A0A087YRK8_POEFO Loading...

Leucine rich repeat and Ig domain containing 2

AlphaFold DB , UniProt , Accession A0A087YRK8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 613 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.6	Very low	37.1	Very low	232 Å²	232	168.8 Å²	168.8	100%	1.143	88%	0.879	S	S	*	*				0	89.8	0	-142.7	180	-67.2	0	0	105.1
2	V	29	Very low	37.2	Very low	115 Å²	115	162.3 Å²	162.3	70%	0.697	87%	0.869	S	S	*	*				107.4	123.6	97.9	161.6	0	0	0	0	107
3	D	34.8	Very low	37.9	Very low	148 Å²	148	160.1 Å²	160.1	79%	0.791	86%	0.864	S	S	*	*			trans	38.7	121.8	158.3	-58.1	-29.8	0	0	0	117.8
4	C	35.3	Very low	38.8	Very low	122 Å²	122	157.7 Å²	157.7	82%	0.824	86%	0.857	S	S	*	*				-176.1	118	62.8	-154.2	0	0	0	0	107.3
5	M	36.8	Very low	39.3	Very low	189 Å²	189	154.7 Å²	154.7	93%	0.931	85%	0.853	S	S	*	*	S	Bend	trans	178.6	54.2	152.7	-99.7	-172	96.7	0	0	110.6
6	N	40.6	Very low	39.8	Very low	163 Å²	163	152.3 Å²	152.3	87%	0.872	85%	0.848	S	S	*	*			trans	-150	71.6	170.6	-114.9	-5.9	0	0	0	110.7
7	K	41.9	Very low	40.2	Very low	206 Å²	206	156.9 Å²	156.9	90%	0.896	85%	0.85	S	S	*	*	S	Bend	trans	-171.5	46.2	159.5	-116.2	174.7	-172.9	-179.9	0	115.9
8	V	41.2	Very low	40.6	Very low	145 Å²	145	157.7 Å²	157.7	88%	0.879	85%	0.847	S	S	*	*	S	Bend	trans	-147.1	65.8	159.5	-168.3	0	0	0	0	110
9	M	35.4	Very low	41	Very low	182 Å²	182	153.6 Å²	153.6	90%	0.897	83%	0.83	S	S	*	*			trans	-160.6	46.1	161	-124	-165.9	166.2	0	0	112.3
10	L	43.8	Very low	41.5	Very low	162 Å²	162	154 Å²	154	85%	0.848	82%	0.824	S	S	*	*	S	Bend	trans	-123.2	20.7	172.5	-139.2	91.8	0	0	0	113.5
11	H	41.2	Very low	41.8	Very low	193 Å²	193	153 Å²	153	89%	0.894	82%	0.818	S	S	*	*	S	Bend	trans	-143.7	66	172.2	-89.6	-77.3	0	0	0	110.5
12	A	37.4	Very low	42.7	Very low	91 Å²	91	143.8 Å²	143.8	75%	0.752	78%	0.781	S	S	*	*			trans	-160.6	26.7	159.4	0	0	0	0	0	111.4
13	V	46.9	Very low	43.8	Very low	133 Å²	133	143.8 Å²	143.8	81%	0.806	78%	0.777	S	S	*	*			trans	-80.5	131.9	158.3	-177.1	0	0	0	0	104.8
14	V	50.9	Low	44.5	Very low	127 Å²	127	141.8 Å²	141.8	77%	0.77	77%	0.77	S	S	*	*	S	Bend	trans	86.5	79.8	-176.7	-162.6	0	0	0	0	114.6
15	S	46	Very low	44.9	Very low	113 Å²	113	141.2 Å²	141.2	79%	0.79	76%	0.758	S	S	*	*	S	Bend	trans	166.8	69.9	142.4	-179.1	0	0	0	0	111.2
16	C	47.5	Very low	45.4	Very low	115 Å²	115	136.1 Å²	136.1	78%	0.777	74%	0.737	S	S	*	*	S	Bend	trans	-168.3	3.3	157.3	-120.7	0	0	0	0	116.4
17	W	46	Very low	45.5	Very low	232 Å²	232	131.8 Å²	131.8	88%	0.879	73%	0.725	S	S	*	*	S	Bend	trans	-129	37.1	-179.5	-78.2	76.7	0	0	0	112.9
18	Q	47.7	Very low	45.4	Very low	170 Å²	170	125.6 Å²	125.6	79%	0.794	71%	0.711	S	S	*	*	S	Bend	trans	-111.9	0.6	177.4	-99	-167.6	-31	0	0	118.4
19	P	48.7	Very low	45.4	Very low	81 Å²	81	126.9 Å²	126.9	53%	0.526	71%	0.706	S	S	.	*	S	Bend	trans	-96.2	-16.3	171.3	33.1	-26.9	0	0	0	114.5
20	F	50.7	Low	45.8	Very low	161 Å²	161	123.8 Å²	123.8	71%	0.706	70%	0.697	S	S	*	*	H	α-helix	trans	-93.7	-23.2	-176.1	-80.4	-78.7	0	0	0	115.4
21	L	48.3	Very low	45.7	Very low	134 Å²	134	118.1 Å²	118.1	70%	0.702	68%	0.678	S	S	*	*	H	α-helix	trans	-79.9	-26.7	171.7	-120.2	90.8	0	0	0	112.6	L25	L21-L25 PolarHBondContact O-N 3.37Å
22	G	46.7	Very low	46.1	Very low	37 Å²	37	114.3 Å²	114.3	38%	0.381	67%	0.673	S	S	.	*	H	α-helix	trans	-71.5	-31.1	174.9	0	0	0	0	0	113.1	V26	G22-V26 VanDerWaalsContact O-CB 3.22Å; G22-V26 WeakPolarHBondContact O-CB 3.34Å; G22-V26 WeakPolarHBondContact O-CG2 3.46Å; G22-V26 PolarHBondContact O-N 3.49Å
23	L	51.1	Low	46.6	Very low	115 Å²	115	115.1 Å²	115.1	60%	0.602	67%	0.673	S	S	*	*	H	α-helix	trans	-78.2	-23.8	179.2	-99.5	154.1	0	0	0	113.8	A27	L23-A27 WeakPolarHBondContact O-CB 3.03Å; L23-A27 PolarHBondContact O-N 3.38Å
24	V	49.6	Very low	46.9	Very low	107 Å²	107	117.9 Å²	117.9	65%	0.648	68%	0.682	S	S	*	*	H	α-helix	trans	-85.1	-31.5	174.2	179.9	0	0	0	0	111.7	A28	V24-A28 VanDerWaalsContact O-CB 3.29Å; V24-A28 WeakPolarHBondContact O-CB 3.42Å; V24-A28 PolarHBondContact O-N 2.97Å
25	L	45.3	Very low	47.7	Very low	110 Å²	110	113.4 Å²	113.4	58%	0.576	66%	0.661	S	S	*	*	H	α-helix	trans	-75.9	-26.5	170.3	-97.8	153.2	0	0	0	113.1	L21 F29	L21-L25 PolarHBondContact O-N 3.37Å; L25-F29 PolarHBondContact O-N 2.89Å
26	V	45.8	Very low	49.5	Very low	81 Å²	81	110.3 Å²	110.3	49%	0.491	64%	0.639	S	S	.	*	H	α-helix	trans	-81.6	-34	169.2	174.5	0	0	0	0	111	G22 A28 F29 V30	G22-V26 VanDerWaalsContact O-CB 3.22Å; G22-V26 WeakPolarHBondContact O-CB 3.34Å; G22-V26 WeakPolarHBondContact O-CG2 3.46Å; G22-V26 PolarHBondContact O-N 3.49Å; V26-A28 VanDerWaalsContact C-N 3.31Å; V26-A28 PolarHBondContact O-N 3.48Å; V26-F29 CarbonylContact O-C 3.1Å; V26-F29 PolarHBondContact O-N 3.31Å; V26-F29 VanDerWaalsContact O-N 3.1Å; V26-V30 HydrophobicContact CG1-CG2 3.53Å; V26-V30 WeakPolarHBondContact O-CB 3.41Å; V26-V30 WeakPolarHBondContact O-CG2 3.29Å; V26-V30 PolarHBondContact O-N 2.88Å
27	A	42.6	Very low	51.5	Low	73 Å²	73	105.3 Å²	105.3	60%	0.603	61%	0.605	S	S	*	*	H	α-helix	trans	-71	-24	172	0	0	0	0	0	113.6	L23 F29	L23-A27 WeakPolarHBondContact O-CB 3.03Å; L23-A27 PolarHBondContact O-N 3.38Å; A27-F29 VanDerWaalsContact C-N 3.32Å
28	A	41.5	Very low	53.3	Low	75 Å²	75	100.3 Å²	100.3	62%	0.62	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-10.6	169.1	0	0	0	0	0	113.6	V24 V26	V24-A28 VanDerWaalsContact O-CB 3.29Å; V24-A28 WeakPolarHBondContact O-CB 3.42Å; V24-A28 PolarHBondContact O-N 2.97Å; V26-A28 VanDerWaalsContact C-N 3.31Å; V26-A28 PolarHBondContact O-N 3.48Å
29	F	41.4	Very low	55.2	Low	173 Å²	173	99.9 Å²	99.9	76%	0.759	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.5	-0.1	175.9	-94.2	-83.6	0	0	0	114.6	L25 V26 A27	L25-F29 PolarHBondContact O-N 2.89Å; V26-F29 CarbonylContact O-C 3.1Å; V26-F29 PolarHBondContact O-N 3.31Å; V26-F29 VanDerWaalsContact O-N 3.1Å; A27-F29 VanDerWaalsContact C-N 3.32Å
30	V	42.2	Very low	57.2	Low	116 Å²	116	96.7 Å²	96.7	70%	0.703	58%	0.576	S	S	*	*	S	Bend	trans	-107.5	2.9	178.6	174.5	0	0	0	0	112.5	V26	V26-V30 HydrophobicContact CG1-CG2 3.53Å; V26-V30 WeakPolarHBondContact O-CB 3.41Å; V26-V30 WeakPolarHBondContact O-CG2 3.29Å; V26-V30 PolarHBondContact O-N 2.88Å
31	G	43.2	Very low	59.2	Low	44 Å²	44	95.2 Å²	95.2	45%	0.454	57%	0.572	S	S	.	*	S	Bend	trans	-105.5	115	164.4	0	0	0	0	0	110.8
32	S	47.9	Very low	61.3	Low	112 Å²	112	91.2 Å²	91.2	78%	0.783	55%	0.554	S	S	*	*	S	Bend	trans	76.1	105.3	170.4	11.3	0	0	0	0	117.6
33	S	48.5	Very low	63.5	Low	108 Å²	108	91.5 Å²	91.5	76%	0.755	55%	0.55	S	S	*	*			trans	161.8	7.8	138.8	56.6	0	0	0	0	116.3	G35	S33-G35 PolarHBondContact O-N 3.31Å
34	L	54.3	Low	65.1	Low	192 Å²	192	90.3 Å²	90.3	100%	1.005	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	92.1	166.8	-88.2	104.8	0	0	0	110
35	G	66.9	Low	66.9	Low	32 Å²	32	94.2 Å²	94.2	33%	0.33	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	123.8	29.9	169.1	0	0	0	0	0	115.4	S33 G62 P64	S33-G35 PolarHBondContact O-N 3.31Å; G35-G62 CarbonylContact C-O 3.53Å; G35-P64 WeakPolarHBondContact O-CD 3.47Å; G35-P64 WeakPolarHBondContact O-CG 3.34Å
36	C	83.6	Confident	69	Low	48 Å²	48	92.8 Å²	92.8	32%	0.324	56%	0.564	S	S	.	*			trans	-105.9	132.4	162.2	-174.3	0	0	0	0	109.2	S38 C42	C36-S38 PolarHBondContact O-N 3.28Å; C36-C42 WeakPolarHBondContact CA-SG 3.33Å; C36-C42 HydrophobicContact CB-CB 3.69Å; C36-C42 WeakPolarHBondContact CB-SG 3.43Å; C36-C42 WeakPolarHBondContact SG-CB 3.37Å; C36-C42 PolarHBondContact SG-N 2.73Å; C36-C42 CovalentContact SG-SG 2.02Å; C36-C42 PolarHBondContact SG-SG 3.5Å
37	P	88.8	Confident	71.3	Confident	10 Å²	10	92.8 Å²	92.8	7%	0.065	56%	0.558	C	S	.	*			trans	-60	135.6	176.5	-21.3	32	0	0	0	110.9	R39 C40 P60 G62 I63	P37-R39 PolarHBondContact O-N 2.62Å; P37-C40 HydrophobicContact CB-CB 4.06Å; P37-C40 HydrophobicContact CG-CB 4.29Å; P37-C40 PolarHBondContact O-N 2.81Å; P37-P60 HydrophobicContact CB-CB 3.99Å; P37-P60 HydrophobicContact CB-CG 4.23Å; P37-P60 HydrophobicContact CG-CB 4.24Å; P37-P60 HydrophobicContact CG-CG 4.12Å; P37-G62 VanDerWaalsContact CD-O 3.28Å; P37-G62 WeakPolarHBondContact CD-O 3.38Å; P37-I63 HydrophobicContact CG-CG1 3.83Å
38	S	84.2	Confident	73.8	Confident	127 Å²	127	89.8 Å²	89.8	89%	0.888	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-21.2	-172.2	58.7	0	0	0	0	115.8	C36	C36-S38 PolarHBondContact O-N 3.28Å
39	R	87.3	Confident	76.4	Confident	161 Å²	161	86.3 Å²	86.3	61%	0.608	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-6	179.6	-64	-173.8	176.8	-176.6	2.1	113.8	P37 K54	P37-R39 PolarHBondContact O-N 2.62Å; R39-K54 HydrophobicContact CB-CB 4.47Å; R39-K54 HydrophobicContact CB-CG 4.46Å; R39-K54 WeakPolarHBondContact O-CD 3.27Å; R39-K54 WeakPolarHBondContact O-CE 3.2Å; R39-K54 PolarHBondContact O-NZ 2.71Å
40	C	92.3	Very high	79	Confident	14 Å²	14	80.6 Å²	80.6	10%	0.095	48%	0.483	C	S	.	.	S	Bend	trans	-108.2	161	-174.1	-59.7	0	0	0	0	111.7	P37 V49 V50 C51	P37-C40 HydrophobicContact CB-CB 4.06Å; P37-C40 HydrophobicContact CG-CB 4.29Å; P37-C40 PolarHBondContact O-N 2.81Å; C40-V49 HydrophobicContact CB-CG1 4.3Å; C40-V50 WeakPolarHBondContact CA-O 3.44Å; C40-C51 HydrophobicContact CB-CB 4.13Å; C40-C51 WeakPolarHBondContact CB-SG 3.33Å; C40-C51 WeakPolarHBondContact SG-CB 3.25Å; C40-C51 CovalentContact SG-SG 2.03Å; C40-C51 PolarHBondContact SG-SG 3.41Å
41	E	92.6	Very high	81.5	Confident	131 Å²	131	75 Å²	75	61%	0.612	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	117.7	177.1	-71.5	165.1	-143.9	0	0	107.9	V50 K54	E41-V50 PolarHBondContact N-O 3.11Å; E41-V50 PolarHBondContact O-N 3.39Å; E41-K54 IonicContact OE1-NZ 3.29Å
42	C	92.3	Very high	83.9	Confident	49 Å²	49	75.5 Å²	75.5	33%	0.331	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	136	-179.4	-51.5	0	0	0	0	110.7	C36 A48 V49	C36-C42 WeakPolarHBondContact CA-SG 3.33Å; C36-C42 HydrophobicContact CB-CB 3.69Å; C36-C42 WeakPolarHBondContact CB-SG 3.43Å; C36-C42 WeakPolarHBondContact SG-CB 3.37Å; C36-C42 PolarHBondContact SG-N 2.73Å; C36-C42 CovalentContact SG-SG 2.02Å; C36-C42 PolarHBondContact SG-SG 3.5Å; C42-A48 WeakPolarHBondContact CA-O 3.38Å; C42-V49 HydrophobicContact CB-CG2 4.34Å
43	S	91.9	Very high	86.1	Confident	44 Å²	44	77.9 Å²	77.9	31%	0.308	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	112.1	174.9	169.6	0	0	0	0	109.4	Q45 T46 K47 A48	S43-Q45 VanDerWaalsContact C-N 3.28Å; S43-Q45 PolarHBondContact O-N 2.91Å; S43-T46 WeakPolarHBondContact CB-OG1 3.47Å; S43-T46 PolarHBondContact OG-N 3.5Å; S43-T46 PolarHBondContact OG-OG1 3.2Å; S43-K47 VanDerWaalsContact O-CA 3.25Å; S43-K47 WeakPolarHBondContact O-CA 3.33Å; S43-K47 PolarHBondContact O-N 3.38Å; S43-A48 PolarHBondContact N-O 3.2Å; S43-A48 PolarHBondContact O-N 3.46Å; S43-A48 VanDerWaalsContact O-N 3.15Å
44	A	86.1	Confident	88.3	Confident	90 Å²	90	75.7 Å²	75.7	74%	0.744	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-28	178.4	0	0	0	0	0	112.8
45	Q	87.2	Confident	90.1	Very high	188 Å²	188	75.6 Å²	75.6	88%	0.879	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-46.3	-179.2	-66	179.9	-0.1	0	0	111.9	S43	S43-Q45 VanDerWaalsContact C-N 3.28Å; S43-Q45 PolarHBondContact O-N 2.91Å
46	T	89.4	Confident	91.2	Very high	81 Å²	81	74.8 Å²	74.8	50%	0.497	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-4.2	179.5	55.2	0	0	0	0	112.8	S43 A48	S43-T46 WeakPolarHBondContact CB-OG1 3.47Å; S43-T46 PolarHBondContact OG-N 3.5Å; S43-T46 PolarHBondContact OG-OG1 3.2Å; T46-A48 PolarHBondContact O-N 3.07Å; T46-A48 WeakPolarHBondContact OG1-CB 3.24Å
47	K	93.3	Very high	91.6	Very high	80 Å²	80	76.7 Å²	76.7	35%	0.348	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	39.5	-172.9	-56	-178.2	173.6	-166.6	0	111.5	S43 E66 R68 I69	S43-K47 VanDerWaalsContact O-CA 3.25Å; S43-K47 WeakPolarHBondContact O-CA 3.33Å; S43-K47 PolarHBondContact O-N 3.38Å; K47-E66 WeakPolarHBondContact CD-O 3.46Å; K47-R68 HydrophobicContact CB-CB 4.28Å; K47-R68 HydrophobicContact CB-CG 4.19Å; K47-R68 HydrophobicContact CD-CG 4.24Å; K47-R68 PolarHBondContact O-N 3.37Å; K47-I69 PolarHBondContact O-N 3.28Å
48	A	94.8	Very high	91.8	Very high	11 Å²	11	80.8 Å²	80.8	9%	0.091	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	139.6	-176.4	0	0	0	0	0	110.5	C42 S43 T46 I69	C42-A48 WeakPolarHBondContact CA-O 3.38Å; S43-A48 PolarHBondContact N-O 3.2Å; S43-A48 PolarHBondContact O-N 3.46Å; S43-A48 VanDerWaalsContact O-N 3.15Å; T46-A48 PolarHBondContact O-N 3.07Å; T46-A48 WeakPolarHBondContact OG1-CB 3.24Å; A48-I69 CarbonylContact C-O 3.27Å; A48-I69 VanDerWaalsContact CA-O 3.31Å; A48-I69 WeakPolarHBondContact CA-O 3.34Å; A48-I69 HydrophobicContact CB-CB 3.91Å; A48-I69 HydrophobicContact CB-CD1 4.5Å; A48-I69 HydrophobicContact CB-CG2 4.36Å
49	V	95.4	Very high	92.1	Very high	2 Å²	2	76.1 Å²	76.1	1%	0.012	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	115.2	175.3	178.7	0	0	0	0	108.4	C40 C42 I63 P64 T67 I69 L70 D71	C40-V49 HydrophobicContact CB-CG1 4.3Å; C42-V49 HydrophobicContact CB-CG2 4.34Å; V49-I63 HydrophobicContact CG2-CG2 4.29Å; V49-P64 HydrophobicContact CG2-CG 4.44Å; V49-T67 HydrophobicContact CB-CG2 4.19Å; V49-T67 HydrophobicContact CG2-CG2 3.78Å; V49-I69 PolarHBondContact N-O 3.4Å; V49-L70 HydrophobicContact CB-CD1 3.93Å; V49-L70 HydrophobicContact CG1-CD1 3.98Å; V49-D71 PolarHBondContact O-N 2.77Å
50	V	95.9	Very high	92.2	Very high	52 Å²	52	69.6 Å²	69.6	32%	0.315	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	116.9	-176.5	-178.7	0	0	0	0	110	C40 E41 H52 D71	C40-V50 WeakPolarHBondContact CA-O 3.44Å; E41-V50 PolarHBondContact N-O 3.11Å; E41-V50 PolarHBondContact O-N 3.39Å; V50-H52 HydrophobicContact CG1-CB 4.24Å; V50-D71 HydrophobicContact CG1-CB 4.4Å; V50-D71 HydrophobicContact CG2-CB 4.42Å
51	C	95	Very high	91.9	Very high	0 Å²	0	76.4 Å²	76.4	0%	0	40%	0.398	C	S	.	.			trans	-123.3	36.9	-173.6	-72.1	0	0	0	0	111.2	C40 K54 M56 D71 L72 N75	C40-C51 HydrophobicContact CB-CB 4.13Å; C40-C51 WeakPolarHBondContact CB-SG 3.33Å; C40-C51 WeakPolarHBondContact SG-CB 3.25Å; C40-C51 CovalentContact SG-SG 2.03Å; C40-C51 PolarHBondContact SG-SG 3.41Å; C51-K54 WeakPolarHBondContact O-CG 3.2Å; C51-M56 HydrophobicContact CB-CE 3.4Å; C51-D71 WeakPolarHBondContact CA-O 3.42Å; C51-D71 VanDerWaalsContact CB-O 3.24Å; C51-D71 WeakPolarHBondContact CB-O 3.47Å; C51-D71 PolarHBondContact N-O 2.9Å; C51-L72 HydrophobicContact CB-CD2 3.72Å; C51-N75 PolarHBondContact O-ND2 2.76Å
52	H	94	Very high	91.6	Very high	54 Å²	54	72.3 Å²	72.3	25%	0.25	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	133.1	-175	-168.3	70.3	0	0	0	113.7	V50 K54 S73 K74	V50-H52 HydrophobicContact CG1-CB 4.24Å; H52-K54 VanDerWaalsContact C-N 3.26Å; H52-K54 WeakPolarHBondContact O-CD 3.35Å; H52-K54 WeakPolarHBondContact O-CE 3.32Å; H52-K54 WeakPolarHBondContact O-CG 3.25Å; H52-K54 PolarHBondContact O-N 3.41Å; H52-S73 WeakPolarHBondContact CA-O 3.07Å; H52-S73 PolarHBondContact CE1-OG 3.38Å; H52-S73 PolarHBondContact ND1-OG 3.08Å; H52-K74 WeakPolarHBondContact CE1-CD 3.44Å; H52-K74 VanDerWaalsContact CE1-CE 3.41Å; H52-K74 WeakPolarHBondContact CE1-CE 3.43Å; H52-K74 PolarHBondContact CE1-NZ 2.84Å; H52-K74 VanDerWaalsContact CE1-NZ 3.27Å; H52-K74 PolarHBondContact NE2-NZ 2.91Å
53	R	94	Very high	91.6	Very high	162 Å²	162	70.6 Å²	70.6	61%	0.611	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	29.4	171.8	-70.8	175.1	173.7	162.8	-0.1	115.3	R55 S73 K74	R53-R55 VanDerWaalsContact C-N 3.33Å; R53-S73 PolarHBondContact N-O 2.94Å; R53-K74 VanDerWaalsContact CA-O 3.32Å; R53-K74 WeakPolarHBondContact CA-O 3.49Å; R53-K74 HydrophobicContact CG-CB 3.63Å; R53-K74 HydrophobicContact CG-CD 3.96Å; R53-K74 HydrophobicContact CG-CG 4.4Å
54	K	94.2	Very high	91.5	Very high	62 Å²	62	70 Å²	70	27%	0.27	37%	0.373	S	S	.	.			trans	-89.4	2.9	-177.7	-52.8	-58.7	176	155.7	0	113.9	R39 E41 C51 H52 M56 N75	R39-K54 HydrophobicContact CB-CB 4.47Å; R39-K54 HydrophobicContact CB-CG 4.46Å; R39-K54 WeakPolarHBondContact O-CD 3.27Å; R39-K54 WeakPolarHBondContact O-CE 3.2Å; R39-K54 PolarHBondContact O-NZ 2.71Å; E41-K54 IonicContact OE1-NZ 3.29Å; C51-K54 WeakPolarHBondContact O-CG 3.2Å; H52-K54 VanDerWaalsContact C-N 3.26Å; H52-K54 WeakPolarHBondContact O-CD 3.35Å; H52-K54 WeakPolarHBondContact O-CE 3.32Å; H52-K54 WeakPolarHBondContact O-CG 3.25Å; H52-K54 PolarHBondContact O-N 3.41Å; K54-M56 HydrophobicContact CB-CE 3.87Å; K54-M56 HydrophobicContact CB-CG 3.92Å; K54-M56 HydrophobicContact CB-SD 4.24Å; K54-M56 HydrophobicContact CG-CE 4.31Å; K54-M56 PolarHBondContact O-N 3.34Å; K54-N75 WeakPolarHBondContact CA-OD1 3.49Å; K54-N75 PolarHBondContact N-OD1 2.81Å
55	R	93.3	Very high	91.7	Very high	190 Å²	190	70 Å²	70	72%	0.717	36%	0.364	S	S	*	.			trans	57.8	33.1	178.6	-57.4	178.4	175.8	-177.2	-0.6	113.1	R53 N75 K76	R53-R55 VanDerWaalsContact C-N 3.33Å; R55-N75 PolarHBondContact N-OD1 2.92Å; R55-K76 HydrophobicContact CB-CD 4.39Å
56	M	90.6	Very high	91.8	Very high	15 Å²	15	66.2 Å²	66.2	7%	0.074	35%	0.346	C	S	.	.			trans	-77.2	129.7	-175.4	-64.3	-172.2	-75.2	0	0	111.5	C51 K54 P60 L72 N75 K76 L77	C51-M56 HydrophobicContact CB-CE 3.4Å; K54-M56 HydrophobicContact CB-CE 3.87Å; K54-M56 HydrophobicContact CB-CG 3.92Å; K54-M56 HydrophobicContact CB-SD 4.24Å; K54-M56 HydrophobicContact CG-CE 4.31Å; K54-M56 PolarHBondContact O-N 3.34Å; M56-P60 HydrophobicContact CE-CG 4.08Å; M56-P60 HydrophobicContact SD-CB 3.88Å; M56-P60 HydrophobicContact SD-CG 3.8Å; M56-L72 HydrophobicContact CE-CD2 4.07Å; M56-N75 HydrophobicContact CB-CB 4.37Å; M56-N75 PolarHBondContact N-OD1 2.72Å; M56-K76 CarbonylContact O-C 3.5Å; M56-K76 WeakPolarHBondContact O-CA 3.27Å; M56-K76 WeakPolarHBondContact O-CB 3.24Å; M56-K76 PolarHBondContact O-N 3.5Å; M56-L77 PolarHBondContact O-N 2.89Å
57	P	91.8	Very high	92	Very high	87 Å²	87	62.4 Å²	62.4	57%	0.565	32%	0.323	S	S	*	.	S	Bend	trans	-81.8	-23.1	177.7	32.9	-34.4	0	0	0	113
58	T	91.9	Very high	92.1	Very high	97 Å²	97	63.8 Å²	63.8	60%	0.595	33%	0.326	S	S	*	.	S	Bend	trans	-134.2	165.1	-179.7	57.7	0	0	0	0	109.5
59	I	91.6	Very high	92.2	Very high	29 Å²	29	65.8 Å²	65.8	15%	0.149	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-66.2	131	173	-62.9	164.4	0	0	0	107.9	I63 L72 L77 D84 F85	I59-I63 HydrophobicContact CG2-CD1 3.83Å; I59-L72 HydrophobicContact CG1-CD1 4.06Å; I59-L72 HydrophobicContact CG2-CD1 4.26Å; I59-L77 HydrophobicContact CG1-CD1 4.41Å; I59-L77 HydrophobicContact CG1-CD2 4.27Å; I59-D84 HydrophobicContact CD1-CB 3.56Å; I59-F85 HydrophobicContact CD1-CD1 4.49Å; I59-F85 HydrophobicContact CD1-CE1 3.76Å; I59-F85 HydrophobicContact CD1-CE2 4.26Å; I59-F85 HydrophobicContact CD1-CZ 3.62Å
60	P	89.2	Confident	92.3	Very high	23 Å²	23	65.7 Å²	65.7	15%	0.149	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-74	140.3	-175.1	28.8	-34.3	0	0	0	112	P37 M56 I63 L72	P37-P60 HydrophobicContact CB-CB 3.99Å; P37-P60 HydrophobicContact CB-CG 4.23Å; P37-P60 HydrophobicContact CG-CB 4.24Å; P37-P60 HydrophobicContact CG-CG 4.12Å; M56-P60 HydrophobicContact CE-CG 4.08Å; M56-P60 HydrophobicContact SD-CB 3.88Å; M56-P60 HydrophobicContact SD-CG 3.8Å; P60-I63 HydrophobicContact CG-CD1 4.14Å; P60-I63 HydrophobicContact CG-CG1 4.35Å; P60-I63 WeakPolarHBondContact O-CD1 3.47Å; P60-I63 WeakPolarHBondContact O-CG1 2.95Å; P60-L72 HydrophobicContact CG-CD2 4.34Å
61	D	86.4	Confident	92.3	Very high	157 Å²	157	64.6 Å²	64.6	84%	0.84	33%	0.327	S	S	*	.	S	Bend	trans	-67.6	154	169.8	-62.2	-44.7	0	0	0	111.4
62	G	86.4	Confident	92.4	Very high	45 Å²	45	64.7 Å²	64.7	46%	0.464	33%	0.327	S	S	.	.			trans	80	30.3	176.5	0	0	0	0	0	114	G35 P37	G35-G62 CarbonylContact C-O 3.53Å; P37-G62 VanDerWaalsContact CD-O 3.28Å; P37-G62 WeakPolarHBondContact CD-O 3.38Å
63	I	90.6	Very high	92.5	Very high	13 Å²	13	62.3 Å²	62.3	7%	0.067	32%	0.317	C	S	.	.			trans	-75.8	135.8	162.4	-63.4	168.1	0	0	0	108.2	P37 V49 I59 P60 T67 L70 F88	P37-I63 HydrophobicContact CG-CG1 3.83Å; V49-I63 HydrophobicContact CG2-CG2 4.29Å; I59-I63 HydrophobicContact CG2-CD1 3.83Å; P60-I63 HydrophobicContact CG-CD1 4.14Å; P60-I63 HydrophobicContact CG-CG1 4.35Å; P60-I63 WeakPolarHBondContact O-CD1 3.47Å; P60-I63 WeakPolarHBondContact O-CG1 2.95Å; I63-T67 HydrophobicContact CG2-CG2 4.45Å; I63-L70 HydrophobicContact CD1-CD1 4.04Å; I63-L70 HydrophobicContact CD1-CD2 4.3Å; I63-F88 HydrophobicContact CB-CE1 3.73Å; I63-F88 HydrophobicContact CB-CZ 3.73Å; I63-F88 HydrophobicContact CD1-CZ 4.29Å; I63-F88 HydrophobicContact CG2-CD1 4.12Å; I63-F88 HydrophobicContact CG2-CE1 3.54Å; I63-F88 HydrophobicContact CG2-CZ 3.89Å
64	P	90.7	Very high	92.6	Very high	31 Å²	31	59 Å²	59	20%	0.201	31%	0.307	C	S	.	.			trans	-62	139.1	176.4	-17.1	28.3	0	0	0	112.2	G35 V49 E66 T67	G35-P64 WeakPolarHBondContact O-CD 3.47Å; G35-P64 WeakPolarHBondContact O-CG 3.34Å; V49-P64 HydrophobicContact CG2-CG 4.44Å; P64-E66 HydrophobicContact CB-CG 4.33Å; P64-E66 PolarHBondContact O-N 2.9Å; P64-T67 WeakPolarHBondContact CD-OG1 3.2Å; P64-T67 VanDerWaalsContact O-CB 3.29Å; P64-T67 WeakPolarHBondContact O-CB 3.43Å; P64-T67 PolarHBondContact O-N 2.82Å; P64-T67 PolarHBondContact O-OG1 2.96Å
65	T	89.4	Confident	92.7	Very high	90 Å²	90	56.5 Å²	56.5	55%	0.552	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-25.9	178.9	45.9	0	0	0	0	113.5	T67	T65-T67 PolarHBondContact O-N 2.7Å
66	E	90.9	Very high	92.9	Very high	109 Å²	109	52.5 Å²	52.5	51%	0.509	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	6.3	176.9	62.2	-91.6	-155.6	0	0	114.2	K47 P64 R68	K47-E66 WeakPolarHBondContact CD-O 3.46Å; P64-E66 HydrophobicContact CB-CG 4.33Å; P64-E66 PolarHBondContact O-N 2.9Å; E66-R68 PolarHBondContact O-N 2.8Å
67	T	93.3	Very high	93.1	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.012	28%	0.283	C	S	.	.			trans	-59.5	133.2	179.4	-59.9	0	0	0	0	111.2	V49 I63 P64 T65 I69 L70 L91	V49-T67 HydrophobicContact CB-CG2 4.19Å; V49-T67 HydrophobicContact CG2-CG2 3.78Å; I63-T67 HydrophobicContact CG2-CG2 4.45Å; P64-T67 WeakPolarHBondContact CD-OG1 3.2Å; P64-T67 VanDerWaalsContact O-CB 3.29Å; P64-T67 WeakPolarHBondContact O-CB 3.43Å; P64-T67 PolarHBondContact O-N 2.82Å; P64-T67 PolarHBondContact O-OG1 2.96Å; T65-T67 PolarHBondContact O-N 2.7Å; T67-I69 VanDerWaalsContact CG2-O 3.32Å; T67-I69 WeakPolarHBondContact CG2-O 3.45Å; T67-L70 HydrophobicContact CG2-CB 4.29Å; T67-L91 HydrophobicContact CG2-CD1 4.13Å
68	R	95.3	Very high	93.3	Very high	109 Å²	109	51.6 Å²	51.6	41%	0.411	28%	0.278	S	S	.	.			trans	-106.5	-36.7	175.6	-70.9	-176.1	172.9	-171.8	-2.8	112.7	K47 E66 E92 E93	K47-R68 HydrophobicContact CB-CB 4.28Å; K47-R68 HydrophobicContact CB-CG 4.19Å; K47-R68 HydrophobicContact CD-CG 4.24Å; K47-R68 PolarHBondContact O-N 3.37Å; E66-R68 PolarHBondContact O-N 2.8Å; R68-E92 HydrophobicContact CB-CG 4.5Å; R68-E92 WeakPolarHBondContact CD-OE1 3.21Å; R68-E92 IonicContact CZ-OE1 3.64Å; R68-E92 IonicContact NE-OE1 3.74Å; R68-E92 PolarHBondContact NE-OE1 3.2Å; R68-E92 IonicContact NH1-OE1 3.34Å; R68-E92 PolarHBondContact O-N 3.38Å; R68-E93 PolarHBondContact O-N 3.05Å
69	I	96.5	Very high	93.4	Very high	52 Å²	52	51.3 Å²	51.3	27%	0.267	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	119.7	-178.2	-57	173.9	0	0	0	107.6	K47 A48 V49 T67 E93	K47-I69 PolarHBondContact O-N 3.28Å; A48-I69 CarbonylContact C-O 3.27Å; A48-I69 VanDerWaalsContact CA-O 3.31Å; A48-I69 WeakPolarHBondContact CA-O 3.34Å; A48-I69 HydrophobicContact CB-CB 3.91Å; A48-I69 HydrophobicContact CB-CD1 4.5Å; A48-I69 HydrophobicContact CB-CG2 4.36Å; V49-I69 PolarHBondContact N-O 3.4Å; T67-I69 VanDerWaalsContact CG2-O 3.32Å; T67-I69 WeakPolarHBondContact CG2-O 3.45Å; I69-E93 HydrophobicContact CB-CB 4.5Å; I69-E93 HydrophobicContact CG1-CB 4.23Å; I69-E93 HydrophobicContact CG1-CG 4.45Å; I69-E93 HydrophobicContact CG2-CB 4.22Å
70	L	96.2	Very high	93.6	Very high	1 Å²	1	50 Å²	50	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	110.6	178.4	179.6	60.4	0	0	0	110	V49 I63 T67 L72 F85 L91 E93 L94 D95	V49-L70 HydrophobicContact CB-CD1 3.93Å; V49-L70 HydrophobicContact CG1-CD1 3.98Å; I63-L70 HydrophobicContact CD1-CD1 4.04Å; I63-L70 HydrophobicContact CD1-CD2 4.3Å; T67-L70 HydrophobicContact CG2-CB 4.29Å; L70-L72 HydrophobicContact CD1-CD1 4.29Å; L70-L72 HydrophobicContact CD1-CD2 4.41Å; L70-L72 HydrophobicContact CD1-CG 4.01Å; L70-L72 HydrophobicContact CD2-CD1 3.84Å; L70-L72 HydrophobicContact CD2-CG 4.41Å; L70-L72 HydrophobicContact CG-CD1 3.95Å; L70-L72 HydrophobicContact CG-CG 3.98Å; L70-F85 HydrophobicContact CD2-CD1 4.44Å; L70-F85 HydrophobicContact CD2-CE1 4.07Å; L70-L91 HydrophobicContact CB-CD1 3.7Å; L70-L91 HydrophobicContact CB-CD2 4.46Å; L70-E93 PolarHBondContact N-O 2.83Å; L70-L94 HydrophobicContact CB-CD1 4.11Å; L70-L94 HydrophobicContact CD2-CD1 4.01Å; L70-L94 HydrophobicContact CG-CD1 4.08Å; L70-L94 WeakPolarHBondContact O-CA 3.29Å; L70-D95 PolarHBondContact O-N 3.34Å
71	D	96.9	Very high	93.8	Very high	29 Å²	29	51.2 Å²	51.2	16%	0.155	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	106.4	174.5	173.8	7.3	0	0	0	109.7	V49 V50 C51 S73 D95	V49-D71 PolarHBondContact O-N 2.77Å; V50-D71 HydrophobicContact CG1-CB 4.4Å; V50-D71 HydrophobicContact CG2-CB 4.42Å; C51-D71 WeakPolarHBondContact CA-O 3.42Å; C51-D71 VanDerWaalsContact CB-O 3.24Å; C51-D71 WeakPolarHBondContact CB-O 3.47Å; C51-D71 PolarHBondContact N-O 2.9Å; D71-S73 WeakPolarHBondContact OD1-CA 3.43Å; D71-S73 WeakPolarHBondContact OD1-CB 3.28Å; D71-S73 PolarHBondContact OD1-N 2.97Å; D71-S73 PolarHBondContact OD1-OG 2.83Å; D71-D95 HydrophobicContact CB-CB 4.41Å
72	L	96.2	Very high	94	Very high	2 Å²	2	46 Å²	46	1%	0.01	24%	0.244	C	C	.	.			trans	-109.3	23.6	174.1	-70.6	167	0	0	0	111.4	C51 M56 I59 P60 L70 N75 L77 F85 D95 L96 N99	C51-L72 HydrophobicContact CB-CD2 3.72Å; M56-L72 HydrophobicContact CE-CD2 4.07Å; I59-L72 HydrophobicContact CG1-CD1 4.06Å; I59-L72 HydrophobicContact CG2-CD1 4.26Å; P60-L72 HydrophobicContact CG-CD2 4.34Å; L70-L72 HydrophobicContact CD1-CD1 4.29Å; L70-L72 HydrophobicContact CD1-CD2 4.41Å; L70-L72 HydrophobicContact CD1-CG 4.01Å; L70-L72 HydrophobicContact CD2-CD1 3.84Å; L70-L72 HydrophobicContact CD2-CG 4.41Å; L70-L72 HydrophobicContact CG-CD1 3.95Å; L70-L72 HydrophobicContact CG-CG 3.98Å; L72-N75 VanDerWaalsContact C-ND2 3.34Å; L72-N75 PolarHBondContact O-ND2 2.76Å; L72-L77 HydrophobicContact CB-CD1 4.32Å; L72-F85 HydrophobicContact CD1-CE1 4.47Å; L72-D95 CarbonylContact C-O 3.19Å; L72-D95 WeakPolarHBondContact CA-O 3.44Å; L72-D95 PolarHBondContact N-O 2.9Å; L72-L96 HydrophobicContact CB-CD2 3.89Å; L72-L96 HydrophobicContact CD1-CD2 3.98Å; L72-N99 PolarHBondContact O-ND2 3.11Å
