; D603-S605 PolarHBondContact OD1-N 3.08Å; D603-S605 PolarHBondContact OD1-OG 3.39Å
606	L	74.8	Confident	82.9	Confident	82 Å²	82	51 Å²	51	43%	0.429	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-29.9	-177.1	-61.8	174.6	0	0	0	113.1	D603 L608 E609 E610	D603-L606 HydrophobicContact CB-CB 4.21Å; D603-L606 HydrophobicContact CB-CD1 4.16Å; D603-L606 HydrophobicContact CB-CG 4.29Å; D603-L606 PolarHBondContact O-N 3.12Å; L606-L608 PolarHBondContact O-N 2.88Å; L606-E609 WeakPolarHBondContact O-CB 3.3Å; L606-E609 PolarHBondContact O-N 3.04Å; L606-E610 HydrophobicContact CB-CB 4.09Å
607	G	75.1	Confident	82.7	Confident	25 Å²	25	51 Å²	51	26%	0.258	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	-107.6	171.6	0	0	0	0	0	114	Q602 D603	Q602-G607 PolarHBondContact NE2-O 2.81Å; D603-G607 PolarHBondContact O-N 2.84Å
608	L	74.8	Confident	82.4	Confident	109 Å²	109	52.5 Å²	52.5	57%	0.571	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-8.6	-179.8	-56.8	176.7	0	0	0	113.5	D529 R532 L606	D529-L608 HydrophobicContact CB-CD2 4.47Å; D529-L608 WeakPolarHBondContact OD2-CD2 3.47Å; R532-L608 PolarHBondContact NH1-O 3.22Å; L606-L608 PolarHBondContact O-N 2.88Å
609	E	81.3	Confident	82.3	Confident	108 Å²	108	53.5 Å²	53.5	51%	0.505	30%	0.297	S	S	.	.			trans	-92	-6.8	179.4	-62.2	-61.6	140.7	0	0	113.4	R532 L606 K611	R532-E609 VanDerWaalsContact CZ-CD 3.49Å; R532-E609 IonicContact CZ-OE1 3.18Å; R532-E609 IonicContact CZ-OE2 3.16Å; R532-E609 IonicContact NH1-OE1 3.12Å; R532-E609 PolarHBondContact NH1-OE1 3.38Å; R532-E609 VanDerWaalsContact NH1-OE1 3.12Å; R532-E609 IonicContact NH1-OE2 2.71Å; R532-E609 PolarHBondContact NH1-OE2 2.88Å; R532-E609 IonicContact NH2-OE1 2.91Å; R532-E609 PolarHBondContact NH2-OE1 3.29Å; R532-E609 IonicContact NH2-OE2 2.75Å; R532-E609 PolarHBondContact NH2-OE2 3.42Å; L606-E609 WeakPolarHBondContact O-CB 3.3Å; L606-E609 PolarHBondContact O-N 3.04Å; E609-K611 PolarHBondContact O-N 3.13Å
610	E	84.7	Confident	82.3	Confident	4 Å²	4	53.9 Å²	53.9	2%	0.019	30%	0.301	C	S	.	.			trans	-62	123.4	-179.9	-174.2	165.1	-149.1	0	0	111.9	Y527 R528 D603 L606 R613	Y527-E610 CarbonylContact C-O 3.51Å; Y527-E610 VanDerWaalsContact CA-O 3.31Å; Y527-E610 WeakPolarHBondContact CA-O 2.96Å; R528-E610 HydrophobicContact CB-CB 4.21Å; R528-E610 HydrophobicContact CB-CG 4.22Å; R528-E610 WeakPolarHBondContact CD-OE2 3.2Å; R528-E610 PolarHBondContact N-O 3.4Å; R528-E610 IonicContact NE-OE2 2.7Å; D603-E610 PolarHBondContact N-OE2 3.04Å; L606-E610 HydrophobicContact CB-CB 4.09Å; E610-R613 IonicContact OE1-CZ 3.14Å; E610-R613 IonicContact OE1-NE 2.69Å; E610-R613 PolarHBondContact OE1-NE 2.02Å; E610-R613 IonicContact OE1-NH2 3.04Å; E610-R613 PolarHBondContact OE1-NH2 2.89Å
611	K	87.9	Confident	82.1	Confident	64 Å²	64	57.8 Å²	57.8	28%	0.278	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-105	177.2	178	-68.6	177.8	179.5	-170.8	0	111.2	H526 Y527 E609 R613	H526-K611 WeakPolarHBondContact NE2-CD 3.12Å; H526-K611 VanDerWaalsContact NE2-CE 3.35Å; H526-K611 WeakPolarHBondContact NE2-CE 3.11Å; H526-K611 PolarHBondContact NE2-NZ 3.37Å; H526-K611 WeakPolarHBondContact O-CA 2.96Å; Y527-K611 HydrophobicContact CD1-CG 3.65Å; Y527-K611 HydrophobicContact CE1-CD 4.14Å; Y527-K611 VanDerWaalsContact CE1-CE 3.46Å; Y527-K611 HydrophobicContact CE1-CG 3.61Å; E609-K611 PolarHBondContact O-N 3.13Å; K611-R613 PolarHBondContact O-N 3.23Å
612	A	89.3	Confident	82.2	Confident	5 Å²	5	52.8 Å²	52.8	4%	0.041	29%	0.294	C	S	.	.			trans	-59.2	130.7	161.6	0	0	0	0	0	109.5	L466 H526 W598	L466-A612 HydrophobicContact CD2-CB 3.82Å; H526-A612 PolarHBondContact O-N 3.1Å; H526-A612 VanDerWaalsContact O-N 3.13Å; W598-A612 HydrophobicContact CD2-CB 4.43Å; W598-A612 HydrophobicContact CZ2-CB 4.07Å; W598-A612 VanDerWaalsContact NE1-N 3.16Å
613	R	89.4	Confident	82.6	Confident	48 Å²	48	51 Å²	51	18%	0.181	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	155.8	176.3	-60.7	171.1	-178.2	-127.6	2.7	109.2	T596 G597 D603 E610 K611 N655 I656 T661	T596-R613 VanDerWaalsContact CA-O 3.28Å; T596-R613 WeakPolarHBondContact CA-O 3.34Å; T596-R613 WeakPolarHBondContact CB-O 3.33Å; T596-R613 PolarHBondContact OG1-O 3.2Å; G597-R613 PolarHBondContact N-O 2.83Å; G597-R613 PolarHBondContact O-N 2.82Å; D603-R613 IonicContact OD2-NH2 3.5Å; D603-R613 PolarHBondContact OD2-NH2 3.14Å; E610-R613 IonicContact OE1-CZ 3.14Å; E610-R613 IonicContact OE1-NE 2.69Å; E610-R613 PolarHBondContact OE1-NE 2.02Å; E610-R613 IonicContact OE1-NH2 3.04Å; E610-R613 PolarHBondContact OE1-NH2 2.89Å; K611-R613 PolarHBondContact O-N 3.23Å; R613-N655 VanDerWaalsContact CA-OD1 3.31Å; R613-N655 WeakPolarHBondContact CA-OD1 3.46Å; R613-N655 WeakPolarHBondContact CB-OD1 3.37Å; R613-N655 VanDerWaalsContact CD-O 3.3Å; R613-N655 WeakPolarHBondContact CD-O 3.22Å; R613-N655 WeakPolarHBondContact CG-O 3.44Å; R613-I656 HydrophobicContact CB-CB 3.7Å; R613-I656 HydrophobicContact CB-CD1 4.15Å; R613-I656 HydrophobicContact CB-CG1 3.82Å; R613-T661 HydrophobicContact CB-CG2 4.46Å
614	V	90.4	Very high	83.2	Confident	5 Å²	5	51.4 Å²	51.4	3%	0.03	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	147.4	179.9	63.8	0	0	0	0	112	P458 E459 W463 L594 V595 S654 N655 I656	P458-V614 HydrophobicContact CB-CG1 4Å; P458-V614 HydrophobicContact CB-CG2 4.3Å; P458-V614 HydrophobicContact CG-CG1 4.32Å; E459-V614 HydrophobicContact CB-CG1 4.08Å; W463-V614 HydrophobicContact CZ2-CB 4.49Å; W463-V614 HydrophobicContact CZ2-CG2 3.85Å; L594-V614 HydrophobicContact CD2-CG2 4.16Å; V595-V614 VanDerWaalsContact O-CA 3.28Å; V595-V614 WeakPolarHBondContact O-CA 3.29Å; V614-S654 PolarHBondContact O-OG 3.24Å; V614-N655 PolarHBondContact N-OD1 2.88Å; V614-N655 PolarHBondContact O-N 3.18Å; V614-N655 PolarHBondContact O-OD1 2.66Å; V614-N655 VanDerWaalsContact O-OD1 3.12Å; V614-I656 VanDerWaalsContact C-CG2 3.42Å
615	G	88.6	Confident	84	Confident	4 Å²	4	45.6 Å²	45.6	4%	0.041	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	146	176.1	0	0	0	0	0	111.6	L594 V595 S654 I656	L594-G615 WeakPolarHBondContact CA-O 3.45Å; V595-G615 PolarHBondContact N-O 2.94Å; V595-G615 PolarHBondContact O-N 2.88Å; G615-S654 WeakPolarHBondContact CA-OG 3.49Å; G615-I656 VanDerWaalsContact N-CG2 3.31Å
616	L	87.7	Confident	84.6	Confident	58 Å²	58	45.1 Å²	45.1	30%	0.304	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	131.5	165.1	-169.5	74.3	0	0	0	107.9	Q592 L594 Y651	Q592-L616 HydrophobicContact CB-CD1 4.36Å; L594-L616 HydrophobicContact CD2-CB 4.34Å; L594-L616 HydrophobicContact CD2-CD1 3.93Å; L594-L616 HydrophobicContact CG-CD1 4.26Å; L616-Y651 HydrophobicContact CD2-CD1 3.53Å; L616-Y651 HydrophobicContact CD2-CE1 3.86Å; L616-Y651 HydrophobicContact CD2-CG 3.95Å
617	V	88.4	Confident	85.2	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	141.8	175.9	-66.2	0	0	0	0	109.9	Q592 G593 V595 A645 S646 Q647 L665	Q592-V617 WeakPolarHBondContact CA-O 3.4Å; G593-V617 PolarHBondContact N-O 2.92Å; G593-V617 PolarHBondContact O-N 2.87Å; V595-V617 HydrophobicContact CG1-CG1 3.71Å; V617-A645 HydrophobicContact CB-CB 3.82Å; V617-A645 HydrophobicContact CG2-CB 3.79Å; V617-S646 WeakPolarHBondContact CA-O 3.34Å; V617-Q647 HydrophobicContact CG1-CG 3.76Å; V617-L665 HydrophobicContact CG2-CD1 3.45Å; V617-L665 VanDerWaalsContact CG2-CD1 3.45Å
618	H	87.8	Confident	85.7	Confident	32 Å²	32	47.1 Å²	47.1	15%	0.148	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	125.9	170.4	-177.9	63.9	0	0	0	108.8	E591 A645 S646 K648 Y651	E591-H618 WeakPolarHBondContact O-CA 3.29Å; E591-H618 PolarHBondContact O-ND1 3.09Å; H618-A645 WeakPolarHBondContact O-CA 3.42Å; H618-A645 VanDerWaalsContact O-CB 3.32Å; H618-A645 WeakPolarHBondContact O-CB 3.49Å; H618-S646 PolarHBondContact N-O 3.24Å; H618-S646 PolarHBondContact O-N 2.83Å; H618-S646 VanDerWaalsContact O-N 3.15Å; H618-K648 HydrophobicContact CB-CD 4.42Å; H618-K648 HydrophobicContact CB-CG 4.34Å; H618-K648 WeakPolarHBondContact CD2-CE 3.49Å; H618-K648 PolarHBondContact CD2-NZ 2.87Å; H618-K648 PolarHBondContact NE2-NZ 2.69Å; H618-Y651 HydrophobicContact CB-CE2 4.38Å