73	S	96.9	Very high	94.1	Very high	4 Å²	4	49.8 Å²	49.8	3%	0.028	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	153.4	-175.1	66.9	0	0	0	0	113.8	H52 R53 D71 N75 D95 S97	H52-S73 WeakPolarHBondContact CA-O 3.07Å; H52-S73 PolarHBondContact CE1-OG 3.38Å; H52-S73 PolarHBondContact ND1-OG 3.08Å; R53-S73 PolarHBondContact N-O 2.94Å; D71-S73 WeakPolarHBondContact OD1-CA 3.43Å; D71-S73 WeakPolarHBondContact OD1-CB 3.28Å; D71-S73 PolarHBondContact OD1-N 2.97Å; D71-S73 PolarHBondContact OD1-OG 2.83Å; S73-N75 VanDerWaalsContact C-N 3.31Å; S73-N75 PolarHBondContact O-N 2.81Å; S73-N75 PolarHBondContact O-ND2 3.16Å; S73-D95 PolarHBondContact N-O 2.85Å; S73-S97 CarbonylContact C-O 3.14Å; S73-S97 WeakPolarHBondContact CA-O 3.3Å; S73-S97 WeakPolarHBondContact CB-O 3.21Å; S73-S97 WeakPolarHBondContact CB-OG 3.19Å
74	K	96.4	Very high	94.1	Very high	93 Å²	93	51.4 Å²	51.4	40%	0.404	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	40.4	179.2	-56.4	-170	-164.7	145.4	0	113.6	H52 R53 S97 G98	H52-K74 WeakPolarHBondContact CE1-CD 3.44Å; H52-K74 VanDerWaalsContact CE1-CE 3.41Å; H52-K74 WeakPolarHBondContact CE1-CE 3.43Å; H52-K74 PolarHBondContact CE1-NZ 2.84Å; H52-K74 VanDerWaalsContact CE1-NZ 3.27Å; H52-K74 PolarHBondContact NE2-NZ 2.91Å; R53-K74 VanDerWaalsContact CA-O 3.32Å; R53-K74 WeakPolarHBondContact CA-O 3.49Å; R53-K74 HydrophobicContact CG-CB 3.63Å; R53-K74 HydrophobicContact CG-CD 3.96Å; R53-K74 HydrophobicContact CG-CG 4.4Å; K74-S97 PolarHBondContact N-O 2.87Å; K74-G98 VanDerWaalsContact CA-O 3.31Å; K74-G98 WeakPolarHBondContact CA-O 3.46Å
75	N	96.2	Very high	94.1	Very high	9 Å²	9	50 Å²	50	5%	0.048	25%	0.253	C	S	.	.	S	Bend	trans	-103.7	-155.9	173.1	-76.6	-62.5	0	0	0	111.1	C51 K54 R55 M56 L72 S73 N99	C51-N75 PolarHBondContact O-ND2 2.76Å; K54-N75 WeakPolarHBondContact CA-OD1 3.49Å; K54-N75 PolarHBondContact N-OD1 2.81Å; R55-N75 PolarHBondContact N-OD1 2.92Å; M56-N75 HydrophobicContact CB-CB 4.37Å; M56-N75 PolarHBondContact N-OD1 2.72Å; L72-N75 VanDerWaalsContact C-ND2 3.34Å; L72-N75 PolarHBondContact O-ND2 2.76Å; S73-N75 VanDerWaalsContact C-N 3.31Å; S73-N75 PolarHBondContact O-N 2.81Å; S73-N75 PolarHBondContact O-ND2 3.16Å; N75-N99 WeakPolarHBondContact CA-OD1 3.49Å; N75-N99 WeakPolarHBondContact CB-OD1 3.47Å; N75-N99 PolarHBondContact N-OD1 2.92Å; N75-N99 PolarHBondContact O-OD1 2.92Å
76	K	96.6	Very high	94.2	Very high	106 Å²	106	50 Å²	50	46%	0.461	25%	0.249	S	C	.	.			trans	-126	27.7	-177.6	-63.5	-174.6	174.7	-172.5	0	111.6	R55 M56 N99 L100	R55-K76 HydrophobicContact CB-CD 4.39Å; M56-K76 CarbonylContact O-C 3.5Å; M56-K76 WeakPolarHBondContact O-CA 3.27Å; M56-K76 WeakPolarHBondContact O-CB 3.24Å; M56-K76 PolarHBondContact O-N 3.5Å; K76-N99 PolarHBondContact N-OD1 2.85Å; K76-L100 HydrophobicContact CB-CD1 4.24Å; K76-L100 HydrophobicContact CG-CD1 4.46Å
77	L	96	Very high	94.1	Very high	8 Å²	8	50 Å²	50	4%	0.042	25%	0.252	C	S	.	.			trans	-61.8	136.8	176.5	-58.2	176.2	0	0	0	109.5	M56 I59 L72 L96 N99 L100 I101	M56-L77 PolarHBondContact O-N 2.89Å; I59-L77 HydrophobicContact CG1-CD1 4.41Å; I59-L77 HydrophobicContact CG1-CD2 4.27Å; L72-L77 HydrophobicContact CB-CD1 4.32Å; L77-L96 HydrophobicContact CD1-CD2 3.68Å; L77-N99 HydrophobicContact CB-CB 4.11Å; L77-N99 WeakPolarHBondContact CB-OD1 3.38Å; L77-N99 WeakPolarHBondContact CG-OD1 3.44Å; L77-N99 PolarHBondContact N-OD1 3.12Å; L77-N99 VanDerWaalsContact N-OD1 3.09Å; L77-L100 CarbonylContact O-C 3.55Å; L77-L100 WeakPolarHBondContact O-CA 3.34Å; L77-L100 WeakPolarHBondContact O-CB 3.32Å; L77-L100 PolarHBondContact O-N 2.84Å; L77-I101 HydrophobicContact CB-CD1 4.4Å; L77-I101 HydrophobicContact CB-CG1 4.04Å; L77-I101 PolarHBondContact O-N 3.47Å; L77-I101 VanDerWaalsContact O-N 3.1Å
78	T	95.2	Very high	94	Very high	75 Å²	75	50.6 Å²	50.6	46%	0.46	26%	0.255	S	S	.	.			trans	-113.3	-26	-174	53.8	0	0	0	0	113.9	L100 I101 S102	T78-L100 HydrophobicContact CG2-CB 4.34Å; T78-I101 WeakPolarHBondContact O-CA 3.32Å; T78-S102 PolarHBondContact O-N 2.78Å; T78-S102 PolarHBondContact O-OG 2.8Å
79	M	94.6	Very high	93.8	Very high	90 Å²	90	48.7 Å²	48.7	44%	0.443	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	164.9	177	67.1	-167.9	-54	0	0	110.2	N81 Y103	M79-N81 WeakPolarHBondContact CE-OD1 3.49Å; M79-Y103 WeakPolarHBondContact CA-O 3.34Å
80	I	95	Very high	93.6	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.015	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	128.8	173.9	-51.9	175.3	0	0	0	108.6	D84 F85 L96 I101 Y103 V104 E105 A108 F109 L120	I80-D84 WeakPolarHBondContact CA-OD2 3.26Å; I80-D84 HydrophobicContact CG2-CB 4.47Å; I80-F85 HydrophobicContact CG2-CD2 4.19Å; I80-F85 HydrophobicContact CG2-CE2 3.58Å; I80-L96 HydrophobicContact CD1-CD1 3.58Å; I80-I101 HydrophobicContact CD1-CD1 4.03Å; I80-I101 HydrophobicContact CD1-CG2 4.4Å; I80-I101 HydrophobicContact CG1-CD1 4.19Å; I80-I101 HydrophobicContact CG1-CG1 4.47Å; I80-I101 HydrophobicContact CG1-CG2 4.22Å; I80-Y103 PolarHBondContact N-O 2.92Å; I80-V104 HydrophobicContact CB-CG1 4.27Å; I80-V104 HydrophobicContact CD1-CG1 4.43Å; I80-V104 HydrophobicContact CD1-CG2 3.98Å; I80-V104 HydrophobicContact CG1-CG2 4.41Å; I80-E105 PolarHBondContact O-N 2.81Å; I80-A108 HydrophobicContact CB-CB 4.43Å; I80-A108 HydrophobicContact CG2-CB 3.77Å; I80-F109 HydrophobicContact CD1-CE1 4.2Å; I80-F109 HydrophobicContact CD1-CZ 3.82Å; I80-F109 HydrophobicContact CG2-CE1 4.32Å; I80-L120 HydrophobicContact CD1-CD2 4.05Å
81	N	93.7	Very high	93.5	Very high	48 Å²	48	47.3 Å²	47.3	26%	0.257	26%	0.255	S	S	.	.			trans	-109	160.2	-178.6	-51.9	-49.2	0	0	0	111.5	M79 D83 D84	M79-N81 WeakPolarHBondContact CE-OD1 3.49Å; N81-D83 PolarHBondContact O-N 2.79Å; N81-D84 PolarHBondContact N-OD2 3.47Å; N81-D84 WeakPolarHBondContact O-CB 3.35Å; N81-D84 PolarHBondContact O-N 3.43Å
82	P	91.3	Very high	93.5	Very high	48 Å²	48	48.5 Å²	48.5	31%	0.312	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-32.2	175.8	-27.8	37	0	0	0	115.2	D84 E105	P82-D84 VanDerWaalsContact C-N 3.34Å; P82-E105 WeakPolarHBondContact CD-OE2 2.93Å; P82-E105 HydrophobicContact CG-CB 4.29Å
83	D	88	Confident	93.5	Very high	124 Å²	124	52.8 Å²	52.8	66%	0.663	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-14.3	-175.9	-61.5	-35.1	0	0	0	113.3	N81 F85 I86	N81-D83 PolarHBondContact O-N 2.79Å; D83-F85 VanDerWaalsContact C-N 3.31Å; D83-F85 PolarHBondContact O-N 3.29Å; D83-I86 WeakPolarHBondContact O-CG2 3.44Å
84	D	90.4	Very high	93.5	Very high	46 Å²	46	52.7 Å²	52.7	25%	0.246	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-33.6	-169.8	-77.8	-9.3	0	0	0	113.4	I59 I80 N81 P82	I59-D84 HydrophobicContact CD1-CB 3.56Å; I80-D84 WeakPolarHBondContact CA-OD2 3.26Å; I80-D84 HydrophobicContact CG2-CB 4.47Å; N81-D84 PolarHBondContact N-OD2 3.47Å; N81-D84 WeakPolarHBondContact O-CB 3.35Å; N81-D84 PolarHBondContact O-N 3.43Å; P82-D84 VanDerWaalsContact C-N 3.34Å
85	F	92	Very high	93.6	Very high	1 Å²	1	50.5 Å²	50.5	0%	0.004	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	9.9	-174.3	-57.7	-69.7	0	0	0	114.7	I59 L70 L72 I80 D83 N87 F88 L94 L96 F109 L112	I59-F85 HydrophobicContact CD1-CD1 4.49Å; I59-F85 HydrophobicContact CD1-CE1 3.76Å; I59-F85 HydrophobicContact CD1-CE2 4.26Å; I59-F85 HydrophobicContact CD1-CZ 3.62Å; L70-F85 HydrophobicContact CD2-CD1 4.44Å; L70-F85 HydrophobicContact CD2-CE1 4.07Å; L72-F85 HydrophobicContact CD1-CE1 4.47Å; I80-F85 HydrophobicContact CG2-CD2 4.19Å; I80-F85 HydrophobicContact CG2-CE2 3.58Å; D83-F85 VanDerWaalsContact C-N 3.31Å; D83-F85 PolarHBondContact O-N 3.29Å; F85-N87 PolarHBondContact O-N 3.26Å; F85-N87 VanDerWaalsContact O-N 3.15Å; F85-F88 HydrophobicContact CD1-CD2 4.29Å; F85-F88 PolarHBondContact O-N 3.26Å; F85-F88 VanDerWaalsContact O-N 3.11Å; F85-L94 HydrophobicContact CE1-CD1 4.04Å; F85-L94 HydrophobicContact CE1-CD2 4.08Å; F85-L94 HydrophobicContact CE2-CD2 4.07Å; F85-L94 HydrophobicContact CZ-CD1 4.26Å; F85-L94 HydrophobicContact CZ-CD2 3.85Å; F85-L96 HydrophobicContact CE2-CD1 4.47Å; F85-L96 HydrophobicContact CZ-CD1 4.13Å; F85-L96 HydrophobicContact CZ-CD2 4.33Å; F85-F109 HydrophobicContact CD2-CD1 4.15Å; F85-F109 HydrophobicContact CD2-CE1 4.22Å; F85-F109 HydrophobicContact CE2-CD1 4.31Å; F85-F109 AromaticContact CE2-CE1 3.92Å; F85-F109 HydrophobicContact CE2-CE1 3.92Å; F85-L112 HydrophobicContact CB-CD1 3.82Å; F85-L112 HydrophobicContact CB-CD2 4.04Å; F85-L112 HydrophobicContact CB-CG 4.21Å; F85-L112 HydrophobicContact CD2-CD1 4.34Å; F85-L112 HydrophobicContact CG-CD1 4.11Å
86	I	89.8	Confident	93.7	Very high	92 Å²	92	50.1 Å²	50.1	47%	0.472	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-29.2	-174.8	-161.1	166.6	0	0	0	113.2	D83 F88 A111	D83-I86 WeakPolarHBondContact O-CG2 3.44Å; I86-F88 VanDerWaalsContact C-N 3.3Å; I86-F88 PolarHBondContact O-N 2.86Å; I86-A111 HydrophobicContact CG1-CB 4.46Å
87	N	89	Confident	93.7	Very high	107 Å²	107	46 Å²	46	57%	0.572	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-2.5	-177.7	-64.9	-38.2	0	0	0	113.9	F85 P89	F85-N87 PolarHBondContact O-N 3.26Å; F85-N87 VanDerWaalsContact O-N 3.15Å; N87-P89 WeakPolarHBondContact O-CD 3.04Å
88	F	91.1	Very high	93.7	Very high	16 Å²	16	46.9 Å²	46.9	7%	0.07	27%	0.265	C	S	.	.			trans	-122.8	55.4	-174.5	-43.1	-66.8	0	0	0	112.8	I63 F85 I86 G90 L91 L112	I63-F88 HydrophobicContact CB-CE1 3.73Å; I63-F88 HydrophobicContact CB-CZ 3.73Å; I63-F88 HydrophobicContact CD1-CZ 4.29Å; I63-F88 HydrophobicContact CG2-CD1 4.12Å; I63-F88 HydrophobicContact CG2-CE1 3.54Å; I63-F88 HydrophobicContact CG2-CZ 3.89Å; F85-F88 HydrophobicContact CD1-CD2 4.29Å; F85-F88 PolarHBondContact O-N 3.26Å; F85-F88 VanDerWaalsContact O-N 3.11Å; I86-F88 VanDerWaalsContact C-N 3.3Å; I86-F88 PolarHBondContact O-N 2.86Å; F88-G90 PolarHBondContact O-N 3.24Å; F88-G90 VanDerWaalsContact O-N 3.09Å; F88-L91 WeakPolarHBondContact O-CB 3.4Å; F88-L91 PolarHBondContact O-N 3.35Å; F88-L112 WeakPolarHBondContact O-CD2 2.95Å
89	P	90.9	Very high	93.8	Very high	68 Å²	68	43.6 Å²	43.6	44%	0.442	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-17.1	-176.3	29.2	-36.8	0	0	0	113.8	N87 L91 A111	N87-P89 WeakPolarHBondContact O-CD 3.04Å; P89-L91 VanDerWaalsContact C-N 3.32Å; P89-A111 WeakPolarHBondContact CA-O 2.98Å
90	G	92.3	Very high	93.9	Very high	24 Å²	24	42.1 Å²	42.1	25%	0.247	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	5.4	178.2	0	0	0	0	0	115.1	F88 E92	F88-G90 PolarHBondContact O-N 3.24Å; F88-G90 VanDerWaalsContact O-N 3.09Å; G90-E92 PolarHBondContact O-N 3.19Å
91	L	95.4	Very high	94	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.237	C	C	.	.			trans	-67.3	130.3	-177.2	-152.5	82.5	0	0	0	111.5	T67 L70 F88 P89 L94 L112 N114 M115	T67-L91 HydrophobicContact CG2-CD1 4.13Å; L70-L91 HydrophobicContact CB-CD1 3.7Å; L70-L91 HydrophobicContact CB-CD2 4.46Å; F88-L91 WeakPolarHBondContact O-CB 3.4Å; F88-L91 PolarHBondContact O-N 3.35Å; P89-L91 VanDerWaalsContact C-N 3.32Å; L91-L94 HydrophobicContact CD2-CB 3.68Å; L91-L94 HydrophobicContact CD2-CD1 4.07Å; L91-L94 HydrophobicContact CD2-CD2 4.11Å; L91-L94 HydrophobicContact CD2-CG 4.16Å; L91-L112 HydrophobicContact CB-CD2 3.95Å; L91-L112 HydrophobicContact CD2-CD1 4.4Å; L91-L112 HydrophobicContact CD2-CD2 4.48Å; L91-N114 CarbonylContact O-C 2.99Å; L91-N114 VanDerWaalsContact O-C 3.27Å; L91-M115 WeakPolarHBondContact O-CA 3.41Å; L91-M115 PolarHBondContact O-N 3.03Å
92	E	96.1	Very high	94.1	Very high	54 Å²	54	42.8 Å²	42.8	25%	0.252	25%	0.247	S	C	.	.			trans	-107.8	-36.7	179.2	-67.9	170.6	-163.3	0	0	110.5	R68 G90 H116 S117	R68-E92 HydrophobicContact CB-CG 4.5Å; R68-E92 WeakPolarHBondContact CD-OE1 3.21Å; R68-E92 IonicContact CZ-OE1 3.64Å; R68-E92 IonicContact NE-OE1 3.74Å; R68-E92 PolarHBondContact NE-OE1 3.2Å; R68-E92 IonicContact NH1-OE1 3.34Å; R68-E92 PolarHBondContact O-N 3.38Å; G90-E92 PolarHBondContact O-N 3.19Å; E92-H116 PolarHBondContact O-N 2.84Å; E92-S117 PolarHBondContact O-N 3.08Å
93	E	97.4	Very high	94.2	Very high	92 Å²	92	45.2 Å²	45.2	43%	0.43	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	130.4	-178.7	-60.3	-176.3	179.9	0	0	111.6	R68 I69 L70 S117	R68-E93 PolarHBondContact O-N 3.05Å; I69-E93 HydrophobicContact CB-CB 4.5Å; I69-E93 HydrophobicContact CG1-CB 4.23Å; I69-E93 HydrophobicContact CG1-CG 4.45Å; I69-E93 HydrophobicContact CG2-CB 4.22Å; L70-E93 PolarHBondContact N-O 2.83Å; E93-S117 WeakPolarHBondContact CA-O 3.18Å
94	L	97.1	Very high	94.6	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.016	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	113.5	178.7	-176.7	53.3	0	0	0	111	L70 F85 L91 L96 F109 L112 M115 S117 L118 S119	L70-L94 HydrophobicContact CB-CD1 4.11Å; L70-L94 HydrophobicContact CD2-CD1 4.01Å; L70-L94 HydrophobicContact CG-CD1 4.08Å; L70-L94 WeakPolarHBondContact O-CA 3.29Å; F85-L94 HydrophobicContact CE1-CD1 4.04Å; F85-L94 HydrophobicContact CE1-CD2 4.08Å; F85-L94 HydrophobicContact CE2-CD2 4.07Å; F85-L94 HydrophobicContact CZ-CD1 4.26Å; F85-L94 HydrophobicContact CZ-CD2 3.85Å; L91-L94 HydrophobicContact CD2-CB 3.68Å; L91-L94 HydrophobicContact CD2-CD1 4.07Å; L91-L94 HydrophobicContact CD2-CD2 4.11Å; L91-L94 HydrophobicContact CD2-CG 4.16Å; L94-L96 HydrophobicContact CD1-CD1 4.29Å; L94-L96 HydrophobicContact CD1-CD2 4.34Å; L94-L96 HydrophobicContact CD1-CG 4Å; L94-L96 HydrophobicContact CD2-CD1 3.82Å; L94-L96 HydrophobicContact CD2-CG 4.41Å; L94-L96 HydrophobicContact CG-CD1 3.9Å; L94-L96 HydrophobicContact CG-CG 3.96Å; L94-F109 HydrophobicContact CD2-CD1 4.41Å; L94-F109 HydrophobicContact CD2-CE1 4.08Å; L94-L112 HydrophobicContact CD2-CD1 4.35Å; L94-M115 HydrophobicContact CB-CE 4.19Å; L94-M115 HydrophobicContact CD2-CE 4Å; L94-S117 PolarHBondContact N-O 2.92Å; L94-L118 HydrophobicContact CB-CD1 3.99Å; L94-L118 HydrophobicContact CD2-CD1 3.94Å; L94-L118 HydrophobicContact CG-CD1 4.01Å; L94-L118 WeakPolarHBondContact O-CA 3.39Å; L94-S119 PolarHBondContact O-N 2Å
95	D	97.8	Very high	94.7	Very high	47 Å²	47	40.9 Å²	40.9	25%	0.251	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	111.5	173.2	-171.9	-5.1	0	0	0	110.6	L70 D71 L72 S73 S97	L70-D95 PolarHBondContact O-N 3.34Å; D71-D95 HydrophobicContact CB-CB 4.41Å; L72-D95 CarbonylContact C-O 3.19Å; L72-D95 WeakPolarHBondContact CA-O 3.44Å; L72-D95 PolarHBondContact N-O 2.9Å; S73-D95 PolarHBondContact N-O 2.85Å; D95-S97 WeakPolarHBondContact OD1-CA 3.42Å; D95-S97 WeakPolarHBondContact OD1-CB 3.45Å; D95-S97 PolarHBondContact OD1-N 2.87Å; D95-S97 PolarHBondContact OD1-OG 2.87Å; D95-S97 PolarHBondContact OD2-OG 3.26Å
96	L	97.1	Very high	94.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.244	C	C	.	.			trans	-113.9	18.5	175.4	-68.4	164.9	0	0	0	111.4	L72 L77 I80 F85 L94 N99 I101 F109 S119 L120 N123	L72-L96 HydrophobicContact CB-CD2 3.89Å; L72-L96 HydrophobicContact CD1-CD2 3.98Å; L77-L96 HydrophobicContact CD1-CD2 3.68Å; I80-L96 HydrophobicContact CD1-CD1 3.58Å; F85-L96 HydrophobicContact CE2-CD1 4.47Å; F85-L96 HydrophobicContact CZ-CD1 4.13Å; F85-L96 HydrophobicContact CZ-CD2 4.33Å; L94-L96 HydrophobicContact CD1-CD1 4.29Å; L94-L96 HydrophobicContact CD1-CD2 4.34Å; L94-L96 HydrophobicContact CD1-CG 4Å; L94-L96 HydrophobicContact CD2-CD1 3.82Å; L94-L96 HydrophobicContact CD2-CG 4.41Å; L94-L96 HydrophobicContact CG-CD1 3.9Å; L94-L96 HydrophobicContact CG-CG 3.96Å; L96-N99 PolarHBondContact O-ND2 3.16Å; L96-I101 HydrophobicContact CB-CD1 4.05Å; L96-F109 HydrophobicContact CD1-CE1 4.46Å; L96-S119 WeakPolarHBondContact CA-O 3.4Å; L96-S119 WeakPolarHBondContact CB-O 3.49Å; L96-S119 PolarHBondContact N-O 2.64Å; L96-L120 HydrophobicContact CB-CD2 4Å; L96-L120 HydrophobicContact CD1-CD2 3.93Å; L96-N123 PolarHBondContact O-ND2 3.06Å
97	S	97.6	Very high	94.9	Very high	21 Å²	21	39.7 Å²	39.7	15%	0.147	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	150.4	-174.3	67	0	0	0	0	113.3	S73 K74 D95 N99 K121	S73-S97 CarbonylContact C-O 3.14Å; S73-S97 WeakPolarHBondContact CA-O 3.3Å; S73-S97 WeakPolarHBondContact CB-O 3.21Å; S73-S97 WeakPolarHBondContact CB-OG 3.19Å; K74-S97 PolarHBondContact N-O 2.87Å; D95-S97 WeakPolarHBondContact OD1-CA 3.42Å; D95-S97 WeakPolarHBondContact OD1-CB 3.45Å; D95-S97 PolarHBondContact OD1-N 2.87Å; D95-S97 PolarHBondContact OD1-OG 2.87Å; D95-S97 PolarHBondContact OD2-OG 3.26Å; S97-N99 VanDerWaalsContact C-N 3.29Å; S97-N99 PolarHBondContact O-N 3.03Å; S97-N99 PolarHBondContact O-ND2 2.87Å; S97-K121 CarbonylContact C-O 3.38Å; S97-K121 WeakPolarHBondContact CA-O 3.28Å; S97-K121 WeakPolarHBondContact CB-O 3.43Å
98	G	96.5	Very high	95.1	Very high	26 Å²	26	34.7 Å²	34.7	27%	0.268	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	25.9	175	0	0	0	0	0	114.5	K74 K121 S122	K74-G98 VanDerWaalsContact CA-O 3.31Å; K74-G98 WeakPolarHBondContact CA-O 3.46Å; G98-K121 PolarHBondContact N-O 2.86Å; G98-S122 VanDerWaalsContact CA-O 3.22Å; G98-S122 WeakPolarHBondContact CA-O 3.39Å; G98-S122 PolarHBondContact N-O 3.2Å
99	N	97.3	Very high	95.2	Very high	5 Å²	5	33.9 Å²	33.9	3%	0.027	20%	0.195	C	C	.	.	S	Bend	trans	-94.1	-165.1	173.8	-83.3	-75.6	0	0	0	110.8	L72 N75 K76 L77 L96 S97 I101 N123	L72-N99 PolarHBondContact O-ND2 3.11Å; N75-N99 WeakPolarHBondContact CA-OD1 3.49Å; N75-N99 WeakPolarHBondContact CB-OD1 3.47Å; N75-N99 PolarHBondContact N-OD1 2.92Å; N75-N99 PolarHBondContact O-OD1 2.92Å; K76-N99 PolarHBondContact N-OD1 2.85Å; L77-N99 HydrophobicContact CB-CB 4.11Å; L77-N99 WeakPolarHBondContact CB-OD1 3.38Å; L77-N99 WeakPolarHBondContact CG-OD1 3.44Å; L77-N99 PolarHBondContact N-OD1 3.12Å; L77-N99 VanDerWaalsContact N-OD1 3.09Å; L96-N99 PolarHBondContact O-ND2 3.16Å; S97-N99 VanDerWaalsContact C-N 3.29Å; S97-N99 PolarHBondContact O-N 3.03Å; S97-N99 PolarHBondContact O-ND2 2.87Å; N99-I101 HydrophobicContact CB-CD1 3.92Å; N99-I101 HydrophobicContact CB-CG1 3.97Å; N99-N123 VanDerWaalsContact CA-OD1 3.26Å; N99-N123 WeakPolarHBondContact CA-OD1 3.34Å; N99-N123 WeakPolarHBondContact CB-OD1 3.31Å; N99-N123 PolarHBondContact N-OD1 3.26Å; N99-N123 PolarHBondContact O-OD1 3.4Å
100	L	97.1	Very high	95.2	Very high	59 Å²	59	34.3 Å²	34.3	31%	0.309	19%	0.193	S	C	.	.			trans	-114.7	25.4	177.6	-56.5	174.7	0	0	0	110.9	K76 L77 T78 S102 N123	K76-L100 HydrophobicContact CB-CD1 4.24Å; K76-L100 HydrophobicContact CG-CD1 4.46Å; L77-L100 CarbonylContact O-C 3.55Å; L77-L100 WeakPolarHBondContact O-CA 3.34Å; L77-L100 WeakPolarHBondContact O-CB 3.32Å; L77-L100 PolarHBondContact O-N 2.84Å; T78-L100 HydrophobicContact CG2-CB 4.34Å; L100-S102 PolarHBondContact O-N 2.82Å; L100-S102 VanDerWaalsContact O-N 3.14Å; L100-N123 PolarHBondContact N-OD1 2.01Å
101	I	96.8	Very high	95	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.19	C	C	.	.			trans	-66.4	114.5	-171.3	-62.4	158.2	0	0	0	108.8	L77 T78 I80 L96 N99 V104 L120 N123 R124 I125	L77-I101 HydrophobicContact CB-CD1 4.4Å; L77-I101 HydrophobicContact CB-CG1 4.04Å; L77-I101 PolarHBondContact O-N 3.47Å; L77-I101 VanDerWaalsContact O-N 3.1Å; T78-I101 WeakPolarHBondContact O-CA 3.32Å; I80-I101 HydrophobicContact CD1-CD1 4.03Å; I80-I101 HydrophobicContact CD1-CG2 4.4Å; I80-I101 HydrophobicContact CG1-CD1 4.19Å; I80-I101 HydrophobicContact CG1-CG1 4.47Å; I80-I101 HydrophobicContact CG1-CG2 4.22Å; L96-I101 HydrophobicContact CB-CD1 4.05Å; N99-I101 HydrophobicContact CB-CD1 3.92Å; N99-I101 HydrophobicContact CB-CG1 3.97Å; I101-V104 HydrophobicContact CG2-CG2 3.95Å; I101-L120 HydrophobicContact CD1-CD2 4.38Å; I101-N123 HydrophobicContact CB-CB 4.21Å; I101-N123 WeakPolarHBondContact CB-OD1 3.35Å; I101-N123 WeakPolarHBondContact CG1-OD1 3.1Å; I101-N123 PolarHBondContact N-OD1 2.93Å; I101-R124 CarbonylContact O-C 3.54Å; I101-R124 VanDerWaalsContact O-CA 3.27Å; I101-R124 WeakPolarHBondContact O-CA 3.24Å; I101-R124 PolarHBondContact O-N 3.03Å; I101-I125 HydrophobicContact CG2-CD1 4.41Å; I101-I125 HydrophobicContact CG2-CG1 4.21Å; I101-I125 WeakPolarHBondContact O-CG1 3.13Å; I101-I125 PolarHBondContact O-N 2.8Å
102	S	95.1	Very high	94.9	Very high	66 Å²	66	34.2 Å²	34.2	46%	0.462	19%	0.19	S	C	.	.			trans	-98.4	-20.7	177.9	52.5	0	0	0	0	113.8	T78 L100	T78-S102 PolarHBondContact O-N 2.78Å; T78-S102 PolarHBondContact O-OG 2.8Å; L100-S102 PolarHBondContact O-N 2.82Å; L100-S102 VanDerWaalsContact O-N 3.14Å
103	Y	94.1	Very high	94.6	Very high	99 Å²	99	37 Å²	37	39%	0.388	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	142.3	-173.6	-176.5	-112.5	0	0	0	110.7	M79 I80 E105 P129	M79-Y103 WeakPolarHBondContact CA-O 3.34Å; I80-Y103 PolarHBondContact N-O 2.92Å; Y103-E105 HydrophobicContact CD1-CG 4.26Å; Y103-E105 HydrophobicContact CE1-CB 4.34Å; Y103-E105 HydrophobicContact CE1-CG 3.46Å; Y103-E105 VanDerWaalsContact CE1-CG 3.46Å; Y103-P129 HydrophobicContact CE2-CG 4.19Å
104	V	95.3	Very high	94.4	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.024	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	120	175.2	-178.9	0	0	0	0	106.5	I80 I101 A108 F109 I125 V132	I80-V104 HydrophobicContact CB-CG1 4.27Å; I80-V104 HydrophobicContact CD1-CG1 4.43Å; I80-V104 HydrophobicContact CD1-CG2 3.98Å; I80-V104 HydrophobicContact CG1-CG2 4.41Å; I101-V104 HydrophobicContact CG2-CG2 3.95Å; V104-A108 HydrophobicContact CG1-CB 3.62Å; V104-F109 HydrophobicContact CG1-CE2 3.75Å; V104-F109 HydrophobicContact CG1-CZ 4.05Å; V104-I125 HydrophobicContact CG2-CD1 4.24Å; V104-V132 HydrophobicContact CB-CG1 4.37Å; V104-V132 HydrophobicContact CB-CG2 4.45Å; V104-V132 HydrophobicContact CG1-CG1 3.62Å; V104-V132 HydrophobicContact CG1-CG2 4.2Å
105	E	93.7	Very high	94.2	Very high	74 Å²	74	36.2 Å²	36.2	35%	0.346	20%	0.2	S	C	.	.			trans	-68.7	144.2	179	-93.3	-168	146.6	0	0	111.7	I80 P82 Y103 G107 A108	I80-E105 PolarHBondContact O-N 2.81Å; P82-E105 WeakPolarHBondContact CD-OE2 2.93Å; P82-E105 HydrophobicContact CG-CB 4.29Å; Y103-E105 HydrophobicContact CD1-CG 4.26Å; Y103-E105 HydrophobicContact CE1-CB 4.34Å; Y103-E105 HydrophobicContact CE1-CG 3.46Å; Y103-E105 VanDerWaalsContact CE1-CG 3.46Å; E105-G107 PolarHBondContact O-N 2.99Å; E105-A108 WeakPolarHBondContact O-CB 3.1Å; E105-A108 PolarHBondContact O-N 2.85Å
106	P	93.8	Very high	94.1	Very high	62 Å²	62	37.9 Å²	37.9	40%	0.403	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	130.2	167.8	-24.7	34.7	0	0	0	110.6	P129	P106-P129 HydrophobicContact CG-CB 4.34Å; P106-P129 HydrophobicContact CG-CG 4.17Å
107	G	91.2	Very high	94.2	Very high	6 Å²	6	39.1 Å²	39.1	6%	0.062	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.1	1.9	-176.4	0	0	0	0	0	116.7	E105 F109 N110 G131	E105-G107 PolarHBondContact O-N 2.99Å; G107-F109 PolarHBondContact O-N 2.91Å; G107-N110 WeakPolarHBondContact CA-ND2 3.41Å; G107-N110 WeakPolarHBondContact O-CB 3.46Å; G107-N110 PolarHBondContact O-N 2.84Å; G107-G131 PolarHBondContact N-O 3.3Å
108	A	93.5	Very high	94.2	Very high	2 Å²	2	38.2 Å²	38.2	2%	0.017	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.9	-34.3	171.8	0	0	0	0	0	114.3	I80 V104 E105	I80-A108 HydrophobicContact CB-CB 4.43Å; I80-A108 HydrophobicContact CG2-CB 3.77Å; V104-A108 HydrophobicContact CG1-CB 3.62Å; E105-A108 WeakPolarHBondContact O-CB 3.1Å; E105-A108 PolarHBondContact O-N 2.85Å
109	F	93.9	Very high	94.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.3	16	-175.9	-50.4	-61	0	0	0	113.5	I80 F85 L94 L96 V104 G107 A111 L112 M115 L118 V132 L136	I80-F109 HydrophobicContact CD1-CE1 4.2Å; I80-F109 HydrophobicContact CD1-CZ 3.82Å; I80-F109 HydrophobicContact CG2-CE1 4.32Å; F85-F109 HydrophobicContact CD2-CD1 4.15Å; F85-F109 HydrophobicContact CD2-CE1 4.22Å; F85-F109 HydrophobicContact CE2-CD1 4.31Å; F85-F109 AromaticContact CE2-CE1 3.92Å; F85-F109 HydrophobicContact CE2-CE1 3.92Å; L94-F109 HydrophobicContact CD2-CD1 4.41Å; L94-F109 HydrophobicContact CD2-CE1 4.08Å; L96-F109 HydrophobicContact CD1-CE1 4.46Å; V104-F109 HydrophobicContact CG1-CE2 3.75Å; V104-F109 HydrophobicContact CG1-CZ 4.05Å; G107-F109 PolarHBondContact O-N 2.91Å; F109-A111 PolarHBondContact O-N 3.01Å; F109-A111 VanDerWaalsContact O-N 3.17Å; F109-L112 HydrophobicContact CB-CD1 4.23Å; F109-L112 HydrophobicContact CD1-CD1 3.93Å; F109-L112 PolarHBondContact O-N 2.91Å; F109-L112 VanDerWaalsContact O-N 3.1Å; F109-M115 HydrophobicContact CD1-CE 4.45Å; F109-L118 HydrophobicContact CD2-CD2 4.37Å; F109-L118 HydrophobicContact CE1-CD1 4.47Å; F109-L118 HydrophobicContact CE2-CD2 4.05Å; F109-L118 HydrophobicContact CZ-CD1 4.45Å; F109-L118 HydrophobicContact CZ-CD2 4.23Å; F109-V132 HydrophobicContact CD2-CG1 3.85Å; F109-V132 HydrophobicContact CE2-CG1 3.71Å; F109-L136 HydrophobicContact CB-CD1 3.98Å; F109-L136 HydrophobicContact CB-CD2 3.88Å; F109-L136 HydrophobicContact CB-CG 4.02Å; F109-L136 HydrophobicContact CD2-CD1 4.11Å; F109-L136 HydrophobicContact CG-CD1 4.24Å
110	N	90.1	Very high	94.2	Very high	76 Å²	76	37.7 Å²	37.7	41%	0.406	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-26	-171.7	-85.1	-6.5	0	0	0	114.7	G107 L112 F113 A135	G107-N110 WeakPolarHBondContact CA-ND2 3.41Å; G107-N110 WeakPolarHBondContact O-CB 3.46Å; G107-N110 PolarHBondContact O-N 2.84Å; N110-L112 VanDerWaalsContact C-N 3.34Å; N110-F113 WeakPolarHBondContact O-CE1 3.27Å; N110-F113 WeakPolarHBondContact O-CZ 3.26Å; N110-A135 HydrophobicContact CB-CB 4.37Å
111	A	88.6	Confident	94.2	Very high	22 Å²	22	37.6 Å²	37.6	18%	0.182	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-7.7	179.5	0	0	0	0	0	113.9	I86 P89 F109 F113	I86-A111 HydrophobicContact CG1-CB 4.46Å; P89-A111 WeakPolarHBondContact CA-O 2.98Å; F109-A111 PolarHBondContact O-N 3.01Å; F109-A111 VanDerWaalsContact O-N 3.17Å; A111-F113 WeakPolarHBondContact O-CD2 3.49Å; A111-F113 WeakPolarHBondContact O-CE2 3Å; A111-F113 PolarHBondContact O-N 3.47Å
112	L	92.4	Very high	94.1	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.			trans	-100.4	60.2	-164.6	-54.5	178	0	0	0	112.5	F85 F88 L91 L94 F109 N110 N114 M115 L136	F85-L112 HydrophobicContact CB-CD1 3.82Å; F85-L112 HydrophobicContact CB-CD2 4.04Å; F85-L112 HydrophobicContact CB-CG 4.21Å; F85-L112 HydrophobicContact CD2-CD1 4.34Å; F85-L112 HydrophobicContact CG-CD1 4.11Å; F88-L112 WeakPolarHBondContact O-CD2 2.95Å; L91-L112 HydrophobicContact CB-CD2 3.95Å; L91-L112 HydrophobicContact CD2-CD1 4.4Å; L91-L112 HydrophobicContact CD2-CD2 4.48Å; L94-L112 HydrophobicContact CD2-CD1 4.35Å; F109-L112 HydrophobicContact CB-CD1 4.23Å; F109-L112 HydrophobicContact CD1-CD1 3.93Å; F109-L112 PolarHBondContact O-N 2.91Å; F109-L112 VanDerWaalsContact O-N 3.1Å; N110-L112 VanDerWaalsContact C-N 3.34Å; L112-N114 VanDerWaalsContact C-N 3.27Å; L112-N114 PolarHBondContact O-N 2.86Å; L112-M115 HydrophobicContact CB-CB 4.36Å; L112-M115 HydrophobicContact CB-CE 3.66Å; L112-M115 HydrophobicContact CD1-CE 3.14Å; L112-M115 HydrophobicContact CG-CE 4Å; L112-M115 WeakPolarHBondContact O-CB 2.97Å; L112-M115 PolarHBondContact O-N 2.8Å; L112-L136 HydrophobicContact CB-CD2 4.22Å
113	F	89.9	Confident	94.2	Very high	113 Å²	113	37.2 Å²	37.2	50%	0.496	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-22	-173.9	-49.1	-71.9	0	0	0	114.4	N110 A111 A135 N138	N110-F113 WeakPolarHBondContact O-CE1 3.27Å; N110-F113 WeakPolarHBondContact O-CZ 3.26Å; A111-F113 WeakPolarHBondContact O-CD2 3.49Å; A111-F113 WeakPolarHBondContact O-CE2 3Å; A111-F113 PolarHBondContact O-N 3.47Å; F113-A135 HydrophobicContact CE1-CB 4.38Å; F113-N138 WeakPolarHBondContact O-CB 3.21Å; F113-N138 PolarHBondContact O-ND2 3.11Å
114	N	92.8	Very high	94.3	Very high	79 Å²	79	39.3 Å²	39.3	42%	0.422	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	5	-178.5	-67.2	-16.6	0	0	0	113.3	L91 L112 H116	L91-N114 CarbonylContact O-C 2.99Å; L91-N114 VanDerWaalsContact O-C 3.27Å; L112-N114 VanDerWaalsContact C-N 3.27Å; L112-N114 PolarHBondContact O-N 2.86Å; N114-H116 PolarHBondContact O-N 2.86Å
115	M	94.4	Very high	94.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.201	C	C	.	.			trans	-67.4	130.8	-174.9	-167.5	-172.3	-72.6	0	0	111.2	L91 L94 F109 L112 L118 L136 N138 L139	L91-M115 WeakPolarHBondContact O-CA 3.41Å; L91-M115 PolarHBondContact O-N 3.03Å; L94-M115 HydrophobicContact CB-CE 4.19Å; L94-M115 HydrophobicContact CD2-CE 4Å; F109-M115 HydrophobicContact CD1-CE 4.45Å; L112-M115 HydrophobicContact CB-CB 4.36Å; L112-M115 HydrophobicContact CB-CE 3.66Å; L112-M115 HydrophobicContact CD1-CE 3.14Å; L112-M115 HydrophobicContact CG-CE 4Å; L112-M115 WeakPolarHBondContact O-CB 2.97Å; L112-M115 PolarHBondContact O-N 2.8Å; M115-L118 HydrophobicContact SD-CB 3.74Å; M115-L118 HydrophobicContact SD-CD1 4.22Å; M115-L118 HydrophobicContact SD-CD2 4.22Å; M115-L118 HydrophobicContact SD-CG 4.28Å; M115-L136 HydrophobicContact CB-CD2 4.05Å; M115-L136 HydrophobicContact CE-CD2 4.05Å; M115-L136 HydrophobicContact SD-CD1 4.11Å; M115-L136 HydrophobicContact SD-CD2 3.79Å; M115-N138 CarbonylContact O-C 3.02Å; M115-N138 VanDerWaalsContact O-O 3.11Å; M115-L139 HydrophobicContact CB-CD1 4.31Å; M115-L139 HydrophobicContact CG-CD1 3.68Å; M115-L139 WeakPolarHBondContact O-CA 3.09Å; M115-L139 PolarHBondContact O-N 2.97Å; M115-L139 HydrophobicContact SD-CD1 3.68Å
116	H	95.9	Very high	94.2	Very high	82 Å²	82	42.9 Å²	42.9	38%	0.38	22%	0.216	S	C	.	.			trans	-110.2	-34.2	177.3	-67.9	-46.2	0	0	0	112.7	E92 N114 N138 T140 Q141	E92-H116 PolarHBondContact O-N 2.84Å; N114-H116 PolarHBondContact O-N 2.86Å; H116-N138 PolarHBondContact ND1-O 2.76Å; H116-T140 PolarHBondContact O-N 2.91Å; H116-T140 PolarHBondContact O-OG1 3.01Å; H116-Q141 PolarHBondContact O-N 2.91Å
117	S	97.8	Very high	94	Very high	26 Å²	26	44 Å²	44	18%	0.182	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	130.8	-178.4	-168.8	0	0	0	0	112	E92 E93 L94 Q141	E92-S117 PolarHBondContact O-N 3.08Å; E93-S117 WeakPolarHBondContact CA-O 3.18Å; L94-S117 PolarHBondContact N-O 2.92Å; S117-Q141 WeakPolarHBondContact CA-O 3.48Å
118	L	97.4	Very high	94	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	120.9	175.6	179.2	58.7	0	0	0	109.9	L94 F109 M115 L120 F133 L136 L139 Q141 L142 D143	L94-L118 HydrophobicContact CB-CD1 3.99Å; L94-L118 HydrophobicContact CD2-CD1 3.94Å; L94-L118 HydrophobicContact CG-CD1 4.01Å; L94-L118 WeakPolarHBondContact O-CA 3.39Å; F109-L118 HydrophobicContact CD2-CD2 4.37Å; F109-L118 HydrophobicContact CE1-CD1 4.47Å; F109-L118 HydrophobicContact CE2-CD2 4.05Å; F109-L118 HydrophobicContact CZ-CD1 4.45Å; F109-L118 HydrophobicContact CZ-CD2 4.23Å; M115-L118 HydrophobicContact SD-CB 3.74Å; M115-L118 HydrophobicContact SD-CD1 4.22Å; M115-L118 HydrophobicContact SD-CD2 4.22Å; M115-L118 HydrophobicContact SD-CG 4.28Å; L118-L120 HydrophobicContact CD1-CG 4.44Å; L118-L120 HydrophobicContact CD2-CD1 4.32Å; L118-L120 HydrophobicContact CG-CG 4.38Å; L118-F133 HydrophobicContact CD2-CE1 4.22Å; L118-L136 HydrophobicContact CD2-CD1 3.94Å; L118-L139 HydrophobicContact CB-CD1 3.86Å; L118-L139 HydrophobicContact CB-CD2 4.32Å; L118-Q141 PolarHBondContact N-O 3.41Å; L118-L142 HydrophobicContact CB-CD1 4.1Å; L118-L142 HydrophobicContact CD2-CD1 4Å; L118-L142 HydrophobicContact CG-CD1 4.08Å; L118-L142 WeakPolarHBondContact O-CA 3.42Å; L118-D143 PolarHBondContact O-N 2.83Å
119	S	97.7	Very high	93.8	Very high	18 Å²	18	45.7 Å²	45.7	13%	0.126	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	121.9	170.5	-171.1	0	0	0	0	111.6	L94 L96 K121	L94-S119 PolarHBondContact O-N 2Å; L96-S119 WeakPolarHBondContact CA-O 3.4Å; L96-S119 WeakPolarHBondContact CB-O 3.49Å; L96-S119 PolarHBondContact N-O 2.64Å; S119-K121 PolarHBondContact OG-N 3.23Å
120	L	96.5	Very high	93.5	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.01	26%	0.262	C	S	.	.			trans	-115.4	20.5	170.5	-68.6	168	0	0	0	110.8	I80 L96 I101 L118 N123 I125 D143 I144 N147	I80-L120 HydrophobicContact CD1-CD2 4.05Å; L96-L120 HydrophobicContact CB-CD2 4Å; L96-L120 HydrophobicContact CD1-CD2 3.93Å; I101-L120 HydrophobicContact CD1-CD2 4.38Å; L118-L120 HydrophobicContact CD1-CG 4.44Å; L118-L120 HydrophobicContact CD2-CD1 4.32Å; L118-L120 HydrophobicContact CG-CG 4.38Å; L120-N123 PolarHBondContact O-ND2 3.33Å; L120-I125 HydrophobicContact CB-CD1 4.08Å; L120-I125 HydrophobicContact CD1-CD1 4.17Å; L120-I125 HydrophobicContact CD2-CD1 4.43Å; L120-I125 HydrophobicContact CG-CD1 4.47Å; L120-D143 CarbonylContact C-O 3.17Å; L120-D143 PolarHBondContact N-O 3.15Å; L120-I144 HydrophobicContact CB-CG2 4.35Å; L120-I144 HydrophobicContact CD1-CG2 4.44Å; L120-N147 PolarHBondContact O-ND2 3.01Å
121	K	96.6	Very high	93.3	Very high	58 Å²	58	49.6 Å²	49.6	25%	0.252	25%	0.251	S	S	.	.			trans	-57.5	149.8	-178.1	177.2	170.2	-167.3	149.9	0	113.3	S97 G98 S119 N123 D143 S145 D146	S97-K121 CarbonylContact C-O 3.38Å; S97-K121 WeakPolarHBondContact CA-O 3.28Å; S97-K121 WeakPolarHBondContact CB-O 3.43Å; G98-K121 PolarHBondContact N-O 2.86Å; S119-K121 PolarHBondContact OG-N 3.23Å; K121-N123 VanDerWaalsContact C-N 3.34Å; K121-N123 PolarHBondContact O-N 3.08Å; K121-N123 PolarHBondContact O-ND2 3.33Å; K121-D143 WeakPolarHBondContact CB-OD2 3.49Å; K121-D143 WeakPolarHBondContact CD-OD2 3.47Å; K121-D143 PolarHBondContact N-O 2.87Å; K121-S145 CarbonylContact C-O 3.07Å; K121-S145 WeakPolarHBondContact CA-O 3.02Å; K121-S145 WeakPolarHBondContact CD-OG 3.02Å; K121-S145 WeakPolarHBondContact CE-OG 3.45Å; K121-S145 WeakPolarHBondContact CG-OG 3.35Å; K121-D146 HydrophobicContact CG-CB 4.43Å
122	S	96.2	Very high	93.6	Very high	50 Å²	50	48.6 Å²	48.6	35%	0.35	24%	0.243	S	C	.	.	S	Bend	trans	57.5	46.1	171.5	-67.2	0	0	0	0	112.6	G98 S145 D146	G98-S122 VanDerWaalsContact CA-O 3.22Å; G98-S122 WeakPolarHBondContact CA-O 3.39Å; G98-S122 PolarHBondContact N-O 3.2Å; S122-S145 PolarHBondContact N-O 2.02Å; S122-D146 CarbonylContact C-O 3.37Å; S122-D146 WeakPolarHBondContact CA-O 3.46Å; S122-D146 PolarHBondContact N-O 3.47Å
123	N	96.8	Very high	93.6	Very high	8 Å²	8	48.8 Å²	48.8	4%	0.043	24%	0.244	C	C	.	.	S	Bend	trans	-116	-163.5	176.1	-85.7	-68.9	0	0	0	110.4	L96 N99 L100 I101 L120 K121 I125 D146 N147	L96-N123 PolarHBondContact O-ND2 3.06Å; N99-N123 VanDerWaalsContact CA-OD1 3.26Å; N99-N123 WeakPolarHBondContact CA-OD1 3.34Å; N99-N123 WeakPolarHBondContact CB-OD1 3.31Å; N99-N123 PolarHBondContact N-OD1 3.26Å; N99-N123 PolarHBondContact O-OD1 3.4Å; L100-N123 PolarHBondContact N-OD1 2.01Å; I101-N123 HydrophobicContact CB-CB 4.21Å; I101-N123 WeakPolarHBondContact CB-OD1 3.35Å; I101-N123 WeakPolarHBondContact CG1-OD1 3.1Å; I101-N123 PolarHBondContact N-OD1 2.93Å; L120-N123 PolarHBondContact O-ND2 3.33Å; K121-N123 VanDerWaalsContact C-N 3.34Å; K121-N123 PolarHBondContact O-N 3.08Å; K121-N123 PolarHBondContact O-ND2 3.33Å; N123-I125 HydrophobicContact CB-CD1 4.39Å; N123-I125 HydrophobicContact CB-CG1 4.23Å; N123-D146 PolarHBondContact N-O 2.91Å; N123-N147 WeakPolarHBondContact CA-OD1 3.28Å; N123-N147 WeakPolarHBondContact CB-OD1 3.48Å
124	R	96	Very high	93.5	Very high	142 Å²	142	46.5 Å²	46.5	54%	0.536	24%	0.239	S	C	.	.			trans	-119.8	24.7	-177.9	-61.7	-176.9	176.7	-166.7	-1.9	112.3	I101 K126 N147 K148	I101-R124 CarbonylContact O-C 3.54Å; I101-R124 VanDerWaalsContact O-CA 3.27Å; I101-R124 WeakPolarHBondContact O-CA 3.24Å; I101-R124 PolarHBondContact O-N 3.03Å; R124-K126 PolarHBondContact O-N 3.36Å; R124-N147 PolarHBondContact N-OD1 2.69Å; R124-K148 HydrophobicContact CB-CG 4.32Å
125	I	94.6	Very high	93.2	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	23%	0.226	C	C	.	.			trans	-71	121.9	-173.9	-57.6	171.2	0	0	0	109	I101 V104 L120 N123 I128 N147 K148 I149	I101-I125 HydrophobicContact CG2-CD1 4.41Å; I101-I125 HydrophobicContact CG2-CG1 4.21Å; I101-I125 WeakPolarHBondContact O-CG1 3.13Å; I101-I125 PolarHBondContact O-N 2.8Å; V104-I125 HydrophobicContact CG2-CD1 4.24Å; L120-I125 HydrophobicContact CB-CD1 4.08Å; L120-I125 HydrophobicContact CD1-CD1 4.17Å; L120-I125 HydrophobicContact CD2-CD1 4.43Å; L120-I125 HydrophobicContact CG-CD1 4.47Å; N123-I125 HydrophobicContact CB-CD1 4.39Å; N123-I125 HydrophobicContact CB-CG1 4.23Å; I125-I128 HydrophobicContact CG2-CG1 3.89Å; I125-N147 HydrophobicContact CB-CB 4.37Å; I125-N147 WeakPolarHBondContact CB-OD1 3.31Å; I125-N147 WeakPolarHBondContact CG1-OD1 3.29Å; I125-N147 PolarHBondContact N-OD1 3.36Å; I125-N147 VanDerWaalsContact N-OD1 3.13Å; I125-K148 CarbonylContact O-C 3.42Å; I125-K148 WeakPolarHBondContact O-CA 3.35Å; I125-K148 PolarHBondContact O-N 2.98Å; I125-I149 WeakPolarHBondContact O-CG1 3.36Å; I125-I149 PolarHBondContact O-N 3.2Å
126	K	91.9	Very high	93.1	Very high	153 Å²	153	43.6 Å²	43.6	67%	0.665	23%	0.226	S	C	*	.			trans	-90.9	-34.7	178.3	-67.2	-176.9	179.3	-178.6	0	113.5	R124 K148	R124-K126 PolarHBondContact O-N 3.36Å; K126-K148 WeakPolarHBondContact CA-O 3.2Å; K126-K148 HydrophobicContact CG-CB 3.96Å
127	L	90.3	Very high	92.7	Very high	86 Å²	86	42.1 Å²	42.1	45%	0.45	22%	0.223	S	C	.	.			trans	-150	139.6	-177.1	179.4	70.8	0	0	0	107.8	L153 M156	L127-L153 HydrophobicContact CD1-CD1 3.75Å; L127-M156 HydrophobicContact CD1-CE 4.44Å
128	I	91.1	Very high	92.5	Very high	13 Å²	13	44.1 Å²	44.1	7%	0.067	23%	0.231	C	C	.	.			trans	-100.4	110.8	168.1	-59.6	171.9	0	0	0	106.7	I125 V132 F133 I144 I149	I125-I128 HydrophobicContact CG2-CG1 3.89Å; I128-V132 HydrophobicContact CG2-CB 4.01Å; I128-V132 HydrophobicContact CG2-CG1 4.26Å; I128-V132 HydrophobicContact CG2-CG2 4.21Å; I128-F133 HydrophobicContact CD1-CE2 4.16Å; I128-F133 HydrophobicContact CD1-CZ 4.03Å; I128-F133 HydrophobicContact CG2-CD2 4.33Å; I128-F133 HydrophobicContact CG2-CE2 3.72Å; I128-F133 HydrophobicContact CG2-CZ 3.99Å; I128-I144 HydrophobicContact CD1-CD1 4.04Å; I128-I144 HydrophobicContact CD1-CG2 4.04Å; I128-I149 HydrophobicContact CD1-CD1 4.41Å
129	P	88.9	Confident	92.4	Very high	30 Å²	30	44 Å²	44	20%	0.195	23%	0.231	C	C	.	.			trans	-69.3	155.7	178.2	25.2	-29.3	0	0	0	111.6	Y103 P106 V132	Y103-P129 HydrophobicContact CE2-CG 4.19Å; P106-P129 HydrophobicContact CG-CB 4.34Å; P106-P129 HydrophobicContact CG-CG 4.17Å; P129-V132 HydrophobicContact CG-CG2 3.72Å; P129-V132 WeakPolarHBondContact O-CG2 3.11Å; P129-V132 PolarHBondContact O-N 3.08Å
130	L	87.4	Confident	92.4	Very high	139 Å²	139	44.9 Å²	44.9	73%	0.728	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	141.8	170.7	-63	171.2	0	0	0	109.5
131	G	87.1	Confident	92.5	Very high	18 Å²	18	49.9 Å²	49.9	19%	0.186	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.7	-6	-177.9	0	0	0	0	0	115.5	G107 T134	G107-G131 PolarHBondContact N-O 3.3Å; G131-T134 PolarHBondContact O-OG1 2.78Å
132	V	93.4	Very high	92.5	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.006	25%	0.248	C	C	.	.	S	Bend	trans	-71.9	-36.8	174.1	173.9	0	0	0	0	111.3	V104 F109 I128 P129	V104-V132 HydrophobicContact CB-CG1 4.37Å; V104-V132 HydrophobicContact CB-CG2 4.45Å; V104-V132 HydrophobicContact CG1-CG1 3.62Å; V104-V132 HydrophobicContact CG1-CG2 4.2Å; F109-V132 HydrophobicContact CD2-CG1 3.85Å; F109-V132 HydrophobicContact CE2-CG1 3.71Å; I128-V132 HydrophobicContact CG2-CB 4.01Å; I128-V132 HydrophobicContact CG2-CG1 4.26Å; I128-V132 HydrophobicContact CG2-CG2 4.21Å; P129-V132 HydrophobicContact CG-CG2 3.72Å; P129-V132 WeakPolarHBondContact O-CG2 3.11Å; P129-V132 PolarHBondContact O-N 3.08Å
133	F	92.4	Very high	92.6	Very high	5 Å²	5	46 Å²	46	2%	0.022	24%	0.237	C	C	.	.	S	Bend	trans	-104	3.1	-173.1	-61.7	-41	0	0	0	114.8	L118 I128 A135 L136 L142 F157 L160	L118-F133 HydrophobicContact CD2-CE1 4.22Å; I128-F133 HydrophobicContact CD1-CE2 4.16Å; I128-F133 HydrophobicContact CD1-CZ 4.03Å; I128-F133 HydrophobicContact CG2-CD2 4.33Å; I128-F133 HydrophobicContact CG2-CE2 3.72Å; I128-F133 HydrophobicContact CG2-CZ 3.99Å; F133-A135 VanDerWaalsContact C-N 3.27Å; F133-A135 PolarHBondContact O-N 3.41Å; F133-A135 VanDerWaalsContact O-N 3.14Å; F133-L136 HydrophobicContact CD1-CD1 3.93Å; F133-L136 PolarHBondContact O-N 2.82Å; F133-L136 VanDerWaalsContact O-N 3.07Å; F133-L142 HydrophobicContact CE1-CD1 4.32Å; F133-L142 HydrophobicContact CE1-CD2 4.35Å; F133-L142 HydrophobicContact CE2-CD2 4.08Å; F133-L142 HydrophobicContact CZ-CD1 4.29Å; F133-L142 HydrophobicContact CZ-CD2 3.82Å; F133-F157 HydrophobicContact CE2-CD1 4.19Å; F133-F157 HydrophobicContact CE2-CE1 4.2Å; F133-L160 HydrophobicContact CB-CD1 4.31Å; F133-L160 HydrophobicContact CB-CD2 3.88Å; F133-L160 HydrophobicContact CB-CG 4.02Å; F133-L160 HydrophobicContact CD2-CD1 3.94Å; F133-L160 HydrophobicContact CD2-CG 4.47Å; F133-L160 HydrophobicContact CE2-CD1 4.37Å; F133-L160 HydrophobicContact CG-CD1 4.06Å; F133-L160 HydrophobicContact CG-CD2 4.34Å; F133-L160 HydrophobicContact CG-CG 4.32Å
134	T	89.1	Confident	92.6	Very high	64 Å²	64	45.8 Å²	45.8	39%	0.393	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-32.4	-169.9	39.9	0	0	0	0	114.9	G131 D159	G131-T134 PolarHBondContact O-OG1 2.78Å; T134-D159 VanDerWaalsContact CG2-OD2 3.27Å; T134-D159 WeakPolarHBondContact CG2-OD2 3.15Å
135	A	86.6	Confident	92.6	Very high	17 Å²	17	39.2 Å²	39.2	14%	0.14	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-8.2	-179	0	0	0	0	0	114.1	N110 F113 F133 T137	N110-A135 HydrophobicContact CB-CB 4.37Å; F113-A135 HydrophobicContact CE1-CB 4.38Å; F133-A135 VanDerWaalsContact C-N 3.27Å; F133-A135 PolarHBondContact O-N 3.41Å; F133-A135 VanDerWaalsContact O-N 3.14Å; A135-T137 PolarHBondContact O-N 3.36Å
136	L	91.5	Very high	92.6	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	22%	0.218	C	C	.	.			trans	-86.7	50.2	-172.7	-65.2	-174.1	0	0	0	111.9	F109 L112 M115 L118 F133 N138 L139 L160	F109-L136 HydrophobicContact CB-CD1 3.98Å; F109-L136 HydrophobicContact CB-CD2 3.88Å; F109-L136 HydrophobicContact CB-CG 4.02Å; F109-L136 HydrophobicContact CD2-CD1 4.11Å; F109-L136 HydrophobicContact CG-CD1 4.24Å; L112-L136 HydrophobicContact CB-CD2 4.22Å; M115-L136 HydrophobicContact CB-CD2 4.05Å; M115-L136 HydrophobicContact CE-CD2 4.05Å; M115-L136 HydrophobicContact SD-CD1 4.11Å; M115-L136 HydrophobicContact SD-CD2 3.79Å; L118-L136 HydrophobicContact CD2-CD1 3.94Å; F133-L136 HydrophobicContact CD1-CD1 3.93Å; F133-L136 PolarHBondContact O-N 2.82Å; F133-L136 VanDerWaalsContact O-N 3.07Å; L136-N138 VanDerWaalsContact C-N 3.29Å; L136-N138 PolarHBondContact O-N 3.39Å; L136-L139 HydrophobicContact CB-CB 4.1Å; L136-L139 HydrophobicContact CB-CD2 4.44Å; L136-L139 HydrophobicContact CD1-CD2 4.18Å; L136-L139 VanDerWaalsContact O-CB 3.28Å; L136-L139 WeakPolarHBondContact O-CB 3.17Å; L136-L139 PolarHBondContact O-N 3.33Å; L136-L160 HydrophobicContact CB-CD2 3.98Å; L136-L160 WeakPolarHBondContact O-CD2 3.35Å
137	T	87.8	Confident	92.7	Very high	51 Å²	51	33.2 Å²	33.2	31%	0.313	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-25.8	-174.7	58.3	0	0	0	0	113.1	A135 L139 N162	A135-T137 PolarHBondContact O-N 3.36Å; T137-L139 VanDerWaalsContact C-N 3.34Å; T137-N162 WeakPolarHBondContact O-CB 3.34Å; T137-N162 PolarHBondContact O-ND2 3.1Å
138	N	93.3	Very high	92.9	Very high	68 Å²	68	32.7 Å²	32.7	36%	0.364	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	2	178	-72.2	-22.5	0	0	0	113.9	F113 M115 H116 L136 T140	F113-N138 WeakPolarHBondContact O-CB 3.21Å; F113-N138 PolarHBondContact O-ND2 3.11Å; M115-N138 CarbonylContact O-C 3.02Å; M115-N138 VanDerWaalsContact O-O 3.11Å; H116-N138 PolarHBondContact ND1-O 2.76Å; L136-N138 VanDerWaalsContact C-N 3.29Å; L136-N138 PolarHBondContact O-N 3.39Å; N138-T140 PolarHBondContact O-N 2.74Å
139	L	96.1	Very high	93	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.179	C	C	.	.			trans	-68.1	128.3	-178.2	-164.1	74.5	0	0	0	110.1	M115 L118 L136 T137 L142 L160 N162 L163	M115-L139 HydrophobicContact CB-CD1 4.31Å; M115-L139 HydrophobicContact CG-CD1 3.68Å; M115-L139 WeakPolarHBondContact O-CA 3.09Å; M115-L139 PolarHBondContact O-N 2.97Å; M115-L139 HydrophobicContact SD-CD1 3.68Å; L118-L139 HydrophobicContact CB-CD1 3.86Å; L118-L139 HydrophobicContact CB-CD2 4.32Å; L136-L139 HydrophobicContact CB-CB 4.1Å; L136-L139 HydrophobicContact CB-CD2 4.44Å; L136-L139 HydrophobicContact CD1-CD2 4.18Å; L136-L139 VanDerWaalsContact O-CB 3.28Å; L136-L139 WeakPolarHBondContact O-CB 3.17Å; L136-L139 PolarHBondContact O-N 3.33Å; T137-L139 VanDerWaalsContact C-N 3.34Å; L139-L142 HydrophobicContact CD2-CB 4.06Å; L139-L142 HydrophobicContact CD2-CD1 4.33Å; L139-L160 HydrophobicContact CB-CD2 4.23Å; L139-L160 HydrophobicContact CD2-CD1 4.42Å; L139-L160 HydrophobicContact CD2-CD2 3.92Å; L139-N162 CarbonylContact O-C 3.19Å; L139-L163 HydrophobicContact CB-CD1 4.49Å; L139-L163 HydrophobicContact CD2-CD1 4.08Å; L139-L163 HydrophobicContact CG-CD1 4.08Å; L139-L163 WeakPolarHBondContact O-CA 3.34Å; L139-L163 PolarHBondContact O-N 3.36Å
140	T	97.3	Very high	93.2	Very high	36 Å²	36	34.3 Å²	34.3	22%	0.221	19%	0.191	C	C	.	.			trans	-112.3	-27.2	-178.8	60.7	0	0	0	0	112.6	H116 N138 R164 S165	H116-T140 PolarHBondContact O-N 2.91Å; H116-T140 PolarHBondContact O-OG1 3.01Å; N138-T140 PolarHBondContact O-N 2.74Å; T140-R164 WeakPolarHBondContact O-CA 3.36Å; T140-R164 PolarHBondContact O-N 3.27Å; T140-S165 PolarHBondContact O-N 3.06Å
141	Q	98.1	Very high	93.4	Very high	106 Å²	106	31.1 Å²	31.1	50%	0.495	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	129.1	-179.4	-61.8	-179.4	2.2	0	0	109.8	H116 S117 L118 S165	H116-Q141 PolarHBondContact O-N 2.91Å; S117-Q141 WeakPolarHBondContact CA-O 3.48Å; L118-Q141 PolarHBondContact N-O 3.41Å; Q141-S165 WeakPolarHBondContact CA-O 3.15Å
142	L	97.6	Very high	93.8	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.021	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	125.4	175.4	176.6	63.1	0	0	0	109.4	L118 F133 L139 I144 F157 L160 L163 S165 L166 E167	L118-L142 HydrophobicContact CB-CD1 4.1Å; L118-L142 HydrophobicContact CD2-CD1 4Å; L118-L142 HydrophobicContact CG-CD1 4.08Å; L118-L142 WeakPolarHBondContact O-CA 3.42Å; F133-L142 HydrophobicContact CE1-CD1 4.32Å; F133-L142 HydrophobicContact CE1-CD2 4.35Å; F133-L142 HydrophobicContact CE2-CD2 4.08Å; F133-L142 HydrophobicContact CZ-CD1 4.29Å; F133-L142 HydrophobicContact CZ-CD2 3.82Å; L139-L142 HydrophobicContact CD2-CB 4.06Å; L139-L142 HydrophobicContact CD2-CD1 4.33Å; L142-I144 HydrophobicContact CD1-CG2 3.9Å; L142-I144 HydrophobicContact CD2-CG2 4.37Å; L142-I144 HydrophobicContact CG-CG2 4.06Å; L142-F157 HydrophobicContact CD2-CD1 4.27Å; L142-F157 HydrophobicContact CD2-CE1 4.16Å; L142-L160 HydrophobicContact CD2-CD1 3.58Å; L142-L163 HydrophobicContact CB-CD1 3.76Å; L142-L163 HydrophobicContact CB-CD2 4.16Å; L142-S165 PolarHBondContact N-O 2.98Å; L142-S165 VanDerWaalsContact N-O 3.08Å; L142-L166 HydrophobicContact CB-CD1 4.15Å; L142-L166 HydrophobicContact CD2-CD1 4Å; L142-L166 HydrophobicContact CG-CD1 4.09Å; L142-L166 WeakPolarHBondContact O-CA 3.26Å; L142-E167 PolarHBondContact O-N 2.85Å
143	D	97.8	Very high	93.8	Very high	24 Å²	24	34.2 Å²	34.2	13%	0.128	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	113.3	173.9	-179.5	1	0	0	0	110.2	L118 L120 K121 S145 E167	L118-D143 PolarHBondContact O-N 2.83Å; L120-D143 CarbonylContact C-O 3.17Å; L120-D143 PolarHBondContact N-O 3.15Å; K121-D143 WeakPolarHBondContact CB-OD2 3.49Å; K121-D143 WeakPolarHBondContact CD-OD2 3.47Å; K121-D143 PolarHBondContact N-O 2.87Å; D143-S145 VanDerWaalsContact OD1-CB 3.26Å; D143-S145 WeakPolarHBondContact OD1-CB 3.4Å; D143-S145 PolarHBondContact OD1-N 3.43Å; D143-S145 PolarHBondContact OD1-OG 2.85Å; D143-E167 HydrophobicContact CB-CB 4.22Å
144	I	95.5	Very high	93.9	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.01	20%	0.203	C	C	.	.			trans	-119.6	19.4	175.8	57.1	167.1	0	0	0	111.3	L120 I128 L142 N147 I149 F157 E167 V168	L120-I144 HydrophobicContact CB-CG2 4.35Å; L120-I144 HydrophobicContact CD1-CG2 4.44Å; I128-I144 HydrophobicContact CD1-CD1 4.04Å; I128-I144 HydrophobicContact CD1-CG2 4.04Å; L142-I144 HydrophobicContact CD1-CG2 3.9Å; L142-I144 HydrophobicContact CD2-CG2 4.37Å; L142-I144 HydrophobicContact CG-CG2 4.06Å; I144-N147 PolarHBondContact O-ND2 3.16Å; I144-I149 HydrophobicContact CD1-CD1 4.13Å; I144-F157 HydrophobicContact CD1-CE1 3.84Å; I144-F157 HydrophobicContact CD1-CZ 3.65Å; I144-E167 WeakPolarHBondContact CG1-O 3.43Å; I144-E167 PolarHBondContact N-O 3.02Å; I144-V168 HydrophobicContact CD1-CB 4.08Å; I144-V168 HydrophobicContact CD1-CG2 3.67Å; I144-V168 HydrophobicContact CG1-CB 3.95Å; I144-V168 HydrophobicContact CG1-CG2 3.91Å
145	S	95.9	Very high	94.1	Very high	4 Å²	4	38.3 Å²	38.3	3%	0.028	20%	0.2	C	C	.	.			trans	-67.2	160.9	179.7	66.4	0	0	0	0	113	K121 S122 D143 N147 G169	K121-S145 CarbonylContact C-O 3.07Å; K121-S145 WeakPolarHBondContact CA-O 3.02Å; K121-S145 WeakPolarHBondContact CD-OG 3.02Å; K121-S145 WeakPolarHBondContact CE-OG 3.45Å; K121-S145 WeakPolarHBondContact CG-OG 3.35Å; S122-S145 PolarHBondContact N-O 2.02Å; D143-S145 VanDerWaalsContact OD1-CB 3.26Å; D143-S145 WeakPolarHBondContact OD1-CB 3.4Å; D143-S145 PolarHBondContact OD1-N 3.43Å; D143-S145 PolarHBondContact OD1-OG 2.85Å; S145-N147 PolarHBondContact O-N 3.3Å; S145-N147 PolarHBondContact O-ND2 3.31Å; S145-G169 CarbonylContact C-O 3.3Å; S145-G169 WeakPolarHBondContact CA-O 3.38Å
146	D	94.8	Very high	94.4	Very high	27 Å²	27	38.1 Å²	38.1	14%	0.144	20%	0.196	C	C	.	.	S	Bend	trans	53.5	48.2	179.5	-70.3	-32.3	0	0	0	113.7	K121 S122 N123 G169 R194	K121-D146 HydrophobicContact CG-CB 4.43Å; S122-D146 CarbonylContact C-O 3.37Å; S122-D146 WeakPolarHBondContact CA-O 3.46Å; S122-D146 PolarHBondContact N-O 3.47Å; N123-D146 PolarHBondContact N-O 2.91Å; D146-G169 PolarHBondContact N-O 2.88Å; D146-R194 VanDerWaalsContact OD1-CD 3.32Å; D146-R194 WeakPolarHBondContact OD1-CD 3.44Å; D146-R194 IonicContact OD1-CZ 3.41Å; D146-R194 IonicContact OD1-NE 3.36Å; D146-R194 IonicContact OD1-NH1 3.7Å; D146-R194 PolarHBondContact OD1-NH1 3.14Å; D146-R194 IonicContact OD2-CZ 2.78Å; D146-R194 IonicContact OD2-NH1 3.49Å; D146-R194 PolarHBondContact OD2-NH1 2.87Å
147	N	94.9	Very high	94.5	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.011	20%	0.196	C	C	.	.	S	Bend	trans	-102.1	-139	179.8	-95.1	-72.6	0	0	0	113	L120 N123 R124 I125 I144 S145 I149 D170	L120-N147 PolarHBondContact O-ND2 3.01Å; N123-N147 WeakPolarHBondContact CA-OD1 3.28Å; N123-N147 WeakPolarHBondContact CB-OD1 3.48Å; R124-N147 PolarHBondContact N-OD1 2.69Å; I125-N147 HydrophobicContact CB-CB 4.37Å; I125-N147 WeakPolarHBondContact CB-OD1 3.31Å; I125-N147 WeakPolarHBondContact CG1-OD1 3.29Å; I125-N147 PolarHBondContact N-OD1 3.36Å; I125-N147 VanDerWaalsContact N-OD1 3.13Å; I144-N147 PolarHBondContact O-ND2 3.16Å; S145-N147 PolarHBondContact O-N 3.3Å; S145-N147 PolarHBondContact O-ND2 3.31Å; N147-I149 HydrophobicContact CB-CD1 4.17Å; N147-I149 HydrophobicContact CB-CG1 3.96Å; N147-D170 VanDerWaalsContact C-CG 3.44Å
148	K	94.2	Very high	94.8	Very high	74 Å²	74	40.9 Å²	40.9	32%	0.322	21%	0.205	S	C	.	.			trans	-130.4	28.9	168.4	-67.4	-76.4	126.3	-97.9	0	110.2	R124 I125 K126 V150 D170 D172	R124-K148 HydrophobicContact CB-CG 4.32Å; I125-K148 CarbonylContact O-C 3.42Å; I125-K148 WeakPolarHBondContact O-CA 3.35Å; I125-K148 PolarHBondContact O-N 2.98Å; K126-K148 WeakPolarHBondContact CA-O 3.2Å; K126-K148 HydrophobicContact CG-CB 3.96Å; K148-V150 PolarHBondContact O-N 3.41Å; K148-D170 WeakPolarHBondContact CA-OD2 3.23Å; K148-D170 PolarHBondContact N-OD2 3.32Å; K148-D170 IonicContact NZ-OD1 3.68Å; K148-D170 PolarHBondContact NZ-OD1 3.32Å; K148-D170 IonicContact NZ-OD2 3.79Å; K148-D172 WeakPolarHBondContact CD-OD2 3.27Å; K148-D172 IonicContact NZ-OD2 2.71Å; K148-D172 PolarHBondContact NZ-OD2 3.13Å