619	L	88.3	Confident	86.2	Confident	23 Å²	23	42.1 Å²	42.1	12%	0.12	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	140	175.3	-53.1	-171.2	0	0	0	109.2	E587 S590 E591 A645 L665 L686	E587-L619 HydrophobicContact CG-CD1 4.38Å; S590-L619 VanDerWaalsContact O-CD1 3.31Å; S590-L619 WeakPolarHBondContact O-CD1 3.4Å; E591-L619 PolarHBondContact O-N 2.86Å; E591-L619 VanDerWaalsContact O-N 3.09Å; L619-A645 HydrophobicContact CD2-CB 3.96Å; L619-L665 HydrophobicContact CD2-CD2 3.94Å; L619-L686 HydrophobicContact CD1-CD2 3.55Å; L619-L686 HydrophobicContact CD2-CD2 4.25Å
620	A	84.4	Confident	86.2	Confident	23 Å²	23	40.2 Å²	40.2	19%	0.19	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	153	178.4	0	0	0	0	0	111.1	C644 Y703	A620-C644 PolarHBondContact N-O 3.31Å; A620-Y703 HydrophobicContact CB-CD1 4.12Å; A620-Y703 HydrophobicContact CB-CE1 3.34Å
621	D	79.5	Confident	86.2	Confident	111 Å²	111	50.1 Å²	50.1	59%	0.594	26%	0.255	S	S	*	.			trans	-60.3	155.8	170	-164.8	-5.9	0	0	0	110.6	V623 P624	D621-V623 VanDerWaalsContact C-N 3.3Å; D621-V623 PolarHBondContact O-N 2.92Å; D621-P624 HydrophobicContact CB-CG 4.45Å; D621-P624 WeakPolarHBondContact O-CD 3.29Å
622	I	82.4	Confident	85.8	Confident	32 Å²	32	50 Å²	50	16%	0.164	26%	0.258	C	S	.	.	H	α-helix	trans	-65.3	-33.8	-177.2	-163.7	170.5	0	0	0	112.1	C625 E626 V638 T639	I622-C625 VanDerWaalsContact O-CB 3.29Å; I622-C625 WeakPolarHBondContact O-CB 3.36Å; I622-C625 PolarHBondContact O-N 2.87Å; I622-E626 PolarHBondContact O-N 2.87Å; I622-V638 HydrophobicContact CD1-CB 4.07Å; I622-V638 HydrophobicContact CD1-CG1 3.8Å; I622-V638 HydrophobicContact CG1-CB 3.84Å; I622-V638 HydrophobicContact CG1-CG1 3.57Å; I622-T639 VanDerWaalsContact CD1-C 3.42Å; I622-T639 WeakPolarHBondContact CD1-O 3.29Å
623	V	84.1	Confident	84.8	Confident	66 Å²	66	52.8 Å²	52.8	40%	0.4	29%	0.287	S	S	.	.	H	α-helix	trans	-66.7	-48.2	-174.1	175.7	0	0	0	0	113.3	D621 C625 E626 H627	D621-V623 VanDerWaalsContact C-N 3.3Å; D621-V623 PolarHBondContact O-N 2.92Å; V623-C625 PolarHBondContact O-N 3.01Å; V623-E626 PolarHBondContact O-N 2.82Å; V623-H627 WeakPolarHBondContact O-CB 3.44Å; V623-H627 PolarHBondContact O-CD2 3.47Å; V623-H627 VanDerWaalsContact O-CD2 3.28Å; V623-H627 PolarHBondContact O-N 3.47Å
624	P	86.3	Confident	83.7	Confident	58 Å²	58	52 Å²	52	38%	0.377	29%	0.287	S	S	.	.	H	α-helix	trans	-54.6	-37.3	169.8	-28.2	33.7	0	0	0	114.2	D621 Q628 Y703	D621-P624 HydrophobicContact CB-CG 4.45Å; D621-P624 WeakPolarHBondContact O-CD 3.29Å; P624-Q628 PolarHBondContact O-N 2.87Å; P624-Y703 HydrophobicContact CB-CE2 4.17Å
625	C	86.6	Confident	82.4	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-69.1	-53.4	-179	-171.8	0	0	0	0	111.2	I622 V623 H627 Q628 Y629 C644 Y703	I622-C625 VanDerWaalsContact O-CB 3.29Å; I622-C625 WeakPolarHBondContact O-CB 3.36Å; I622-C625 PolarHBondContact O-N 2.87Å; V623-C625 PolarHBondContact O-N 3.01Å; C625-H627 VanDerWaalsContact C-N 3.29Å; C625-H627 PolarHBondContact O-N 3.07Å; C625-Q628 PolarHBondContact O-N 3.15Å; C625-Y629 WeakPolarHBondContact O-CD2 3.41Å; C625-Y629 PolarHBondContact O-N 2.94Å; C625-Y629 VanDerWaalsContact O-N 3.08Å; C625-C644 HydrophobicContact CB-CB 3.41Å; C625-C644 VanDerWaalsContact CB-CB 3.41Å; C625-C644 WeakPolarHBondContact CB-SG 3.32Å; C625-C644 WeakPolarHBondContact SG-CB 3.37Å; C625-C644 CovalentContact SG-SG 2.03Å; C625-C644 PolarHBondContact SG-SG 2.85Å; C625-Y703 HydrophobicContact CB-CD2 4.17Å; C625-Y703 HydrophobicContact CB-CG 4.21Å
626	E	85.1	Confident	81.4	Confident	90 Å²	90	59.3 Å²	59.3	42%	0.421	33%	0.333	S	S	.	.	H	α-helix	trans	-53.9	-45.1	174.8	-170.8	-168.4	173.7	0	0	111.5	I622 V623 Q628 Y629 A630 V638	I622-E626 PolarHBondContact O-N 2.87Å; V623-E626 PolarHBondContact O-N 2.82Å; E626-Q628 VanDerWaalsContact C-N 3.33Å; E626-Q628 PolarHBondContact O-N 2.89Å; E626-Y629 PolarHBondContact O-N 3.18Å; E626-A630 WeakPolarHBondContact O-CB 3.38Å; E626-A630 PolarHBondContact O-N 3.2Å; E626-V638 HydrophobicContact CB-CG2 4.39Å
627	H	86.5	Confident	81	Confident	109 Å²	109	60.1 Å²	60.1	51%	0.505	34%	0.344	S	S	.	.	H	α-helix	trans	-62.6	-33.5	177	-79.3	-41.9	0	0	0	114	V623 C625 R631	V623-H627 WeakPolarHBondContact O-CB 3.44Å; V623-H627 PolarHBondContact O-CD2 3.47Å; V623-H627 VanDerWaalsContact O-CD2 3.28Å; V623-H627 PolarHBondContact O-N 3.47Å; C625-H627 VanDerWaalsContact C-N 3.29Å; C625-H627 PolarHBondContact O-N 3.07Å; H627-R631 VanDerWaalsContact O-CG 3.25Å; H627-R631 WeakPolarHBondContact O-CG 3.32Å; H627-R631 PolarHBondContact O-N 3.05Å
628	Q	86.9	Confident	80.7	Confident	41 Å²	41	60.8 Å²	60.8	19%	0.192	35%	0.348	C	S	.	.	H	α-helix	trans	-70.5	-45.3	175.7	-169.6	-176.7	64.2	0	0	110.8	P624 C625 E626 A630 R631 N632 E701 Y703	P624-Q628 PolarHBondContact O-N 2.87Å; C625-Q628 PolarHBondContact O-N 3.15Å; E626-Q628 VanDerWaalsContact C-N 3.33Å; E626-Q628 PolarHBondContact O-N 2.89Å; Q628-A630 PolarHBondContact O-N 3.43Å; Q628-R631 PolarHBondContact O-N 2.89Å; Q628-N632 PolarHBondContact O-N 3.08Å; Q628-N632 VanDerWaalsContact O-N 3.1Å; Q628-E701 PolarHBondContact NE2-O 2.92Å; Q628-Y703 HydrophobicContact CB-CD2 4.25Å; Q628-Y703 VanDerWaalsContact OE1-CD2 3.29Å
629	Y	83.9	Confident	80.7	Confident	4 Å²	4	60.8 Å²	60.8	2%	0.016	35%	0.35	C	S	.	.	H	α-helix	trans	-63.9	-41.6	178.9	-83.8	-112	0	0	0	112.1	C625 E626 R631 N632 G633 V634 F691 G692 Y693 Y703 V705	C625-Y629 WeakPolarHBondContact O-CD2 3.41Å; C625-Y629 PolarHBondContact O-N 2.94Å; C625-Y629 VanDerWaalsContact O-N 3.08Å; E626-Y629 PolarHBondContact O-N 3.18Å; Y629-R631 PolarHBondContact O-N 2.92Å; Y629-N632 CarbonylContact O-C 3.3Å; Y629-N632 PolarHBondContact O-N 3.13Å; Y629-G633 PolarHBondContact O-N 2.92Å; Y629-V634 HydrophobicContact CD1-CB 4Å; Y629-V634 HydrophobicContact CD1-CG1 3.91Å; Y629-V634 HydrophobicContact CD1-CG2 4.23Å; Y629-V634 PolarHBondContact O-N 3.16Å; Y629-F691 HydrophobicContact CD1-CE2 4.47Å; Y629-F691 HydrophobicContact CE1-CD2 4.13Å; Y629-F691 AromaticContact CE1-CE2 3.88Å; Y629-F691 HydrophobicContact CE1-CE2 3.88Å; Y629-G692 WeakPolarHBondContact OH-CA 3.18Å; Y629-Y693 PolarHBondContact OH-N 3.31Å; Y629-Y703 WeakPolarHBondContact CE2-O 3.43Å; Y629-Y703 PolarHBondContact OH-O 3.48Å; Y629-V705 HydrophobicContact CE2-CG2 4.4Å
630	A	82.3	Confident	80.7	Confident	67 Å²	67	65.9 Å²	65.9	55%	0.554	38%	0.378	S	S	*	.	H	α-helix	trans	-62.6	-39	175.5	0	0	0	0	0	112.8	E626 Q628 N632 G633	E626-A630 WeakPolarHBondContact O-CB 3.38Å; E626-A630 PolarHBondContact O-N 3.2Å; Q628-A630 PolarHBondContact O-N 3.43Å; A630-N632 VanDerWaalsContact C-N 3.34Å; A630-G633 PolarHBondContact O-N 3Å
631	R	84.4	Confident	81	Confident	212 Å²	212	66.7 Å²	66.7	80%	0.8	38%	0.379	S	S	*	.	H	α-helix	trans	-66.2	-35.7	175.1	-75.1	172.5	-171.3	-176	5.7	112.6	H627 Q628 Y629 G633	H627-R631 VanDerWaalsContact O-CG 3.25Å; H627-R631 WeakPolarHBondContact O-CG 3.32Å; H627-R631 PolarHBondContact O-N 3.05Å; Q628-R631 PolarHBondContact O-N 2.89Å; Y629-R631 PolarHBondContact O-N 2.92Å; R631-G633 PolarHBondContact O-N 3.11Å
632	N	79.6	Confident	81.5	Confident	63 Å²	63	61.8 Å²	61.8	34%	0.337	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	6	178.5	-68.5	-7.8	0	0	0	113.1	Q628 Y629 A630 V634 Y693	Q628-N632 PolarHBondContact O-N 3.08Å; Q628-N632 VanDerWaalsContact O-N 3.1Å; Y629-N632 CarbonylContact O-C 3.3Å; Y629-N632 PolarHBondContact O-N 3.13Å; A630-N632 VanDerWaalsContact C-N 3.34Å; N632-V634 HydrophobicContact CB-CG2 4.49Å; N632-Y693 HydrophobicContact CB-CD1 4.04Å; N632-Y693 HydrophobicContact CB-CE1 3.67Å; N632-Y693 HydrophobicContact CB-CE2 4.44Å; N632-Y693 WeakPolarHBondContact ND2-CD1 3.4Å
633	G	68.6	Low	81.9	Confident	63 Å²	63	60.7 Å²	60.7	65%	0.649	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.7	18.2	173.7	0	0	0	0	0	114.9	Y629 A630 R631 P635	Y629-G633 PolarHBondContact O-N 2.92Å; A630-G633 PolarHBondContact O-N 3Å; R631-G633 PolarHBondContact O-N 3.11Å; G633-P635 WeakPolarHBondContact O-CD 3.2Å
634	V	66.9	Low	82.2	Confident	31 Å²	31	57.6 Å²	57.6	19%	0.188	33%	0.328	C	S	.	.			trans	-87.2	117.1	-179.5	-174	0	0	0	0	110	Y629 N632 V636 Y693	Y629-V634 HydrophobicContact CD1-CB 4Å; Y629-V634 HydrophobicContact CD1-CG1 3.91Å; Y629-V634 HydrophobicContact CD1-CG2 4.23Å; Y629-V634 PolarHBondContact O-N 3.16Å; N632-V634 HydrophobicContact CB-CG2 4.49Å; V634-V636 HydrophobicContact CG1-CB 4.05Å; V634-V636 HydrophobicContact CG1-CG2 3.73Å; V634-V636 PolarHBondContact O-N 3.32Å; V634-Y693 HydrophobicContact CG2-CD2 3.19Å; V634-Y693 HydrophobicContact CG2-CE2 3.46Å; V634-Y693 VanDerWaalsContact CG2-CE2 3.46Å; V634-Y693 HydrophobicContact CG2-CG 3.98Å