149	I	93.4	Very high	94.7	Very high	4 Å²	4	40.4 Å²	40.4	2%	0.021	20%	0.203	C	C	.	.			trans	-79.3	120.7	-170.4	-60.2	173.9	0	0	0	109	I125 I128 I144 N147 L152 D170 D172 L173	I125-I149 WeakPolarHBondContact O-CG1 3.36Å; I125-I149 PolarHBondContact O-N 3.2Å; I128-I149 HydrophobicContact CD1-CD1 4.41Å; I144-I149 HydrophobicContact CD1-CD1 4.13Å; N147-I149 HydrophobicContact CB-CD1 4.17Å; N147-I149 HydrophobicContact CB-CG1 3.96Å; I149-L152 HydrophobicContact CG2-CD2 3.99Å; I149-D170 PolarHBondContact N-OD2 2.97Å; I149-D172 CarbonylContact O-C 3.47Å; I149-L173 HydrophobicContact CG2-CD1 4.24Å; I149-L173 VanDerWaalsContact O-CA 3.26Å; I149-L173 WeakPolarHBondContact O-CA 3.49Å; I149-L173 WeakPolarHBondContact O-CB 3.37Å; I149-L173 PolarHBondContact O-N 3Å
150	V	92.4	Very high	94.6	Very high	74 Å²	74	40.4 Å²	40.4	45%	0.448	20%	0.203	S	C	.	.			trans	-91	-35.6	-177.3	-172.4	0	0	0	0	112.6	K148 D172 V174	K148-V150 PolarHBondContact O-N 3.41Å; V150-D172 WeakPolarHBondContact CA-O 2.89Å; V150-D172 HydrophobicContact CG2-CB 4.43Å; V150-V174 PolarHBondContact O-N 2.93Å
151	I	92.4	Very high	94.4	Very high	71 Å²	71	42.1 Å²	42.1	36%	0.364	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	136	-174.5	-57.7	177.1	0	0	0	109.8	L153 Y175	I151-L153 HydrophobicContact CG2-CD2 4.05Å; I151-Y175 WeakPolarHBondContact CA-O 3.3Å; I151-Y175 HydrophobicContact CG2-CD1 3.94Å
152	L	94.6	Very high	94.3	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	121.1	162.2	-59.5	-178.9	0	0	0	109.3	I149 M156 F157 V168 L173 Y175 I176 S177 A180 F181	I149-L152 HydrophobicContact CG2-CD2 3.99Å; L152-M156 HydrophobicContact CD2-CE 4.41Å; L152-M156 HydrophobicContact CD2-SD 3.71Å; L152-F157 HydrophobicContact CD2-CZ 4.39Å; L152-V168 HydrophobicContact CD1-CG1 4.28Å; L152-V168 HydrophobicContact CD1-CG2 3.91Å; L152-V168 HydrophobicContact CD2-CG2 4.02Å; L152-V168 HydrophobicContact CG-CG2 4.49Å; L152-L173 HydrophobicContact CD1-CD2 4.39Å; L152-L173 HydrophobicContact CG-CD1 3.99Å; L152-L173 HydrophobicContact CG-CD2 4.4Å; L152-Y175 PolarHBondContact N-O 3.26Å; L152-Y175 VanDerWaalsContact N-O 3.13Å; L152-I176 HydrophobicContact CB-CG1 4.42Å; L152-I176 HydrophobicContact CB-CG2 4.29Å; L152-I176 HydrophobicContact CD1-CD1 4.09Å; L152-I176 HydrophobicContact CD1-CG1 3.97Å; L152-I176 HydrophobicContact CD1-CG2 4.26Å; L152-I176 HydrophobicContact CG-CG1 4.3Å; L152-S177 WeakPolarHBondContact O-CB 3.48Å; L152-S177 PolarHBondContact O-N 3.29Å; L152-S177 PolarHBondContact O-OG 2.83Å; L152-A180 HydrophobicContact CB-CB 3.9Å; L152-F181 HydrophobicContact CD1-CE1 4.05Å; L152-F181 HydrophobicContact CD1-CZ 4.02Å
153	L	93.6	Very high	94.3	Very high	85 Å²	85	39.9 Å²	39.9	45%	0.445	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-88.1	160.5	-178	-62.2	175	0	0	0	111.5	L127 I151 Y155 M156 A180	L127-L153 HydrophobicContact CD1-CD1 3.75Å; I151-L153 HydrophobicContact CG2-CD2 4.05Å; L153-Y155 PolarHBondContact O-N 3.17Å; L153-M156 HydrophobicContact CB-CE 4.19Å; L153-M156 HydrophobicContact CG-CE 4.36Å; L153-M156 WeakPolarHBondContact O-CB 3.29Å; L153-M156 PolarHBondContact O-N 3.08Å; L153-A180 WeakPolarHBondContact O-CA 3.34Å
154	D	95	Very high	94.3	Very high	74 Å²	74	44.5 Å²	44.5	40%	0.396	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	137.1	177.2	-73.5	-19.8	0	0	0	110.7	M156 S177 R179	D154-M156 PolarHBondContact O-N 2.84Å; D154-M156 VanDerWaalsContact O-N 3.16Å; D154-S177 WeakPolarHBondContact CA-OG 3.3Å; D154-S177 PolarHBondContact N-OG 3.41Å; D154-S177 WeakPolarHBondContact OD1-CB 3.19Å; D154-S177 PolarHBondContact OD1-OG 2.94Å; D154-R179 HydrophobicContact CB-CB 4.07Å; D154-R179 WeakPolarHBondContact OD1-CA 3.45Å; D154-R179 WeakPolarHBondContact OD1-CB 3.38Å; D154-R179 PolarHBondContact OD1-N 3.45Å
155	Y	94	Very high	94.4	Very high	80 Å²	80	45.3 Å²	45.3	31%	0.314	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	14.9	176.2	-48.5	-70.7	0	0	0	115.9	L153 F157 Q158 R179	L153-Y155 PolarHBondContact O-N 3.17Å; Y155-F157 PolarHBondContact O-N 3.22Å; Y155-F157 VanDerWaalsContact O-N 3.1Å; Y155-Q158 VanDerWaalsContact O-CB 3.29Å; Y155-Q158 WeakPolarHBondContact O-CB 3.46Å; Y155-Q158 PolarHBondContact O-N 3.27Å; Y155-R179 HydrophobicContact CE1-CB 4.31Å; Y155-R179 PolarHBondContact N-O 2.78Å; Y155-R179 WeakPolarHBondContact OH-CD 3.28Å; Y155-R179 PolarHBondContact OH-NH1 3.09Å
156	M	92.7	Very high	94.5	Very high	14 Å²	14	45.1 Å²	45.1	7%	0.069	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-32.9	-179.6	178.9	177.1	-76.8	0	0	113.6	L127 L152 L153 D154	L127-M156 HydrophobicContact CD1-CE 4.44Å; L152-M156 HydrophobicContact CD2-CE 4.41Å; L152-M156 HydrophobicContact CD2-SD 3.71Å; L153-M156 HydrophobicContact CB-CE 4.19Å; L153-M156 HydrophobicContact CG-CE 4.36Å; L153-M156 WeakPolarHBondContact O-CB 3.29Å; L153-M156 PolarHBondContact O-N 3.08Å; D154-M156 PolarHBondContact O-N 2.84Å; D154-M156 VanDerWaalsContact O-N 3.16Å
157	F	94.1	Very high	94.6	Very high	1 Å²	1	46.4 Å²	46.4	0%	0.004	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.1	20.6	-179.1	-51.7	-72	0	0	0	113.4	F133 L142 I144 L152 Y155 D159 L160 L166 F181 L184	F133-F157 HydrophobicContact CE2-CD1 4.19Å; F133-F157 HydrophobicContact CE2-CE1 4.2Å; L142-F157 HydrophobicContact CD2-CD1 4.27Å; L142-F157 HydrophobicContact CD2-CE1 4.16Å; I144-F157 HydrophobicContact CD1-CE1 3.84Å; I144-F157 HydrophobicContact CD1-CZ 3.65Å; L152-F157 HydrophobicContact CD2-CZ 4.39Å; Y155-F157 PolarHBondContact O-N 3.22Å; Y155-F157 VanDerWaalsContact O-N 3.1Å; F157-D159 PolarHBondContact O-N 2.98Å; F157-L160 HydrophobicContact CD1-CD1 4.13Å; F157-L160 PolarHBondContact O-N 3.02Å; F157-L160 VanDerWaalsContact O-N 3.14Å; F157-L166 HydrophobicContact CD2-CD2 4.32Å; F157-L166 HydrophobicContact CE1-CD1 4.4Å; F157-L166 HydrophobicContact CE2-CD2 4.21Å; F157-L166 HydrophobicContact CZ-CD2 4.39Å; F157-F181 HydrophobicContact CD2-CD1 4.24Å; F157-F181 HydrophobicContact CE2-CD1 4.34Å; F157-F181 HydrophobicContact CE2-CE1 4.28Å; F157-L184 HydrophobicContact CB-CD1 3.98Å; F157-L184 HydrophobicContact CB-CD2 3.69Å; F157-L184 HydrophobicContact CB-CG 3.85Å; F157-L184 HydrophobicContact CD2-CD1 4.24Å; F157-L184 HydrophobicContact CG-CD1 4.31Å
158	Q	93	Very high	94.7	Very high	109 Å²	109	46.4 Å²	46.4	51%	0.509	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-32.7	-172.8	179.3	175.6	-7.7	0	0	113.3	Y155 L160	Y155-Q158 VanDerWaalsContact O-CB 3.29Å; Y155-Q158 WeakPolarHBondContact O-CB 3.46Å; Y155-Q158 PolarHBondContact O-N 3.27Å; Q158-L160 VanDerWaalsContact C-N 3.31Å; Q158-L160 PolarHBondContact O-N 3.18Å
159	D	91.1	Very high	94.4	Very high	58 Å²	58	43 Å²	43	31%	0.31	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-23	-177.9	-59.8	-43.4	0	0	0	112.8	T134 F157 H161	T134-D159 VanDerWaalsContact CG2-OD2 3.27Å; T134-D159 WeakPolarHBondContact CG2-OD2 3.15Å; F157-D159 PolarHBondContact O-N 2.98Å; D159-H161 VanDerWaalsContact C-N 3.31Å; D159-H161 PolarHBondContact O-N 3.16Å; D159-H161 PolarHBondContact O-ND1 3.19Å
160	L	94.2	Very high	94.2	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.211	C	C	.	.			trans	-88.6	56.1	-171.9	-60.6	179.3	0	0	0	112.7	F133 L136 L139 L142 F157 Q158 N162 L163 L184	F133-L160 HydrophobicContact CB-CD1 4.31Å; F133-L160 HydrophobicContact CB-CD2 3.88Å; F133-L160 HydrophobicContact CB-CG 4.02Å; F133-L160 HydrophobicContact CD2-CD1 3.94Å; F133-L160 HydrophobicContact CD2-CG 4.47Å; F133-L160 HydrophobicContact CE2-CD1 4.37Å; F133-L160 HydrophobicContact CG-CD1 4.06Å; F133-L160 HydrophobicContact CG-CD2 4.34Å; F133-L160 HydrophobicContact CG-CG 4.32Å; L136-L160 HydrophobicContact CB-CD2 3.98Å; L136-L160 WeakPolarHBondContact O-CD2 3.35Å; L139-L160 HydrophobicContact CB-CD2 4.23Å; L139-L160 HydrophobicContact CD2-CD1 4.42Å; L139-L160 HydrophobicContact CD2-CD2 3.92Å; L142-L160 HydrophobicContact CD2-CD1 3.58Å; F157-L160 HydrophobicContact CD1-CD1 4.13Å; F157-L160 PolarHBondContact O-N 3.02Å; F157-L160 VanDerWaalsContact O-N 3.14Å; Q158-L160 VanDerWaalsContact C-N 3.31Å; Q158-L160 PolarHBondContact O-N 3.18Å; L160-N162 VanDerWaalsContact C-N 3.32Å; L160-N162 PolarHBondContact O-N 3.05Å; L160-L163 HydrophobicContact CB-CB 4.08Å; L160-L163 HydrophobicContact CB-CD2 4.41Å; L160-L163 HydrophobicContact CD1-CD2 4.21Å; L160-L163 VanDerWaalsContact O-CB 3.28Å; L160-L163 WeakPolarHBondContact O-CB 3.48Å; L160-L163 PolarHBondContact O-N 3.36Å; L160-L184 HydrophobicContact CB-CD2 4.09Å; L160-L184 WeakPolarHBondContact O-CD2 3.49Å
161	H	93.1	Very high	93.9	Very high	72 Å²	72	44.4 Å²	44.4	33%	0.333	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-24.3	-173.3	50.6	-86.4	0	0	0	114.9	D159 S186	D159-H161 VanDerWaalsContact C-N 3.31Å; D159-H161 PolarHBondContact O-N 3.16Å; D159-H161 PolarHBondContact O-ND1 3.19Å; H161-S186 VanDerWaalsContact O-CB 3.25Å; H161-S186 WeakPolarHBondContact O-CB 3.23Å; H161-S186 PolarHBondContact O-N 2.97Å; H161-S186 PolarHBondContact O-OG 2.7Å
162	N	95.6	Very high	93.8	Very high	62 Å²	62	44.2 Å²	44.2	33%	0.332	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	3.2	177.6	-64.8	-40.3	0	0	0	113.7	T137 L139 L160 R164	T137-N162 WeakPolarHBondContact O-CB 3.34Å; T137-N162 PolarHBondContact O-ND2 3.1Å; L139-N162 CarbonylContact O-C 3.19Å; L160-N162 VanDerWaalsContact C-N 3.32Å; L160-N162 PolarHBondContact O-N 3.05Å; N162-R164 PolarHBondContact O-N 2.69Å
163	L	97.2	Very high	93.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.216	C	C	.	.			trans	-62.9	130	179.8	-161.9	73.9	0	0	0	110.1	L139 L142 L160 L166 L184 S186 L187	L139-L163 HydrophobicContact CB-CD1 4.49Å; L139-L163 HydrophobicContact CD2-CD1 4.08Å; L139-L163 HydrophobicContact CG-CD1 4.08Å; L139-L163 WeakPolarHBondContact O-CA 3.34Å; L139-L163 PolarHBondContact O-N 3.36Å; L142-L163 HydrophobicContact CB-CD1 3.76Å; L142-L163 HydrophobicContact CB-CD2 4.16Å; L160-L163 HydrophobicContact CB-CB 4.08Å; L160-L163 HydrophobicContact CB-CD2 4.41Å; L160-L163 HydrophobicContact CD1-CD2 4.21Å; L160-L163 VanDerWaalsContact O-CB 3.28Å; L160-L163 WeakPolarHBondContact O-CB 3.48Å; L160-L163 PolarHBondContact O-N 3.36Å; L163-L166 HydrophobicContact CD2-CB 3.94Å; L163-L166 HydrophobicContact CD2-CD1 4.2Å; L163-L166 HydrophobicContact CD2-CG 4.46Å; L163-L184 HydrophobicContact CB-CD2 4.05Å; L163-L184 HydrophobicContact CD2-CD2 3.81Å; L163-S186 CarbonylContact O-C 3.17Å; L163-L187 HydrophobicContact CB-CD1 4.32Å; L163-L187 HydrophobicContact CD2-CD1 4Å; L163-L187 HydrophobicContact CG-CD1 4.06Å; L163-L187 VanDerWaalsContact O-CA 3.23Å; L163-L187 WeakPolarHBondContact O-CA 3.46Å; L163-L187 PolarHBondContact O-N 3.33Å; L163-L187 VanDerWaalsContact O-N 3.1Å
164	R	97.8	Very high	93.7	Very high	122 Å²	122	43.8 Å²	43.8	46%	0.46	22%	0.216	S	C	.	.			trans	-105.4	-38.9	-179.1	-68.4	-180	173.6	-96.6	-4.5	111.9	T140 N162 E188 E189	T140-R164 WeakPolarHBondContact O-CA 3.36Å; T140-R164 PolarHBondContact O-N 3.27Å; N162-R164 PolarHBondContact O-N 2.69Å; R164-E188 IonicContact CZ-OE1 3.5Å; R164-E188 IonicContact NH1-OE1 3.91Å; R164-E188 PolarHBondContact NH1-OE1 3.05Å; R164-E188 IonicContact NH1-OE2 2.84Å; R164-E188 PolarHBondContact NH1-OE2 2.97Å; R164-E188 PolarHBondContact O-N 3.33Å; R164-E189 PolarHBondContact O-N 2.88Å
165	S	98.4	Very high	93.5	Very high	18 Å²	18	45.6 Å²	45.6	13%	0.126	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	130.4	179.3	-173.7	0	0	0	0	110.9	T140 Q141 L142 E189	T140-S165 PolarHBondContact O-N 3.06Å; Q141-S165 WeakPolarHBondContact CA-O 3.15Å; L142-S165 PolarHBondContact N-O 2.98Å; L142-S165 VanDerWaalsContact N-O 3.08Å; S165-E189 WeakPolarHBondContact CA-O 3.48Å
166	L	98.1	Very high	93.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	121.8	176.2	177.1	60.7	0	0	0	109.5	L142 F157 L163 F181 L184 L187 E189 L190 T191	L142-L166 HydrophobicContact CB-CD1 4.15Å; L142-L166 HydrophobicContact CD2-CD1 4Å; L142-L166 HydrophobicContact CG-CD1 4.09Å; L142-L166 WeakPolarHBondContact O-CA 3.26Å; F157-L166 HydrophobicContact CD2-CD2 4.32Å; F157-L166 HydrophobicContact CE1-CD1 4.4Å; F157-L166 HydrophobicContact CE2-CD2 4.21Å; F157-L166 HydrophobicContact CZ-CD2 4.39Å; L163-L166 HydrophobicContact CD2-CB 3.94Å; L163-L166 HydrophobicContact CD2-CD1 4.2Å; L163-L166 HydrophobicContact CD2-CG 4.46Å; L166-F181 HydrophobicContact CD2-CD1 4.26Å; L166-F181 HydrophobicContact CD2-CE1 4.12Å; L166-L184 HydrophobicContact CD2-CD1 3.79Å; L166-L187 HydrophobicContact CB-CD1 3.78Å; L166-L187 HydrophobicContact CB-CD2 4.33Å; L166-E189 PolarHBondContact N-O 3.16Å; L166-E189 VanDerWaalsContact N-O 3.08Å; L166-L190 HydrophobicContact CB-CD1 4.09Å; L166-L190 HydrophobicContact CD2-CD1 4.04Å; L166-L190 HydrophobicContact CG-CD1 4.06Å; L166-L190 WeakPolarHBondContact O-CA 3.41Å; L166-T191 PolarHBondContact O-N 3.34Å
167	E	97.6	Very high	93.7	Very high	55 Å²	55	42 Å²	42	26%	0.257	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	119.6	167.1	-58.6	-164.7	-172.8	0	0	109.6	L142 D143 I144	L142-E167 PolarHBondContact O-N 2.85Å; D143-E167 HydrophobicContact CB-CB 4.22Å; I144-E167 WeakPolarHBondContact CG1-O 3.43Å; I144-E167 PolarHBondContact N-O 3.02Å
168	V	95.5	Very high	93.8	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.012	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	143.7	176.6	64	0	0	0	0	109.6	I144 L152 F181 L190 T191 L192 E193	I144-V168 HydrophobicContact CD1-CB 4.08Å; I144-V168 HydrophobicContact CD1-CG2 3.67Å; I144-V168 HydrophobicContact CG1-CB 3.95Å; I144-V168 HydrophobicContact CG1-CG2 3.91Å; L152-V168 HydrophobicContact CD1-CG1 4.28Å; L152-V168 HydrophobicContact CD1-CG2 3.91Å; L152-V168 HydrophobicContact CD2-CG2 4.02Å; L152-V168 HydrophobicContact CG-CG2 4.49Å; V168-F181 HydrophobicContact CG1-CE1 4.46Å; V168-L190 HydrophobicContact CG1-CD1 4.29Å; V168-T191 PolarHBondContact N-O 3.38Å; V168-L192 HydrophobicContact CG1-CD2 3.26Å; V168-L192 VanDerWaalsContact O-CA 3.3Å; V168-L192 WeakPolarHBondContact O-CA 3.5Å; V168-E193 PolarHBondContact O-N 3.35Å
169	G	88.6	Confident	94	Very high	3 Å²	3	47.9 Å²	47.9	3%	0.031	23%	0.227	C	C	.	.			trans	159.1	134.2	-176.6	0	0	0	0	0	113.2	S145 D146 E193	S145-G169 CarbonylContact C-O 3.3Å; S145-G169 WeakPolarHBondContact CA-O 3.38Å; D146-G169 PolarHBondContact N-O 2.88Å; G169-E193 CarbonylContact C-O 3.3Å; G169-E193 VanDerWaalsContact C-O 3.27Å; G169-E193 WeakPolarHBondContact CA-O 3.47Å
170	D	88.5	Confident	94.2	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.021	21%	0.213	C	C	.	.			trans	-160.2	150.5	177.8	-177	11.7	0	0	0	109.3	N147 K148 I149 D172 L173 E193 R194 C195	N147-D170 VanDerWaalsContact C-CG 3.44Å; K148-D170 WeakPolarHBondContact CA-OD2 3.23Å; K148-D170 PolarHBondContact N-OD2 3.32Å; K148-D170 IonicContact NZ-OD1 3.68Å; K148-D170 PolarHBondContact NZ-OD1 3.32Å; K148-D170 IonicContact NZ-OD2 3.79Å; I149-D170 PolarHBondContact N-OD2 2.97Å; D170-D172 PolarHBondContact O-N 3.39Å; D170-D172 VanDerWaalsContact O-N 3.13Å; D170-L173 WeakPolarHBondContact O-CB 3.46Å; D170-L173 PolarHBondContact O-N 3.48Å; D170-E193 PolarHBondContact N-O 2.9Å; D170-R194 CarbonylContact C-O 3.41Å; D170-C195 WeakPolarHBondContact O-CA 3.36Å
171	N	87.6	Confident	94.3	Very high	102 Å²	102	45.1 Å²	45.1	55%	0.545	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-27	177.6	-66.1	-42.9	0	0	0	112.3	R194	N171-R194 WeakPolarHBondContact CA-O 2.99Å; N171-R194 PolarHBondContact N-O 2.83Å; N171-R194 VanDerWaalsContact N-O 3.12Å
172	D	89.9	Confident	94.4	Very high	67 Å²	67	43.2 Å²	43.2	36%	0.358	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-9	179.2	-61.5	-48.4	0	0	0	113	K148 I149 V150 D170 V174	K148-D172 WeakPolarHBondContact CD-OD2 3.27Å; K148-D172 IonicContact NZ-OD2 2.71Å; K148-D172 PolarHBondContact NZ-OD2 3.13Å; I149-D172 CarbonylContact O-C 3.47Å; V150-D172 WeakPolarHBondContact CA-O 2.89Å; V150-D172 HydrophobicContact CG2-CB 4.43Å; D170-D172 PolarHBondContact O-N 3.39Å; D170-D172 VanDerWaalsContact O-N 3.13Å; D172-V174 WeakPolarHBondContact O-CG2 3.49Å; D172-V174 PolarHBondContact O-N 3Å; D172-V174 VanDerWaalsContact O-N 3.16Å
173	L	92.5	Very high	94.3	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	20%	0.202	C	C	.	.			trans	-76.2	105.2	-177.7	-175.3	66	0	0	0	110.6	I149 L152 D170 I176 C195 N196	I149-L173 HydrophobicContact CG2-CD1 4.24Å; I149-L173 VanDerWaalsContact O-CA 3.26Å; I149-L173 WeakPolarHBondContact O-CA 3.49Å; I149-L173 WeakPolarHBondContact O-CB 3.37Å; I149-L173 PolarHBondContact O-N 3Å; L152-L173 HydrophobicContact CD1-CD2 4.39Å; L152-L173 HydrophobicContact CG-CD1 3.99Å; L152-L173 HydrophobicContact CG-CD2 4.4Å; D170-L173 WeakPolarHBondContact O-CB 3.46Å; D170-L173 PolarHBondContact O-N 3.48Å; L173-I176 HydrophobicContact CD2-CD1 4.14Å; L173-I176 HydrophobicContact CD2-CG1 4.18Å; L173-C195 HydrophobicContact CB-CB 4.38Å; L173-C195 HydrophobicContact CD2-CB 4.32Å; L173-N196 CarbonylContact O-C 3.15Å; L173-N196 PolarHBondContact O-N 3.06Å
174	V	92.3	Very high	94.2	Very high	76 Å²	76	41.5 Å²	41.5	46%	0.461	20%	0.203	S	C	.	.			trans	-102.6	-27	-176.7	-176.3	0	0	0	0	112.4	V150 D172 L197	V150-V174 PolarHBondContact O-N 2.93Å; D172-V174 WeakPolarHBondContact O-CG2 3.49Å; D172-V174 PolarHBondContact O-N 3Å; D172-V174 VanDerWaalsContact O-N 3.16Å; V174-L197 WeakPolarHBondContact O-CD2 3.38Å
175	Y	92.4	Very high	94	Very high	112 Å²	112	41.2 Å²	41.2	44%	0.439	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	137.6	-173.2	-174.9	-107.1	0	0	0	112.9	I151 L152	I151-Y175 WeakPolarHBondContact CA-O 3.3Å; I151-Y175 HydrophobicContact CG2-CD1 3.94Å; L152-Y175 PolarHBondContact N-O 3.26Å; L152-Y175 VanDerWaalsContact N-O 3.13Å
176	I	95.4	Very high	93.9	Very high	8 Å²	8	42.2 Å²	42.2	4%	0.041	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	118.4	172.5	-60.9	178.4	0	0	0	106.9	L152 L173 A180 F181 L192 L197 P201 A204	L152-I176 HydrophobicContact CB-CG1 4.42Å; L152-I176 HydrophobicContact CB-CG2 4.29Å; L152-I176 HydrophobicContact CD1-CD1 4.09Å; L152-I176 HydrophobicContact CD1-CG1 3.97Å; L152-I176 HydrophobicContact CD1-CG2 4.26Å; L152-I176 HydrophobicContact CG-CG1 4.3Å; L173-I176 HydrophobicContact CD2-CD1 4.14Å; L173-I176 HydrophobicContact CD2-CG1 4.18Å; I176-A180 HydrophobicContact CG2-CB 3.76Å; I176-F181 HydrophobicContact CD1-CZ 4.38Å; I176-F181 HydrophobicContact CG2-CE2 3.9Å; I176-F181 HydrophobicContact CG2-CZ 4.16Å; I176-L192 HydrophobicContact CD1-CD1 4.34Å; I176-L192 HydrophobicContact CD1-CD2 4.49Å; I176-L197 HydrophobicContact CD1-CD1 3.98Å; I176-L197 HydrophobicContact CD1-CD2 4.4Å; I176-L197 HydrophobicContact CG1-CD2 4.22Å; I176-P201 HydrophobicContact CB-CB 4.18Å; I176-P201 HydrophobicContact CD1-CB 4.43Å; I176-P201 HydrophobicContact CD1-CG 4.13Å; I176-P201 HydrophobicContact CG2-CB 4.44Å; I176-A204 HydrophobicContact CG2-CB 3.8Å
177	S	95.5	Very high	93.9	Very high	11 Å²	11	42.3 Å²	42.3	8%	0.077	22%	0.218	C	C	.	.			trans	-67.6	157	179.8	74.6	0	0	0	0	112	L152 D154 R179 A180 A204	L152-S177 WeakPolarHBondContact O-CB 3.48Å; L152-S177 PolarHBondContact O-N 3.29Å; L152-S177 PolarHBondContact O-OG 2.83Å; D154-S177 WeakPolarHBondContact CA-OG 3.3Å; D154-S177 PolarHBondContact N-OG 3.41Å; D154-S177 WeakPolarHBondContact OD1-CB 3.19Å; D154-S177 PolarHBondContact OD1-OG 2.94Å; S177-R179 PolarHBondContact O-N 3.06Å; S177-R179 VanDerWaalsContact O-N 3.16Å; S177-A180 WeakPolarHBondContact O-CB 3.24Å; S177-A180 PolarHBondContact O-N 3.1Å; S177-A180 PolarHBondContact OG-N 3.49Å; S177-A204 WeakPolarHBondContact O-CB 3.39Å
178	H	95.9	Very high	93.9	Very high	107 Å²	107	43.7 Å²	43.7	50%	0.495	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-26.2	-172.9	-60.7	-31.7	0	0	0	114	E203 A204 H207	H178-E203 HydrophobicContact CB-CB 4.41Å; H178-A204 WeakPolarHBondContact O-CA 3.15Å; H178-H207 PolarHBondContact O-CE1 3.42Å; H178-H207 PolarHBondContact O-ND1 3.28Å; H178-H207 VanDerWaalsContact O-ND1 3.15Å
179	R	96.5	Very high	94	Very high	125 Å²	125	47.1 Å²	47.1	47%	0.472	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	19.1	179.8	-53.6	-176.7	-179.7	-160.6	-3.9	112.4	D154 Y155 S177 F181 S182	D154-R179 HydrophobicContact CB-CB 4.07Å; D154-R179 WeakPolarHBondContact OD1-CA 3.45Å; D154-R179 WeakPolarHBondContact OD1-CB 3.38Å; D154-R179 PolarHBondContact OD1-N 3.45Å; Y155-R179 HydrophobicContact CE1-CB 4.31Å; Y155-R179 PolarHBondContact N-O 2.78Å; Y155-R179 WeakPolarHBondContact OH-CD 3.28Å; Y155-R179 PolarHBondContact OH-NH1 3.09Å; S177-R179 PolarHBondContact O-N 3.06Å; S177-R179 VanDerWaalsContact O-N 3.16Å; R179-F181 VanDerWaalsContact C-N 3.28Å; R179-F181 PolarHBondContact O-N 2.89Å; R179-S182 WeakPolarHBondContact O-CB 3.43Å; R179-S182 PolarHBondContact O-N 3.32Å
180	A	96	Very high	94.5	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-43.1	179.6	0	0	0	0	0	112.8	L152 L153 I176 S177 S182	L152-A180 HydrophobicContact CB-CB 3.9Å; L153-A180 WeakPolarHBondContact O-CA 3.34Å; I176-A180 HydrophobicContact CG2-CB 3.76Å; S177-A180 WeakPolarHBondContact O-CB 3.24Å; S177-A180 PolarHBondContact O-N 3.1Å; S177-A180 PolarHBondContact OG-N 3.49Å; A180-S182 VanDerWaalsContact C-N 3.33Å
181	F	96.5	Very high	94.9	Very high	1 Å²	1	47 Å²	47	0%	0.004	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	11	179.5	-56.2	-53.5	0	0	0	113.9	L152 F157 L166 V168 I176 R179 G183 L184 L190 L192 A204 L205 L208	L152-F181 HydrophobicContact CD1-CE1 4.05Å; L152-F181 HydrophobicContact CD1-CZ 4.02Å; F157-F181 HydrophobicContact CD2-CD1 4.24Å; F157-F181 HydrophobicContact CE2-CD1 4.34Å; F157-F181 HydrophobicContact CE2-CE1 4.28Å; L166-F181 HydrophobicContact CD2-CD1 4.26Å; L166-F181 HydrophobicContact CD2-CE1 4.12Å; V168-F181 HydrophobicContact CG1-CE1 4.46Å; I176-F181 HydrophobicContact CD1-CZ 4.38Å; I176-F181 HydrophobicContact CG2-CE2 3.9Å; I176-F181 HydrophobicContact CG2-CZ 4.16Å; R179-F181 VanDerWaalsContact C-N 3.28Å; R179-F181 PolarHBondContact O-N 2.89Å; F181-G183 PolarHBondContact O-N 2.92Å; F181-L184 HydrophobicContact CB-CD1 4.18Å; F181-L184 HydrophobicContact CD1-CD1 3.98Å; F181-L184 PolarHBondContact O-N 3.24Å; F181-L190 HydrophobicContact CE1-CD1 4.44Å; F181-L190 HydrophobicContact CE2-CD2 4.33Å; F181-L190 HydrophobicContact CZ-CD2 4.31Å; F181-L192 HydrophobicContact CZ-CD2 4.15Å; F181-A204 HydrophobicContact CD2-CB 3.9Å; F181-A204 HydrophobicContact CE2-CB 4.13Å; F181-L205 HydrophobicContact CE2-CD2 4.32Å; F181-L208 HydrophobicContact CB-CD1 4.31Å; F181-L208 HydrophobicContact CB-CD2 3.86Å; F181-L208 HydrophobicContact CB-CG 4.08Å; F181-L208 HydrophobicContact CD2-CD1 4.23Å; F181-L208 HydrophobicContact CG-CD1 4.28Å
182	S	95.4	Very high	95.4	Very high	31 Å²	31	42.1 Å²	42.1	22%	0.217	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	131.3	177.9	-164.2	0	0	0	0	110.4	R179 A180	R179-S182 WeakPolarHBondContact O-CB 3.43Å; R179-S182 PolarHBondContact O-N 3.32Å; A180-S182 VanDerWaalsContact C-N 3.33Å
183	G	92.1	Very high	95.6	Very high	21 Å²	21	40 Å²	40	22%	0.216	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	102.2	-15.4	-176.4	0	0	0	0	0	114.5	F181 L185	F181-G183 PolarHBondContact O-N 2.92Å; G183-L185 PolarHBondContact O-N 3.13Å
184	L	95.6	Very high	95.5	Very high	5 Å²	5	43.9 Å²	43.9	3%	0.026	22%	0.215	C	C	.	.			trans	-77.2	66.8	174.7	-66.6	178.6	0	0	0	111.8	F157 L160 L163 L166 F181 S186 L187 L208	F157-L184 HydrophobicContact CB-CD1 3.98Å; F157-L184 HydrophobicContact CB-CD2 3.69Å; F157-L184 HydrophobicContact CB-CG 3.85Å; F157-L184 HydrophobicContact CD2-CD1 4.24Å; F157-L184 HydrophobicContact CG-CD1 4.31Å; L160-L184 HydrophobicContact CB-CD2 4.09Å; L160-L184 WeakPolarHBondContact O-CD2 3.49Å; L163-L184 HydrophobicContact CB-CD2 4.05Å; L163-L184 HydrophobicContact CD2-CD2 3.81Å; L166-L184 HydrophobicContact CD2-CD1 3.79Å; F181-L184 HydrophobicContact CB-CD1 4.18Å; F181-L184 HydrophobicContact CD1-CD1 3.98Å; F181-L184 PolarHBondContact O-N 3.24Å; L184-S186 VanDerWaalsContact C-N 3.35Å; L184-S186 PolarHBondContact O-N 3.08Å; L184-L187 HydrophobicContact CB-CB 4.13Å; L184-L187 HydrophobicContact CD1-CD2 4.09Å; L184-L208 HydrophobicContact CB-CD2 3.94Å; L184-L208 HydrophobicContact CD1-CD2 4.4Å
185	L	93	Very high	95.4	Very high	116 Å²	116	40.4 Å²	40.4	61%	0.607	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-28.6	-171.9	-60.8	179.1	0	0	0	113.5	G183 N210	G183-L185 PolarHBondContact O-N 3.13Å; L185-N210 PolarHBondContact O-ND2 2.81Å
186	S	96.3	Very high	95.4	Very high	40 Å²	40	39 Å²	39	28%	0.28	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	7.4	-175.4	-52.7	0	0	0	0	113.9	H161 L163 L184 E188	H161-S186 VanDerWaalsContact O-CB 3.25Å; H161-S186 WeakPolarHBondContact O-CB 3.23Å; H161-S186 PolarHBondContact O-N 2.97Å; H161-S186 PolarHBondContact O-OG 2.7Å; L163-S186 CarbonylContact O-C 3.17Å; L184-S186 VanDerWaalsContact C-N 3.35Å; L184-S186 PolarHBondContact O-N 3.08Å; S186-E188 PolarHBondContact O-N 3.47Å
187	L	97.8	Very high	95.1	Very high	1 Å²	1	39 Å²	39	1%	0.005	19%	0.194	C	C	.	.			trans	-69.3	122.4	-173.4	-158.6	78.2	0	0	0	111.1	L163 L166 L184 L190 L208 N210 L211	L163-L187 HydrophobicContact CB-CD1 4.32Å; L163-L187 HydrophobicContact CD2-CD1 4Å; L163-L187 HydrophobicContact CG-CD1 4.06Å; L163-L187 VanDerWaalsContact O-CA 3.23Å; L163-L187 WeakPolarHBondContact O-CA 3.46Å; L163-L187 PolarHBondContact O-N 3.33Å; L163-L187 VanDerWaalsContact O-N 3.1Å; L166-L187 HydrophobicContact CB-CD1 3.78Å; L166-L187 HydrophobicContact CB-CD2 4.33Å; L184-L187 HydrophobicContact CB-CB 4.13Å; L184-L187 HydrophobicContact CD1-CD2 4.09Å; L187-L190 HydrophobicContact CD2-CB 4.13Å; L187-L190 HydrophobicContact CD2-CD1 4.47Å; L187-L208 HydrophobicContact CB-CD2 4.2Å; L187-L208 HydrophobicContact CD2-CD1 4.13Å; L187-L208 HydrophobicContact CD2-CD2 3.66Å; L187-N210 CarbonylContact O-C 3.6Å; L187-L211 HydrophobicContact CD2-CD1 4.16Å; L187-L211 HydrophobicContact CG-CD1 4.36Å; L187-L211 WeakPolarHBondContact O-CA 3.3Å; L187-L211 PolarHBondContact O-N 2.87Å
188	E	98.1	Very high	94.7	Very high	84 Å²	84	43.8 Å²	43.8	39%	0.393	22%	0.223	S	C	.	.			trans	-106.2	-32.4	-178.6	-72.1	171	172.8	0	0	110.9	R164 S186 V212 S213	R164-E188 IonicContact CZ-OE1 3.5Å; R164-E188 IonicContact NH1-OE1 3.91Å; R164-E188 PolarHBondContact NH1-OE1 3.05Å; R164-E188 IonicContact NH1-OE2 2.84Å; R164-E188 PolarHBondContact NH1-OE2 2.97Å; R164-E188 PolarHBondContact O-N 3.33Å; S186-E188 PolarHBondContact O-N 3.47Å; E188-V212 HydrophobicContact CB-CG2 4.44Å; E188-V212 HydrophobicContact CG-CG2 4.47Å; E188-V212 WeakPolarHBondContact O-CA 3.2Å; E188-V212 PolarHBondContact O-N 3.43Å; E188-S213 PolarHBondContact O-N 2.9Å
189	E	98.5	Very high	94.5	Very high	75 Å²	75	41.6 Å²	41.6	35%	0.35	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131.7	-177.3	-175.7	171.2	-170.9	0	0	111.4	R164 S165 L166 S213 H215	R164-E189 PolarHBondContact O-N 2.88Å; S165-E189 WeakPolarHBondContact CA-O 3.48Å; L166-E189 PolarHBondContact N-O 3.16Å; L166-E189 VanDerWaalsContact N-O 3.08Å; E189-S213 WeakPolarHBondContact CA-O 3.33Å; E189-H215 IonicContact OE1-CD2 3.06Å; E189-H215 IonicContact OE1-NE2 2.75Å; E189-H215 PolarHBondContact OE1-NE2 2.96Å
190	L	98.4	Very high	94.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	126.7	174.6	175.8	65.3	0	0	0	109.5	L166 V168 F181 L187 L192 L205 L208 L211 S213 L214 H215	L166-L190 HydrophobicContact CB-CD1 4.09Å; L166-L190 HydrophobicContact CD2-CD1 4.04Å; L166-L190 HydrophobicContact CG-CD1 4.06Å; L166-L190 WeakPolarHBondContact O-CA 3.41Å; V168-L190 HydrophobicContact CG1-CD1 4.29Å; F181-L190 HydrophobicContact CE1-CD1 4.44Å; F181-L190 HydrophobicContact CE2-CD2 4.33Å; F181-L190 HydrophobicContact CZ-CD2 4.31Å; L187-L190 HydrophobicContact CD2-CB 4.13Å; L187-L190 HydrophobicContact CD2-CD1 4.47Å; L190-L192 HydrophobicContact CD1-CD2 4.03Å; L190-L192 HydrophobicContact CD2-CD2 4.31Å; L190-L192 HydrophobicContact CD2-CG 4.27Å; L190-L192 HydrophobicContact CG-CD2 4.23Å; L190-L192 HydrophobicContact CG-CG 4.26Å; L190-L205 HydrophobicContact CD2-CD2 3.51Å; L190-L208 HydrophobicContact CD2-CD1 3.57Å; L190-L211 HydrophobicContact CB-CD1 3.75Å; L190-L211 HydrophobicContact CB-CD2 4.36Å; L190-S213 PolarHBondContact N-O 2.99Å; L190-S213 VanDerWaalsContact N-O 3.09Å; L190-L214 HydrophobicContact CB-CD1 4.14Å; L190-L214 HydrophobicContact CD2-CD1 3.99Å; L190-L214 HydrophobicContact CG-CD1 4.14Å; L190-H215 PolarHBondContact O-N 3Å
191	T	98	Very high	94.4	Very high	3 Å²	3	36.8 Å²	36.8	2%	0.018	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	120.1	170.5	-59.8	0	0	0	0	109.5	L166 V168 E193 H215	L166-T191 PolarHBondContact O-N 3.34Å; V168-T191 PolarHBondContact N-O 3.38Å; T191-E193 HydrophobicContact CG2-CB 4.3Å; T191-H215 WeakPolarHBondContact CA-O 3.43Å; T191-H215 HydrophobicContact CG2-CB 4.1Å
192	L	96.3	Very high	94.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	107	167.7	-58.4	-175.8	0	0	0	108.6	V168 I176 F181 L190 P201 L205 H215 L216 R217	V168-L192 HydrophobicContact CG1-CD2 3.26Å; V168-L192 VanDerWaalsContact O-CA 3.3Å; V168-L192 WeakPolarHBondContact O-CA 3.5Å; I176-L192 HydrophobicContact CD1-CD1 4.34Å; I176-L192 HydrophobicContact CD1-CD2 4.49Å; F181-L192 HydrophobicContact CZ-CD2 4.15Å; L190-L192 HydrophobicContact CD1-CD2 4.03Å; L190-L192 HydrophobicContact CD2-CD2 4.31Å; L190-L192 HydrophobicContact CD2-CG 4.27Å; L190-L192 HydrophobicContact CG-CD2 4.23Å; L190-L192 HydrophobicContact CG-CG 4.26Å; L192-P201 HydrophobicContact CD1-CG 4.09Å; L192-L205 HydrophobicContact CD1-CD2 4.48Å; L192-H215 PolarHBondContact N-O 3.23Å; L192-L216 HydrophobicContact CB-CD2 3.82Å; L192-L216 HydrophobicContact CD1-CD2 3.8Å; L192-L216 HydrophobicContact CG-CD2 4.03Å; L192-L216 CarbonylContact O-C 3.22Å; L192-L216 WeakPolarHBondContact O-CA 3.41Å; L192-R217 PolarHBondContact O-N 3.39Å
193	E	94.3	Very high	94.3	Very high	22 Å²	22	40.2 Å²	40.2	10%	0.103	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	145.5	-177	176.4	165	166.1	0	0	112.4	V168 G169 D170 T191 C195 R217 Y218	V168-E193 PolarHBondContact O-N 3.35Å; G169-E193 CarbonylContact C-O 3.3Å; G169-E193 VanDerWaalsContact C-O 3.27Å; G169-E193 WeakPolarHBondContact CA-O 3.47Å; D170-E193 PolarHBondContact N-O 2.9Å; T191-E193 HydrophobicContact CG2-CB 4.3Å; E193-C195 PolarHBondContact O-N 3.3Å; E193-C195 PolarHBondContact O-SG 3.42Å; E193-R217 CarbonylContact C-O 3.54Å; E193-R217 VanDerWaalsContact CA-O 3.25Å; E193-R217 WeakPolarHBondContact CA-O 3.28Å; E193-R217 HydrophobicContact CB-CB 4.28Å; E193-R217 HydrophobicContact CG-CB 4.2Å; E193-Y218 HydrophobicContact CG-CD2 3.85Å; E193-Y218 WeakPolarHBondContact OE1-CD2 3.29Å
194	R	91.3	Very high	94.5	Very high	84 Å²	84	39.3 Å²	39.3	32%	0.317	21%	0.206	S	C	.	.	S	Bend	trans	56.7	25.1	168.7	-71.9	169	-156.8	179.5	8.2	115.3	D146 D170 N171 R217 Y218	D146-R194 VanDerWaalsContact OD1-CD 3.32Å; D146-R194 WeakPolarHBondContact OD1-CD 3.44Å; D146-R194 IonicContact OD1-CZ 3.41Å; D146-R194 IonicContact OD1-NE 3.36Å; D146-R194 IonicContact OD1-NH1 3.7Å; D146-R194 PolarHBondContact OD1-NH1 3.14Å; D146-R194 IonicContact OD2-CZ 2.78Å; D146-R194 IonicContact OD2-NH1 3.49Å; D146-R194 PolarHBondContact OD2-NH1 2.87Å; D170-R194 CarbonylContact C-O 3.41Å; N171-R194 WeakPolarHBondContact CA-O 2.99Å; N171-R194 PolarHBondContact N-O 2.83Å; N171-R194 VanDerWaalsContact N-O 3.12Å; R194-R217 PolarHBondContact N-O 3.25Å; R194-Y218 WeakPolarHBondContact CA-O 3.36Å; R194-Y218 HydrophobicContact CG-CG 4.21Å
195	C	91.1	Very high	94.6	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.014	21%	0.205	C	C	.	.			trans	-84.9	141.6	-178.4	-45.4	0	0	0	0	111.1	D170 L173 E193 L197 L219	D170-C195 WeakPolarHBondContact O-CA 3.36Å; L173-C195 HydrophobicContact CB-CB 4.38Å; L173-C195 HydrophobicContact CD2-CB 4.32Å; E193-C195 PolarHBondContact O-N 3.3Å; E193-C195 PolarHBondContact O-SG 3.42Å; C195-L197 HydrophobicContact CB-CD1 3.78Å; C195-L197 HydrophobicContact CB-CG 3.61Å; C195-L197 PolarHBondContact O-N 3.13Å; C195-L197 VanDerWaalsContact O-N 3.07Å; C195-L219 HydrophobicContact CB-CD2 3.66Å; C195-L219 VanDerWaalsContact N-CD2 3.32Å
196	N	91.1	Very high	94.7	Very high	83 Å²	83	33.8 Å²	33.8	44%	0.444	18%	0.178	S	C	.	.			trans	-87.1	46.5	172.9	-164	21	0	0	0	111.5	L173	L173-N196 CarbonylContact O-C 3.15Å; L173-N196 PolarHBondContact O-N 3.06Å
197	L	89.9	Confident	94.7	Very high	7 Å²	7	34.8 Å²	34.8	4%	0.037	18%	0.178	C	C	.	.			trans	-78.7	136.2	178.7	-61.6	171.9	0	0	0	109.8	V174 I176 C195 P201 I221	V174-L197 WeakPolarHBondContact O-CD2 3.38Å; I176-L197 HydrophobicContact CD1-CD1 3.98Å; I176-L197 HydrophobicContact CD1-CD2 4.4Å; I176-L197 HydrophobicContact CG1-CD2 4.22Å; C195-L197 HydrophobicContact CB-CD1 3.78Å; C195-L197 HydrophobicContact CB-CG 3.61Å; C195-L197 PolarHBondContact O-N 3.13Å; C195-L197 VanDerWaalsContact O-N 3.07Å; L197-P201 HydrophobicContact CD1-CG 4.43Å; L197-I221 WeakPolarHBondContact O-CG1 3.45Å
198	T	87.8	Confident	94.6	Very high	112 Å²	112	34.8 Å²	34.8	69%	0.687	18%	0.178	S	C	*	.	S	Bend	trans	-82.6	-28.1	175.5	55.4	0	0	0	0	112.5
199	V	91.1	Very high	94.3	Very high	61 Å²	61	35.4 Å²	35.4	37%	0.37	18%	0.181	S	C	.	.	S	Bend	trans	-141.9	150.8	-176.8	-175.7	0	0	0	0	109.5
200	V	94.1	Very high	94.2	Very high	6 Å²	6	34.4 Å²	34.4	4%	0.036	18%	0.178	C	C	.	.			trans	-58.7	127.5	171.2	178.6	0	0	0	0	109.6	T202 L205 I221 L224 F229 W243	V200-T202 PolarHBondContact O-N 3.43Å; V200-T202 PolarHBondContact O-OG1 2.86Å; V200-L205 HydrophobicContact CG1-CD1 3.88Å; V200-I221 HydrophobicContact CG2-CD1 3.82Å; V200-L224 HydrophobicContact CG2-CD2 3.53Å; V200-F229 HydrophobicContact CG1-CE1 4Å; V200-F229 HydrophobicContact CG1-CZ 4.39Å; V200-W243 HydrophobicContact CG2-CH2 3.86Å; V200-W243 HydrophobicContact CG2-CZ3 4.47Å
201	P	94.9	Very high	94.2	Very high	18 Å²	18	34.4 Å²	34.4	12%	0.117	18%	0.178	C	C	.	.			trans	-74.5	67	-176	32.8	-38	0	0	0	111.5	I176 L192 L197 E203 A204 L205	I176-P201 HydrophobicContact CB-CB 4.18Å; I176-P201 HydrophobicContact CD1-CB 4.43Å; I176-P201 HydrophobicContact CD1-CG 4.13Å; I176-P201 HydrophobicContact CG2-CB 4.44Å; L192-P201 HydrophobicContact CD1-CG 4.09Å; L197-P201 HydrophobicContact CD1-CG 4.43Å; P201-E203 PolarHBondContact O-N 3.36Å; P201-A204 HydrophobicContact CB-CB 4.2Å; P201-A204 PolarHBondContact O-N 3.1Å; P201-L205 HydrophobicContact CG-CD1 4.16Å; P201-L205 HydrophobicContact CG-CG 4.18Å; P201-L205 WeakPolarHBondContact O-CG 3.48Å; P201-L205 PolarHBondContact O-N 3.44Å
202	T	95.2	Very high	94.2	Very high	22 Å²	22	37.1 Å²	37.1	14%	0.135	19%	0.194	C	C	.	.	H	α-helix	trans	-57.2	-46.9	-168.1	-57.3	0	0	0	0	112.1	V200 S206 S228 K230	V200-T202 PolarHBondContact O-N 3.43Å; V200-T202 PolarHBondContact O-OG1 2.86Å; T202-S206 WeakPolarHBondContact O-CB 3.44Å; T202-S206 PolarHBondContact O-N 3.23Å; T202-S228 WeakPolarHBondContact CG2-O 3.32Å; T202-S228 PolarHBondContact OG1-O 3.33Å; T202-K230 HydrophobicContact CG2-CB 4.3Å; T202-K230 HydrophobicContact CG2-CD 3.91Å; T202-K230 HydrophobicContact CG2-CG 3.83Å
203	E	95.3	Very high	94.3	Very high	83 Å²	83	37.9 Å²	37.9	39%	0.388	20%	0.2	S	C	.	.	H	α-helix	trans	-69.9	-37.3	-177.7	-62.9	-57.7	135.7	0	0	111.8	H178 P201 S206 H207 K230	H178-E203 HydrophobicContact CB-CB 4.41Å; P201-E203 PolarHBondContact O-N 3.36Å; E203-S206 WeakPolarHBondContact O-CB 3.34Å; E203-S206 PolarHBondContact O-N 3.36Å; E203-S206 PolarHBondContact O-OG 3.06Å; E203-H207 PolarHBondContact O-CE1 2.9Å; E203-H207 PolarHBondContact O-ND1 3.22Å; E203-K230 IonicContact OE1-NZ 2.96Å; E203-K230 PolarHBondContact OE1-NZ 2.55Å
204	A	96.6	Very high	94.5	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.008	20%	0.195	C	C	.	.	H	α-helix	trans	-65	-49	175.9	0	0	0	0	0	111.3	I176 S177 H178 F181 P201 S206 H207	I176-A204 HydrophobicContact CG2-CB 3.8Å; S177-A204 WeakPolarHBondContact O-CB 3.39Å; H178-A204 WeakPolarHBondContact O-CA 3.15Å; F181-A204 HydrophobicContact CD2-CB 3.9Å; F181-A204 HydrophobicContact CE2-CB 4.13Å; P201-A204 HydrophobicContact CB-CB 4.2Å; P201-A204 PolarHBondContact O-N 3.1Å; A204-S206 PolarHBondContact O-N 2.8Å; A204-H207 PolarHBondContact O-N 3.38Å; A204-H207 PolarHBondContact O-ND1 2.75Å
205	L	96.8	Very high	94.8	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-60.8	-29.4	177	-67.2	172.6	0	0	0	112.3	F181 L190 L192 V200 P201 H207 L208 L214 L232	F181-L205 HydrophobicContact CE2-CD2 4.32Å; L190-L205 HydrophobicContact CD2-CD2 3.51Å; L192-L205 HydrophobicContact CD1-CD2 4.48Å; V200-L205 HydrophobicContact CG1-CD1 3.88Å; P201-L205 HydrophobicContact CG-CD1 4.16Å; P201-L205 HydrophobicContact CG-CG 4.18Å; P201-L205 WeakPolarHBondContact O-CG 3.48Å; P201-L205 PolarHBondContact O-N 3.44Å; L205-H207 PolarHBondContact O-N 3.33Å; L205-L208 HydrophobicContact CD2-CD1 4.1Å; L205-L208 WeakPolarHBondContact O-CB 3.27Å; L205-L208 PolarHBondContact O-N 3.05Å; L205-L214 HydrophobicContact CD1-CD2 4.23Å; L205-L214 HydrophobicContact CD2-CD1 4.25Å; L205-L232 VanDerWaalsContact O-CD2 3.3Å; L205-L232 WeakPolarHBondContact O-CD2 3.45Å
206	S	95.9	Very high	95.1	Very high	5 Å²	5	33.3 Å²	33.3	4%	0.035	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-15	-177.3	82.8	0	0	0	0	114.9	T202 E203 A204 L208 H209 K230	T202-S206 WeakPolarHBondContact O-CB 3.44Å; T202-S206 PolarHBondContact O-N 3.23Å; E203-S206 WeakPolarHBondContact O-CB 3.34Å; E203-S206 PolarHBondContact O-N 3.36Å; E203-S206 PolarHBondContact O-OG 3.06Å; A204-S206 PolarHBondContact O-N 2.8Å; S206-L208 VanDerWaalsContact C-N 3.34Å; S206-H209 PolarHBondContact O-CE1 3.1Å; S206-H209 PolarHBondContact O-ND1 2.73Å; S206-K230 WeakPolarHBondContact CA-O 3.47Å
207	H	95.6	Very high	95.3	Very high	61 Å²	61	32.4 Å²	32.4	28%	0.282	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-14	175	-63.6	87.6	0	0	0	113	H178 E203 A204 L205 H209	H178-H207 PolarHBondContact O-CE1 3.42Å; H178-H207 PolarHBondContact O-ND1 3.28Å; H178-H207 VanDerWaalsContact O-ND1 3.15Å; E203-H207 PolarHBondContact O-CE1 2.9Å; E203-H207 PolarHBondContact O-ND1 3.22Å; A204-H207 PolarHBondContact O-N 3.38Å; A204-H207 PolarHBondContact O-ND1 2.75Å; L205-H207 PolarHBondContact O-N 3.33Å; H207-H209 PolarHBondContact O-CD2 2.77Å; H207-H209 PolarHBondContact O-N 3.07Å; H207-H209 VanDerWaalsContact O-N 3.12Å
208	L	96.1	Very high	95.5	Very high	1 Å²	1	37 Å²	37	1%	0.005	19%	0.19	C	C	.	.			trans	-88.7	71.4	-176.5	-61.9	173.1	0	0	0	111.2	F181 L184 L187 L190 L205 S206 N210 L211 L232	F181-L208 HydrophobicContact CB-CD1 4.31Å; F181-L208 HydrophobicContact CB-CD2 3.86Å; F181-L208 HydrophobicContact CB-CG 4.08Å; F181-L208 HydrophobicContact CD2-CD1 4.23Å; F181-L208 HydrophobicContact CG-CD1 4.28Å; L184-L208 HydrophobicContact CB-CD2 3.94Å; L184-L208 HydrophobicContact CD1-CD2 4.4Å; L187-L208 HydrophobicContact CB-CD2 4.2Å; L187-L208 HydrophobicContact CD2-CD1 4.13Å; L187-L208 HydrophobicContact CD2-CD2 3.66Å; L190-L208 HydrophobicContact CD2-CD1 3.57Å; L205-L208 HydrophobicContact CD2-CD1 4.1Å; L205-L208 WeakPolarHBondContact O-CB 3.27Å; L205-L208 PolarHBondContact O-N 3.05Å; S206-L208 VanDerWaalsContact C-N 3.34Å; L208-N210 VanDerWaalsContact C-N 3.27Å; L208-N210 PolarHBondContact O-N 3Å; L208-L211 HydrophobicContact CB-CB 4.04Å; L208-L211 HydrophobicContact CB-CD2 4.38Å; L208-L211 HydrophobicContact CD1-CD1 4.49Å; L208-L211 HydrophobicContact CD1-CD2 4.18Å; L208-L211 WeakPolarHBondContact O-CB 3.36Å; L208-L211 PolarHBondContact O-N 2.63Å; L208-L232 HydrophobicContact CB-CD2 4.23Å; L208-L232 WeakPolarHBondContact O-CD2 3.48Å
209	H	93.1	Very high	95.8	Very high	97 Å²	97	31.8 Å²	31.8	45%	0.449	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-24.6	-172.7	-56.8	-49.3	0	0	0	114.6	S206 H207	S206-H209 PolarHBondContact O-CE1 3.1Å; S206-H209 PolarHBondContact O-ND1 2.73Å; H207-H209 PolarHBondContact O-CD2 2.77Å; H207-H209 PolarHBondContact O-N 3.07Å; H207-H209 VanDerWaalsContact O-N 3.12Å
210	N	95.8	Very high	95.7	Very high	53 Å²	53	32 Å²	32	28%	0.283	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	2.4	-178.3	-75.3	-36.6	0	0	0	114.5	L185 L187 L208 V212 R234	L185-N210 PolarHBondContact O-ND2 2.81Å; L187-N210 CarbonylContact O-C 3.6Å; L208-N210 VanDerWaalsContact C-N 3.27Å; L208-N210 PolarHBondContact O-N 3Å; N210-V212 WeakPolarHBondContact O-CG2 3.49Å; N210-V212 PolarHBondContact O-N 3.24Å; N210-R234 PolarHBondContact OD1-NH1 3.45Å
211	L	97.8	Very high	95.6	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.16	C	C	.	.			trans	-61.9	127.8	-177.1	-160.7	69.9	0	0	0	111.3	L187 L190 L208 L214 L232 R234 L235	L187-L211 HydrophobicContact CD2-CD1 4.16Å; L187-L211 HydrophobicContact CG-CD1 4.36Å; L187-L211 WeakPolarHBondContact O-CA 3.3Å; L187-L211 PolarHBondContact O-N 2.87Å; L190-L211 HydrophobicContact CB-CD1 3.75Å; L190-L211 HydrophobicContact CB-CD2 4.36Å; L208-L211 HydrophobicContact CB-CB 4.04Å; L208-L211 HydrophobicContact CB-CD2 4.38Å; L208-L211 HydrophobicContact CD1-CD1 4.49Å; L208-L211 HydrophobicContact CD1-CD2 4.18Å; L208-L211 WeakPolarHBondContact O-CB 3.36Å; L208-L211 PolarHBondContact O-N 2.63Å; L211-L214 HydrophobicContact CD2-CB 4Å; L211-L214 HydrophobicContact CD2-CD1 4.18Å; L211-L214 HydrophobicContact CD2-CG 4.48Å; L211-L232 HydrophobicContact CB-CD2 4.29Å; L211-L232 HydrophobicContact CD2-CD2 4.15Å; L211-R234 CarbonylContact O-C 3.41Å; L211-L235 HydrophobicContact CB-CD1 4.44Å; L211-L235 HydrophobicContact CD2-CD1 4.04Å; L211-L235 HydrophobicContact CG-CD1 4.03Å; L211-L235 VanDerWaalsContact O-CA 3.27Å; L211-L235 WeakPolarHBondContact O-CA 3.49Å; L211-L235 PolarHBondContact O-N 2.88Å
212	V	98.1	Very high	95.1	Very high	59 Å²	59	33.6 Å²	33.6	36%	0.358	17%	0.173	S	C	.	.			trans	-106.2	-39.9	179.9	-178.4	0	0	0	0	110.6	E188 N210 R236 H237	E188-V212 HydrophobicContact CB-CG2 4.44Å; E188-V212 HydrophobicContact CG-CG2 4.47Å; E188-V212 WeakPolarHBondContact O-CA 3.2Å; E188-V212 PolarHBondContact O-N 3.43Å; N210-V212 WeakPolarHBondContact O-CG2 3.49Å; N210-V212 PolarHBondContact O-N 3.24Å; V212-R236 HydrophobicContact CG1-CB 4.21Å; V212-R236 HydrophobicContact CG1-CG 4.27Å; V212-R236 PolarHBondContact O-N 2.97Å; V212-H237 PolarHBondContact O-N 3.34Å
213	S	98.4	Very high	94.6	Very high	17 Å²	17	35.9 Å²	35.9	12%	0.119	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	130.2	-179.2	-157.2	0	0	0	0	111.6	E188 E189 L190 H215 H237	E188-S213 PolarHBondContact O-N 2.9Å; E189-S213 WeakPolarHBondContact CA-O 3.33Å; L190-S213 PolarHBondContact N-O 2.99Å; L190-S213 VanDerWaalsContact N-O 3.09Å; S213-H215 PolarHBondContact OG-CE1 3.19Å; S213-H215 VanDerWaalsContact OG-CE1 3.27Å; S213-H215 PolarHBondContact OG-NE2 2.96Å; S213-H237 WeakPolarHBondContact CA-O 3.31Å; S213-H237 WeakPolarHBondContact OG-CB 3.5Å; S213-H237 PolarHBondContact OG-CD2 2.62Å
214	L	98.4	Very high	94.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	119.4	176.1	178.1	60.2	0	0	0	109.4	L190 L205 L211 L216 F229 L232 L235 H237 L238 E239	L190-L214 HydrophobicContact CB-CD1 4.14Å; L190-L214 HydrophobicContact CD2-CD1 3.99Å; L190-L214 HydrophobicContact CG-CD1 4.14Å; L205-L214 HydrophobicContact CD1-CD2 4.23Å; L205-L214 HydrophobicContact CD2-CD1 4.25Å; L211-L214 HydrophobicContact CD2-CB 4Å; L211-L214 HydrophobicContact CD2-CD1 4.18Å; L211-L214 HydrophobicContact CD2-CG 4.48Å; L214-L216 HydrophobicContact CD1-CD2 3.84Å; L214-L216 HydrophobicContact CD1-CG 4.41Å; L214-L216 HydrophobicContact CD2-CD1 4.5Å; L214-L216 HydrophobicContact CD2-CD2 4.45Å; L214-L216 HydrophobicContact CD2-CG 4.48Å; L214-L216 HydrophobicContact CG-CD2 4.11Å; L214-L216 HydrophobicContact CG-CG 4.15Å; L214-F229 HydrophobicContact CD2-CD1 4.05Å; L214-F229 HydrophobicContact CD2-CE1 3.83Å; L214-L232 HydrophobicContact CD2-CD1 4.3Å; L214-L235 HydrophobicContact CB-CD1 3.72Å; L214-L235 HydrophobicContact CB-CD2 4.34Å; L214-H237 PolarHBondContact N-O 3.19Å; L214-L238 HydrophobicContact CB-CD1 4.15Å; L214-L238 HydrophobicContact CD2-CD1 3.99Å; L214-L238 HydrophobicContact CG-CD1 4.09Å; L214-L238 WeakPolarHBondContact O-CA 3.32Å; L214-E239 PolarHBondContact O-N 3.11Å
215	H	98.2	Very high	94.2	Very high	11 Å²	11	36.6 Å²	36.6	5%	0.051	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	121.2	177.9	-52.6	-84.3	0	0	0	109.4	E189 L190 T191 L192 S213 R217 H237 E239	E189-H215 IonicContact OE1-CD2 3.06Å; E189-H215 IonicContact OE1-NE2 2.75Å; E189-H215 PolarHBondContact OE1-NE2 2.96Å; L190-H215 PolarHBondContact O-N 3Å; T191-H215 WeakPolarHBondContact CA-O 3.43Å; T191-H215 HydrophobicContact CG2-CB 4.1Å; L192-H215 PolarHBondContact N-O 3.23Å; S213-H215 PolarHBondContact OG-CE1 3.19Å; S213-H215 VanDerWaalsContact OG-CE1 3.27Å; S213-H215 PolarHBondContact OG-NE2 2.96Å; H215-R217 HydrophobicContact CB-CG 4.5Å; H215-H237 AromaticContact CE1-CD2 3.37Å; H215-H237 PolarHBondContact CE1-CD2 2.97Å; H215-H237 AromaticContact CE1-NE2 3.41Å; H215-H237 PolarHBondContact CE1-NE2 2.96Å; H215-H237 AromaticContact ND1-CD2 3.94Å; H215-H237 AromaticContact ND1-NE2 3.83Å; H215-E239 HydrophobicContact CB-CB 4.45Å; H215-E239 IonicContact CE1-OE2 3.19Å; H215-E239 PolarHBondContact CE1-OE2 2.94Å; H215-E239 IonicContact CG-OE2 3.55Å; H215-E239 IonicContact ND1-OE2 3.69Å; H215-E239 PolarHBondContact ND1-OE2 2.81Å
216	L	96.7	Very high	94	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	96.9	177.1	-54.1	177.8	0	0	0	109.1	L192 L214 L219 F229 E239 D241 W243	L192-L216 HydrophobicContact CB-CD2 3.82Å; L192-L216 HydrophobicContact CD1-CD2 3.8Å; L192-L216 HydrophobicContact CG-CD2 4.03Å; L192-L216 CarbonylContact O-C 3.22Å; L192-L216 WeakPolarHBondContact O-CA 3.41Å; L214-L216 HydrophobicContact CD1-CD2 3.84Å; L214-L216 HydrophobicContact CD1-CG 4.41Å; L214-L216 HydrophobicContact CD2-CD1 4.5Å; L214-L216 HydrophobicContact CD2-CD2 4.45Å; L214-L216 HydrophobicContact CD2-CG 4.48Å; L214-L216 HydrophobicContact CG-CD2 4.11Å; L214-L216 HydrophobicContact CG-CG 4.15Å; L216-L219 HydrophobicContact CB-CD1 3.99Å; L216-L219 HydrophobicContact CD2-CD1 4.46Å; L216-F229 HydrophobicContact CD1-CE1 3.97Å; L216-F229 HydrophobicContact CD1-CZ 4.06Å; L216-E239 PolarHBondContact N-O 2.8Å; L216-D241 PolarHBondContact O-N 3.02Å; L216-W243 HydrophobicContact CB-CZ2 3.58Å; L216-W243 HydrophobicContact CD1-CH2 4.03Å; L216-W243 HydrophobicContact CD1-CZ2 3.71Å; L216-W243 HydrophobicContact CG-CZ2 4.3Å; L216-W243 PolarHBondContact O-NE1 2.78Å
217	R	96	Very high	93.9	Very high	64 Å²	64	44.2 Å²	44.2	24%	0.242	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	143.6	-169.8	-55.7	-174	172.8	140.3	5.8	111.9	L192 E193 R194 H215 L219 E239 D241	L192-R217 PolarHBondContact O-N 3.39Å; E193-R217 CarbonylContact C-O 3.54Å; E193-R217 VanDerWaalsContact CA-O 3.25Å; E193-R217 WeakPolarHBondContact CA-O 3.28Å; E193-R217 HydrophobicContact CB-CB 4.28Å; E193-R217 HydrophobicContact CG-CB 4.2Å; R194-R217 PolarHBondContact N-O 3.25Å; H215-R217 HydrophobicContact CB-CG 4.5Å; R217-L219 VanDerWaalsContact C-N 3.3Å; R217-L219 WeakPolarHBondContact O-CD2 3.23Å; R217-L219 PolarHBondContact O-N 3.31Å; R217-E239 IonicContact CZ-OE1 3.08Å; R217-E239 IonicContact CZ-OE2 3.17Å; R217-E239 IonicContact NE-OE1 3.05Å; R217-E239 PolarHBondContact NE-OE1 3.13Å; R217-E239 IonicContact NE-OE2 3.54Å; R217-E239 IonicContact NH2-OE1 3.79Å; R217-E239 PolarHBondContact NH2-OE1 3.46Å; R217-E239 IonicContact NH2-OE2 3.88Å; R217-E239 PolarHBondContact NH2-OE2 3.14Å; R217-D241 CarbonylContact C-O 3.4Å; R217-D241 WeakPolarHBondContact CA-O 3.39Å; R217-D241 HydrophobicContact CG-CB 4.37Å
218	Y	94.4	Very high	93.8	Very high	103 Å²	103	41.4 Å²	41.4	40%	0.404	22%	0.215	S	C	.	.	S	Bend	trans	54.4	41.7	173.2	-57.3	-95.1	0	0	0	113.3	E193 R194 D241 N242	E193-Y218 HydrophobicContact CG-CD2 3.85Å; E193-Y218 WeakPolarHBondContact OE1-CD2 3.29Å; R194-Y218 WeakPolarHBondContact CA-O 3.36Å; R194-Y218 HydrophobicContact CG-CG 4.21Å; Y218-D241 PolarHBondContact N-O 3.34Å; Y218-N242 WeakPolarHBondContact CA-O 3.46Å; Y218-N242 HydrophobicContact CD1-CB 4.14Å; Y218-N242 WeakPolarHBondContact CD1-ND2 3.44Å; Y218-N242 HydrophobicContact CE1-CB 4.23Å; Y218-N242 WeakPolarHBondContact CE1-ND2 3.44Å; Y218-N242 HydrophobicContact CG-CB 4.38Å
219	L	92.7	Very high	93.7	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.01	22%	0.216	C	C	.	.			trans	-98.7	149.9	178.2	-52.3	-171.6	0	0	0	111.4	C195 L216 R217 I221 W243	C195-L219 HydrophobicContact CB-CD2 3.66Å; C195-L219 VanDerWaalsContact N-CD2 3.32Å; L216-L219 HydrophobicContact CB-CD1 3.99Å; L216-L219 HydrophobicContact CD2-CD1 4.46Å; R217-L219 VanDerWaalsContact C-N 3.3Å; R217-L219 WeakPolarHBondContact O-CD2 3.23Å; R217-L219 PolarHBondContact O-N 3.31Å; L219-I221 VanDerWaalsContact C-N 3.33Å; L219-I221 HydrophobicContact CB-CD1 4.24Å; L219-I221 HydrophobicContact CB-CG1 4.26Å; L219-I221 HydrophobicContact CD1-CD1 3.85Å; L219-I221 PolarHBondContact O-N 3.43Å; L219-W243 HydrophobicContact CB-CD2 4.25Å; L219-W243 HydrophobicContact CB-CG 4.4Å; L219-W243 HydrophobicContact CB-CZ2 4.22Å; L219-W243 HydrophobicContact CD1-CZ2 3.66Å; L219-W243 HydrophobicContact CG-CZ2 4.25Å
220	S	89.9	Confident	93.6	Very high	65 Å²	65	41.2 Å²	41.2	46%	0.455	21%	0.213	S	C	.	.			trans	-96.2	28	-179.4	-62.6	0	0	0	0	113.5	S222	S220-S222 PolarHBondContact O-N 3.25Å
221	I	91.1	Very high	93.4	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	22%	0.223	C	C	.	.			trans	-77.4	121.9	-178.1	-61.3	168.6	0	0	0	109.3	L197 V200 L219 W243	L197-I221 WeakPolarHBondContact O-CG1 3.45Å; V200-I221 HydrophobicContact CG2-CD1 3.82Å; L219-I221 VanDerWaalsContact C-N 3.33Å; L219-I221 HydrophobicContact CB-CD1 4.24Å; L219-I221 HydrophobicContact CB-CG1 4.26Å; L219-I221 HydrophobicContact CD1-CD1 3.85Å; L219-I221 PolarHBondContact O-N 3.43Å; I221-W243 HydrophobicContact CB-CD2 4.47Å; I221-W243 HydrophobicContact CB-CE3 3.81Å; I221-W243 HydrophobicContact CB-CH2 4.28Å; I221-W243 HydrophobicContact CB-CZ3 3.7Å; I221-W243 HydrophobicContact CD1-CH2 3.66Å; I221-W243 HydrophobicContact CD1-CZ2 4.04Å; I221-W243 HydrophobicContact CD1-CZ3 3.98Å; I221-W243 HydrophobicContact CG1-CZ3 4.41Å; I221-W243 HydrophobicContact CG2-CE3 4.25Å; I221-W243 HydrophobicContact CG2-CZ3 3.79Å
222	S	86.1	Confident	93.3	Very high	57 Å²	57	44.2 Å²	44.2	40%	0.399	22%	0.224	S	C	.	.			trans	-84.8	-38	-179.6	56.7	0	0	0	0	113.5	S220	S220-S222 PolarHBondContact O-N 3.25Å
223	T	84.1	Confident	93	Very high	70 Å²	70	48 Å²	48	43%	0.429	24%	0.236	S	C	.	.			trans	-133.9	127.3	-173.2	55	0	0	0	0	111
224	L	92	Very high	92.9	Very high	5 Å²	5	54.2 Å²	54.2	3%	0.026	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-83	144.8	166.3	-71.3	170.2	0	0	0	109.7	V200 I240 W243 L246 M249 P250 T253	V200-L224 HydrophobicContact CG2-CD2 3.53Å; L224-I240 HydrophobicContact CD1-CD1 4.33Å; L224-W243 HydrophobicContact CD1-CZ3 4.41Å; L224-W243 HydrophobicContact CD2-CH2 4.02Å; L224-W243 HydrophobicContact CD2-CZ3 3.69Å; L224-W243 HydrophobicContact CG-CZ3 4.1Å; L224-L246 HydrophobicContact CD1-CD1 4.06Å; L224-L246 HydrophobicContact CD1-CD2 4.17Å; L224-L246 HydrophobicContact CG-CD1 4.01Å; L224-M249 HydrophobicContact CD1-CE 4.02Å; L224-M249 HydrophobicContact CD1-CG 4.43Å; L224-P250 WeakPolarHBondContact O-CD 3.46Å; L224-P250 WeakPolarHBondContact O-CG 3.46Å; L224-T253 HydrophobicContact CB-CG2 3.76Å; L224-T253 HydrophobicContact CD1-CG2 3.89Å; L224-T253 HydrophobicContact CG-CG2 4.29Å
225	H	91.8	Very high	92.8	Very high	95 Å²	95	54.2 Å²	54.2	44%	0.44	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-101.1	155.9	174.4	-66	-63.2	0	0	0	111.1	Y227 S228	H225-Y227 PolarHBondContact O-N 2.85Å; H225-S228 PolarHBondContact N-OG 2.8Å; H225-S228 WeakPolarHBondContact O-CB 3.32Å; H225-S228 PolarHBondContact O-N 2.72Å; H225-S228 PolarHBondContact O-OG 3.45Å