635	P	62.9	Low	82.3	Confident	128 Å²	128	54.9 Å²	54.9	83%	0.831	31%	0.31	S	S	*	.			trans	-85.9	46.9	-176.2	37.4	-37.6	0	0	0	112.2	G633	G633-P635 WeakPolarHBondContact O-CD 3.2Å
636	V	67.7	Low	82.4	Confident	35 Å²	35	55.2 Å²	55.2	21%	0.212	31%	0.312	C	S	.	.			trans	-112.5	124.6	-179.8	179.2	0	0	0	0	109.4	V634 F691	V634-V636 HydrophobicContact CG1-CB 4.05Å; V634-V636 HydrophobicContact CG1-CG2 3.73Å; V634-V636 PolarHBondContact O-N 3.32Å; V636-F691 HydrophobicContact CG1-CE1 4.4Å; V636-F691 HydrophobicContact CG1-CE2 3.91Å; V636-F691 HydrophobicContact CG1-CZ 3.61Å
637	S	77.4	Confident	82.2	Confident	75 Å²	75	52 Å²	52	52%	0.524	30%	0.298	S	S	.	.			trans	-82.1	119.1	173.4	-60.6	0	0	0	0	109.9
638	V	83.6	Confident	81.6	Confident	14 Å²	14	50.3 Å²	50.3	9%	0.085	29%	0.289	C	S	.	.			trans	-76.4	133.1	170.1	-161.1	0	0	0	0	107.9	I622 E626 M642 V705	I622-V638 HydrophobicContact CD1-CB 4.07Å; I622-V638 HydrophobicContact CD1-CG1 3.8Å; I622-V638 HydrophobicContact CG1-CB 3.84Å; I622-V638 HydrophobicContact CG1-CG1 3.57Å; E626-V638 HydrophobicContact CB-CG2 4.39Å; V638-M642 HydrophobicContact CB-SD 4.33Å; V638-M642 HydrophobicContact CG1-CB 3.84Å; V638-M642 HydrophobicContact CG1-CG 4.4Å; V638-M642 HydrophobicContact CG1-SD 3.7Å; V638-V705 HydrophobicContact CG1-CG1 4.18Å
639	T	87.6	Confident	80.5	Confident	32 Å²	32	52.2 Å²	52.2	20%	0.196	30%	0.304	C	S	.	.			trans	-112.7	164.7	-174.1	70.7	0	0	0	0	112.3	D557 I622 N641 M642	D557-T639 HydrophobicContact CB-CG2 4.28Å; D557-T639 WeakPolarHBondContact OD1-CB 3.39Å; D557-T639 PolarHBondContact OD1-OG1 2.79Å; I622-T639 VanDerWaalsContact CD1-C 3.42Å; I622-T639 WeakPolarHBondContact CD1-O 3.29Å; T639-N641 PolarHBondContact O-N 3.27Å; T639-N641 PolarHBondContact OG1-N 3.4Å; T639-M642 HydrophobicContact CG2-CE 4.16Å; T639-M642 PolarHBondContact N-SD 2.98Å; T639-M642 WeakPolarHBondContact O-CA 3.18Å; T639-M642 WeakPolarHBondContact O-CB 3.36Å; T639-M642 PolarHBondContact O-N 2.59Å
640	D	87.4	Confident	79.5	Confident	130 Å²	130	59.4 Å²	59.4	70%	0.695	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-12.3	174.6	-60.6	-28.5	0	0	0	114.1	M642 N711	D640-M642 VanDerWaalsContact C-N 3.27Å; D640-N711 PolarHBondContact O-ND2 2.64Å
641	N	90.6	Very high	78.5	Confident	40 Å²	40	59.6 Å²	59.6	21%	0.214	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	0.3	172.5	-64.1	-39.3	0	0	0	113.5	D557 T639 R708 N711 F712	D557-N641 WeakPolarHBondContact OD1-CB 2.99Å; D557-N641 PolarHBondContact OD1-ND2 3.12Å; D557-N641 PolarHBondContact OD2-ND2 2.85Å; T639-N641 PolarHBondContact O-N 3.27Å; T639-N641 PolarHBondContact OG1-N 3.4Å; N641-R708 VanDerWaalsContact O-CB 3.29Å; N641-R708 WeakPolarHBondContact O-CB 3.37Å; N641-R708 PolarHBondContact O-N 2.94Å; N641-N711 WeakPolarHBondContact CA-ND2 3.12Å; N641-N711 PolarHBondContact OD1-ND2 3.47Å; N641-N711 VanDerWaalsContact OD1-ND2 3.1Å; N641-F712 HydrophobicContact CB-CE2 4Å; N641-F712 HydrophobicContact CB-CZ 3.79Å
642	M	90.9	Very high	77.3	Confident	8 Å²	8	52.3 Å²	52.3	4%	0.039	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	159.6	-178.8	-56	175.2	-174.2	0	0	110.2	D557 V638 T639 D640 F691 V705 Y706	D557-M642 HydrophobicContact CB-CE 4.19Å; V638-M642 HydrophobicContact CB-SD 4.33Å; V638-M642 HydrophobicContact CG1-CB 3.84Å; V638-M642 HydrophobicContact CG1-CG 4.4Å; V638-M642 HydrophobicContact CG1-SD 3.7Å; T639-M642 HydrophobicContact CG2-CE 4.16Å; T639-M642 PolarHBondContact N-SD 2.98Å; T639-M642 WeakPolarHBondContact O-CA 3.18Å; T639-M642 WeakPolarHBondContact O-CB 3.36Å; T639-M642 PolarHBondContact O-N 2.59Å; D640-M642 VanDerWaalsContact C-N 3.27Å; M642-F691 HydrophobicContact CE-CE1 4.13Å; M642-F691 HydrophobicContact SD-CE1 4.03Å; M642-F691 HydrophobicContact SD-CZ 4.16Å; M642-V705 HydrophobicContact CB-CG1 3.75Å; M642-V705 HydrophobicContact CG-CG1 3.99Å; M642-V705 HydrophobicContact SD-CG1 3.66Å; M642-Y706 CarbonylContact C-O 3.53Å; M642-Y706 VanDerWaalsContact CA-O 3.24Å; M642-Y706 WeakPolarHBondContact CA-O 3.49Å
643	L	89.6	Confident	76.3	Confident	9 Å²	9	56.2 Å²	56.2	5%	0.047	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	153.1	167.2	66.5	87	0	0	0	108.5	L665 L686 Y706 R708	L643-L665 HydrophobicContact CD1-CD2 3.52Å; L643-L665 HydrophobicContact CD2-CD2 4.41Å; L643-L686 HydrophobicContact CD2-CG 4.06Å; L643-Y706 HydrophobicContact CD1-CD2 3.83Å; L643-Y706 HydrophobicContact CD1-CG 3.96Å; L643-Y706 PolarHBondContact N-O 3.45Å; L643-Y706 PolarHBondContact O-N 3Å; L643-R708 HydrophobicContact CD2-CB 4.25Å; L643-R708 HydrophobicContact CD2-CG 4.17Å
644	C	90.4	Very high	76.4	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.007	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	145.4	178.7	-67.5	0	0	0	0	112	A620 C625 Y703 T704	A620-C644 PolarHBondContact N-O 3.31Å; C625-C644 HydrophobicContact CB-CB 3.41Å; C625-C644 VanDerWaalsContact CB-CB 3.41Å; C625-C644 WeakPolarHBondContact CB-SG 3.32Å; C625-C644 WeakPolarHBondContact SG-CB 3.37Å; C625-C644 CovalentContact SG-SG 2.03Å; C625-C644 PolarHBondContact SG-SG 2.85Å; C644-Y703 HydrophobicContact CB-CD1 4.25Å; C644-Y703 HydrophobicContact CB-CG 4.44Å; C644-T704 WeakPolarHBondContact CA-O 3.48Å
645	A	90.3	Very high	76.9	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	147	173.9	0	0	0	0	0	111.6	V617 H618 L619 T704 Y706	V617-A645 HydrophobicContact CB-CB 3.82Å; V617-A645 HydrophobicContact CG2-CB 3.79Å; H618-A645 WeakPolarHBondContact O-CA 3.42Å; H618-A645 VanDerWaalsContact O-CB 3.32Å; H618-A645 WeakPolarHBondContact O-CB 3.49Å; L619-A645 HydrophobicContact CD2-CB 3.96Å; A645-T704 PolarHBondContact N-O 3.12Å; A645-T704 PolarHBondContact O-N 3.23Å; A645-Y706 HydrophobicContact CB-CD2 4.42Å; A645-Y706 HydrophobicContact CB-CE2 3.75Å
646	S	87.9	Confident	77.8	Confident	7 Å²	7	51.4 Å²	51.4	5%	0.049	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	158.9	178.1	60.1	0	0	0	0	111.8	V617 H618 K648 L702 Y703	V617-S646 WeakPolarHBondContact CA-O 3.34Å; H618-S646 PolarHBondContact N-O 3.24Å; H618-S646 PolarHBondContact O-N 2.83Å; H618-S646 VanDerWaalsContact O-N 3.15Å; S646-K648 PolarHBondContact O-N 2.87Å; S646-L702 WeakPolarHBondContact CB-O 3.36Å; S646-Y703 WeakPolarHBondContact OG-CE1 3.01Å
647	Q	80.8	Confident	78.7	Confident	24 Å²	24	50.3 Å²	50.3	11%	0.112	30%	0.299	C	S	.	.			trans	-98.1	73.1	-177.8	-68.1	-176.2	-5.3	0	0	110.2	V617 S654 I656 P700	V617-Q647 HydrophobicContact CG1-CG 3.76Å; Q647-S654 PolarHBondContact NE2-OG 3.33Å; Q647-I656 PolarHBondContact NE2-O 2.83Å; Q647-I656 PolarHBondContact OE1-O 3.27Å; Q647-P700 CarbonylContact C-O 3.51Å; Q647-P700 VanDerWaalsContact C-O 3.3Å; Q647-P700 HydrophobicContact CB-CB 4.47Å; Q647-P700 PolarHBondContact N-O 3.04Å; Q647-P700 CarbonylContact O-C 3.57Å; Q647-P700 WeakPolarHBondContact O-CA 3.43Å; Q647-P700 WeakPolarHBondContact O-CB 3.29Å
648	K	74.6	Confident	78.9	Confident	73 Å²	73	47.1 Å²	47.1	32%	0.317	28%	0.276	S	S	.	.			trans	-49.2	137.6	-174.1	-61.8	-176.2	179.8	162.2	0	112.4	H618 S646 D650 Y651	H618-K648 HydrophobicContact CB-CD 4.42Å; H618-K648 HydrophobicContact CB-CG 4.34Å; H618-K648 WeakPolarHBondContact CD2-CE 3.49Å; H618-K648 PolarHBondContact CD2-NZ 2.87Å; H618-K648 PolarHBondContact NE2-NZ 2.69Å; S646-K648 PolarHBondContact O-N 2.87Å; K648-D650 PolarHBondContact O-N 3.34Å; K648-Y651 HydrophobicContact CB-CD2 3.74Å; K648-Y651 HydrophobicContact CB-CE2 3.79Å; K648-Y651 HydrophobicContact CD-CE2 4.13Å; K648-Y651 HydrophobicContact CG-CE2 4.18Å; K648-Y651 WeakPolarHBondContact O-CD2 3.25Å; K648-Y651 PolarHBondContact O-N 3.47Å
649	P	62.2	Low	78.7	Confident	80 Å²	80	47.9 Å²	47.9	52%	0.519	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-15.2	-171.9	24.8	-35.2	0	0	0	115	Y651 P700	P649-Y651 VanDerWaalsContact C-N 3.29Å; P649-P700 HydrophobicContact CB-CB 4.45Å; P649-P700 HydrophobicContact CB-CG 4.34Å
650	D	63.7	Low	78.3	Confident	155 Å²	155	49.9 Å²	49.9	83%	0.829	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-15.9	174.7	-59.3	-43.8	0	0	0	113.6	K648	K648-D650 PolarHBondContact O-N 3.34Å