226	P	92.7	Very high	92.8	Very high	65 Å²	65	58 Å²	58	42%	0.422	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	138	168.7	-25.1	35.1	0	0	0	110.7	S228 N252	P226-S228 VanDerWaalsContact C-N 3.31Å; P226-S228 PolarHBondContact O-N 2.85Å; P226-N252 HydrophobicContact CB-CB 4.44Å
227	Y	92.3	Very high	92.9	Very high	100 Å²	100	59.6 Å²	59.6	39%	0.392	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	34.4	-178.7	-40.6	-79.8	0	0	0	114.4	H225 F229 K230 N252 H255	H225-Y227 PolarHBondContact O-N 2.85Å; Y227-F229 PolarHBondContact O-N 3.01Å; Y227-K230 WeakPolarHBondContact O-CE 3.41Å; Y227-K230 VanDerWaalsContact O-CG 3.28Å; Y227-K230 WeakPolarHBondContact O-CG 3.27Å; Y227-N252 HydrophobicContact CE1-CB 4.02Å; Y227-N252 HydrophobicContact CE2-CB 4.42Å; Y227-N252 PolarHBondContact N-O 2.91Å; Y227-N252 PolarHBondContact OH-ND2 2.93Å; Y227-H255 HydrophobicContact CD1-CB 3.81Å; Y227-H255 AromaticContact CD1-CG 3.98Å; Y227-H255 AromaticContact CD1-ND1 3.86Å; Y227-H255 HydrophobicContact CE1-CB 3.76Å; Y227-H255 AromaticContact CE1-CG 3.6Å; Y227-H255 AromaticContact CE1-ND1 3.6Å
228	S	93.8	Very high	93	Very high	2 Å²	2	56.6 Å²	56.6	1%	0.014	27%	0.266	C	S	.	.			trans	-62.7	-16.8	175.8	-69.1	0	0	0	0	113.7	T202 H225 P226	T202-S228 WeakPolarHBondContact CG2-O 3.32Å; T202-S228 PolarHBondContact OG1-O 3.33Å; H225-S228 PolarHBondContact N-OG 2.8Å; H225-S228 WeakPolarHBondContact O-CB 3.32Å; H225-S228 PolarHBondContact O-N 2.72Å; H225-S228 PolarHBondContact O-OG 3.45Å; P226-S228 VanDerWaalsContact C-N 3.31Å; P226-S228 PolarHBondContact O-N 2.85Å
229	F	94.4	Very high	93.1	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.018	25%	0.252	C	S	.	.	S	Bend	trans	-123.2	99.2	179.5	-57.6	-79	0	0	0	109.6	V200 L214 L216 Y227 L232 L238 L254 L257	V200-F229 HydrophobicContact CG1-CE1 4Å; V200-F229 HydrophobicContact CG1-CZ 4.39Å; L214-F229 HydrophobicContact CD2-CD1 4.05Å; L214-F229 HydrophobicContact CD2-CE1 3.83Å; L216-F229 HydrophobicContact CD1-CE1 3.97Å; L216-F229 HydrophobicContact CD1-CZ 4.06Å; Y227-F229 PolarHBondContact O-N 3.01Å; F229-L232 HydrophobicContact CB-CD1 4.26Å; F229-L232 HydrophobicContact CD1-CD1 4.22Å; F229-L238 HydrophobicContact CE1-CD1 4.19Å; F229-L238 HydrophobicContact CE2-CD2 4.1Å; F229-L238 HydrophobicContact CZ-CD1 4.23Å; F229-L238 HydrophobicContact CZ-CD2 4.15Å; F229-L254 HydrophobicContact CD2-CD2 4Å; F229-L254 HydrophobicContact CE2-CD2 3.95Å; F229-L257 HydrophobicContact CB-CD1 3.81Å; F229-L257 HydrophobicContact CB-CD2 3.91Å; F229-L257 HydrophobicContact CB-CG 4.1Å; F229-L257 HydrophobicContact CD2-CD1 4.11Å; F229-L257 HydrophobicContact CG-CD1 4.07Å
230	K	90.1	Very high	93.3	Very high	91 Å²	91	52.8 Å²	52.8	40%	0.396	25%	0.252	S	S	.	.			trans	-109.3	145.5	-176.9	-61.1	-178.9	-170	164	0	111.2	T202 E203 S206 Y227 L232	T202-K230 HydrophobicContact CG2-CB 4.3Å; T202-K230 HydrophobicContact CG2-CD 3.91Å; T202-K230 HydrophobicContact CG2-CG 3.83Å; E203-K230 IonicContact OE1-NZ 2.96Å; E203-K230 PolarHBondContact OE1-NZ 2.55Å; S206-K230 WeakPolarHBondContact CA-O 3.47Å; Y227-K230 WeakPolarHBondContact O-CE 3.41Å; Y227-K230 VanDerWaalsContact O-CG 3.28Å; Y227-K230 WeakPolarHBondContact O-CG 3.27Å; K230-L232 PolarHBondContact O-N 2.83Å; K230-L232 VanDerWaalsContact O-N 3.07Å
231	K	92	Very high	93.7	Very high	115 Å²	115	50.6 Å²	50.6	50%	0.5	24%	0.235	S	C	.	.	S	Bend	trans	59.8	14.7	172.7	-55.2	179.6	-177.6	170.2	0	115.8	F233	K231-F233 VanDerWaalsContact C-N 3.29Å; K231-F233 HydrophobicContact CB-CE2 3.96Å; K231-F233 HydrophobicContact CB-CZ 4.01Å; K231-F233 HydrophobicContact CG-CE2 4.46Å; K231-F233 HydrophobicContact CG-CZ 4.16Å; K231-F233 WeakPolarHBondContact O-CD2 3.47Å; K231-F233 PolarHBondContact O-N 3.06Å
232	L	95.2	Very high	93.9	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.01	25%	0.249	C	C	.	.			trans	-88.4	61.7	174.5	-63.4	178.5	0	0	0	110.6	L205 L208 L211 L214 F229 K230 R234 L235 L257	L205-L232 VanDerWaalsContact O-CD2 3.3Å; L205-L232 WeakPolarHBondContact O-CD2 3.45Å; L208-L232 HydrophobicContact CB-CD2 4.23Å; L208-L232 WeakPolarHBondContact O-CD2 3.48Å; L211-L232 HydrophobicContact CB-CD2 4.29Å; L211-L232 HydrophobicContact CD2-CD2 4.15Å; L214-L232 HydrophobicContact CD2-CD1 4.3Å; F229-L232 HydrophobicContact CB-CD1 4.26Å; F229-L232 HydrophobicContact CD1-CD1 4.22Å; K230-L232 PolarHBondContact O-N 2.83Å; K230-L232 VanDerWaalsContact O-N 3.07Å; L232-R234 VanDerWaalsContact C-N 3.29Å; L232-R234 PolarHBondContact O-N 2.93Å; L232-L235 HydrophobicContact CB-CB 4.04Å; L232-L235 HydrophobicContact CB-CD2 4.41Å; L232-L235 HydrophobicContact CD1-CD2 4.1Å; L232-L235 WeakPolarHBondContact O-CB 3.42Å; L232-L235 PolarHBondContact O-N 3.34Å; L232-L257 HydrophobicContact CB-CD2 3.97Å
233	F	92	Very high	94.3	Very high	139 Å²	139	50.4 Å²	50.4	61%	0.61	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69	-25.3	-168.5	-52.5	-65.3	0	0	0	114.3	K231	K231-F233 VanDerWaalsContact C-N 3.29Å; K231-F233 HydrophobicContact CB-CE2 3.96Å; K231-F233 HydrophobicContact CB-CZ 4.01Å; K231-F233 HydrophobicContact CG-CE2 4.46Å; K231-F233 HydrophobicContact CG-CZ 4.16Å; K231-F233 WeakPolarHBondContact O-CD2 3.47Å; K231-F233 PolarHBondContact O-N 3.06Å
234	R	96.1	Very high	94.7	Very high	147 Å²	147	50.8 Å²	50.8	56%	0.555	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-5	179.6	-72	-170.6	171.6	-172.4	-0.8	113.8	N210 L211 L232 R236	N210-R234 PolarHBondContact OD1-NH1 3.45Å; L211-R234 CarbonylContact O-C 3.41Å; L232-R234 VanDerWaalsContact C-N 3.29Å; L232-R234 PolarHBondContact O-N 2.93Å; R234-R236 WeakPolarHBondContact O-CG 2.99Å; R234-R236 PolarHBondContact O-N 3.07Å
235	L	97.5	Very high	94.7	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.251	C	S	.	.			trans	-63.8	125.4	-175.8	-164.7	74.4	0	0	0	110.4	L211 L214 L232 L238 L257 L259	L211-L235 HydrophobicContact CB-CD1 4.44Å; L211-L235 HydrophobicContact CD2-CD1 4.04Å; L211-L235 HydrophobicContact CG-CD1 4.03Å; L211-L235 VanDerWaalsContact O-CA 3.27Å; L211-L235 WeakPolarHBondContact O-CA 3.49Å; L211-L235 PolarHBondContact O-N 2.88Å; L214-L235 HydrophobicContact CB-CD1 3.72Å; L214-L235 HydrophobicContact CB-CD2 4.34Å; L232-L235 HydrophobicContact CB-CB 4.04Å; L232-L235 HydrophobicContact CB-CD2 4.41Å; L232-L235 HydrophobicContact CD1-CD2 4.1Å; L232-L235 WeakPolarHBondContact O-CB 3.42Å; L232-L235 PolarHBondContact O-N 3.34Å; L235-L238 HydrophobicContact CD2-CB 4.49Å; L235-L257 HydrophobicContact CB-CD2 4.49Å; L235-L257 HydrophobicContact CD2-CD1 4.35Å; L235-L257 HydrophobicContact CD2-CD2 4.05Å; L235-L259 HydrophobicContact CB-CD2 4.4Å; L235-L259 HydrophobicContact CD2-CD2 3.99Å; L235-L259 HydrophobicContact CG-CD2 3.97Å
236	R	97.6	Very high	94.8	Very high	90 Å²	90	48.8 Å²	48.8	34%	0.34	23%	0.23	S	C	.	.			trans	-116	-32.6	179.6	-63.4	-52.7	-178	-137.4	-7.1	112.3	V212 R234 N258 L259 T260 T261	V212-R236 HydrophobicContact CG1-CB 4.21Å; V212-R236 HydrophobicContact CG1-CG 4.27Å; V212-R236 PolarHBondContact O-N 2.97Å; R234-R236 WeakPolarHBondContact O-CG 2.99Å; R234-R236 PolarHBondContact O-N 3.07Å; R236-N258 WeakPolarHBondContact CD-O 2.89Å; R236-N258 PolarHBondContact NH1-O 3.47Å; R236-L259 WeakPolarHBondContact O-CA 3.33Å; R236-T260 PolarHBondContact O-N 3.19Å; R236-T260 PolarHBondContact O-OG1 3.06Å; R236-T261 PolarHBondContact O-N 3.22Å
237	H	98.3	Very high	94.7	Very high	35 Å²	35	49.4 Å²	49.4	16%	0.162	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	124.5	-178.5	-173.9	91.6	0	0	0	109.9	V212 S213 L214 H215 T261 F263	V212-H237 PolarHBondContact O-N 3.34Å; S213-H237 WeakPolarHBondContact CA-O 3.31Å; S213-H237 WeakPolarHBondContact OG-CB 3.5Å; S213-H237 PolarHBondContact OG-CD2 2.62Å; L214-H237 PolarHBondContact N-O 3.19Å; H215-H237 AromaticContact CE1-CD2 3.37Å; H215-H237 PolarHBondContact CE1-CD2 2.97Å; H215-H237 AromaticContact CE1-NE2 3.41Å; H215-H237 PolarHBondContact CE1-NE2 2.96Å; H215-H237 AromaticContact ND1-CD2 3.94Å; H215-H237 AromaticContact ND1-NE2 3.83Å; H237-T261 WeakPolarHBondContact CA-O 3.33Å; H237-T261 VanDerWaalsContact CE1-CG2 3.46Å; H237-T261 WeakPolarHBondContact CE1-CG2 3.35Å; H237-T261 VanDerWaalsContact ND1-CB 3.35Å; H237-T261 WeakPolarHBondContact ND1-CB 3.2Å; H237-T261 WeakPolarHBondContact ND1-CG2 3.46Å; H237-F263 AromaticContact CE1-CD2 3.75Å; H237-F263 AromaticContact CE1-CE2 3.63Å
238	L	98.1	Very high	94.6	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	121.3	172.3	176.7	61.9	0	0	0	108.8	L214 F229 L235 I240 L254 L257 L259 T261 L262 F263	L214-L238 HydrophobicContact CB-CD1 4.15Å; L214-L238 HydrophobicContact CD2-CD1 3.99Å; L214-L238 HydrophobicContact CG-CD1 4.09Å; L214-L238 WeakPolarHBondContact O-CA 3.32Å; F229-L238 HydrophobicContact CE1-CD1 4.19Å; F229-L238 HydrophobicContact CE2-CD2 4.1Å; F229-L238 HydrophobicContact CZ-CD1 4.23Å; F229-L238 HydrophobicContact CZ-CD2 4.15Å; L235-L238 HydrophobicContact CD2-CB 4.49Å; L238-I240 HydrophobicContact CD1-CG1 4.44Å; L238-I240 HydrophobicContact CD2-CD1 4.47Å; L238-I240 HydrophobicContact CG-CG1 4.41Å; L238-L254 HydrophobicContact CD2-CD2 3.68Å; L238-L257 HydrophobicContact CD2-CD1 4.24Å; L238-L259 HydrophobicContact CB-CD1 3.86Å; L238-L259 HydrophobicContact CB-CD2 4.02Å; L238-L259 HydrophobicContact CD2-CD1 4.13Å; L238-T261 PolarHBondContact N-O 3.39Å; L238-T261 VanDerWaalsContact N-O 3.1Å; L238-L262 HydrophobicContact CB-CD1 4.04Å; L238-L262 HydrophobicContact CD2-CD1 3.94Å; L238-L262 HydrophobicContact CG-CD1 4.05Å; L238-L262 WeakPolarHBondContact O-CA 3.12Å; L238-F263 PolarHBondContact O-N 2.86Å
239	E	98.2	Very high	94.5	Very high	25 Å²	25	49.6 Å²	49.6	12%	0.117	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	123.1	174.6	-174.9	-172.1	149.1	0	0	109.4	L214 H215 L216 R217 D241 F263	L214-E239 PolarHBondContact O-N 3.11Å; H215-E239 HydrophobicContact CB-CB 4.45Å; H215-E239 IonicContact CE1-OE2 3.19Å; H215-E239 PolarHBondContact CE1-OE2 2.94Å; H215-E239 IonicContact CG-OE2 3.55Å; H215-E239 IonicContact ND1-OE2 3.69Å; H215-E239 PolarHBondContact ND1-OE2 2.81Å; L216-E239 PolarHBondContact N-O 2.8Å; R217-E239 IonicContact CZ-OE1 3.08Å; R217-E239 IonicContact CZ-OE2 3.17Å; R217-E239 IonicContact NE-OE1 3.05Å; R217-E239 PolarHBondContact NE-OE1 3.13Å; R217-E239 IonicContact NE-OE2 3.54Å; R217-E239 IonicContact NH2-OE1 3.79Å; R217-E239 PolarHBondContact NH2-OE1 3.46Å; R217-E239 IonicContact NH2-OE2 3.88Å; R217-E239 PolarHBondContact NH2-OE2 3.14Å; E239-D241 HydrophobicContact CG-CB 4.25Å; E239-F263 WeakPolarHBondContact CA-O 3.33Å; E239-F263 HydrophobicContact CB-CB 4.41Å; E239-F263 HydrophobicContact CG-CB 4.13Å
240	I	96.6	Very high	94.4	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	104	169.5	-63.9	177	0	0	0	105.4	L224 L238 W243 L246 F263 I264 T265 T267	L224-I240 HydrophobicContact CD1-CD1 4.33Å; L238-I240 HydrophobicContact CD1-CG1 4.44Å; L238-I240 HydrophobicContact CD2-CD1 4.47Å; L238-I240 HydrophobicContact CG-CG1 4.41Å; I240-W243 HydrophobicContact CG1-CZ2 4.48Å; I240-W243 HydrophobicContact CG2-CD2 3.59Å; I240-W243 HydrophobicContact CG2-CE3 3.97Å; I240-W243 HydrophobicContact CG2-CG 3.89Å; I240-W243 HydrophobicContact CG2-CH2 4.32Å; I240-W243 HydrophobicContact CG2-CZ2 3.97Å; I240-W243 HydrophobicContact CG2-CZ3 4.33Å; I240-L246 HydrophobicContact CG2-CD2 4.31Å; I240-F263 PolarHBondContact N-O 3.24Å; I240-I264 HydrophobicContact CB-CG2 4.32Å; I240-I264 HydrophobicContact CG2-CG2 4.28Å; I240-I264 CarbonylContact O-C 3.2Å; I240-I264 VanDerWaalsContact O-CA 3.26Å; I240-I264 WeakPolarHBondContact O-CA 3.01Å; I240-T265 PolarHBondContact O-N 3.19Å; I240-T267 HydrophobicContact CG2-CG2 4.49Å
241	D	96.9	Very high	94.4	Very high	20 Å²	20	49.3 Å²	49.3	11%	0.107	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	137.2	-176.8	-174.6	52.9	0	0	0	112	L216 R217 Y218 E239 W243 T265 N266	L216-D241 PolarHBondContact O-N 3.02Å; R217-D241 CarbonylContact C-O 3.4Å; R217-D241 WeakPolarHBondContact CA-O 3.39Å; R217-D241 HydrophobicContact CG-CB 4.37Å; Y218-D241 PolarHBondContact N-O 3.34Å; E239-D241 HydrophobicContact CG-CB 4.25Å; D241-W243 VanDerWaalsContact O-CD1 3.3Å; D241-T265 WeakPolarHBondContact CA-O 3.19Å; D241-T265 WeakPolarHBondContact OD1-CB 3.42Å; D241-T265 PolarHBondContact OD1-OG1 3.27Å; D241-N266 PolarHBondContact OD1-ND2 2.91Å
242	N	95.6	Very high	94.4	Very high	53 Å²	53	45.8 Å²	45.8	28%	0.283	23%	0.227	S	C	.	.			trans	58.1	56.7	175.8	-160.4	29.3	0	0	0	113.7	Y218 P244 T265 N266	Y218-N242 WeakPolarHBondContact CA-O 3.46Å; Y218-N242 HydrophobicContact CD1-CB 4.14Å; Y218-N242 WeakPolarHBondContact CD1-ND2 3.44Å; Y218-N242 HydrophobicContact CE1-CB 4.23Å; Y218-N242 WeakPolarHBondContact CE1-ND2 3.44Å; Y218-N242 HydrophobicContact CG-CB 4.38Å; N242-P244 VanDerWaalsContact O-CD 3.27Å; N242-P244 WeakPolarHBondContact O-CD 3.46Å; N242-T265 PolarHBondContact N-O 3.49Å; N242-N266 VanDerWaalsContact CA-O 3.3Å; N242-N266 WeakPolarHBondContact CA-O 3.27Å; N242-N266 HydrophobicContact CB-CB 4.2Å
243	W	94.7	Very high	94.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.227	C	C	.	.			trans	-107.7	84.2	171.1	-70.2	26.2	0	0	0	109.2	V200 L216 L219 I221 L224 I240 D241 S245 L246 N266 T267	V200-W243 HydrophobicContact CG2-CH2 3.86Å; V200-W243 HydrophobicContact CG2-CZ3 4.47Å; L216-W243 HydrophobicContact CB-CZ2 3.58Å; L216-W243 HydrophobicContact CD1-CH2 4.03Å; L216-W243 HydrophobicContact CD1-CZ2 3.71Å; L216-W243 HydrophobicContact CG-CZ2 4.3Å; L216-W243 PolarHBondContact O-NE1 2.78Å; L219-W243 HydrophobicContact CB-CD2 4.25Å; L219-W243 HydrophobicContact CB-CG 4.4Å; L219-W243 HydrophobicContact CB-CZ2 4.22Å; L219-W243 HydrophobicContact CD1-CZ2 3.66Å; L219-W243 HydrophobicContact CG-CZ2 4.25Å; I221-W243 HydrophobicContact CB-CD2 4.47Å; I221-W243 HydrophobicContact CB-CE3 3.81Å; I221-W243 HydrophobicContact CB-CH2 4.28Å; I221-W243 HydrophobicContact CB-CZ3 3.7Å; I221-W243 HydrophobicContact CD1-CH2 3.66Å; I221-W243 HydrophobicContact CD1-CZ2 4.04Å; I221-W243 HydrophobicContact CD1-CZ3 3.98Å; I221-W243 HydrophobicContact CG1-CZ3 4.41Å; I221-W243 HydrophobicContact CG2-CE3 4.25Å; I221-W243 HydrophobicContact CG2-CZ3 3.79Å; L224-W243 HydrophobicContact CD1-CZ3 4.41Å; L224-W243 HydrophobicContact CD2-CH2 4.02Å; L224-W243 HydrophobicContact CD2-CZ3 3.69Å; L224-W243 HydrophobicContact CG-CZ3 4.1Å; I240-W243 HydrophobicContact CG1-CZ2 4.48Å; I240-W243 HydrophobicContact CG2-CD2 3.59Å; I240-W243 HydrophobicContact CG2-CE3 3.97Å; I240-W243 HydrophobicContact CG2-CG 3.89Å; I240-W243 HydrophobicContact CG2-CH2 4.32Å; I240-W243 HydrophobicContact CG2-CZ2 3.97Å; I240-W243 HydrophobicContact CG2-CZ3 4.33Å; D241-W243 VanDerWaalsContact O-CD1 3.3Å; W243-S245 PolarHBondContact O-N 2.91Å; W243-S245 VanDerWaalsContact O-N 3.13Å; W243-L246 HydrophobicContact CB-CB 3.96Å; W243-L246 HydrophobicContact CE3-CB 4.29Å; W243-L246 HydrophobicContact CE3-CD2 3.96Å; W243-L246 PolarHBondContact O-N 3.48Å; W243-L246 VanDerWaalsContact O-N 3.14Å; W243-N266 PolarHBondContact N-O 3.27Å; W243-T267 HydrophobicContact CB-CG2 4.03Å; W243-T267 WeakPolarHBondContact O-CA 3.42Å; W243-T267 WeakPolarHBondContact O-CB 2.92Å
244	P	92.2	Very high	94.4	Very high	78 Å²	78	39.1 Å²	39.1	51%	0.506	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-22.7	-170	26.5	-36	0	0	0	113.4	N242 N268	N242-P244 VanDerWaalsContact O-CD 3.27Å; N242-P244 WeakPolarHBondContact O-CD 3.46Å; P244-N268 WeakPolarHBondContact O-CB 3.43Å
245	S	92.3	Very high	94.2	Very high	58 Å²	58	36 Å²	36	41%	0.406	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-12.2	-179.3	-56.5	0	0	0	0	113.9	W243 D247	W243-S245 PolarHBondContact O-N 2.91Å; W243-S245 VanDerWaalsContact O-N 3.13Å; S245-D247 PolarHBondContact O-N 2.89Å
246	L	93.4	Very high	93.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.216	C	C	.	.			trans	-80.7	109.2	-176.5	-178.2	69.9	0	0	0	110.4	L224 I240 W243 T267 N268 L269	L224-L246 HydrophobicContact CD1-CD1 4.06Å; L224-L246 HydrophobicContact CD1-CD2 4.17Å; L224-L246 HydrophobicContact CG-CD1 4.01Å; I240-L246 HydrophobicContact CG2-CD2 4.31Å; W243-L246 HydrophobicContact CB-CB 3.96Å; W243-L246 HydrophobicContact CE3-CB 4.29Å; W243-L246 HydrophobicContact CE3-CD2 3.96Å; W243-L246 PolarHBondContact O-N 3.48Å; W243-L246 VanDerWaalsContact O-N 3.14Å; L246-T267 HydrophobicContact CD2-CG2 4.35Å; L246-N268 CarbonylContact O-C 3.31Å; L246-N268 VanDerWaalsContact O-C 3.22Å; L246-N268 VanDerWaalsContact O-CA 3.23Å; L246-N268 WeakPolarHBondContact O-CA 3.25Å; L246-N268 WeakPolarHBondContact O-CB 3.34Å; L246-N268 PolarHBondContact O-N 2.91Å; L246-L269 HydrophobicContact CG-CD2 4.43Å; L246-L269 PolarHBondContact O-N 2.98Å
247	D	91.9	Very high	93.6	Very high	78 Å²	78	34.7 Å²	34.7	42%	0.417	20%	0.202	S	C	.	.			trans	-109.7	-22.9	-176.7	65.6	-12.4	0	0	0	114.3	S245 N268 L269 S270	S245-D247 PolarHBondContact O-N 2.89Å; D247-N268 WeakPolarHBondContact CA-O 3.08Å; D247-L269 WeakPolarHBondContact O-CA 3.42Å; D247-S270 PolarHBondContact O-N 3.2Å
248	H	90.1	Very high	93.4	Very high	98 Å²	98	35.6 Å²	35.6	45%	0.454	21%	0.208	S	C	.	.			trans	-141.2	145.2	-178.8	-178.5	68.8	0	0	0	112.5
249	M	91.9	Very high	93.3	Very high	9 Å²	9	35.6 Å²	35.6	4%	0.044	21%	0.208	C	C	.	.			trans	-112.1	110.9	169.2	-69.8	-168.6	79	0	0	110.4	L224 T253 L254 I264 L269 P273 A276	L224-M249 HydrophobicContact CD1-CE 4.02Å; L224-M249 HydrophobicContact CD1-CG 4.43Å; M249-T253 HydrophobicContact CE-CG2 4.15Å; M249-L254 HydrophobicContact CE-CD1 4.17Å; M249-L254 HydrophobicContact CE-CD2 4.33Å; M249-L254 HydrophobicContact CE-CG 4.19Å; M249-I264 HydrophobicContact CE-CD1 3.78Å; M249-I264 HydrophobicContact SD-CD1 3.28Å; M249-I264 WeakPolarHBondContact SD-CD1 3.39Å; M249-L269 HydrophobicContact CG-CD2 3.93Å; M249-L269 HydrophobicContact SD-CD1 4.46Å; M249-P273 HydrophobicContact CB-CB 4.02Å; M249-P273 HydrophobicContact CG-CB 4.38Å; M249-P273 HydrophobicContact SD-CB 3.94Å; M249-P273 HydrophobicContact SD-CG 4.17Å; M249-A276 HydrophobicContact CB-CB 4.37Å; M249-A276 HydrophobicContact CE-CB 4.41Å
250	P	91.3	Very high	93.3	Very high	28 Å²	28	36.7 Å²	36.7	18%	0.182	22%	0.216	C	C	.	.			trans	-70.9	164.7	179.6	23.3	-25.8	0	0	0	112.4	L224 T253	L224-P250 WeakPolarHBondContact O-CD 3.46Å; L224-P250 WeakPolarHBondContact O-CG 3.46Å; P250-T253 WeakPolarHBondContact CD-OG1 3.5Å; P250-T253 WeakPolarHBondContact CG-OG1 3.48Å; P250-T253 WeakPolarHBondContact O-CB 3.45Å; P250-T253 PolarHBondContact O-N 3.36Å; P250-T253 PolarHBondContact O-OG1 2.96Å
251	V	90.8	Very high	93.4	Very high	61 Å²	61	37.7 Å²	37.7	37%	0.37	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	145.9	175.7	-166.6	0	0	0	0	110.6	T253 Q275	V251-T253 PolarHBondContact O-N 3.08Å; V251-Q275 HydrophobicContact CG1-CB 4.4Å; V251-Q275 HydrophobicContact CG2-CB 3.95Å; V251-Q275 HydrophobicContact CG2-CG 4.47Å
252	N	91.5	Very high	93.4	Very high	40 Å²	40	36.7 Å²	36.7	21%	0.214	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	13	177.7	-58.9	-23.2	0	0	0	115.4	P226 Y227 L254 H255	P226-N252 HydrophobicContact CB-CB 4.44Å; Y227-N252 HydrophobicContact CE1-CB 4.02Å; Y227-N252 HydrophobicContact CE2-CB 4.42Å; Y227-N252 PolarHBondContact N-O 2.91Å; Y227-N252 PolarHBondContact OH-ND2 2.93Å; N252-L254 VanDerWaalsContact C-N 3.25Å; N252-L254 PolarHBondContact O-N 3.02Å; N252-H255 HydrophobicContact CB-CB 3.88Å; N252-H255 VanDerWaalsContact O-CB 3.3Å; N252-H255 WeakPolarHBondContact O-CB 3.35Å; N252-H255 PolarHBondContact O-N 3Å
253	T	93.3	Very high	93.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-43.6	173.4	-62.3	0	0	0	0	111.7	L224 M249 P250 V251	L224-T253 HydrophobicContact CB-CG2 3.76Å; L224-T253 HydrophobicContact CD1-CG2 3.89Å; L224-T253 HydrophobicContact CG-CG2 4.29Å; M249-T253 HydrophobicContact CE-CG2 4.15Å; P250-T253 WeakPolarHBondContact CD-OG1 3.5Å; P250-T253 WeakPolarHBondContact CG-OG1 3.48Å; P250-T253 WeakPolarHBondContact O-CB 3.45Å; P250-T253 PolarHBondContact O-N 3.36Å; P250-T253 PolarHBondContact O-OG1 2.96Å; V251-T253 PolarHBondContact O-N 3.08Å
254	L	94.2	Very high	93.7	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.01	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	15.6	-178.8	-55.1	178.4	0	0	0	113	F229 L238 M249 N252 G256 L257 L262 L280	F229-L254 HydrophobicContact CD2-CD2 4Å; F229-L254 HydrophobicContact CE2-CD2 3.95Å; L238-L254 HydrophobicContact CD2-CD2 3.68Å; M249-L254 HydrophobicContact CE-CD1 4.17Å; M249-L254 HydrophobicContact CE-CD2 4.33Å; M249-L254 HydrophobicContact CE-CG 4.19Å; N252-L254 VanDerWaalsContact C-N 3.25Å; N252-L254 PolarHBondContact O-N 3.02Å; L254-G256 PolarHBondContact O-N 2.98Å; L254-L257 HydrophobicContact CB-CD1 4.3Å; L254-L257 HydrophobicContact CD2-CD1 4.03Å; L254-L257 WeakPolarHBondContact O-CB 3.41Å; L254-L257 PolarHBondContact O-N 2.85Å; L254-L262 HydrophobicContact CD1-CD1 4.45Å; L254-L262 HydrophobicContact CD1-CD2 3.7Å; L254-L280 HydrophobicContact CD1-CD1 3.87Å
255	H	91.3	Very high	93.9	Very high	82 Å²	82	33.8 Å²	33.8	38%	0.38	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	134.4	-176.2	-179.9	-75.8	0	0	0	111.5	Y227 N252 L257	Y227-H255 HydrophobicContact CD1-CB 3.81Å; Y227-H255 AromaticContact CD1-CG 3.98Å; Y227-H255 AromaticContact CD1-ND1 3.86Å; Y227-H255 HydrophobicContact CE1-CB 3.76Å; Y227-H255 AromaticContact CE1-CG 3.6Å; Y227-H255 AromaticContact CE1-ND1 3.6Å; N252-H255 HydrophobicContact CB-CB 3.88Å; N252-H255 VanDerWaalsContact O-CB 3.3Å; N252-H255 WeakPolarHBondContact O-CB 3.35Å; N252-H255 PolarHBondContact O-N 3Å; H255-L257 VanDerWaalsContact C-N 3.3Å
256	G	88.9	Confident	94.1	Very high	52 Å²	52	34 Å²	34	54%	0.536	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.8	-4.4	-179.2	0	0	0	0	0	114	L254	L254-G256 PolarHBondContact O-N 2.98Å
257	L	93.9	Very high	94.2	Very high	9 Å²	9	34.4 Å²	34.4	5%	0.047	20%	0.195	C	C	.	.			trans	-86.4	149.1	169.8	-57.7	-178.5	0	0	0	110.8	F229 L232 L235 L238 L254 H255 L259 L280	F229-L257 HydrophobicContact CB-CD1 3.81Å; F229-L257 HydrophobicContact CB-CD2 3.91Å; F229-L257 HydrophobicContact CB-CG 4.1Å; F229-L257 HydrophobicContact CD2-CD1 4.11Å; F229-L257 HydrophobicContact CG-CD1 4.07Å; L232-L257 HydrophobicContact CB-CD2 3.97Å; L235-L257 HydrophobicContact CB-CD2 4.49Å; L235-L257 HydrophobicContact CD2-CD1 4.35Å; L235-L257 HydrophobicContact CD2-CD2 4.05Å; L238-L257 HydrophobicContact CD2-CD1 4.24Å; L254-L257 HydrophobicContact CB-CD1 4.3Å; L254-L257 HydrophobicContact CD2-CD1 4.03Å; L254-L257 WeakPolarHBondContact O-CB 3.41Å; L254-L257 PolarHBondContact O-N 2.85Å; H255-L257 VanDerWaalsContact C-N 3.3Å; L257-L259 HydrophobicContact CB-CD1 4.47Å; L257-L259 HydrophobicContact CB-CD2 4.32Å; L257-L259 HydrophobicContact CB-CG 4Å; L257-L259 HydrophobicContact CD1-CD1 4.18Å; L257-L259 HydrophobicContact CD1-CD2 4.44Å; L257-L259 HydrophobicContact CD1-CG 4.41Å; L257-L280 HydrophobicContact CB-CD2 4.48Å; L257-L280 WeakPolarHBondContact O-CD2 3.47Å
258	N	94	Very high	94.3	Very high	54 Å²	54	32.6 Å²	32.6	29%	0.289	19%	0.185	S	C	.	.			trans	-128	70.9	175.1	-175	5	0	0	0	109.3	R236 Y282	R236-N258 WeakPolarHBondContact CD-O 2.89Å; R236-N258 PolarHBondContact NH1-O 3.47Å; N258-Y282 WeakPolarHBondContact OD1-CB 3.11Å; N258-Y282 WeakPolarHBondContact OD1-CD2 3.2Å
259	L	96.8	Very high	94.5	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.164	C	C	.	.			trans	-79.7	144.6	-173.2	-57.9	176.1	0	0	0	111.9	L235 R236 L238 L257 L262 L280 Y282 L283	L235-L259 HydrophobicContact CB-CD2 4.4Å; L235-L259 HydrophobicContact CD2-CD2 3.99Å; L235-L259 HydrophobicContact CG-CD2 3.97Å; R236-L259 WeakPolarHBondContact O-CA 3.33Å; L238-L259 HydrophobicContact CB-CD1 3.86Å; L238-L259 HydrophobicContact CB-CD2 4.02Å; L238-L259 HydrophobicContact CD2-CD1 4.13Å; L257-L259 HydrophobicContact CB-CD1 4.47Å; L257-L259 HydrophobicContact CB-CD2 4.32Å; L257-L259 HydrophobicContact CB-CG 4Å; L257-L259 HydrophobicContact CD1-CD1 4.18Å; L257-L259 HydrophobicContact CD1-CD2 4.44Å; L257-L259 HydrophobicContact CD1-CG 4.41Å; L259-L262 HydrophobicContact CD1-CB 4.35Å; L259-L262 HydrophobicContact CD1-CD1 4.09Å; L259-L280 HydrophobicContact CB-CD2 4.28Å; L259-L280 HydrophobicContact CD1-CD1 4.21Å; L259-L280 HydrophobicContact CD1-CD2 4.44Å; L259-L280 HydrophobicContact CG-CD2 4.28Å; L259-Y282 CarbonylContact O-C 3.54Å; L259-L283 HydrophobicContact CB-CD1 4.08Å; L259-L283 WeakPolarHBondContact O-CA 3.43Å; L259-L283 PolarHBondContact O-N 3.31Å
260	T	97.5	Very high	94.5	Very high	49 Å²	49	31.2 Å²	31.2	30%	0.301	19%	0.187	S	C	.	.	S	Bend	trans	-99.6	-31.5	165.1	54.8	0	0	0	0	111.2	R236 T284 H285	R236-T260 PolarHBondContact O-N 3.19Å; R236-T260 PolarHBondContact O-OG1 3.06Å; T260-T284 PolarHBondContact O-N 3.24Å; T260-T284 PolarHBondContact O-OG1 3.42Å; T260-H285 PolarHBondContact O-N 3Å; T260-H285 VanDerWaalsContact O-N 3.07Å
261	T	98.4	Very high	94.6	Very high	20 Å²	20	32.4 Å²	32.4	12%	0.123	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	128.5	-177	-54	0	0	0	0	109.6	R236 H237 L238 F263 H285	R236-T261 PolarHBondContact O-N 3.22Å; H237-T261 WeakPolarHBondContact CA-O 3.33Å; H237-T261 VanDerWaalsContact CE1-CG2 3.46Å; H237-T261 WeakPolarHBondContact CE1-CG2 3.35Å; H237-T261 VanDerWaalsContact ND1-CB 3.35Å; H237-T261 WeakPolarHBondContact ND1-CB 3.2Å; H237-T261 WeakPolarHBondContact ND1-CG2 3.46Å; L238-T261 PolarHBondContact N-O 3.39Å; L238-T261 VanDerWaalsContact N-O 3.1Å; T261-F263 HydrophobicContact CG2-CD1 3.89Å; T261-F263 HydrophobicContact CG2-CD2 4.45Å; T261-F263 HydrophobicContact CG2-CE1 3.36Å; T261-F263 HydrophobicContact CG2-CE2 4Å; T261-F263 HydrophobicContact CG2-CG 4.41Å; T261-F263 HydrophobicContact CG2-CZ 3.43Å; T261-F263 VanDerWaalsContact CG2-CZ 3.43Å; T261-H285 WeakPolarHBondContact CA-O 3.4Å; T261-H285 HydrophobicContact CG2-CB 3.97Å
262	L	98.2	Very high	94.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	116.4	177.8	175.6	62.1	0	0	0	109.7	L238 L254 L259 I264 L277 L280 L283 H285 L286 N287	L238-L262 HydrophobicContact CB-CD1 4.04Å; L238-L262 HydrophobicContact CD2-CD1 3.94Å; L238-L262 HydrophobicContact CG-CD1 4.05Å; L238-L262 WeakPolarHBondContact O-CA 3.12Å; L254-L262 HydrophobicContact CD1-CD1 4.45Å; L254-L262 HydrophobicContact CD1-CD2 3.7Å; L259-L262 HydrophobicContact CD1-CB 4.35Å; L259-L262 HydrophobicContact CD1-CD1 4.09Å; L262-I264 HydrophobicContact CD1-CD1 4.07Å; L262-I264 HydrophobicContact CD1-CG1 3.89Å; L262-I264 HydrophobicContact CD2-CD1 4.19Å; L262-I264 HydrophobicContact CG-CD1 4.18Å; L262-I264 HydrophobicContact CG-CG1 4.06Å; L262-L277 HydrophobicContact CD2-CD2 3.3Å; L262-L280 HydrophobicContact CD2-CD1 4.08Å; L262-L283 HydrophobicContact CB-CD1 3.7Å; L262-L283 HydrophobicContact CB-CD2 4.41Å; L262-H285 PolarHBondContact N-O 3.08Å; L262-L286 HydrophobicContact CB-CD1 4.25Å; L262-L286 HydrophobicContact CD2-CD1 4.13Å; L262-L286 HydrophobicContact CG-CD1 4.2Å; L262-L286 WeakPolarHBondContact O-CA 3.49Å; L262-N287 PolarHBondContact O-N 3.45Å
263	F	98.4	Very high	94.9	Very high	55 Å²	55	28.3 Å²	28.3	24%	0.241	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124.5	176.1	-61.1	-17.9	0	0	0	109.2	H237 L238 E239 I240 T261 H285 N287	H237-F263 AromaticContact CE1-CD2 3.75Å; H237-F263 AromaticContact CE1-CE2 3.63Å; L238-F263 PolarHBondContact O-N 2.86Å; E239-F263 WeakPolarHBondContact CA-O 3.33Å; E239-F263 HydrophobicContact CB-CB 4.41Å; E239-F263 HydrophobicContact CG-CB 4.13Å; I240-F263 PolarHBondContact N-O 3.24Å; T261-F263 HydrophobicContact CG2-CD1 3.89Å; T261-F263 HydrophobicContact CG2-CD2 4.45Å; T261-F263 HydrophobicContact CG2-CE1 3.36Å; T261-F263 HydrophobicContact CG2-CE2 4Å; T261-F263 HydrophobicContact CG2-CG 4.41Å; T261-F263 HydrophobicContact CG2-CZ 3.43Å; T261-F263 VanDerWaalsContact CG2-CZ 3.43Å; F263-H285 HydrophobicContact CE1-CB 4.35Å; F263-N287 WeakPolarHBondContact CA-O 3.44Å; F263-N287 HydrophobicContact CB-CB 4.26Å; F263-N287 HydrophobicContact CD1-CB 3.24Å; F263-N287 HydrophobicContact CE1-CB 3.73Å; F263-N287 HydrophobicContact CG-CB 3.92Å
264	I	96.7	Very high	94.9	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	85.3	174.2	-46.6	-177.9	0	0	0	106.7	I240 M249 L262 T267 L269 N287 L288 N291	I240-I264 HydrophobicContact CB-CG2 4.32Å; I240-I264 HydrophobicContact CG2-CG2 4.28Å; I240-I264 CarbonylContact O-C 3.2Å; I240-I264 VanDerWaalsContact O-CA 3.26Å; I240-I264 WeakPolarHBondContact O-CA 3.01Å; M249-I264 HydrophobicContact CE-CD1 3.78Å; M249-I264 HydrophobicContact SD-CD1 3.28Å; M249-I264 WeakPolarHBondContact SD-CD1 3.39Å; L262-I264 HydrophobicContact CD1-CD1 4.07Å; L262-I264 HydrophobicContact CD1-CG1 3.89Å; L262-I264 HydrophobicContact CD2-CD1 4.19Å; L262-I264 HydrophobicContact CG-CD1 4.18Å; L262-I264 HydrophobicContact CG-CG1 4.06Å; I264-T267 HydrophobicContact CG2-CG2 3.99Å; I264-L269 HydrophobicContact CG2-CD1 3.81Å; I264-N287 PolarHBondContact N-O 2.95Å; I264-L288 HydrophobicContact CB-CD2 3.76Å; I264-L288 HydrophobicContact CD1-CD2 4.26Å; I264-L288 HydrophobicContact CG1-CD2 4.17Å; I264-L288 WeakPolarHBondContact O-CA 3.37Å; I264-N291 PolarHBondContact O-ND2 3.1Å
265	T	97.4	Very high	94.8	Very high	14 Å²	14	35 Å²	35	9%	0.086	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	152.4	-168.6	48	0	0	0	0	111.9	I240 D241 N242 T267 N287 S289	I240-T265 PolarHBondContact O-N 3.19Å; D241-T265 WeakPolarHBondContact CA-O 3.19Å; D241-T265 WeakPolarHBondContact OD1-CB 3.42Å; D241-T265 PolarHBondContact OD1-OG1 3.27Å; N242-T265 PolarHBondContact N-O 3.49Å; T265-T267 VanDerWaalsContact C-N 3.31Å; T265-T267 VanDerWaalsContact O-CG2 3.28Å; T265-T267 WeakPolarHBondContact O-CG2 3.43Å; T265-T267 PolarHBondContact O-N 2.92Å; T265-N287 HydrophobicContact CG2-CB 4.27Å; T265-N287 WeakPolarHBondContact CG2-OD1 3.18Å; T265-S289 VanDerWaalsContact CA-O 3.3Å; T265-S289 WeakPolarHBondContact CA-O 3.36Å
266	N	95.9	Very high	94.8	Very high	63 Å²	63	31.2 Å²	31.2	34%	0.337	19%	0.185	S	C	.	.	S	Bend	trans	54.7	45.9	178.7	-59	-63.5	0	0	0	112.6	D241 N242 W243 S289 F290	D241-N266 PolarHBondContact OD1-ND2 2.91Å; N242-N266 VanDerWaalsContact CA-O 3.3Å; N242-N266 WeakPolarHBondContact CA-O 3.27Å; N242-N266 HydrophobicContact CB-CB 4.2Å; W243-N266 PolarHBondContact N-O 3.27Å; N266-S289 PolarHBondContact N-O 3.16Å; N266-F290 WeakPolarHBondContact CA-O 3.47Å; N266-F290 WeakPolarHBondContact OD1-CB 3.07Å; N266-F290 WeakPolarHBondContact OD1-CG 3.37Å
267	T	95.4	Very high	95.1	Very high	9 Å²	9	28.9 Å²	28.9	6%	0.055	16%	0.16	C	C	.	.	S	Bend	trans	-120.5	-180	176	82.6	0	0	0	0	110.9	I240 W243 L246 I264 T265 L269 F290 N291	I240-T267 HydrophobicContact CG2-CG2 4.49Å; W243-T267 HydrophobicContact CB-CG2 4.03Å; W243-T267 WeakPolarHBondContact O-CA 3.42Å; W243-T267 WeakPolarHBondContact O-CB 2.92Å; L246-T267 HydrophobicContact CD2-CG2 4.35Å; I264-T267 HydrophobicContact CG2-CG2 3.99Å; T265-T267 VanDerWaalsContact C-N 3.31Å; T265-T267 VanDerWaalsContact O-CG2 3.28Å; T265-T267 WeakPolarHBondContact O-CG2 3.43Å; T265-T267 PolarHBondContact O-N 2.92Å; T267-L269 WeakPolarHBondContact OG1-CG 3.48Å; T267-F290 PolarHBondContact N-O 3.27Å; T267-N291 WeakPolarHBondContact CA-OD1 3.05Å; T267-N291 WeakPolarHBondContact CB-OD1 3.34Å; T267-N291 PolarHBondContact N-OD1 3.35Å; T267-N291 PolarHBondContact O-OD1 2.74Å; T267-N291 PolarHBondContact OG1-OD1 3.48Å
268	N	94.8	Very high	94.8	Very high	40 Å²	40	34.2 Å²	34.2	21%	0.214	18%	0.183	C	C	.	.			trans	-102.2	24.1	-176.9	-170.4	26.4	0	0	0	112.9	P244 L246 D247 S270 R292	P244-N268 WeakPolarHBondContact O-CB 3.43Å; L246-N268 CarbonylContact O-C 3.31Å; L246-N268 VanDerWaalsContact O-C 3.22Å; L246-N268 VanDerWaalsContact O-CA 3.23Å; L246-N268 WeakPolarHBondContact O-CA 3.25Å; L246-N268 WeakPolarHBondContact O-CB 3.34Å; L246-N268 PolarHBondContact O-N 2.91Å; D247-N268 WeakPolarHBondContact CA-O 3.08Å; N268-S270 PolarHBondContact O-N 3.35Å; N268-S270 VanDerWaalsContact O-N 3.1Å; N268-R292 WeakPolarHBondContact OD1-CD 3.48Å; N268-R292 PolarHBondContact OD1-NE 3.32Å; N268-R292 PolarHBondContact OD1-NH1 3.38Å
269	L	94.2	Very high	94.4	Very high	1 Å²	1	36 Å²	36	1%	0.005	19%	0.19	C	C	.	.			trans	-58.4	117.8	-179.4	-68.7	176.2	0	0	0	111.5	L246 D247 M249 I264 T267 N291 R292 I293	L246-L269 HydrophobicContact CG-CD2 4.43Å; L246-L269 PolarHBondContact O-N 2.98Å; D247-L269 WeakPolarHBondContact O-CA 3.42Å; M249-L269 HydrophobicContact CG-CD2 3.93Å; M249-L269 HydrophobicContact SD-CD1 4.46Å; I264-L269 HydrophobicContact CG2-CD1 3.81Å; T267-L269 WeakPolarHBondContact OG1-CG 3.48Å; L269-N291 HydrophobicContact CB-CB 4.24Å; L269-R292 CarbonylContact O-C 3.59Å; L269-R292 VanDerWaalsContact O-CA 3.31Å; L269-R292 WeakPolarHBondContact O-CA 3.12Å; L269-R292 PolarHBondContact O-N 2.96Å; L269-I293 PolarHBondContact O-N 2.94Å
270	S	92.3	Very high	94.2	Very high	76 Å²	76	36 Å²	36	53%	0.531	19%	0.19	S	C	.	.			trans	-83.5	-21.9	-179.8	59.2	0	0	0	0	113.7	D247 N268	D247-S270 PolarHBondContact O-N 3.2Å; N268-S270 PolarHBondContact O-N 3.35Å; N268-S270 VanDerWaalsContact O-N 3.1Å
271	S	92.9	Very high	93.9	Very high	54 Å²	54	36.4 Å²	36.4	38%	0.378	19%	0.193	S	C	.	.	S	Bend	trans	-138.3	151	-175.7	58.1	0	0	0	0	110.7
272	F	94.4	Very high	93.8	Very high	5 Å²	5	40.5 Å²	40.5	2%	0.022	21%	0.207	C	C	.	.			trans	-64.8	132.7	175.5	-159.8	-75.4	0	0	0	110.7	Y274 L277 L286 L288 I293 I296 L301 L312	F272-Y274 VanDerWaalsContact C-N 3.28Å; F272-Y274 HydrophobicContact CB-CD1 4.46Å; F272-Y274 HydrophobicContact CB-CD2 4.43Å; F272-Y274 HydrophobicContact CB-CE1 3.85Å; F272-Y274 HydrophobicContact CB-CE2 3.82Å; F272-Y274 VanDerWaalsContact CB-CZ 3.48Å; F272-Y274 AromaticContact CD1-CD1 3.57Å; F272-Y274 HydrophobicContact CD1-CD1 3.57Å; F272-Y274 AromaticContact CD1-CE1 3.45Å; F272-Y274 HydrophobicContact CD1-CE1 3.45Å; F272-Y274 VanDerWaalsContact CD1-CE1 3.45Å; F272-Y274 HydrophobicContact CD1-CG 4.23Å; F272-Y274 HydrophobicContact CE1-CD1 4.22Å; F272-Y274 HydrophobicContact CE1-CE1 4.2Å; F272-Y274 HydrophobicContact CG-CD1 4.32Å; F272-Y274 AromaticContact CG-CE1 3.79Å; F272-Y274 HydrophobicContact CG-CE1 3.79Å; F272-Y274 AromaticContact CG-CZ 3.96Å; F272-Y274 VanDerWaalsContact O-CD2 3.23Å; F272-Y274 WeakPolarHBondContact O-CD2 3.17Å; F272-Y274 PolarHBondContact O-N 3.13Å; F272-L277 HydrophobicContact CD1-CD1 4.22Å; F272-L277 HydrophobicContact CE1-CD1 3.49Å; F272-L277 VanDerWaalsContact CE1-CD1 3.49Å; F272-L277 HydrophobicContact CZ-CD1 4.27Å; F272-L286 HydrophobicContact CE1-CD2 4.37Å; F272-L286 HydrophobicContact CZ-CD2 3.8Å; F272-L288 HydrophobicContact CD1-CD1 4.44Å; F272-L288 HydrophobicContact CD2-CD1 3.82Å; F272-L288 HydrophobicContact CE1-CD1 4.1Å; F272-L288 HydrophobicContact CE2-CD1 3.46Å; F272-L288 VanDerWaalsContact CE2-CD1 3.46Å; F272-L288 HydrophobicContact CG-CD1 4.3Å; F272-L288 HydrophobicContact CZ-CD1 3.61Å; F272-I293 HydrophobicContact CB-CG2 4.28Å; F272-I293 HydrophobicContact CD2-CD1 4.41Å; F272-I296 HydrophobicContact CD2-CD1 4.46Å; F272-I296 HydrophobicContact CD2-CG1 4.2Å; F272-L301 HydrophobicContact CD1-CD2 4.13Å; F272-L301 HydrophobicContact CE1-CD1 4.44Å; F272-L301 HydrophobicContact CE1-CD2 3.45Å; F272-L301 VanDerWaalsContact CE1-CD2 3.45Å; F272-L301 HydrophobicContact CZ-CD1 4.24Å; F272-L301 HydrophobicContact CZ-CD2 4Å; F272-L312 HydrophobicContact CD2-CD2 4.49Å; F272-L312 HydrophobicContact CE2-CD1 4.41Å; F272-L312 HydrophobicContact CE2-CD2 4.28Å
273	P	94.4	Very high	93.7	Very high	9 Å²	9	40.5 Å²	40.5	6%	0.058	21%	0.207	C	C	.	.			trans	-83.7	58.3	-170.4	33.8	-37	0	0	0	113.5	M249 Q275 A276 L277 L288	M249-P273 HydrophobicContact CB-CB 4.02Å; M249-P273 HydrophobicContact CG-CB 4.38Å; M249-P273 HydrophobicContact SD-CB 3.94Å; M249-P273 HydrophobicContact SD-CG 4.17Å; P273-Q275 VanDerWaalsContact C-N 3.34Å; P273-Q275 PolarHBondContact O-N 3.12Å; P273-A276 HydrophobicContact CB-CB 4.32Å; P273-A276 PolarHBondContact O-N 3.07Å; P273-L277 HydrophobicContact CG-CD1 4.02Å; P273-L277 HydrophobicContact CG-CG 4.3Å; P273-L277 WeakPolarHBondContact O-CG 3.09Å; P273-L277 PolarHBondContact O-N 3.46Å; P273-L288 HydrophobicContact CG-CD1 4.41Å
274	Y	93.3	Very high	93.7	Very high	27 Å²	27	39.3 Å²	39.3	11%	0.106	20%	0.204	C	C	.	.	H	α-helix	trans	-52.4	-47.3	-174.5	-54.6	-69.8	0	0	0	113.8	F272 A276 L277 K278 I296 E297 M300 L301	F272-Y274 VanDerWaalsContact C-N 3.28Å; F272-Y274 HydrophobicContact CB-CD1 4.46Å; F272-Y274 HydrophobicContact CB-CD2 4.43Å; F272-Y274 HydrophobicContact CB-CE1 3.85Å; F272-Y274 HydrophobicContact CB-CE2 3.82Å; F272-Y274 VanDerWaalsContact CB-CZ 3.48Å; F272-Y274 AromaticContact CD1-CD1 3.57Å; F272-Y274 HydrophobicContact CD1-CD1 3.57Å; F272-Y274 AromaticContact CD1-CE1 3.45Å; F272-Y274 HydrophobicContact CD1-CE1 3.45Å; F272-Y274 VanDerWaalsContact CD1-CE1 3.45Å; F272-Y274 HydrophobicContact CD1-CG 4.23Å; F272-Y274 HydrophobicContact CE1-CD1 4.22Å; F272-Y274 HydrophobicContact CE1-CE1 4.2Å; F272-Y274 HydrophobicContact CG-CD1 4.32Å; F272-Y274 AromaticContact CG-CE1 3.79Å; F272-Y274 HydrophobicContact CG-CE1 3.79Å; F272-Y274 AromaticContact CG-CZ 3.96Å; F272-Y274 VanDerWaalsContact O-CD2 3.23Å; F272-Y274 WeakPolarHBondContact O-CD2 3.17Å; F272-Y274 PolarHBondContact O-N 3.13Å; Y274-A276 VanDerWaalsContact C-N 3.34Å; Y274-A276 PolarHBondContact O-N 3.1Å; Y274-L277 PolarHBondContact O-N 2.84Å; Y274-K278 PolarHBondContact O-N 3.05Å; Y274-I296 WeakPolarHBondContact OH-CA 3.09Å; Y274-E297 HydrophobicContact CE2-CB 4.29Å; Y274-E297 HydrophobicContact CE2-CG 4.33Å; Y274-E297 PolarHBondContact OH-N 3.14Å; Y274-M300 HydrophobicContact CD1-CB 3.37Å; Y274-M300 HydrophobicContact CD1-CG 4.4Å; Y274-M300 HydrophobicContact CD2-CB 4.32Å; Y274-M300 HydrophobicContact CD2-CE 4.25Å; Y274-M300 HydrophobicContact CE1-CB 3.6Å; Y274-M300 HydrophobicContact CE1-CG 4.48Å; Y274-M300 HydrophobicContact CE2-CB 4.5Å; Y274-M300 HydrophobicContact CG-CB 3.77Å; Y274-M300 HydrophobicContact CG-CE 4.28Å; Y274-M300 HydrophobicContact CG-CG 4.45Å; Y274-L301 HydrophobicContact CD1-CD2 3.7Å; Y274-L301 HydrophobicContact CD1-CG 4.32Å; Y274-L301 HydrophobicContact CE1-CD2 3.93Å; Y274-L301 HydrophobicContact CE1-CG 4.19Å
275	Q	91.5	Very high	93.7	Very high	116 Å²	116	42 Å²	42	54%	0.542	22%	0.217	S	C	.	.	H	α-helix	trans	-69.4	-31.2	-175.1	-67.2	178.5	-19	0	0	112.6	V251 P273	V251-Q275 HydrophobicContact CG1-CB 4.4Å; V251-Q275 HydrophobicContact CG2-CB 3.95Å; V251-Q275 HydrophobicContact CG2-CG 4.47Å; P273-Q275 VanDerWaalsContact C-N 3.34Å; P273-Q275 PolarHBondContact O-N 3.12Å
276	A	92.4	Very high	93.8	Very high	2 Å²	2	41.3 Å²	41.3	2%	0.017	21%	0.213	C	C	.	.	H	α-helix	trans	-73.6	-33.4	175.6	0	0	0	0	0	111.8	M249 P273 Y274	M249-A276 HydrophobicContact CB-CB 4.37Å; M249-A276 HydrophobicContact CE-CB 4.41Å; P273-A276 HydrophobicContact CB-CB 4.32Å; P273-A276 PolarHBondContact O-N 3.07Å; Y274-A276 VanDerWaalsContact C-N 3.34Å; Y274-A276 PolarHBondContact O-N 3.1Å
277	L	93.4	Very high	93.9	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.016	21%	0.205	C	C	.	.	H	α-helix	trans	-83.2	-18.2	-177.9	-63.3	173.9	0	0	0	113.9	L262 F272 P273 Y274 H279 L280 L283 L286	L262-L277 HydrophobicContact CD2-CD2 3.3Å; F272-L277 HydrophobicContact CD1-CD1 4.22Å; F272-L277 HydrophobicContact CE1-CD1 3.49Å; F272-L277 VanDerWaalsContact CE1-CD1 3.49Å; F272-L277 HydrophobicContact CZ-CD1 4.27Å; P273-L277 HydrophobicContact CG-CD1 4.02Å; P273-L277 HydrophobicContact CG-CG 4.3Å; P273-L277 WeakPolarHBondContact O-CG 3.09Å; P273-L277 PolarHBondContact O-N 3.46Å; Y274-L277 PolarHBondContact O-N 2.84Å; L277-H279 PolarHBondContact O-N 3.5Å; L277-L280 HydrophobicContact CD2-CD1 3.99Å; L277-L280 PolarHBondContact O-N 3.49Å; L277-L283 HydrophobicContact CD2-CD2 4.45Å; L277-L286 HydrophobicContact CD1-CD2 3.88Å; L277-L286 HydrophobicContact CD2-CD1 4.4Å
278	K	89	Confident	94	Very high	122 Å²	122	39.4 Å²	39.4	53%	0.53	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51	-31.5	-175.6	-171.3	177.6	-179.7	178.2	0	114	Y274 E303	Y274-K278 PolarHBondContact O-N 3.05Å; K278-E303 HydrophobicContact CG-CG 4.23Å
279	H	86	Confident	94.1	Very high	91 Å²	91	37.7 Å²	37.7	42%	0.421	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	10.9	-176.3	-61.9	-66	0	0	0	114.4	L277 P281	L277-H279 PolarHBondContact O-N 3.5Å; H279-P281 WeakPolarHBondContact O-CD 3.26Å
280	L	92.8	Very high	94.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.215	C	C	.	.			trans	-112.2	64.8	-176.9	-58.7	176.7	0	0	0	112.5	L254 L257 L259 L262 L277 Y282 L283 L304	L254-L280 HydrophobicContact CD1-CD1 3.87Å; L257-L280 HydrophobicContact CB-CD2 4.48Å; L257-L280 WeakPolarHBondContact O-CD2 3.47Å; L259-L280 HydrophobicContact CB-CD2 4.28Å; L259-L280 HydrophobicContact CD1-CD1 4.21Å; L259-L280 HydrophobicContact CD1-CD2 4.44Å; L259-L280 HydrophobicContact CG-CD2 4.28Å; L262-L280 HydrophobicContact CD2-CD1 4.08Å; L277-L280 HydrophobicContact CD2-CD1 3.99Å; L277-L280 PolarHBondContact O-N 3.49Å; L280-Y282 PolarHBondContact O-N 2.81Å; L280-L283 HydrophobicContact CB-CB 4.24Å; L280-L283 WeakPolarHBondContact O-CB 3.49Å; L280-L283 PolarHBondContact O-N 3.36Å; L280-L304 WeakPolarHBondContact O-CD2 3.22Å
281	P	91.1	Very high	94.4	Very high	58 Å²	58	39.2 Å²	39.2	38%	0.377	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-15.3	-175.6	29.9	-36.2	0	0	0	113.7	H279	H279-P281 WeakPolarHBondContact O-CD 3.26Å
282	Y	95	Very high	94.5	Very high	105 Å²	105	43 Å²	43	41%	0.412	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-1.1	-180	-64.3	-82.4	0	0	0	114	N258 L259 L280 T284	N258-Y282 WeakPolarHBondContact OD1-CB 3.11Å; N258-Y282 WeakPolarHBondContact OD1-CD2 3.2Å; L259-Y282 CarbonylContact O-C 3.54Å; L280-Y282 PolarHBondContact O-N 2.81Å; Y282-T284 PolarHBondContact O-N 2.73Å
283	L	96.6	Very high	94.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.195	C	C	.	.			trans	-63.7	126.3	-178.4	-162.2	72.9	0	0	0	110.4	L259 L262 L277 L280 L286 L304 R306 L307	L259-L283 HydrophobicContact CB-CD1 4.08Å; L259-L283 WeakPolarHBondContact O-CA 3.43Å; L259-L283 PolarHBondContact O-N 3.31Å; L262-L283 HydrophobicContact CB-CD1 3.7Å; L262-L283 HydrophobicContact CB-CD2 4.41Å; L277-L283 HydrophobicContact CD2-CD2 4.45Å; L280-L283 HydrophobicContact CB-CB 4.24Å; L280-L283 WeakPolarHBondContact O-CB 3.49Å; L280-L283 PolarHBondContact O-N 3.36Å; L283-L286 HydrophobicContact CD2-CB 4.04Å; L283-L286 HydrophobicContact CD2-CD1 4.22Å; L283-L286 HydrophobicContact CD2-CD2 4.44Å; L283-L286 HydrophobicContact CD2-CG 4.46Å; L283-L304 HydrophobicContact CB-CD2 4.46Å; L283-R306 CarbonylContact O-C 3.52Å; L283-L307 HydrophobicContact CD2-CD1 4.14Å; L283-L307 HydrophobicContact CG-CD1 4.14Å; L283-L307 VanDerWaalsContact O-CA 3.29Å; L283-L307 WeakPolarHBondContact O-CA 3.45Å; L283-L307 PolarHBondContact O-N 3.4Å; L283-L307 VanDerWaalsContact O-N 3.13Å
284	T	97.3	Very high	94.6	Very high	30 Å²	30	49.9 Å²	49.9	18%	0.184	22%	0.221	C	C	.	.			trans	-110.3	-33.1	179.2	53.2	0	0	0	0	111.9	T260 Y282 R306 R308 E309	T260-T284 PolarHBondContact O-N 3.24Å; T260-T284 PolarHBondContact O-OG1 3.42Å; Y282-T284 PolarHBondContact O-N 2.73Å; T284-R306 HydrophobicContact CG2-CB 4.48Å; T284-R308 PolarHBondContact O-N 3.4Å; T284-E309 PolarHBondContact O-N 3.17Å
285	H	98.4	Very high	94.6	Very high	57 Å²	57	51.2 Å²	51.2	26%	0.264	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122.8	-178.6	-58.1	74.4	0	0	0	109.9	T260 T261 L262 F263 E309	T260-H285 PolarHBondContact O-N 3Å; T260-H285 VanDerWaalsContact O-N 3.07Å; T261-H285 WeakPolarHBondContact CA-O 3.4Å; T261-H285 HydrophobicContact CG2-CB 3.97Å; L262-H285 PolarHBondContact N-O 3.08Å; F263-H285 HydrophobicContact CE1-CB 4.35Å; H285-E309 IonicContact CD2-OE2 3.77Å; H285-E309 PolarHBondContact CD2-OE2 2.87Å; H285-E309 IonicContact NE2-OE1 3.62Å; H285-E309 IonicContact NE2-OE2 2.7Å
286	L	97.9	Very high	94.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	122.4	175.6	178.9	58.3	0	0	0	109.6	L262 F272 L277 L283 L288 L307 E309 L310 H311	L262-L286 HydrophobicContact CB-CD1 4.25Å; L262-L286 HydrophobicContact CD2-CD1 4.13Å; L262-L286 HydrophobicContact CG-CD1 4.2Å; L262-L286 WeakPolarHBondContact O-CA 3.49Å; F272-L286 HydrophobicContact CE1-CD2 4.37Å; F272-L286 HydrophobicContact CZ-CD2 3.8Å; L277-L286 HydrophobicContact CD1-CD2 3.88Å; L277-L286 HydrophobicContact CD2-CD1 4.4Å; L283-L286 HydrophobicContact CD2-CB 4.04Å; L283-L286 HydrophobicContact CD2-CD1 4.22Å; L283-L286 HydrophobicContact CD2-CD2 4.44Å; L283-L286 HydrophobicContact CD2-CG 4.46Å; L286-L288 HydrophobicContact CD1-CD1 4.36Å; L286-L288 HydrophobicContact CD1-CD2 4.06Å; L286-L288 HydrophobicContact CD1-CG 3.93Å; L286-L288 HydrophobicContact CD2-CD1 4.2Å; L286-L288 HydrophobicContact CG-CD1 4.33Å; L286-L288 HydrophobicContact CG-CG 4.09Å; L286-L307 HydrophobicContact CB-CD1 3.75Å; L286-L307 HydrophobicContact CB-CD2 4.46Å; L286-E309 PolarHBondContact N-O 3.3Å; L286-L310 HydrophobicContact CB-CD1 4.11Å; L286-L310 HydrophobicContact CD2-CD1 3.88Å; L286-L310 HydrophobicContact CG-CD1 3.96Å; L286-L310 WeakPolarHBondContact O-CA 3.26Å; L286-H311 PolarHBondContact O-N 3.2Å
287	N	98.4	Very high	94.9	Very high	31 Å²	31	49.9 Å²	49.9	17%	0.166	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	116.4	174.1	-167.8	-10.1	0	0	0	109.9	L262 F263 I264 T265 S289 H311	L262-N287 PolarHBondContact O-N 3.45Å; F263-N287 WeakPolarHBondContact CA-O 3.44Å; F263-N287 HydrophobicContact CB-CB 4.26Å; F263-N287 HydrophobicContact CD1-CB 3.24Å; F263-N287 HydrophobicContact CE1-CB 3.73Å; F263-N287 HydrophobicContact CG-CB 3.92Å; I264-N287 PolarHBondContact N-O 2.95Å; T265-N287 HydrophobicContact CG2-CB 4.27Å; T265-N287 WeakPolarHBondContact CG2-OD1 3.18Å; N287-S289 WeakPolarHBondContact OD1-CB 3.26Å; N287-S289 PolarHBondContact OD1-N 3.47Å; N287-S289 PolarHBondContact OD1-OG 2.84Å; N287-H311 HydrophobicContact CB-CB 4.15Å; N287-H311 WeakPolarHBondContact OD1-CB 3.43Å
288	L	97.3	Very high	94.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.237	C	C	.	.			trans	-122.1	31.5	175.6	-62.2	178.2	0	0	0	110.3	I264 F272 P273 L286 N291 I293 H311 L312	I264-L288 HydrophobicContact CB-CD2 3.76Å; I264-L288 HydrophobicContact CD1-CD2 4.26Å; I264-L288 HydrophobicContact CG1-CD2 4.17Å; I264-L288 WeakPolarHBondContact O-CA 3.37Å; F272-L288 HydrophobicContact CD1-CD1 4.44Å; F272-L288 HydrophobicContact CD2-CD1 3.82Å; F272-L288 HydrophobicContact CE1-CD1 4.1Å; F272-L288 HydrophobicContact CE2-CD1 3.46Å; F272-L288 VanDerWaalsContact CE2-CD1 3.46Å; F272-L288 HydrophobicContact CG-CD1 4.3Å; F272-L288 HydrophobicContact CZ-CD1 3.61Å; P273-L288 HydrophobicContact CG-CD1 4.41Å; L286-L288 HydrophobicContact CD1-CD1 4.36Å; L286-L288 HydrophobicContact CD1-CD2 4.06Å; L286-L288 HydrophobicContact CD1-CG 3.93Å; L286-L288 HydrophobicContact CD2-CD1 4.2Å; L286-L288 HydrophobicContact CG-CD1 4.33Å; L286-L288 HydrophobicContact CG-CG 4.09Å; L288-N291 PolarHBondContact O-ND2 3.35Å; L288-I293 HydrophobicContact CB-CD1 4.23Å; L288-I293 HydrophobicContact CD1-CD1 4.24Å; L288-H311 PolarHBondContact N-O 2.98Å; L288-L312 HydrophobicContact CB-CD2 3.71Å; L288-L312 HydrophobicContact CD1-CD2 4.41Å
289	S	97.8	Very high	94.9	Very high	4 Å²	4	46.4 Å²	46.4	3%	0.028	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	152.9	179.9	-57.9	0	0	0	0	112.4	T265 N266 N287 N291 V313	T265-S289 VanDerWaalsContact CA-O 3.3Å; T265-S289 WeakPolarHBondContact CA-O 3.36Å; N266-S289 PolarHBondContact N-O 3.16Å; N287-S289 WeakPolarHBondContact OD1-CB 3.26Å; N287-S289 PolarHBondContact OD1-N 3.47Å; N287-S289 PolarHBondContact OD1-OG 2.84Å; S289-N291 VanDerWaalsContact C-N 3.3Å; S289-N291 PolarHBondContact O-N 3.35Å; S289-N291 PolarHBondContact O-ND2 2.94Å; S289-V313 CarbonylContact C-O 3.59Å; S289-V313 VanDerWaalsContact CA-O 3.28Å; S289-V313 WeakPolarHBondContact CA-O 3.48Å; S289-V313 WeakPolarHBondContact CB-O 3.28Å; S289-V313 PolarHBondContact OG-N 3.09Å
290	F	96.9	Very high	95.2	Very high	107 Å²	107	46.5 Å²	46.5	47%	0.469	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	41.4	178.5	-51	-72.2	0	0	0	113.2	N266 T267 V313	N266-F290 WeakPolarHBondContact CA-O 3.47Å; N266-F290 WeakPolarHBondContact OD1-CB 3.07Å; N266-F290 WeakPolarHBondContact OD1-CG 3.37Å; T267-F290 PolarHBondContact N-O 3.27Å; F290-V313 HydrophobicContact CE1-CG1 4.29Å; F290-V313 HydrophobicContact CZ-CG1 4.04Å; F290-V313 PolarHBondContact N-O 3.23Å
291	N	96.4	Very high	95.1	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.016	22%	0.224	C	C	.	.	S	Bend	trans	-105	-172.8	169.4	-72.6	-60.3	0	0	0	111.1	I264 T267 L269 L288 S289 I293 A315	I264-N291 PolarHBondContact O-ND2 3.1Å; T267-N291 WeakPolarHBondContact CA-OD1 3.05Å; T267-N291 WeakPolarHBondContact CB-OD1 3.34Å; T267-N291 PolarHBondContact N-OD1 3.35Å; T267-N291 PolarHBondContact O-OD1 2.74Å; T267-N291 PolarHBondContact OG1-OD1 3.48Å; L269-N291 HydrophobicContact CB-CB 4.24Å; L288-N291 PolarHBondContact O-ND2 3.35Å; S289-N291 VanDerWaalsContact C-N 3.3Å; S289-N291 PolarHBondContact O-N 3.35Å; S289-N291 PolarHBondContact O-ND2 2.94Å; N291-I293 HydrophobicContact CB-CD1 4.09Å; N291-I293 HydrophobicContact CB-CG1 4Å; N291-A315 CarbonylContact O-C 3.46Å; N291-A315 VanDerWaalsContact O-C 3.3Å; N291-A315 VanDerWaalsContact O-CA 3.29Å; N291-A315 WeakPolarHBondContact O-CA 3.36Å; N291-A315 VanDerWaalsContact O-O 3.1Å
292	R	95.3	Very high	95.1	Very high	132 Å²	132	48.2 Å²	48.2	50%	0.498	23%	0.228	S	C	.	.			trans	-113.9	36.6	176.8	-55.9	-164.4	-172.8	152.5	-5.2	112.3	N268 L269 R294 A315	N268-R292 WeakPolarHBondContact OD1-CD 3.48Å; N268-R292 PolarHBondContact OD1-NE 3.32Å; N268-R292 PolarHBondContact OD1-NH1 3.38Å; L269-R292 CarbonylContact O-C 3.59Å; L269-R292 VanDerWaalsContact O-CA 3.31Å; L269-R292 WeakPolarHBondContact O-CA 3.12Å; L269-R292 PolarHBondContact O-N 2.96Å; R292-R294 PolarHBondContact O-N 2.85Å; R292-A315 CarbonylContact C-O 3.58Å; R292-A315 VanDerWaalsContact C-O 3.3Å; R292-A315 WeakPolarHBondContact CA-O 3.24Å
293	I	95.5	Very high	94.7	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.231	C	C	.	.			trans	-79.4	107	-178.9	-56.4	170.5	0	0	0	109.9	L269 F272 L288 N291 L312 A315 Q316 L317	L269-I293 PolarHBondContact O-N 2.94Å; F272-I293 HydrophobicContact CB-CG2 4.28Å; F272-I293 HydrophobicContact CD2-CD1 4.41Å; L288-I293 HydrophobicContact CB-CD1 4.23Å; L288-I293 HydrophobicContact CD1-CD1 4.24Å; N291-I293 HydrophobicContact CB-CD1 4.09Å; N291-I293 HydrophobicContact CB-CG1 4Å; I293-L312 HydrophobicContact CD1-CD2 4.21Å; I293-A315 CarbonylContact C-O 3.55Å; I293-A315 HydrophobicContact CB-CB 4.43Å; I293-A315 PolarHBondContact N-O 2.8Å; I293-Q316 CarbonylContact O-C 3.52Å; I293-L317 WeakPolarHBondContact O-CA 3.06Å; I293-L317 PolarHBondContact O-N 2.96Å
294	R	94.3	Very high	94.5	Very high	160 Å²	160	48.4 Å²	48.4	60%	0.604	23%	0.232	S	C	*	.			trans	-85	-25.8	-177.7	-63.2	-177.4	-177.8	177.1	1.8	114.5	R292 T318	R292-R294 PolarHBondContact O-N 2.85Å; R294-T318 PolarHBondContact O-N 3.25Å; R294-T318 PolarHBondContact O-OG1 2.71Å
295	H	94.2	Very high	94.3	Very high	54 Å²	54	50.5 Å²	50.5	25%	0.25	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	145.8	-169.5	178.6	-109.1	0	0	0	111.2	T319 D321	H295-T319 PolarHBondContact CD2-O 2.91Å; H295-T319 PolarHBondContact CD2-OG1 2.03Å; H295-T319 VanDerWaalsContact CD2-OG1 3.28Å; H295-D321 IonicContact CD2-OD1 3.3Å; H295-D321 VanDerWaalsContact CE1-CG 3.49Å; H295-D321 IonicContact CE1-OD1 2.78Å; H295-D321 IonicContact CE1-OD2 3.64Å; H295-D321 PolarHBondContact CE1-OD2 2.6Å; H295-D321 IonicContact NE2-OD1 3.67Å; H295-D321 PolarHBondContact NE2-OD1 2.95Å; H295-D321 IonicContact NE2-OD2 3.31Å; H295-D321 PolarHBondContact NE2-OD2 3.18Å