651	Y	61.4	Low	77.9	Confident	72 Å²	72	43.8 Å²	43.8	28%	0.282	26%	0.259	S	S	.	.	S	Bend	trans	-82.4	145.8	175.9	-63.3	-64.1	0	0	0	110.9	Q592 L616 H618 K648 P649	Q592-Y651 PolarHBondContact NE2-OH 3.45Å; Q592-Y651 VanDerWaalsContact NE2-OH 3.13Å; L616-Y651 HydrophobicContact CD2-CD1 3.53Å; L616-Y651 HydrophobicContact CD2-CE1 3.86Å; L616-Y651 HydrophobicContact CD2-CG 3.95Å; H618-Y651 HydrophobicContact CB-CE2 4.38Å; K648-Y651 HydrophobicContact CB-CD2 3.74Å; K648-Y651 HydrophobicContact CB-CE2 3.79Å; K648-Y651 HydrophobicContact CD-CE2 4.13Å; K648-Y651 HydrophobicContact CG-CE2 4.18Å; K648-Y651 WeakPolarHBondContact O-CD2 3.25Å; K648-Y651 PolarHBondContact O-N 3.47Å; P649-Y651 VanDerWaalsContact C-N 3.29Å
652	G	59.3	Low	77.6	Confident	59 Å²	59	42.6 Å²	42.6	61%	0.608	26%	0.256	S	S	*	.			trans	-59.4	169.3	-175.4	0	0	0	0	0	114.2	S654	G652-S654 PolarHBondContact O-N 2.87Å
653	P	57.9	Low	77.5	Confident	145 Å²	145	42.5 Å²	42.5	94%	0.942	26%	0.258	S	S	*	.			trans	-55.4	108.8	-166.8	23.3	-35	0	0	0	112.5
654	S	72.1	Confident	77.8	Confident	46 Å²	46	42.1 Å²	42.1	32%	0.322	26%	0.255	S	S	.	.			trans	-81.5	144.2	168.9	-169.3	0	0	0	0	110.3	V614 G615 Q647 G652 I656	V614-S654 PolarHBondContact O-OG 3.24Å; G615-S654 WeakPolarHBondContact CA-OG 3.49Å; Q647-S654 PolarHBondContact NE2-OG 3.33Å; G652-S654 PolarHBondContact O-N 2.87Å; S654-I656 PolarHBondContact OG-N 3.22Å
655	N	75.9	Confident	78	Confident	72 Å²	72	42 Å²	42	39%	0.385	26%	0.255	S	S	.	.			trans	-111.3	10.5	174.9	72	5.1	0	0	0	113.3	R613 V614	R613-N655 VanDerWaalsContact CA-OD1 3.31Å; R613-N655 WeakPolarHBondContact CA-OD1 3.46Å; R613-N655 WeakPolarHBondContact CB-OD1 3.37Å; R613-N655 VanDerWaalsContact CD-O 3.3Å; R613-N655 WeakPolarHBondContact CD-O 3.22Å; R613-N655 WeakPolarHBondContact CG-O 3.44Å; V614-N655 PolarHBondContact N-OD1 2.88Å; V614-N655 PolarHBondContact O-N 3.18Å; V614-N655 PolarHBondContact O-OD1 2.66Å; V614-N655 VanDerWaalsContact O-OD1 3.12Å
656	I	83.4	Confident	78.1	Confident	2 Å²	2	42 Å²	42	1%	0.01	26%	0.255	C	S	.	.			trans	-115.2	129.7	179.2	-163.6	169.1	0	0	0	110.7	V595 R613 V614 G615 Q647 S654 P658 T661	V595-I656 HydrophobicContact CG1-CD1 4.46Å; V595-I656 HydrophobicContact CG1-CG2 3.85Å; V595-I656 HydrophobicContact CG2-CD1 4.3Å; R613-I656 HydrophobicContact CB-CB 3.7Å; R613-I656 HydrophobicContact CB-CD1 4.15Å; R613-I656 HydrophobicContact CB-CG1 3.82Å; V614-I656 VanDerWaalsContact C-CG2 3.42Å; G615-I656 VanDerWaalsContact N-CG2 3.31Å; Q647-I656 PolarHBondContact NE2-O 2.83Å; Q647-I656 PolarHBondContact OE1-O 3.27Å; S654-I656 PolarHBondContact OG-N 3.22Å; I656-P658 WeakPolarHBondContact O-CD 3.35Å; I656-T661 HydrophobicContact CD1-CG2 3.77Å; I656-T661 HydrophobicContact CG1-CG2 3.73Å; I656-T661 WeakPolarHBondContact CG1-OG1 3.13Å
657	C	85.8	Confident	78.1	Confident	13 Å²	13	42.4 Å²	42.4	9%	0.088	26%	0.256	C	S	.	.			trans	-93.4	109.7	159.4	-179.5	0	0	0	0	107	S659 D660 T661 C698	C657-S659 PolarHBondContact O-N 3.43Å; C657-S659 PolarHBondContact SG-OG 3.01Å; C657-D660 HydrophobicContact CB-CB 4.11Å; C657-D660 PolarHBondContact O-N 2.77Å; C657-T661 WeakPolarHBondContact O-CB 3.3Å; C657-T661 PolarHBondContact O-N 3.03Å; C657-T661 PolarHBondContact O-OG1 3.14Å; C657-C698 VanDerWaalsContact CA-SG 3.54Å; C657-C698 HydrophobicContact CB-CB 3.88Å; C657-C698 WeakPolarHBondContact CB-SG 3.22Å
658	P	82.4	Confident	78.2	Confident	8 Å²	8	43.5 Å²	43.5	5%	0.052	27%	0.266	C	S	.	.	H	α-helix	trans	-63.4	-44.1	-169.6	-25.7	37.3	0	0	0	112.9	V595 I656 D660 G662 V689 T704	V595-P658 HydrophobicContact CG1-CG 4.06Å; V595-P658 HydrophobicContact CG2-CB 4.48Å; I656-P658 WeakPolarHBondContact O-CD 3.35Å; P658-D660 VanDerWaalsContact C-N 3.29Å; P658-D660 PolarHBondContact O-N 3Å; P658-G662 WeakPolarHBondContact O-CA 3.49Å; P658-G662 PolarHBondContact O-N 2.81Å; P658-V689 WeakPolarHBondContact O-CG1 3.28Å; P658-T704 HydrophobicContact CB-CG2 3.94Å
659	S	78.4	Confident	78.1	Confident	30 Å²	30	41.5 Å²	41.5	21%	0.21	26%	0.262	C	S	.	.	H	α-helix	trans	-54.8	-42.9	176.9	52.3	0	0	0	0	113	C657 D694	C657-S659 PolarHBondContact O-N 3.43Å; C657-S659 PolarHBondContact SG-OG 3.01Å; S659-D694 WeakPolarHBondContact OG-CB 3.41Å
660	D	78.8	Confident	78.2	Confident	73 Å²	73	43.1 Å²	43.1	39%	0.39	27%	0.267	S	S	.	.	H	α-helix	trans	-89.6	-30.6	-171.1	-58.3	4	0	0	0	111.8	P600 C657 P658	P600-D660 WeakPolarHBondContact CD-O 3.35Å; C657-D660 HydrophobicContact CB-CB 4.11Å; C657-D660 PolarHBondContact O-N 2.77Å; P658-D660 VanDerWaalsContact C-N 3.29Å; P658-D660 PolarHBondContact O-N 3Å
661	T	80.2	Confident	77.5	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.012	27%	0.267	C	S	.	.	H	α-helix	trans	-83.8	-32.7	-179.7	-50	0	0	0	0	111.6	R613 I656 C657	R613-T661 HydrophobicContact CB-CG2 4.46Å; I656-T661 HydrophobicContact CD1-CG2 3.77Å; I656-T661 HydrophobicContact CG1-CG2 3.73Å; I656-T661 WeakPolarHBondContact CG1-OG1 3.13Å; C657-T661 WeakPolarHBondContact O-CB 3.3Å; C657-T661 PolarHBondContact O-N 3.03Å; C657-T661 PolarHBondContact O-OG1 3.14Å
662	G	82.9	Confident	76.3	Confident	16 Å²	16	40.4 Å²	40.4	17%	0.165	27%	0.274	C	S	.	.			trans	61.1	-163.4	-166.6	0	0	0	0	0	112.8	P658	P658-G662 WeakPolarHBondContact O-CA 3.49Å; P658-G662 PolarHBondContact O-N 2.81Å
663	G	90.4	Very high	75.1	Confident	6 Å²	6	44.4 Å²	44.4	6%	0.062	28%	0.281	C	S	.	.			trans	112.5	-144.7	171.5	0	0	0	0	0	114.4	V689	G663-V689 PolarHBondContact O-N 3.16Å
664	I	95.3	Very high	74.3	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	138.8	-165.5	66.5	174.8	0	0	0	111.7	L466 A491 L578 V595 T596 V666 L685 L688	L466-I664 HydrophobicContact CD1-CD1 3.64Å; L466-I664 HydrophobicContact CD1-CG1 3.75Å; A491-I664 HydrophobicContact CB-CD1 3.98Å; A491-I664 HydrophobicContact CB-CG2 4.18Å; L578-I664 HydrophobicContact CD2-CD1 4.43Å; V595-I664 WeakPolarHBondContact CA-O 3.49Å; T596-I664 HydrophobicContact CG2-CG1 4.03Å; T596-I664 PolarHBondContact N-O 3.22Å; T596-I664 PolarHBondContact O-N 2.86Å; I664-V666 HydrophobicContact CD1-CG1 3.91Å; I664-V666 HydrophobicContact CG1-CG1 4.03Å; I664-L685 HydrophobicContact CB-CD1 3.97Å; I664-L685 HydrophobicContact CG2-CD1 4.33Å; I664-L688 HydrophobicContact CG2-CD2 3.97Å
665	L	93.7	Very high	72.8	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	120.5	171.8	178.5	65	0	0	0	108.9	V595 V617 L619 L643 L686 G687 Y706	V595-L665 HydrophobicContact CB-CD1 4.26Å; V617-L665 HydrophobicContact CG2-CD1 3.45Å; V617-L665 VanDerWaalsContact CG2-CD1 3.45Å; L619-L665 HydrophobicContact CD2-CD2 3.94Å; L643-L665 HydrophobicContact CD1-CD2 3.52Å; L643-L665 HydrophobicContact CD2-CD2 4.41Å; L665-L686 HydrophobicContact CD2-CD2 3.98Å; L665-L686 HydrophobicContact CD2-CG 4.31Å; L665-L686 HydrophobicContact CG-CB 4.35Å; L665-L686 HydrophobicContact CG-CD2 4.3Å; L665-L686 PolarHBondContact O-N 2.64Å; L665-G687 PolarHBondContact N-O 2.75Å; L665-G687 PolarHBondContact O-N 3.49Å; L665-G687 VanDerWaalsContact O-N 3.15Å; L665-Y706 HydrophobicContact CB-CD1 3.81Å; L665-Y706 HydrophobicContact CB-CE1 3.9Å; L665-Y706 HydrophobicContact CD2-CD1 4.15Å; L665-Y706 HydrophobicContact CD2-CE1 4.32Å; L665-Y706 HydrophobicContact CD2-CG 4.3Å
666	V	92.4	Very high	71	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	140.9	-177.3	-54.3	0	0	0	0	111.7	W463 L578 L594 I664 W683 R684	W463-V666 HydrophobicContact CZ3-CG2 4.17Å; L578-V666 HydrophobicContact CD2-CG1 3.58Å; L594-V666 HydrophobicContact CB-CG2 4.12Å; L594-V666 PolarHBondContact N-O 2.86Å; L594-V666 WeakPolarHBondContact O-CG2 3.48Å; L594-V666 PolarHBondContact O-N 2.99Å; I664-V666 HydrophobicContact CD1-CG1 3.91Å; I664-V666 HydrophobicContact CG1-CG1 4.03Å; V666-W683 HydrophobicContact CB-CE3 4.43Å; V666-W683 HydrophobicContact CG2-CE3 3.83Å; V666-W683 HydrophobicContact CG2-CZ3 3.83Å; V666-R684 CarbonylContact C-O 3.53Å; V666-R684 VanDerWaalsContact CA-O 3.25Å; V666-R684 WeakPolarHBondContact CA-O 3.39Å
667	L	88.8	Confident	68.8	Low	14 Å²	14	63 Å²	63	7%	0.073	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	124.9	172.9	-170.3	72.1	0	0	0	109.4	S590 W683 R684	S590-L667 VanDerWaalsContact CB-CD1 3.47Å; L667-W683 WeakPolarHBondContact O-CA 3.4Å; L667-R684 PolarHBondContact N-O 3.09Å; L667-R684 PolarHBondContact O-N 3Å; L667-R684 VanDerWaalsContact O-N 3.15Å
668	P	82.4	Confident	66.8	Low	48 Å²	48	70 Å²	70	31%	0.312	39%	0.39	S	S	.	.			trans	-70.2	157.1	178.3	28.8	-34.5	0	0	0	112.6	N670 W683	P668-N670 PolarHBondContact O-N 3Å; P668-N670 VanDerWaalsContact O-N 3.12Å; P668-W683 HydrophobicContact CB-CE3 4.25Å; P668-W683 HydrophobicContact CB-CH2 3.79Å; P668-W683 HydrophobicContact CB-CZ2 4.09Å; P668-W683 HydrophobicContact CB-CZ3 3.86Å
669	A	72.9	Confident	65	Low	30 Å²	30	75.5 Å²	75.5	25%	0.248	41%	0.413	C	S	.	.			trans	-66.3	106.9	176	0	0	0	0	0	111.6	P671 G681	A669-P671 WeakPolarHBondContact O-CD 3.34Å; A669-G681 VanDerWaalsContact CB-C 3.43Å; A669-G681 WeakPolarHBondContact CB-O 3.42Å
670	N	64.6	Low	63.6	Low	114 Å²	114	80.7 Å²	80.7	61%	0.61	43%	0.428	S	S	*	.			trans	-71.7	119.1	-169.8	-153.3	-12.6	0	0	0	113.4	P668 G672	P668-N670 PolarHBondContact O-N 3Å; P668-N670 VanDerWaalsContact O-N 3.12Å; N670-G672 PolarHBondContact O-N 2.9Å
671	P	48.6	Very low	62.9	Low	129 Å²	129	79.2 Å²	79.2	84%	0.838	43%	0.43	S	S	*	.			trans	-92.4	69	-175.2	36.4	-34	0	0	0	112.8	A669	A669-P671 WeakPolarHBondContact O-CD 3.34Å
672	G	36.4	Very low	63.1	Low	41 Å²	41	82 Å²	82	42%	0.423	44%	0.444	S	S	.	.			trans	-146.5	126.1	-173.5	0	0	0	0	0	118	N670 R680	N670-G672 PolarHBondContact O-N 2.9Å; G672-R680 PolarHBondContact O-NH1 2.9Å
673	N	33.8	Very low	63.4	Low	144 Å²	144	81.7 Å²	81.7	77%	0.77	44%	0.438	S	S	*	.			trans	63.1	135.4	168	-72.3	-17.4	0	0	0	120	V675 R680	N673-V675 PolarHBondContact O-N 3.38Å; N673-R680 PolarHBondContact O-NH1 2.91Å
674	Q	41	Very low	63.5	Low	192 Å²	192	83 Å²	83	90%	0.897	44%	0.441	S	S	*	.	S	Bend	trans	-89.2	17.6	-154	-63.6	-175	-19.6	0	0	117.4
675	V	41	Very low	63.4	Low	126 Å²	126	83 Å²	83	76%	0.764	44%	0.441	S	S	*	.	S	Bend	trans	-94.6	-18.9	-161.3	-173.8	0	0	0	0	115.4	N673	N673-V675 PolarHBondContact O-N 3.38Å
676	Q	38.1	Very low	63.3	Low	139 Å²	139	83.1 Å²	83.1	65%	0.65	44%	0.442	S	S	*	.			trans	-139.1	116.1	176.9	-70.4	179.6	-5	0	0	111.7
677	K	37.4	Very low	63.3	Low	198 Å²	198	83.1 Å²	83.1	86%	0.861	44%	0.442	S	S	*	.			trans	-85.1	-13.6	-166	-86.3	-175.1	172.8	179	0	116.9
678	D	42.4	Very low	63.7	Low	160 Å²	160	82.5 Å²	82.5	86%	0.856	44%	0.439	S	S	*	.	S	Bend	trans	-104.7	-5.3	-163.7	-66.6	-21.1	0	0	0	115.9
679	K	44.9	Very low	64.2	Low	123 Å²	123	80.5 Å²	80.5	54%	0.535	43%	0.426	S	S	.	.	S	Bend	trans	-135.8	3	-179.8	-78.6	-155.6	-178	-165.3	0	116.9	E582	E582-K679 IonicContact OE1-NZ 3.26Å; E582-K679 PolarHBondContact OE1-NZ 3.47Å; E582-K679 IonicContact OE2-NZ 3.54Å; E582-K679 PolarHBondContact OE2-NZ 2.86Å
680	R	48.8	Very low	65.1	Low	139 Å²	139	79.6 Å²	79.6	53%	0.525	42%	0.418	S	S	.	.	S	Bend	trans	-95.7	107.4	-179	-65.6	-176.7	-177.8	-153.3	-7.2	110.9	G672 N673	G672-R680 PolarHBondContact O-NH1 2.9Å; N673-R680 PolarHBondContact O-NH1 2.91Å
681	G	63.9	Low	66.2	Low	42 Å²	42	75.6 Å²	75.6	43%	0.433	40%	0.395	S	S	.	.	S	Bend	trans	144.4	14.4	175	0	0	0	0	0	117.5	A669	A669-G681 VanDerWaalsContact CB-C 3.43Å; A669-G681 WeakPolarHBondContact CB-O 3.42Å
682	L	84.9	Confident	67.9	Low	60 Å²	60	70.8 Å²	70.8	31%	0.314	37%	0.369	S	S	.	.			trans	-111.7	137.6	-178.5	-57	-178.1	0	0	0	111.7	K449	K449-L682 HydrophobicContact CB-CD2 4.44Å
683	W	90.1	Very high	69.6	Low	10 Å²	10	72.6 Å²	72.6	4%	0.038	36%	0.364	C	S	.	.			trans	-73.2	145	171.1	-68.8	69.2	0	0	0	110.8	G448 F453 W463 W465 L578 L594 V666 L667 P668	G448-W683 VanDerWaalsContact CA-O 3.29Å; G448-W683 WeakPolarHBondContact CA-O 3.4Å; G448-W683 WeakPolarHBondContact O-CB 2.89Å; G448-W683 VanDerWaalsContact O-CD1 3.27Å; G448-W683 PolarHBondContact O-N 2.81Å; F453-W683 HydrophobicContact CB-CZ2 4.19Å; F453-W683 AromaticContact CD1-CH2 3.93Å; F453-W683 HydrophobicContact CD1-CH2 3.93Å; F453-W683 AromaticContact CD1-CZ2 3.58Å; F453-W683 HydrophobicContact CD1-CZ2 3.58Å; F453-W683 HydrophobicContact CD2-CH2 4.04Å; F453-W683 HydrophobicContact CD2-CZ2 4.05Å; F453-W683 AromaticContact CE1-CH2 3.76Å; F453-W683 HydrophobicContact CE1-CH2 3.76Å; F453-W683 AromaticContact CE1-CZ2 3.89Å; F453-W683 HydrophobicContact CE1-CZ2 3.89Å; F453-W683 AromaticContact CE2-CH2 3.9Å; F453-W683 HydrophobicContact CE2-CH2 3.9Å; F453-W683 HydrophobicContact CE2-CZ2 4.35Å; F453-W683 HydrophobicContact CG-CH2 4.06Å; F453-W683 AromaticContact CG-CZ2 3.66Å; F453-W683 HydrophobicContact CG-CZ2 3.66Å; F453-W683 AromaticContact CZ-CH2 3.76Å; F453-W683 HydrophobicContact CZ-CH2 3.76Å; F453-W683 HydrophobicContact CZ-CZ2 4.27Å; W463-W683 HydrophobicContact CH2-CH2 4.09Å; W463-W683 HydrophobicContact CH2-CZ3 4Å; W463-W683 HydrophobicContact CZ3-CE3 4.23Å; W463-W683 HydrophobicContact CZ3-CH2 4.01Å; W463-W683 AromaticContact CZ3-CZ3 3.62Å; W463-W683 HydrophobicContact CZ3-CZ3 3.62Å; W465-W683 HydrophobicContact CH2-CB 3.51Å; W465-W683 AromaticContact CH2-CD2 3.7Å; W465-W683 HydrophobicContact CH2-CD2 3.7Å; W465-W683 HydrophobicContact CH2-CE3 4.07Å; W465-W683 AromaticContact CH2-CG 3.46Å; W465-W683 HydrophobicContact CH2-CG 3.46Å; W465-W683 VanDerWaalsContact CH2-CG 3.46Å; W465-W683 HydrophobicContact CZ2-CB 4.06Å; W465-W683 HydrophobicContact CZ2-CD2 4Å; W465-W683 AromaticContact CZ2-CE3 3.87Å; W465-W683 HydrophobicContact CZ2-CE3 3.87Å; W465-W683 HydrophobicContact CZ2-CG 4.12Å; W465-W683 HydrophobicContact CZ3-CB 4.09Å; W465-W683 HydrophobicContact CZ3-CG 4.31Å; L578-W683 HydrophobicContact CD1-CB 3.81Å; L578-W683 WeakPolarHBondContact CD1-O 3.12Å; L594-W683 HydrophobicContact CD1-CH2 3.8Å; L594-W683 HydrophobicContact CD1-CZ3 3.85Å; V666-W683 HydrophobicContact CB-CE3 4.43Å; V666-W683 HydrophobicContact CG2-CE3 3.83Å; V666-W683 HydrophobicContact CG2-CZ3 3.83Å; L667-W683 WeakPolarHBondContact O-CA 3.4Å; P668-W683 HydrophobicContact CB-CE3 4.25Å; P668-W683 HydrophobicContact CB-CH2 3.79Å; P668-W683 HydrophobicContact CB-CZ2 4.09Å; P668-W683 HydrophobicContact CB-CZ3 3.86Å
684	R	91.4	Very high	71.2	Confident	33 Å²	33	67.1 Å²	67.1	13%	0.125	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	148.8	-175.7	-54.5	-167.6	178.4	109.9	-27.5	112.7	C579 E586 V666 L667	C579-R684 HydrophobicContact CB-CG 4.28Å; C579-R684 CarbonylContact O-C 3.55Å; C579-R684 VanDerWaalsContact O-CA 3.31Å; C579-R684 WeakPolarHBondContact O-CA 3.28Å; E586-R684 VanDerWaalsContact CD-NH2 3.31Å; E586-R684 IonicContact OE1-CZ 3.53Å; E586-R684 IonicContact OE1-NH1 2.75Å; E586-R684 PolarHBondContact OE1-NH1 3.06Å; E586-R684 IonicContact OE1-NH2 3.88Å; E586-R684 PolarHBondContact OE1-NH2 2.9Å; E586-R684 IonicContact OE2-CZ 3.33Å; E586-R684 IonicContact OE2-NE 3.64Å; E586-R684 PolarHBondContact OE2-NE 2.87Å; E586-R684 IonicContact OE2-NH1 3.88Å; E586-R684 PolarHBondContact OE2-NH1 2.88Å; E586-R684 IonicContact OE2-NH2 2.73Å; E586-R684 PolarHBondContact OE2-NH2 2.82Å; E586-R684 VanDerWaalsContact OE2-NH2 3.09Å; V666-R684 CarbonylContact C-O 3.53Å; V666-R684 VanDerWaalsContact CA-O 3.25Å; V666-R684 WeakPolarHBondContact CA-O 3.39Å; L667-R684 PolarHBondContact N-O 3.09Å; L667-R684 PolarHBondContact O-N 3Å; L667-R684 VanDerWaalsContact O-N 3.15Å
685	L	93.7	Very high	72.5	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	118.3	168.6	-174.5	61.9	0	0	0	108.4	A491 V499 L578 C579 L580 I664 L688 V709	A491-L685 HydrophobicContact CB-CD1 4Å; A491-L685 HydrophobicContact CB-CD2 3.91Å; V499-L685 HydrophobicContact CB-CD2 4.13Å; V499-L685 HydrophobicContact CG1-CD2 4.13Å; L578-L685 HydrophobicContact CD2-CB 3.62Å; L578-L685 HydrophobicContact CD2-CD1 4Å; L578-L685 HydrophobicContact CD2-CG 4.36Å; L578-L685 HydrophobicContact CG-CB 4.02Å; C579-L685 PolarHBondContact O-N 2.67Å; L580-L685 HydrophobicContact CD2-CD2 4.36Å; I664-L685 HydrophobicContact CB-CD1 3.97Å; I664-L685 HydrophobicContact CG2-CD1 4.33Å; L685-L688 HydrophobicContact CD1-CD2 4.27Å; L685-L688 HydrophobicContact CD2-CD2 4.39Å; L685-V709 HydrophobicContact CD2-CG1 4.04Å; L685-V709 HydrophobicContact CD2-CG2 4.14Å; L685-V709 HydrophobicContact CG-CB 4.45Å; L685-V709 HydrophobicContact CG-CG1 4.17Å; L685-V709 HydrophobicContact CG-CG2 4.08Å
686	L	92.1	Very high	73.6	Confident	3 Å²	3	62 Å²	62	2%	0.016	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	-45.2	179.5	-177.8	63.7	0	0	0	111.1	E587 L619 L643 L665 V709	E587-L686 HydrophobicContact CB-CD1 4.22Å; E587-L686 HydrophobicContact CG-CD1 4.03Å; L619-L686 HydrophobicContact CD1-CD2 3.55Å; L619-L686 HydrophobicContact CD2-CD2 4.25Å; L643-L686 HydrophobicContact CD2-CG 4.06Å; L665-L686 HydrophobicContact CD2-CD2 3.98Å; L665-L686 HydrophobicContact CD2-CG 4.31Å; L665-L686 HydrophobicContact CG-CB 4.35Å; L665-L686 HydrophobicContact CG-CD2 4.3Å; L665-L686 PolarHBondContact O-N 2.64Å; L686-V709 WeakPolarHBondContact O-CB 2.96Å; L686-V709 PolarHBondContact O-N 3.14Å
687	G	93.1	Very high	75.2	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	169.8	-177.9	0	0	0	0	0	114.6	L665 T707	L665-G687 PolarHBondContact N-O 2.75Å; L665-G687 PolarHBondContact O-N 3.49Å; L665-G687 VanDerWaalsContact O-N 3.15Å; G687-T707 WeakPolarHBondContact CA-O 3.45Å
688	L	95.4	Very high	77.1	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132.3	173.3	-54.6	164.9	0	0	0	106.8	V499 I560 I664 L685 S690 Y706 T707 V709	V499-L688 HydrophobicContact CG1-CD1 3.74Å; V499-L688 HydrophobicContact CG1-CD2 4.16Å; V499-L688 HydrophobicContact CG1-CG 4.46Å; I560-L688 HydrophobicContact CB-CD1 4.24Å; I560-L688 HydrophobicContact CD1-CD1 3.84Å; I560-L688 HydrophobicContact CG1-CD1 3.67Å; I664-L688 HydrophobicContact CG2-CD2 3.97Å; L685-L688 HydrophobicContact CD1-CD2 4.27Å; L685-L688 HydrophobicContact CD2-CD2 4.39Å; L688-S690 PolarHBondContact O-N 3.48Å; L688-Y706 CarbonylContact O-C 3.5Å; L688-Y706 WeakPolarHBondContact O-CA 3.16Å; L688-Y706 VanDerWaalsContact O-CB 3.27Å; L688-Y706 WeakPolarHBondContact O-CB 3.28Å; L688-T707 PolarHBondContact N-O 2.88Å; L688-T707 PolarHBondContact O-N 3.47Å; L688-V709 HydrophobicContact CD1-CG2 4.15Å; L688-V709 HydrophobicContact CG-CG2 3.89Å
689	V	94.1	Very high	78.9	Confident	6 Å²	6	52.1 Å²	52.1	4%	0.036	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	129.6	175.7	179.7	0	0	0	0	108.8	V595 P658 G663 T704 Y706	V595-V689 HydrophobicContact CG2-CG2 3.98Å; P658-V689 WeakPolarHBondContact O-CG1 3.28Å; G663-V689 PolarHBondContact O-N 3.16Å; V689-T704 HydrophobicContact CG1-CG2 3.99Å; V689-Y706 HydrophobicContact CB-CD1 4.31Å; V689-Y706 HydrophobicContact CB-CE1 4.42Å; V689-Y706 HydrophobicContact CG2-CD1 3.77Å; V689-Y706 HydrophobicContact CG2-CE1 3.47Å; V689-Y706 VanDerWaalsContact CG2-CE1 3.47Å
690	S	91.3	Very high	80.5	Confident	11 Å²	11	48.4 Å²	48.4	8%	0.077	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	-60.3	178	-172.5	0	0	0	0	111.3	D559 L688 V705	D559-S690 WeakPolarHBondContact OD2-CB 3.34Å; D559-S690 PolarHBondContact OD2-OG 2.81Å; L688-S690 PolarHBondContact O-N 3.48Å; S690-V705 PolarHBondContact N-O 3.13Å
691	F	87.6	Confident	81.9	Confident	30 Å²	30	48 Å²	48	13%	0.132	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	164.4	179.1	62.3	-88.8	0	0	0	113.8	L556 Y629 V636 M642 T704 V705	L556-F691 HydrophobicContact CB-CD1 3.86Å; L556-F691 HydrophobicContact CB-CE1 4.09Å; L556-F691 HydrophobicContact CD1-CB 3.8Å; L556-F691 HydrophobicContact CD1-CD1 3.64Å; L556-F691 HydrophobicContact CD1-CG 4.04Å; L556-F691 HydrophobicContact CG-CD1 4.36Å; Y629-F691 HydrophobicContact CD1-CE2 4.47Å; Y629-F691 HydrophobicContact CE1-CD2 4.13Å; Y629-F691 AromaticContact CE1-CE2 3.88Å; Y629-F691 HydrophobicContact CE1-CE2 3.88Å; V636-F691 HydrophobicContact CG1-CE1 4.4Å; V636-F691 HydrophobicContact CG1-CE2 3.91Å; V636-F691 HydrophobicContact CG1-CZ 3.61Å; M642-F691 HydrophobicContact CE-CE1 4.13Å; M642-F691 HydrophobicContact SD-CE1 4.03Å; M642-F691 HydrophobicContact SD-CZ 4.16Å; F691-T704 WeakPolarHBondContact O-CG2 3.12Å; F691-V705 HydrophobicContact CD1-CB 4.15Å; F691-V705 HydrophobicContact CD1-CG1 4.34Å; F691-V705 HydrophobicContact CD2-CB 4.11Å; F691-V705 HydrophobicContact CD2-CG2 4.02Å; F691-V705 HydrophobicContact CE1-CB 3.89Å; F691-V705 HydrophobicContact CE1-CG1 3.71Å; F691-V705 HydrophobicContact CE1-CG2 4.38Å; F691-V705 HydrophobicContact CE2-CB 3.85Å; F691-V705 HydrophobicContact CE2-CG1 4.33Å; F691-V705 HydrophobicContact CE2-CG2 3.5Å; F691-V705 VanDerWaalsContact CE2-CG2 3.5Å; F691-V705 HydrophobicContact CG-CB 4.26Å; F691-V705 HydrophobicContact CZ-CB 3.74Å; F691-V705 HydrophobicContact CZ-CG1 3.7Å; F691-V705 HydrophobicContact CZ-CG2 3.71Å; F691-V705 PolarHBondContact N-O 2.61Å; F691-V705 PolarHBondContact O-N 2.81Å
692	G	83.8	Confident	82.9	Confident	29 Å²	29	47.3 Å²	47.3	30%	0.299	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	162.2	173.3	0	0	0	0	0	111.5	Y629	Y629-G692 WeakPolarHBondContact OH-CA 3.18Å
693	Y	71.7	Confident	83	Confident	79 Å²	79	46.6 Å²	46.6	31%	0.31	25%	0.246	S	C	.	.			trans	-91	-5	175.2	-179.6	-108.5	0	0	0	114	Y629 N632 V634 Q695 L702	Y629-Y693 PolarHBondContact OH-N 3.31Å; N632-Y693 HydrophobicContact CB-CD1 4.04Å; N632-Y693 HydrophobicContact CB-CE1 3.67Å; N632-Y693 HydrophobicContact CB-CE2 4.44Å; N632-Y693 WeakPolarHBondContact ND2-CD1 3.4Å; V634-Y693 HydrophobicContact CG2-CD2 3.19Å; V634-Y693 HydrophobicContact CG2-CE2 3.46Å; V634-Y693 VanDerWaalsContact CG2-CE2 3.46Å; V634-Y693 HydrophobicContact CG2-CG 3.98Å; Y693-Q695 PolarHBondContact O-N 3.43Å; Y693-L702 HydrophobicContact CD1-CD1 4.34Å
694	D	69.3	Low	83	Confident	29 Å²	29	46.6 Å²	46.6	16%	0.155	25%	0.248	C	C	.	.			trans	-57.4	137.3	-176.7	-154.7	-48.4	0	0	0	112.1	S659 G696 E697 C698 D699 L702	S659-D694 WeakPolarHBondContact OG-CB 3.41Å; D694-G696 VanDerWaalsContact C-N 3.3Å; D694-G696 PolarHBondContact OD1-N 3.26Å; D694-E697 PolarHBondContact OD1-N 2.81Å; D694-C698 PolarHBondContact OD1-N 2.87Å; D694-C698 VanDerWaalsContact OD1-N 3.09Å; D694-C698 WeakPolarHBondContact OD2-CA 3.4Å; D694-C698 PolarHBondContact OD2-N 3.41Å; D694-D699 PolarHBondContact OD2-N 2.72Å; D694-L702 HydrophobicContact CB-CD1 4.49Å
695	Q	66.6	Low	83	Confident	160 Å²	160	45 Å²	45	75%	0.748	24%	0.242	S	C	*	.			trans	-94.7	15.7	178.9	-59.7	-170.3	11.1	0	0	112.4	Y693	Y693-Q695 PolarHBondContact O-N 3.43Å
696	G	65	Low	83	Confident	50 Å²	50	45 Å²	45	52%	0.515	24%	0.242	S	C	.	.	S	Bend	trans	95.5	17.7	-178.6	0	0	0	0	0	113.8	D694	D694-G696 VanDerWaalsContact C-N 3.3Å; D694-G696 PolarHBondContact OD1-N 3.26Å
697	E	71.1	Confident	83.1	Confident	176 Å²	176	45 Å²	45	82%	0.822	24%	0.242	S	C	*	.	S	Bend	trans	-93.9	-15.2	176.1	-62.6	-165.9	164	0	0	112.3	D694	D694-E697 PolarHBondContact OD1-N 2.81Å
698	C	76.9	Confident	83.1	Confident	46 Å²	46	47.1 Å²	47.1	31%	0.311	25%	0.25	S	C	.	.			trans	60.3	51.1	-178.4	-168.7	0	0	0	0	112.2	C657 D694 P700	C657-C698 VanDerWaalsContact CA-SG 3.54Å; C657-C698 HydrophobicContact CB-CB 3.88Å; C657-C698 WeakPolarHBondContact CB-SG 3.22Å; D694-C698 PolarHBondContact OD1-N 2.87Å; D694-C698 VanDerWaalsContact OD1-N 3.09Å; D694-C698 WeakPolarHBondContact OD2-CA 3.4Å; D694-C698 PolarHBondContact OD2-N 3.41Å; C698-P700 WeakPolarHBondContact O-CD 3.16Å
699	D	81.3	Confident	83	Confident	67 Å²	67	47.1 Å²	47.1	36%	0.358	25%	0.25	S	C	.	.			trans	-68.6	116	-176.1	-177.1	-11.7	0	0	0	111	D694 E701 L702	D694-D699 PolarHBondContact OD2-N 2.72Å; D699-E701 PolarHBondContact O-N 3.4Å; D699-E701 PolarHBondContact OD1-N 2.97Å; D699-L702 HydrophobicContact CB-CB 4.41Å; D699-L702 HydrophobicContact CB-CD1 3.86Å; D699-L702 HydrophobicContact CB-CG 3.83Å; D699-L702 PolarHBondContact O-N 3.47Å
700	P	77.6	Confident	82.8	Confident	46 Å²	46	47.7 Å²	47.7	30%	0.299	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-25.2	-180	22.9	-33.3	0	0	0	114.5	Q647 P649 C698	Q647-P700 CarbonylContact C-O 3.51Å; Q647-P700 VanDerWaalsContact C-O 3.3Å; Q647-P700 HydrophobicContact CB-CB 4.47Å; Q647-P700 PolarHBondContact N-O 3.04Å; Q647-P700 CarbonylContact O-C 3.57Å; Q647-P700 WeakPolarHBondContact O-CA 3.43Å; Q647-P700 WeakPolarHBondContact O-CB 3.29Å; P649-P700 HydrophobicContact CB-CB 4.45Å; P649-P700 HydrophobicContact CB-CG 4.34Å; C698-P700 WeakPolarHBondContact O-CD 3.16Å
701	E	78.2	Confident	82.9	Confident	129 Å²	129	50.3 Å²	50.3	60%	0.603	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-12.2	-177.2	-59.2	-162.7	167.3	0	0	113.5	Q628 D699	Q628-E701 PolarHBondContact NE2-O 2.92Å; D699-E701 PolarHBondContact O-N 3.4Å; D699-E701 PolarHBondContact OD1-N 2.97Å
702	L	85.3	Confident	83.2	Confident	29 Å²	29	49.2 Å²	49.2	15%	0.152	26%	0.263	C	S	.	.	S	Bend	trans	-80.6	138.2	177.3	-66.4	-177.5	0	0	0	112.2	S646 Y693 D694 D699	S646-L702 WeakPolarHBondContact CB-O 3.36Å; Y693-L702 HydrophobicContact CD1-CD1 4.34Å; D694-L702 HydrophobicContact CB-CD1 4.49Å; D699-L702 HydrophobicContact CB-CB 4.41Å; D699-L702 HydrophobicContact CB-CD1 3.86Å; D699-L702 HydrophobicContact CB-CG 3.83Å; D699-L702 PolarHBondContact O-N 3.47Å
703	Y	88.6	Confident	83.6	Confident	44 Å²	44	50.1 Å²	50.1	17%	0.173	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-78.5	129.1	171.9	-70	-66.5	0	0	0	111.3	A620 P624 C625 Q628 Y629 C644 S646	A620-Y703 HydrophobicContact CB-CD1 4.12Å; A620-Y703 HydrophobicContact CB-CE1 3.34Å; P624-Y703 HydrophobicContact CB-CE2 4.17Å; C625-Y703 HydrophobicContact CB-CD2 4.17Å; C625-Y703 HydrophobicContact CB-CG 4.21Å; Q628-Y703 HydrophobicContact CB-CD2 4.25Å; Q628-Y703 VanDerWaalsContact OE1-CD2 3.29Å; Y629-Y703 WeakPolarHBondContact CE2-O 3.43Å; Y629-Y703 PolarHBondContact OH-O 3.48Å; C644-Y703 HydrophobicContact CB-CD1 4.25Å; C644-Y703 HydrophobicContact CB-CG 4.44Å; S646-Y703 WeakPolarHBondContact OG-CE1 3.01Å
704	T	89.8	Confident	84.5	Confident	11 Å²	11	52.5 Å²	52.5	7%	0.067	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	141.7	162.1	-57.7	0	0	0	0	109.4	C644 A645 P658 V689 F691 Y706	C644-T704 WeakPolarHBondContact CA-O 3.48Å; A645-T704 PolarHBondContact N-O 3.12Å; A645-T704 PolarHBondContact O-N 3.23Å; P658-T704 HydrophobicContact CB-CG2 3.94Å; V689-T704 HydrophobicContact CG1-CG2 3.99Å; F691-T704 WeakPolarHBondContact O-CG2 3.12Å; T704-Y706 HydrophobicContact CG2-CD2 4.32Å; T704-Y706 HydrophobicContact CG2-CE2 3.79Å; T704-Y706 WeakPolarHBondContact O-CD2 3.33Å; T704-Y706 VanDerWaalsContact O-CE2 3.3Å; T704-Y706 WeakPolarHBondContact O-CE2 3.33Å
705	V	91.4	Very high	85.8	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	134.1	177.4	-171.8	0	0	0	0	110.4	Y629 V638 M642 S690 F691	Y629-V705 HydrophobicContact CE2-CG2 4.4Å; V638-V705 HydrophobicContact CG1-CG1 4.18Å; M642-V705 HydrophobicContact CB-CG1 3.75Å; M642-V705 HydrophobicContact CG-CG1 3.99Å; M642-V705 HydrophobicContact SD-CG1 3.66Å; S690-V705 PolarHBondContact N-O 3.13Å; F691-V705 HydrophobicContact CD1-CB 4.15Å; F691-V705 HydrophobicContact CD1-CG1 4.34Å; F691-V705 HydrophobicContact CD2-CB 4.11Å; F691-V705 HydrophobicContact CD2-CG2 4.02Å; F691-V705 HydrophobicContact CE1-CB 3.89Å; F691-V705 HydrophobicContact CE1-CG1 3.71Å; F691-V705 HydrophobicContact CE1-CG2 4.38Å; F691-V705 HydrophobicContact CE2-CB 3.85Å; F691-V705 HydrophobicContact CE2-CG1 4.33Å; F691-V705 HydrophobicContact CE2-CG2 3.5Å; F691-V705 VanDerWaalsContact CE2-CG2 3.5Å; F691-V705 HydrophobicContact CG-CB 4.26Å; F691-V705 HydrophobicContact CZ-CB 3.74Å; F691-V705 HydrophobicContact CZ-CG1 3.7Å; F691-V705 HydrophobicContact CZ-CG2 3.71Å; F691-V705 PolarHBondContact N-O 2.61Å; F691-V705 PolarHBondContact O-N 2.81Å
706	Y	93.4	Very high	87.2	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	144.1	-178	-56	-111.1	0	0	0	110.3	V595 M642 L643 A645 L665 L688 V689 T704 R708	V595-Y706 HydrophobicContact CB-CE1 4.38Å; V595-Y706 HydrophobicContact CG2-CE1 3.88Å; M642-Y706 CarbonylContact C-O 3.53Å; M642-Y706 VanDerWaalsContact CA-O 3.24Å; M642-Y706 WeakPolarHBondContact CA-O 3.49Å; L643-Y706 HydrophobicContact CD1-CD2 3.83Å; L643-Y706 HydrophobicContact CD1-CG 3.96Å; L643-Y706 PolarHBondContact N-O 3.45Å; L643-Y706 PolarHBondContact O-N 3Å; A645-Y706 HydrophobicContact CB-CD2 4.42Å; A645-Y706 HydrophobicContact CB-CE2 3.75Å; L665-Y706 HydrophobicContact CB-CD1 3.81Å; L665-Y706 HydrophobicContact CB-CE1 3.9Å; L665-Y706 HydrophobicContact CD2-CD1 4.15Å; L665-Y706 HydrophobicContact CD2-CE1 4.32Å; L665-Y706 HydrophobicContact CD2-CG 4.3Å; L688-Y706 CarbonylContact O-C 3.5Å; L688-Y706 WeakPolarHBondContact O-CA 3.16Å; L688-Y706 VanDerWaalsContact O-CB 3.27Å; L688-Y706 WeakPolarHBondContact O-CB 3.28Å; V689-Y706 HydrophobicContact CB-CD1 4.31Å; V689-Y706 HydrophobicContact CB-CE1 4.42Å; V689-Y706 HydrophobicContact CG2-CD1 3.77Å; V689-Y706 HydrophobicContact CG2-CE1 3.47Å; V689-Y706 VanDerWaalsContact CG2-CE1 3.47Å; T704-Y706 HydrophobicContact CG2-CD2 4.32Å; T704-Y706 HydrophobicContact CG2-CE2 3.79Å; T704-Y706 WeakPolarHBondContact O-CD2 3.33Å; T704-Y706 VanDerWaalsContact O-CE2 3.3Å; T704-Y706 WeakPolarHBondContact O-CE2 3.33Å; Y706-R708 PolarHBondContact O-N 3.12Å
707	T	94.4	Very high	88.5	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.012	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	125.1	170.8	-45.9	0	0	0	0	110.2	D559 I560 G687 L688 V709 F712	D559-T707 WeakPolarHBondContact O-CB 3.3Å; D559-T707 PolarHBondContact O-OG1 3.45Å; I560-T707 HydrophobicContact CB-CG2 4.18Å; G687-T707 WeakPolarHBondContact CA-O 3.45Å; L688-T707 PolarHBondContact N-O 2.88Å; L688-T707 PolarHBondContact O-N 3.47Å; T707-V709 PolarHBondContact O-N 3.04Å; T707-F712 HydrophobicContact CG2-CD2 4.08Å; T707-F712 HydrophobicContact CG2-CE2 3.65Å; T707-F712 HydrophobicContact CG2-CZ 4.49Å
708	R	92.7	Very high	89.6	Confident	44 Å²	44	41.5 Å²	41.5	17%	0.166	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	98.6	-175.6	-170.4	167.2	-172	-108.2	-10.4	111.1	D584 E587 N641 L643 Y706 A710 N711 F712	D584-R708 IonicContact OD1-CZ 3.93Å; D584-R708 VanDerWaalsContact OD1-CZ 3.27Å; D584-R708 IonicContact OD1-NH1 2.75Å; D584-R708 PolarHBondContact OD1-NH1 3.42Å; D584-R708 VanDerWaalsContact OD1-NH1 3.08Å; D584-R708 IonicContact OD1-NH2 3.99Å; D584-R708 PolarHBondContact OD1-NH2 3.44Å; E587-R708 IonicContact OE1-NE 3.19Å; E587-R708 PolarHBondContact OE1-NE 3.09Å; E587-R708 VanDerWaalsContact OE1-NE 3.14Å; E587-R708 IonicContact OE2-CZ 3.33Å; E587-R708 IonicContact OE2-NE 2.77Å; E587-R708 PolarHBondContact OE2-NE 3.44Å; E587-R708 IonicContact OE2-NH2 2.76Å; E587-R708 PolarHBondContact OE2-NH2 3.2Å; N641-R708 VanDerWaalsContact O-CB 3.29Å; N641-R708 WeakPolarHBondContact O-CB 3.37Å; N641-R708 PolarHBondContact O-N 2.94Å; L643-R708 HydrophobicContact CD2-CB 4.25Å; L643-R708 HydrophobicContact CD2-CG 4.17Å; Y706-R708 PolarHBondContact O-N 3.12Å; R708-A710 PolarHBondContact O-N 3.18Å; R708-N711 PolarHBondContact NH1-OD1 3.32Å; R708-N711 VanDerWaalsContact NH1-OD1 3.13Å; R708-N711 PolarHBondContact O-N 3.23Å; R708-F712 WeakPolarHBondContact O-CD2 3.48Å
709	V	93.3	Very high	90.4	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.006	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-65.5	-25.5	-167.9	168.9	0	0	0	0	113.3	I560 L580 L685 L686 L688 T707 N711 F712 K713 I716	I560-V709 HydrophobicContact CD1-CG2 4.36Å; L580-V709 HydrophobicContact CD2-CG1 4.11Å; L685-V709 HydrophobicContact CD2-CG1 4.04Å; L685-V709 HydrophobicContact CD2-CG2 4.14Å; L685-V709 HydrophobicContact CG-CB 4.45Å; L685-V709 HydrophobicContact CG-CG1 4.17Å; L685-V709 HydrophobicContact CG-CG2 4.08Å; L686-V709 WeakPolarHBondContact O-CB 2.96Å; L686-V709 PolarHBondContact O-N 3.14Å; L688-V709 HydrophobicContact CD1-CG2 4.15Å; L688-V709 HydrophobicContact CG-CG2 3.89Å; T707-V709 PolarHBondContact O-N 3.04Å; V709-N711 PolarHBondContact O-N 2.82Å; V709-F712 PolarHBondContact O-N 3.44Å; V709-K713 PolarHBondContact O-N 3.27Å; V709-I716 HydrophobicContact CG1-CD1 3.89Å
710	A	90.4	Very high	90.7	Very high	18 Å²	18	39.2 Å²	39.2	15%	0.149	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-56.4	-46.1	177.4	0	0	0	0	0	112.4	R708 F712 K713	R708-A710 PolarHBondContact O-N 3.18Å; A710-F712 PolarHBondContact O-N 3.24Å; A710-F712 VanDerWaalsContact O-N 3.16Å; A710-K713 VanDerWaalsContact O-CB 3.31Å; A710-K713 WeakPolarHBondContact O-CB 3.31Å; A710-K713 PolarHBondContact O-N 2.86Å
711	N	92	Very high	90.4	Very high	66 Å²	66	47 Å²	47	35%	0.353	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-59.5	-28.4	179.9	-63.9	24.2	0	0	0	112.9	D640 N641 R708 V709	D640-N711 PolarHBondContact O-ND2 2.64Å; N641-N711 WeakPolarHBondContact CA-ND2 3.12Å; N641-N711 PolarHBondContact OD1-ND2 3.47Å; N641-N711 VanDerWaalsContact OD1-ND2 3.1Å; R708-N711 PolarHBondContact NH1-OD1 3.32Å; R708-N711 VanDerWaalsContact NH1-OD1 3.13Å; R708-N711 PolarHBondContact O-N 3.23Å; V709-N711 PolarHBondContact O-N 2.82Å
712	F	93.9	Very high	91	Very high	8 Å²	8	42.9 Å²	42.9	4%	0.035	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-99.6	2.3	-175.1	-59.9	-75.5	0	0	0	113.8	H548 I560 N641 T707 R708 V709 A710 D714 W715 I716	H548-F712 AromaticContact CD2-CD1 3.7Å; H548-F712 AromaticContact CD2-CE1 3.99Å; H548-F712 AromaticContact CE1-CE1 3.69Å; H548-F712 AromaticContact ND1-CE1 3.89Å; H548-F712 AromaticContact NE2-CD1 3.66Å; H548-F712 AromaticContact NE2-CE1 3.79Å; I560-F712 HydrophobicContact CD1-CB 3.91Å; I560-F712 HydrophobicContact CD1-CD2 4.31Å; I560-F712 HydrophobicContact CD1-CG 4.24Å; I560-F712 HydrophobicContact CG2-CB 4.3Å; I560-F712 HydrophobicContact CG2-CD1 3.83Å; I560-F712 HydrophobicContact CG2-CD2 4.11Å; I560-F712 HydrophobicContact CG2-CE1 4.2Å; I560-F712 HydrophobicContact CG2-CE2 4.47Å; I560-F712 HydrophobicContact CG2-CG 3.79Å; N641-F712 HydrophobicContact CB-CE2 4Å; N641-F712 HydrophobicContact CB-CZ 3.79Å; T707-F712 HydrophobicContact CG2-CD2 4.08Å; T707-F712 HydrophobicContact CG2-CE2 3.65Å; T707-F712 HydrophobicContact CG2-CZ 4.49Å; R708-F712 WeakPolarHBondContact O-CD2 3.48Å; V709-F712 PolarHBondContact O-N 3.44Å; A710-F712 PolarHBondContact O-N 3.24Å; A710-F712 VanDerWaalsContact O-N 3.16Å; F712-D714 PolarHBondContact O-N 2.69Å; F712-W715 WeakPolarHBondContact O-CB 3.35Å; F712-W715 PolarHBondContact O-N 3.27Å; F712-W715 VanDerWaalsContact O-N 3.1Å; F712-I716 HydrophobicContact CB-CD1 4.21Å; F712-I716 HydrophobicContact CB-CG1 4.41Å; F712-I716 WeakPolarHBondContact O-CG1 3.13Å; F712-I716 PolarHBondContact O-N 2.96Å
713	K	91.8	Very high	91.3	Very high	48 Å²	48	43.6 Å²	43.6	21%	0.209	22%	0.215	C	C	.	.	H	α-helix	trans	-51	-51.2	-174	-177.6	-168.6	-178.4	-170.2	0	113.4	L580 E582 V709 A710 W715 I716 E717	L580-K713 HydrophobicContact CD1-CG 4.46Å; E582-K713 PolarHBondContact O-NZ 3.28Å; V709-K713 PolarHBondContact O-N 3.27Å; A710-K713 VanDerWaalsContact O-CB 3.31Å; A710-K713 WeakPolarHBondContact O-CB 3.31Å; A710-K713 PolarHBondContact O-N 2.86Å; K713-W715 VanDerWaalsContact C-N 3.32Å; K713-W715 PolarHBondContact O-N 2.61Å; K713-I716 PolarHBondContact O-N 2.81Å; K713-E717 WeakPolarHBondContact O-CB 3.47Å; K713-E717 WeakPolarHBondContact O-CG 3.21Å; K713-E717 PolarHBondContact O-N 3.5Å
714	D	92.6	Very high	91.5	Very high	129 Å²	129	43.6 Å²	43.6	69%	0.69	22%	0.217	S	C	*	.	H	α-helix	trans	-64.9	-37.3	-178.4	-72.5	-16.5	0	0	0	112.1	F712 E717 S718	F712-D714 PolarHBondContact O-N 2.69Å; D714-E717 PolarHBondContact O-N 2.85Å; D714-S718 WeakPolarHBondContact O-CB 3.45Å; D714-S718 PolarHBondContact O-N 2.88Å
715	W	95.6	Very high	91.6	Very high	43 Å²	43	45.5 Å²	45.5	16%	0.163	23%	0.226	C	C	.	.	H	α-helix	trans	-66.6	-44.3	174.8	177.9	86.9	0	0	0	111.4	A546 H548 I560 V562 F712 K713 S718 N719	A546-W715 HydrophobicContact CB-CZ2 4.34Å; A546-W715 WeakPolarHBondContact O-CH2 3.36Å; H548-W715 HydrophobicContact CB-CH2 4.22Å; H548-W715 HydrophobicContact CB-CZ2 4.23Å; H548-W715 AromaticContact CD2-CD1 3.89Å; H548-W715 AromaticContact CD2-CD2 3.53Å; H548-W715 AromaticContact CD2-CE2 3.69Å; H548-W715 AromaticContact CD2-CE3 3.93Å; H548-W715 AromaticContact CD2-CG 3.71Å; H548-W715 AromaticContact CD2-NE1 3.88Å; I560-W715 HydrophobicContact CG1-CZ3 4.38Å; I560-W715 HydrophobicContact CG2-CE3 4.5Å; I560-W715 HydrophobicContact CG2-CZ3 4.09Å; V562-W715 HydrophobicContact CG2-CE3 4.39Å; V562-W715 HydrophobicContact CG2-CH2 4.04Å; V562-W715 HydrophobicContact CG2-CZ3 3.71Å; F712-W715 WeakPolarHBondContact O-CB 3.35Å; F712-W715 PolarHBondContact O-N 3.27Å; F712-W715 VanDerWaalsContact O-N 3.1Å; K713-W715 VanDerWaalsContact C-N 3.32Å; K713-W715 PolarHBondContact O-N 2.61Å; W715-S718 PolarHBondContact O-N 2.99Å; W715-S718 PolarHBondContact O-OG 2.98Å; W715-N719 VanDerWaalsContact CE2-ND2 3.32Å; W715-N719 PolarHBondContact NE1-ND2 2.89Å; W715-N719 WeakPolarHBondContact O-CB 3.5Å; W715-N719 PolarHBondContact O-N 3.28Å; W715-N719 VanDerWaalsContact O-N 3.08Å; W715-N719 PolarHBondContact O-ND2 2.71Å
716	I	95.4	Very high	91.6	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-58.9	-50.4	173	-61.9	161.9	0	0	0	109.3	V499 I560 V562 L580 V709 F712 K713 S718 N719 I720	V499-I716 HydrophobicContact CG1-CD1 4.46Å; V499-I716 HydrophobicContact CG2-CD1 4.24Å; V499-I716 HydrophobicContact CG2-CG1 4.36Å; V499-I716 HydrophobicContact CG2-CG2 3.77Å; I560-I716 HydrophobicContact CD1-CD1 3.8Å; I560-I716 HydrophobicContact CD1-CG1 4.2Å; V562-I716 HydrophobicContact CG2-CG1 4.42Å; V562-I716 HydrophobicContact CG2-CG2 4.32Å; L580-I716 HydrophobicContact CD1-CB 4.32Å; L580-I716 HydrophobicContact CD1-CG2 3.86Å; L580-I716 HydrophobicContact CD2-CD1 4.24Å; L580-I716 HydrophobicContact CD2-CG2 4.43Å; V709-I716 HydrophobicContact CG1-CD1 3.89Å; F712-I716 HydrophobicContact CB-CD1 4.21Å; F712-I716 HydrophobicContact CB-CG1 4.41Å; F712-I716 WeakPolarHBondContact O-CG1 3.13Å; F712-I716 PolarHBondContact O-N 2.96Å; K713-I716 PolarHBondContact O-N 2.81Å; I716-S718 VanDerWaalsContact C-N 3.28Å; I716-S718 PolarHBondContact O-N 3.01Å; I716-N719 CarbonylContact O-C 3.47Å; I716-N719 WeakPolarHBondContact O-CA 3.47Å; I716-N719 PolarHBondContact O-N 2.75Å; I716-I720 HydrophobicContact CG2-CD1 4.45Å; I716-I720 HydrophobicContact CG2-CG2 4.09Å; I716-I720 WeakPolarHBondContact O-CG1 3.34Å; I716-I720 WeakPolarHBondContact O-CG2 3.47Å; I716-I720 PolarHBondContact O-N 2.91Å
717	E	93.1	Very high	91.5	Very high	72 Å²	72	51.6 Å²	51.6	34%	0.336	26%	0.256	S	S	.	.	H	α-helix	trans	-60	-34.1	-180	-79	-163.6	-159.8	0	0	113.3	L580 K713 D714 N719 K721	L580-E717 HydrophobicContact CD1-CG 4.37Å; K713-E717 WeakPolarHBondContact O-CB 3.47Å; K713-E717 WeakPolarHBondContact O-CG 3.21Å; K713-E717 PolarHBondContact O-N 3.5Å; D714-E717 PolarHBondContact O-N 2.85Å; E717-N719 VanDerWaalsContact C-N 3.35Å; E717-K721 VanDerWaalsContact O-CD 3.27Å; E717-K721 WeakPolarHBondContact O-CD 3.45Å; E717-K721 VanDerWaalsContact O-CE 3.25Å; E717-K721 WeakPolarHBondContact O-CE 3.31Å; E717-K721 WeakPolarHBondContact O-CG 3.44Å
718	S	93.9	Very high	91.3	Very high	68 Å²	68	55.1 Å²	55.1	48%	0.476	27%	0.274	S	S	.	.	H	α-helix	trans	-69.6	-32.4	172	77.8	0	0	0	0	112.6	D714 W715 I716	D714-S718 WeakPolarHBondContact O-CB 3.45Å; D714-S718 PolarHBondContact O-N 2.88Å; W715-S718 PolarHBondContact O-N 2.99Å; W715-S718 PolarHBondContact O-OG 2.98Å; I716-S718 VanDerWaalsContact C-N 3.28Å; I716-S718 PolarHBondContact O-N 3.01Å
719	N	92.8	Very high	91.1	Very high	29 Å²	29	56 Å²	56	16%	0.155	28%	0.282	C	S	.	.	H	α-helix	trans	-90	-0.6	-178.4	-79.1	-76.5	0	0	0	114.8	V562 K564 W715 I716 E717	V562-N719 HydrophobicContact CB-CB 4.19Å; V562-N719 HydrophobicContact CG1-CB 4.29Å; V562-N719 HydrophobicContact CG2-CB 4.06Å; K564-N719 WeakPolarHBondContact CE-O 3.34Å; W715-N719 VanDerWaalsContact CE2-ND2 3.32Å; W715-N719 PolarHBondContact NE1-ND2 2.89Å; W715-N719 WeakPolarHBondContact O-CB 3.5Å; W715-N719 PolarHBondContact O-N 3.28Å; W715-N719 VanDerWaalsContact O-N 3.08Å; W715-N719 PolarHBondContact O-ND2 2.71Å; I716-N719 CarbonylContact O-C 3.47Å; I716-N719 WeakPolarHBondContact O-CA 3.47Å; I716-N719 PolarHBondContact O-N 2.75Å; E717-N719 VanDerWaalsContact C-N 3.35Å
720	I	88.1	Confident	91	Very high	36 Å²	36	60.6 Å²	60.6	19%	0.185	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.9	7.6	176.2	69.4	178.3	0	0	0	114.6	V493 N494 S497 V562 I716	V493-I720 HydrophobicContact CG2-CG2 4.17Å; N494-I720 PolarHBondContact ND2-O 3.12Å; S497-I720 VanDerWaalsContact CB-CG2 3.45Å; V562-I720 HydrophobicContact CG1-CG2 3.91Å; I716-I720 HydrophobicContact CG2-CD1 4.45Å; I716-I720 HydrophobicContact CG2-CG2 4.09Å; I716-I720 WeakPolarHBondContact O-CG1 3.34Å; I716-I720 WeakPolarHBondContact O-CG2 3.47Å; I716-I720 PolarHBondContact O-N 2.91Å
721	K	72.1	Confident	91	Very high	210 Å²	210	64.5 Å²	64.5	91%	0.913	32%	0.319	S	S	*	.			trans	-90.1	0	173.5	-70.5	163.3	-174.1	157.9	0	110.8	E717	E717-K721 VanDerWaalsContact O-CD 3.27Å; E717-K721 WeakPolarHBondContact O-CD 3.45Å; E717-K721 VanDerWaalsContact O-CE 3.25Å; E717-K721 WeakPolarHBondContact O-CE 3.31Å; E717-K721 WeakPolarHBondContact O-CG 3.44Å

Retrieved 721 of 721 residues in 813 ms (Link to these results)

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