296	I	95.7	Very high	94.1	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	116.8	170.8	-58.3	170.4	0	0	0	108.7	F272 Y274 L301 L312 L317 T319 I320 D321 A324 F325	F272-I296 HydrophobicContact CD2-CD1 4.46Å; F272-I296 HydrophobicContact CD2-CG1 4.2Å; Y274-I296 WeakPolarHBondContact OH-CA 3.09Å; I296-L301 HydrophobicContact CG2-CD1 4.48Å; I296-L312 HydrophobicContact CD1-CD1 3.52Å; I296-L317 HydrophobicContact CD1-CD1 3.98Å; I296-L317 HydrophobicContact CD1-CD2 3.93Å; I296-L317 HydrophobicContact CG1-CD1 3.74Å; I296-T319 PolarHBondContact N-O 2.99Å; I296-I320 HydrophobicContact CB-CG2 4.33Å; I296-I320 HydrophobicContact CD1-CG1 4.32Å; I296-D321 PolarHBondContact O-N 2.91Å; I296-A324 HydrophobicContact CG2-CB 3.84Å; I296-F325 HydrophobicContact CD1-CE1 4.34Å; I296-F325 HydrophobicContact CD1-CZ 4.33Å; I296-F325 HydrophobicContact CG2-CE1 4.37Å
297	E	93.9	Very high	94	Very high	90 Å²	90	54.5 Å²	54.5	42%	0.421	26%	0.258	S	S	.	.			trans	-72.4	142.6	180	-63.4	-177.1	172.4	0	0	113.3	Y274 M300	Y274-E297 HydrophobicContact CE2-CB 4.29Å; Y274-E297 HydrophobicContact CE2-CG 4.33Å; Y274-E297 PolarHBondContact OH-N 3.14Å; E297-M300 HydrophobicContact CB-CG 3.92Å
298	G	93.1	Very high	93.9	Very high	32 Å²	32	59.4 Å²	59.4	33%	0.33	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	135.3	175.4	0	0	0	0	0	113.2	M300	G298-M300 VanDerWaalsContact C-N 3.28Å; G298-M300 PolarHBondContact O-N 2.89Å
299	G	89.3	Confident	94	Very high	21 Å²	21	62.4 Å²	62.4	22%	0.216	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.5	6.1	168.1	0	0	0	0	0	116.6	M302 Y323	G299-M302 WeakPolarHBondContact O-CG 3.33Å; G299-Y323 PolarHBondContact N-O 3.05Å
300	M	91.9	Very high	93.9	Very high	92 Å²	92	62.2 Å²	62.2	45%	0.453	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-7.6	-177.9	-63.9	-65.1	-83	0	0	114	Y274 E297 G298	Y274-M300 HydrophobicContact CD1-CB 3.37Å; Y274-M300 HydrophobicContact CD1-CG 4.4Å; Y274-M300 HydrophobicContact CD2-CB 4.32Å; Y274-M300 HydrophobicContact CD2-CE 4.25Å; Y274-M300 HydrophobicContact CE1-CB 3.6Å; Y274-M300 HydrophobicContact CE1-CG 4.48Å; Y274-M300 HydrophobicContact CE2-CB 4.5Å; Y274-M300 HydrophobicContact CG-CB 3.77Å; Y274-M300 HydrophobicContact CG-CE 4.28Å; Y274-M300 HydrophobicContact CG-CG 4.45Å; E297-M300 HydrophobicContact CB-CG 3.92Å; G298-M300 VanDerWaalsContact C-N 3.28Å; G298-M300 PolarHBondContact O-N 2.89Å
301	L	91.8	Very high	94	Very high	4 Å²	4	59 Å²	59	2%	0.021	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	15.4	-175.6	-59.6	176.9	0	0	0	114	F272 Y274 I296 E303 L304 F325 L328	F272-L301 HydrophobicContact CD1-CD2 4.13Å; F272-L301 HydrophobicContact CE1-CD1 4.44Å; F272-L301 HydrophobicContact CE1-CD2 3.45Å; F272-L301 VanDerWaalsContact CE1-CD2 3.45Å; F272-L301 HydrophobicContact CZ-CD1 4.24Å; F272-L301 HydrophobicContact CZ-CD2 4Å; Y274-L301 HydrophobicContact CD1-CD2 3.7Å; Y274-L301 HydrophobicContact CD1-CG 4.32Å; Y274-L301 HydrophobicContact CE1-CD2 3.93Å; Y274-L301 HydrophobicContact CE1-CG 4.19Å; I296-L301 HydrophobicContact CG2-CD1 4.48Å; L301-E303 PolarHBondContact O-N 2.8Å; L301-E303 VanDerWaalsContact O-N 3.14Å; L301-L304 HydrophobicContact CD2-CD1 4Å; L301-L304 PolarHBondContact O-N 2.8Å; L301-F325 HydrophobicContact CD1-CD1 3.98Å; L301-F325 HydrophobicContact CD1-CE1 4.25Å; L301-L328 HydrophobicContact CB-CD2 4.26Å; L301-L328 HydrophobicContact CD1-CD1 4.44Å
302	M	89.7	Confident	94	Very high	91 Å²	91	58.9 Å²	58.9	45%	0.448	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-27.4	-171.8	-64.7	-171.1	-172.8	0	0	114.4	G299 Q326	G299-M302 WeakPolarHBondContact O-CG 3.33Å; M302-Q326 WeakPolarHBondContact CA-O 3.27Å
303	E	87.9	Confident	94.1	Very high	105 Å²	105	53.5 Å²	53.5	49%	0.491	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-19.3	-177.3	-58.1	-60.5	156.7	0	0	113.4	K278 L301 V305	K278-E303 HydrophobicContact CG-CG 4.23Å; L301-E303 PolarHBondContact O-N 2.8Å; L301-E303 VanDerWaalsContact O-N 3.14Å; E303-V305 PolarHBondContact O-N 3.25Å
304	L	92.4	Very high	94.2	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.021	26%	0.264	C	S	.	.			trans	-83.9	53.1	-175.7	-59.5	-179.9	0	0	0	111.7	L280 L283 L301 R306 L307 L328	L280-L304 WeakPolarHBondContact O-CD2 3.22Å; L283-L304 HydrophobicContact CB-CD2 4.46Å; L301-L304 HydrophobicContact CD2-CD1 4Å; L301-L304 PolarHBondContact O-N 2.8Å; L304-R306 PolarHBondContact O-N 3.19Å; L304-R306 VanDerWaalsContact O-N 3.13Å; L304-L307 HydrophobicContact CB-CB 4.25Å; L304-L307 HydrophobicContact CD1-CD2 4.45Å; L304-L307 WeakPolarHBondContact O-CB 3.47Å; L304-L307 PolarHBondContact O-N 3.18Å; L304-L307 VanDerWaalsContact O-N 3.12Å; L304-L328 HydrophobicContact CB-CD2 3.71Å; L304-L328 VanDerWaalsContact O-CD2 3.27Å; L304-L328 WeakPolarHBondContact O-CD2 3.44Å
305	V	91.4	Very high	94.2	Very high	73 Å²	73	46.9 Å²	46.9	44%	0.442	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-26.4	-169.5	-174.2	0	0	0	0	113	E303	E303-V305 PolarHBondContact O-N 3.25Å
306	R	95	Very high	94.2	Very high	141 Å²	141	47.6 Å²	47.6	53%	0.532	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	0.2	-178.2	-62.7	-167	-178.5	-167.4	0.1	114.3	L283 T284 L304 R308	L283-R306 CarbonylContact O-C 3.52Å; T284-R306 HydrophobicContact CG2-CB 4.48Å; L304-R306 PolarHBondContact O-N 3.19Å; L304-R306 VanDerWaalsContact O-N 3.13Å; R306-R308 PolarHBondContact O-N 3.26Å
307	L	96	Very high	94.3	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	24%	0.239	C	C	.	.			trans	-64.2	127.7	-177.9	-162.4	71	0	0	0	110.2	L283 L286 L304 L310 L328 G330 L331	L283-L307 HydrophobicContact CD2-CD1 4.14Å; L283-L307 HydrophobicContact CG-CD1 4.14Å; L283-L307 VanDerWaalsContact O-CA 3.29Å; L283-L307 WeakPolarHBondContact O-CA 3.45Å; L283-L307 PolarHBondContact O-N 3.4Å; L283-L307 VanDerWaalsContact O-N 3.13Å; L286-L307 HydrophobicContact CB-CD1 3.75Å; L286-L307 HydrophobicContact CB-CD2 4.46Å; L304-L307 HydrophobicContact CB-CB 4.25Å; L304-L307 HydrophobicContact CD1-CD2 4.45Å; L304-L307 WeakPolarHBondContact O-CB 3.47Å; L304-L307 PolarHBondContact O-N 3.18Å; L304-L307 VanDerWaalsContact O-N 3.12Å; L307-L310 HydrophobicContact CD2-CB 4.36Å; L307-L328 HydrophobicContact CB-CD2 4.05Å; L307-L328 HydrophobicContact CD2-CD1 4.05Å; L307-L328 HydrophobicContact CD2-CD2 4.09Å; L307-G330 CarbonylContact O-C 3.48Å; L307-G330 VanDerWaalsContact O-C 3.31Å; L307-L331 PolarHBondContact O-N 3.07Å
308	R	96.8	Very high	94.3	Very high	133 Å²	133	46 Å²	46	50%	0.502	24%	0.236	S	C	.	.			trans	-112.7	-36.7	-179.4	-64.9	-172.3	177.3	-164.5	-1.8	112	T284 R306 G330 K332 V333	T284-R308 PolarHBondContact O-N 3.4Å; R306-R308 PolarHBondContact O-N 3.26Å; R308-G330 WeakPolarHBondContact CA-O 3.05Å; R308-K332 PolarHBondContact O-N 3.43Å; R308-V333 PolarHBondContact O-N 2.81Å
309	E	97.9	Very high	94.3	Very high	63 Å²	63	47.5 Å²	47.5	29%	0.294	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	127.1	-175.6	-52.3	-165.1	176.6	0	0	110.4	T284 H285 L286 H311 V333	T284-E309 PolarHBondContact O-N 3.17Å; H285-E309 IonicContact CD2-OE2 3.77Å; H285-E309 PolarHBondContact CD2-OE2 2.87Å; H285-E309 IonicContact NE2-OE1 3.62Å; H285-E309 IonicContact NE2-OE2 2.7Å; L286-E309 PolarHBondContact N-O 3.3Å; E309-H311 IonicContact OE2-NE2 2.83Å; E309-V333 WeakPolarHBondContact CA-O 3.47Å; E309-V333 HydrophobicContact CB-CB 4.17Å; E309-V333 HydrophobicContact CG-CB 3.91Å; E309-V333 HydrophobicContact CG-CG2 3.97Å
310	L	97.5	Very high	94.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	117.6	176.3	178.2	58.2	0	0	0	110	L286 L307 L312 F325 L331 V333 L334 N335	L286-L310 HydrophobicContact CB-CD1 4.11Å; L286-L310 HydrophobicContact CD2-CD1 3.88Å; L286-L310 HydrophobicContact CG-CD1 3.96Å; L286-L310 WeakPolarHBondContact O-CA 3.26Å; L307-L310 HydrophobicContact CD2-CB 4.36Å; L310-L312 HydrophobicContact CD1-CD1 4.17Å; L310-L312 HydrophobicContact CD1-CG 4.29Å; L310-L312 HydrophobicContact CD2-CD1 4.03Å; L310-L312 HydrophobicContact CG-CD1 4Å; L310-L312 HydrophobicContact CG-CG 4.44Å; L310-F325 HydrophobicContact CD2-CD1 4.27Å; L310-F325 HydrophobicContact CD2-CE1 3.6Å; L310-F325 HydrophobicContact CD2-CZ 3.94Å; L310-L331 HydrophobicContact CB-CD1 3.92Å; L310-V333 PolarHBondContact N-O 3.34Å; L310-L334 HydrophobicContact CB-CD1 4.14Å; L310-L334 HydrophobicContact CD2-CD1 4.01Å; L310-L334 HydrophobicContact CG-CD1 4.11Å; L310-N335 PolarHBondContact O-N 2.78Å
311	H	98.1	Very high	94.7	Very high	40 Å²	40	45.7 Å²	45.7	19%	0.185	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	126.3	179	-61.2	-104.2	0	0	0	110.6	L286 N287 L288 E309 N335	L286-H311 PolarHBondContact O-N 3.2Å; N287-H311 HydrophobicContact CB-CB 4.15Å; N287-H311 WeakPolarHBondContact OD1-CB 3.43Å; L288-H311 PolarHBondContact N-O 2.98Å; E309-H311 IonicContact OE2-NE2 2.83Å; H311-N335 HydrophobicContact CB-CB 4.46Å
312	L	97.1	Very high	94.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.243	C	C	.	.			trans	-139.5	40.6	-177.8	-77.2	159.1	0	0	0	109.6	F272 L288 I293 I296 L310 G314 A315 N335 V336 N339	F272-L312 HydrophobicContact CD2-CD2 4.49Å; F272-L312 HydrophobicContact CE2-CD1 4.41Å; F272-L312 HydrophobicContact CE2-CD2 4.28Å; L288-L312 HydrophobicContact CB-CD2 3.71Å; L288-L312 HydrophobicContact CD1-CD2 4.41Å; I293-L312 HydrophobicContact CD1-CD2 4.21Å; I296-L312 HydrophobicContact CD1-CD1 3.52Å; L310-L312 HydrophobicContact CD1-CD1 4.17Å; L310-L312 HydrophobicContact CD1-CG 4.29Å; L310-L312 HydrophobicContact CD2-CD1 4.03Å; L310-L312 HydrophobicContact CG-CD1 4Å; L310-L312 HydrophobicContact CG-CG 4.44Å; L312-G314 PolarHBondContact O-N 3.42Å; L312-A315 HydrophobicContact CB-CB 4.46Å; L312-A315 HydrophobicContact CD2-CB 4.36Å; L312-N335 PolarHBondContact N-O 3.3Å; L312-V336 HydrophobicContact CB-CG1 4.29Å; L312-V336 HydrophobicContact CD1-CG1 4.49Å; L312-N339 PolarHBondContact O-ND2 3Å
313	V	97.6	Very high	94.9	Very high	19 Å²	19	50.7 Å²	50.7	12%	0.115	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	133.6	-178.1	-176.5	0	0	0	0	109.6	S289 F290 A315 N335 S337 H338	S289-V313 CarbonylContact C-O 3.59Å; S289-V313 VanDerWaalsContact CA-O 3.28Å; S289-V313 WeakPolarHBondContact CA-O 3.48Å; S289-V313 WeakPolarHBondContact CB-O 3.28Å; S289-V313 PolarHBondContact OG-N 3.09Å; F290-V313 HydrophobicContact CE1-CG1 4.29Å; F290-V313 HydrophobicContact CZ-CG1 4.04Å; F290-V313 PolarHBondContact N-O 3.23Å; V313-A315 PolarHBondContact O-N 2.64Å; V313-A315 VanDerWaalsContact O-N 3.13Å; V313-N335 HydrophobicContact CG2-CB 4.35Å; V313-N335 WeakPolarHBondContact CG2-ND2 3.5Å; V313-N335 WeakPolarHBondContact CG2-OD1 3.46Å; V313-S337 WeakPolarHBondContact CA-O 3.33Å; V313-S337 WeakPolarHBondContact CG1-OG 3.32Å; V313-S337 WeakPolarHBondContact CG2-OG 3.41Å; V313-H338 HydrophobicContact CG1-CB 4.32Å
314	G	96.4	Very high	95.3	Very high	20 Å²	20	45.7 Å²	45.7	21%	0.206	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	20.6	172	0	0	0	0	0	115.1	L312 Q316 S337 H338	L312-G314 PolarHBondContact O-N 3.42Å; G314-Q316 VanDerWaalsContact C-N 3.28Å; G314-Q316 PolarHBondContact O-N 2.86Å; G314-S337 PolarHBondContact N-O 2.8Å; G314-H338 VanDerWaalsContact CA-O 3.27Å; G314-H338 WeakPolarHBondContact CA-O 3.25Å
315	A	93.9	Very high	95.3	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.008	22%	0.224	C	C	.	.	S	Bend	trans	-79	-5	-175	0	0	0	0	0	114.4	N291 R292 I293 L312 V313 L317 N339	N291-A315 CarbonylContact O-C 3.46Å; N291-A315 VanDerWaalsContact O-C 3.3Å; N291-A315 VanDerWaalsContact O-CA 3.29Å; N291-A315 WeakPolarHBondContact O-CA 3.36Å; N291-A315 VanDerWaalsContact O-O 3.1Å; R292-A315 CarbonylContact C-O 3.58Å; R292-A315 VanDerWaalsContact C-O 3.3Å; R292-A315 WeakPolarHBondContact CA-O 3.24Å; I293-A315 CarbonylContact C-O 3.55Å; I293-A315 HydrophobicContact CB-CB 4.43Å; I293-A315 PolarHBondContact N-O 2.8Å; L312-A315 HydrophobicContact CB-CB 4.46Å; L312-A315 HydrophobicContact CD2-CB 4.36Å; V313-A315 PolarHBondContact O-N 2.64Å; V313-A315 VanDerWaalsContact O-N 3.13Å; A315-L317 VanDerWaalsContact C-N 3.32Å; A315-N339 WeakPolarHBondContact CA-OD1 3.1Å; A315-N339 PolarHBondContact N-OD1 3.41Å
316	Q	95.4	Very high	95.2	Very high	69 Å²	69	45 Å²	45	32%	0.322	22%	0.216	S	C	.	.			trans	67.9	26.7	-172	-46.6	179.8	1.8	0	0	114.2	I293 G314 T318 N339	I293-Q316 CarbonylContact O-C 3.52Å; G314-Q316 VanDerWaalsContact C-N 3.28Å; G314-Q316 PolarHBondContact O-N 2.86Å; Q316-T318 PolarHBondContact O-N 2.78Å; Q316-N339 PolarHBondContact N-OD1 3.31Å
317	L	96.3	Very high	94.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.196	C	C	.	.			trans	-65.7	124.5	-177.5	-169.4	65.3	0	0	0	111	I293 I296 A315 I320 V336 N339 R340 L341	I293-L317 WeakPolarHBondContact O-CA 3.06Å; I293-L317 PolarHBondContact O-N 2.96Å; I296-L317 HydrophobicContact CD1-CD1 3.98Å; I296-L317 HydrophobicContact CD1-CD2 3.93Å; I296-L317 HydrophobicContact CG1-CD1 3.74Å; A315-L317 VanDerWaalsContact C-N 3.32Å; L317-I320 HydrophobicContact CD1-CG1 4.38Å; L317-I320 HydrophobicContact CD2-CD1 3.67Å; L317-I320 HydrophobicContact CD2-CG1 3.65Å; L317-I320 HydrophobicContact CG-CG1 4.17Å; L317-V336 HydrophobicContact CD2-CG1 4.37Å; L317-N339 HydrophobicContact CB-CB 4.02Å; L317-N339 WeakPolarHBondContact CB-OD1 3.4Å; L317-N339 PolarHBondContact N-OD1 3.12Å; L317-R340 CarbonylContact O-C 3.52Å; L317-R340 VanDerWaalsContact O-CA 3.28Å; L317-R340 WeakPolarHBondContact O-CA 3.35Å; L317-R340 PolarHBondContact O-N 3.43Å; L317-L341 HydrophobicContact CB-CD2 4.4Å; L317-L341 HydrophobicContact CD2-CD1 4.21Å; L317-L341 HydrophobicContact CD2-CD2 3.96Å; L317-L341 HydrophobicContact CD2-CG 4.35Å; L317-L341 HydrophobicContact CG-CD2 3.78Å; L317-L341 HydrophobicContact CG-CG 4.38Å; L317-L341 PolarHBondContact O-N 3.49Å
318	T	94.9	Very high	94.6	Very high	58 Å²	58	39 Å²	39	36%	0.356	20%	0.197	S	C	.	.			trans	-101.5	-39	179.1	55.2	0	0	0	0	112.5	R294 Q316 R340	R294-T318 PolarHBondContact O-N 3.25Å; R294-T318 PolarHBondContact O-OG1 2.71Å; Q316-T318 PolarHBondContact O-N 2.78Å; T318-R340 HydrophobicContact CG2-CB 4.2Å
319	T	92.9	Very high	94.3	Very high	63 Å²	63	41.1 Å²	41.1	39%	0.387	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	147.7	-177.1	49.8	0	0	0	0	110.9	H295 I296	H295-T319 PolarHBondContact CD2-O 2.91Å; H295-T319 PolarHBondContact CD2-OG1 2.03Å; H295-T319 VanDerWaalsContact CD2-OG1 3.28Å; I296-T319 PolarHBondContact N-O 2.99Å
320	I	96.2	Very high	93.9	Very high	20 Å²	20	39.4 Å²	39.4	10%	0.103	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	122.2	171.5	-58.7	173.4	0	0	0	106.7	I296 L317 A324 F325 L341 L344 V348	I296-I320 HydrophobicContact CB-CG2 4.33Å; I296-I320 HydrophobicContact CD1-CG1 4.32Å; L317-I320 HydrophobicContact CD1-CG1 4.38Å; L317-I320 HydrophobicContact CD2-CD1 3.67Å; L317-I320 HydrophobicContact CD2-CG1 3.65Å; L317-I320 HydrophobicContact CG-CG1 4.17Å; I320-A324 HydrophobicContact CG2-CB 3.53Å; I320-F325 HydrophobicContact CD1-CZ 4.33Å; I320-F325 HydrophobicContact CG2-CZ 4.36Å; I320-L341 HydrophobicContact CD1-CD1 4.2Å; I320-L341 HydrophobicContact CD1-CD2 4.21Å; I320-L341 HydrophobicContact CG1-CD2 4.02Å; I320-L344 HydrophobicContact CD1-CD1 3.95Å; I320-V348 HydrophobicContact CB-CG2 4.49Å; I320-V348 HydrophobicContact CG2-CB 4.46Å; I320-V348 HydrophobicContact CG2-CG1 3.51Å; I320-V348 HydrophobicContact CG2-CG2 4.05Å
321	D	94.1	Very high	93.9	Very high	54 Å²	54	39.7 Å²	39.7	29%	0.289	21%	0.206	S	C	.	.			trans	-68.3	151.4	-177.9	-78.1	-7.9	0	0	0	111.7	H295 I296 Y323 A324	H295-D321 IonicContact CD2-OD1 3.3Å; H295-D321 VanDerWaalsContact CE1-CG 3.49Å; H295-D321 IonicContact CE1-OD1 2.78Å; H295-D321 IonicContact CE1-OD2 3.64Å; H295-D321 PolarHBondContact CE1-OD2 2.6Å; H295-D321 IonicContact NE2-OD1 3.67Å; H295-D321 PolarHBondContact NE2-OD1 2.95Å; H295-D321 IonicContact NE2-OD2 3.31Å; H295-D321 PolarHBondContact NE2-OD2 3.18Å; I296-D321 PolarHBondContact O-N 2.91Å; D321-Y323 PolarHBondContact O-N 2.76Å; D321-A324 WeakPolarHBondContact O-CB 3.37Å; D321-A324 PolarHBondContact O-N 2.56Å; D321-A324 VanDerWaalsContact O-N 3.1Å
322	P	91.6	Very high	93.7	Very high	60 Å²	60	41.2 Å²	41.2	39%	0.39	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	141.5	165.8	-24.8	34.6	0	0	0	110.6	A324	P322-A324 PolarHBondContact O-N 3.4Å
323	Y	94.1	Very high	93.8	Very high	141 Å²	141	42.1 Å²	42.1	55%	0.553	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.9	14.1	-177.6	-41.8	-72.1	0	0	0	115.6	G299 D321 F325 Q326 G347	G299-Y323 PolarHBondContact N-O 3.05Å; D321-Y323 PolarHBondContact O-N 2.76Å; Y323-F325 VanDerWaalsContact C-N 3.31Å; Y323-F325 PolarHBondContact O-N 2.88Å; Y323-Q326 WeakPolarHBondContact O-CB 3Å; Y323-Q326 PolarHBondContact O-N 3.48Å; Y323-Q326 VanDerWaalsContact O-N 3.08Å; Y323-G347 PolarHBondContact N-O 3.41Å
324	A	94.9	Very high	93.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-40	176.3	0	0	0	0	0	113.4	I296 I320 D321 P322 Q326 V348	I296-A324 HydrophobicContact CG2-CB 3.84Å; I320-A324 HydrophobicContact CG2-CB 3.53Å; D321-A324 WeakPolarHBondContact O-CB 3.37Å; D321-A324 PolarHBondContact O-N 2.56Å; D321-A324 VanDerWaalsContact O-N 3.1Å; P322-A324 PolarHBondContact O-N 3.4Å; A324-Q326 VanDerWaalsContact C-N 3.28Å; A324-Q326 PolarHBondContact O-N 2.86Å; A324-V348 HydrophobicContact CB-CG1 4.25Å
325	F	94.1	Very high	93.8	Very high	1 Å²	1	41 Å²	41	0%	0.004	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-96.1	23.5	177.1	-56.6	-31.8	0	0	0	112.3	I296 L301 L310 I320 Y323 G327 L328 L331 L334 V348 F349	I296-F325 HydrophobicContact CD1-CE1 4.34Å; I296-F325 HydrophobicContact CD1-CZ 4.33Å; I296-F325 HydrophobicContact CG2-CE1 4.37Å; L301-F325 HydrophobicContact CD1-CD1 3.98Å; L301-F325 HydrophobicContact CD1-CE1 4.25Å; L310-F325 HydrophobicContact CD2-CD1 4.27Å; L310-F325 HydrophobicContact CD2-CE1 3.6Å; L310-F325 HydrophobicContact CD2-CZ 3.94Å; I320-F325 HydrophobicContact CD1-CZ 4.33Å; I320-F325 HydrophobicContact CG2-CZ 4.36Å; Y323-F325 VanDerWaalsContact C-N 3.31Å; Y323-F325 PolarHBondContact O-N 2.88Å; F325-G327 PolarHBondContact O-N 2.81Å; F325-L328 HydrophobicContact CB-CB 4.47Å; F325-L328 HydrophobicContact CB-CD1 3.82Å; F325-L328 HydrophobicContact CB-CG 4.24Å; F325-L328 HydrophobicContact CD1-CD1 3.76Å; F325-L328 HydrophobicContact CG-CD1 4Å; F325-L328 PolarHBondContact O-N 3.19Å; F325-L331 HydrophobicContact CD2-CD2 4.39Å; F325-L334 HydrophobicContact CD2-CD2 4.49Å; F325-L334 HydrophobicContact CE2-CD1 4.07Å; F325-L334 HydrophobicContact CE2-CD2 3.74Å; F325-L334 HydrophobicContact CZ-CD1 4.1Å; F325-L334 HydrophobicContact CZ-CD2 4.5Å; F325-V348 WeakPolarHBondContact CA-O 3.45Å; F325-V348 HydrophobicContact CB-CG1 4.42Å; F325-V348 WeakPolarHBondContact CB-O 3.39Å; F325-V348 HydrophobicContact CD2-CG1 3.39Å; F325-V348 HydrophobicContact CE2-CG1 3.69Å; F325-V348 HydrophobicContact CG-CG1 3.99Å; F325-V348 PolarHBondContact N-O 2.02Å; F325-F349 HydrophobicContact CB-CD1 4.45Å; F325-F349 AromaticContact CD2-CD1 3.91Å; F325-F349 HydrophobicContact CD2-CD1 3.91Å; F325-F349 AromaticContact CD2-CE1 3.64Å; F325-F349 HydrophobicContact CD2-CE1 3.64Å; F325-F349 HydrophobicContact CD2-CZ 4.13Å; F325-F349 HydrophobicContact CE2-CE1 4.18Å; F325-F349 HydrophobicContact CE2-CZ 4.35Å
326	Q	89.4	Confident	94	Very high	60 Å²	60	41 Å²	41	28%	0.28	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	128.6	173	-162.5	173.5	19.1	0	0	110	M302 Y323 A324 Q350	M302-Q326 WeakPolarHBondContact CA-O 3.27Å; Y323-Q326 WeakPolarHBondContact O-CB 3Å; Y323-Q326 PolarHBondContact O-N 3.48Å; Y323-Q326 VanDerWaalsContact O-N 3.08Å; A324-Q326 VanDerWaalsContact C-N 3.28Å; A324-Q326 PolarHBondContact O-N 2.86Å; Q326-Q350 VanDerWaalsContact CG-OE1 3.27Å
327	G	85.7	Confident	94	Very high	12 Å²	12	38.1 Å²	38.1	12%	0.124	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.1	-20.3	-173.5	0	0	0	0	0	114.9	F325 R329	F325-G327 PolarHBondContact O-N 2.81Å; G327-R329 PolarHBondContact O-N 2.82Å
328	L	92.5	Very high	94.1	Very high	5 Å²	5	43 Å²	43	3%	0.026	22%	0.216	C	C	.	.			trans	-78.1	67.7	176	-51.6	-171.8	0	0	0	111.3	L301 L304 L307 F325 G330 L331	L301-L328 HydrophobicContact CB-CD2 4.26Å; L301-L328 HydrophobicContact CD1-CD1 4.44Å; L304-L328 HydrophobicContact CB-CD2 3.71Å; L304-L328 VanDerWaalsContact O-CD2 3.27Å; L304-L328 WeakPolarHBondContact O-CD2 3.44Å; L307-L328 HydrophobicContact CB-CD2 4.05Å; L307-L328 HydrophobicContact CD2-CD1 4.05Å; L307-L328 HydrophobicContact CD2-CD2 4.09Å; F325-L328 HydrophobicContact CB-CB 4.47Å; F325-L328 HydrophobicContact CB-CD1 3.82Å; F325-L328 HydrophobicContact CB-CG 4.24Å; F325-L328 HydrophobicContact CD1-CD1 3.76Å; F325-L328 HydrophobicContact CG-CD1 4Å; F325-L328 PolarHBondContact O-N 3.19Å; L328-G330 VanDerWaalsContact C-N 3.26Å; L328-G330 PolarHBondContact O-N 3.02Å; L328-L331 HydrophobicContact CB-CB 4.14Å; L328-L331 HydrophobicContact CD1-CD2 4.38Å; L328-L331 PolarHBondContact O-N 2.8Å
329	R	88.9	Confident	94.2	Very high	177 Å²	177	40.7 Å²	40.7	67%	0.668	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-27.3	-172.5	-64	-178.6	-174.2	-171.7	1.6	113.7	G327 Q350	G327-R329 PolarHBondContact O-N 2.82Å; R329-Q350 HydrophobicContact CG-CG 4.37Å
330	G	91.2	Very high	94.4	Very high	28 Å²	28	45.7 Å²	45.7	29%	0.289	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	15.2	-175.7	0	0	0	0	0	114.8	L307 R308 L328 K332	L307-G330 CarbonylContact O-C 3.48Å; L307-G330 VanDerWaalsContact O-C 3.31Å; R308-G330 WeakPolarHBondContact CA-O 3.05Å; L328-G330 VanDerWaalsContact C-N 3.26Å; L328-G330 PolarHBondContact O-N 3.02Å; G330-K332 PolarHBondContact O-N 3Å; G330-K332 VanDerWaalsContact O-N 3.14Å
331	L	95.6	Very high	94.4	Very high	6 Å²	6	44.7 Å²	44.7	3%	0.031	21%	0.209	C	C	.	.			trans	-66.8	111.6	-177.9	-170.7	73.9	0	0	0	110.3	L307 L310 F325 L328 L334 F349 A354	L307-L331 PolarHBondContact O-N 3.07Å; L310-L331 HydrophobicContact CB-CD1 3.92Å; F325-L331 HydrophobicContact CD2-CD2 4.39Å; L328-L331 HydrophobicContact CB-CB 4.14Å; L328-L331 HydrophobicContact CD1-CD2 4.38Å; L328-L331 PolarHBondContact O-N 2.8Å; L331-L334 HydrophobicContact CD2-CB 4.45Å; L331-F349 HydrophobicContact CD2-CD1 4.42Å; L331-F349 HydrophobicContact CD2-CE1 4.15Å; L331-A354 CarbonylContact O-C 3.05Å
332	K	95.6	Very high	94.4	Very high	72 Å²	72	44.6 Å²	44.6	31%	0.313	21%	0.208	S	C	.	.			trans	-100.5	-38.6	-179.2	-72.5	176.9	167.7	-114.2	0	112.3	R308 G330 L355 E356 V357	R308-K332 PolarHBondContact O-N 3.43Å; G330-K332 PolarHBondContact O-N 3Å; G330-K332 VanDerWaalsContact O-N 3.14Å; K332-L355 WeakPolarHBondContact O-CD1 3.37Å; K332-E356 IonicContact NZ-OE1 3.4Å; K332-E356 PolarHBondContact NZ-OE1 3.05Å; K332-E356 IonicContact NZ-OE2 3.43Å; K332-E356 PolarHBondContact O-N 3.32Å; K332-V357 PolarHBondContact O-N 3.25Å
333	V	97.4	Very high	94.6	Very high	18 Å²	18	42.4 Å²	42.4	11%	0.109	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	121.6	-175	-176	0	0	0	0	109	R308 E309 L310 V357	R308-V333 PolarHBondContact O-N 2.81Å; E309-V333 WeakPolarHBondContact CA-O 3.47Å; E309-V333 HydrophobicContact CB-CB 4.17Å; E309-V333 HydrophobicContact CG-CB 3.91Å; E309-V333 HydrophobicContact CG-CG2 3.97Å; L310-V333 PolarHBondContact N-O 3.34Å; V333-V357 WeakPolarHBondContact CA-O 3.36Å; V333-V357 HydrophobicContact CB-CB 4.41Å; V333-V357 HydrophobicContact CG1-CB 4.12Å; V333-V357 HydrophobicContact CG1-CG1 4.28Å; V333-V357 HydrophobicContact CG2-CB 4.1Å; V333-V357 HydrophobicContact CG2-CG2 4.21Å
334	L	97.4	Very high	94.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	119.2	169	178.7	65	0	0	0	109	L310 F325 L331 V336 L344 F349 L355 V357 L358 L359	L310-L334 HydrophobicContact CB-CD1 4.14Å; L310-L334 HydrophobicContact CD2-CD1 4.01Å; L310-L334 HydrophobicContact CG-CD1 4.11Å; F325-L334 HydrophobicContact CD2-CD2 4.49Å; F325-L334 HydrophobicContact CE2-CD1 4.07Å; F325-L334 HydrophobicContact CE2-CD2 3.74Å; F325-L334 HydrophobicContact CZ-CD1 4.1Å; F325-L334 HydrophobicContact CZ-CD2 4.5Å; L331-L334 HydrophobicContact CD2-CB 4.45Å; L334-V336 HydrophobicContact CD1-CG1 3.87Å; L334-V336 HydrophobicContact CD2-CG1 4.41Å; L334-V336 HydrophobicContact CG-CG1 4.06Å; L334-L344 HydrophobicContact CD2-CD2 4.29Å; L334-F349 HydrophobicContact CD2-CE1 3.86Å; L334-F349 HydrophobicContact CD2-CZ 3.64Å; L334-L355 HydrophobicContact CB-CD1 3.96Å; L334-V357 PolarHBondContact N-O 3.49Å; L334-L358 HydrophobicContact CB-CD1 4.11Å; L334-L358 HydrophobicContact CD2-CD1 3.91Å; L334-L358 HydrophobicContact CG-CD1 4.17Å; L334-L358 WeakPolarHBondContact O-CA 2.98Å; L334-L359 PolarHBondContact O-N 2.86Å
335	N	97.6	Very high	94.6	Very high	17 Å²	17	38.8 Å²	38.8	9%	0.091	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	108.8	172.9	-171.2	-9.1	0	0	0	110.5	L310 H311 L312 V313 S337 L359	L310-N335 PolarHBondContact O-N 2.78Å; H311-N335 HydrophobicContact CB-CB 4.46Å; L312-N335 PolarHBondContact N-O 3.3Å; V313-N335 HydrophobicContact CG2-CB 4.35Å; V313-N335 WeakPolarHBondContact CG2-ND2 3.5Å; V313-N335 WeakPolarHBondContact CG2-OD1 3.46Å; N335-S337 WeakPolarHBondContact OD1-CB 3.29Å; N335-S337 PolarHBondContact OD1-N 3.22Å; N335-S337 VanDerWaalsContact OD1-N 3.1Å; N335-S337 PolarHBondContact OD1-OG 2.7Å; N335-L359 HydrophobicContact CB-CB 4.09Å; N335-L359 HydrophobicContact CB-CD1 4.04Å; N335-L359 HydrophobicContact CB-CG 4.43Å; N335-L359 VanDerWaalsContact ND2-CD1 3.33Å; N335-L359 WeakPolarHBondContact ND2-CD1 3.39Å; N335-L359 WeakPolarHBondContact OD1-CB 3.4Å
336	V	97.1	Very high	94.5	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.205	C	C	.	.			trans	-123.8	27.1	176	-68.5	0	0	0	0	110.7	L312 L317 L334 N339 L341 L359 I360 N363	L312-V336 HydrophobicContact CB-CG1 4.29Å; L312-V336 HydrophobicContact CD1-CG1 4.49Å; L317-V336 HydrophobicContact CD2-CG1 4.37Å; L334-V336 HydrophobicContact CD1-CG1 3.87Å; L334-V336 HydrophobicContact CD2-CG1 4.41Å; L334-V336 HydrophobicContact CG-CG1 4.06Å; V336-N339 VanDerWaalsContact C-ND2 3.28Å; V336-N339 PolarHBondContact O-ND2 3.08Å; V336-L341 HydrophobicContact CB-CD1 3.97Å; V336-L341 HydrophobicContact CG2-CD1 3.89Å; V336-L359 CarbonylContact C-O 3.44Å; V336-L359 WeakPolarHBondContact CG2-O 3.34Å; V336-L359 PolarHBondContact N-O 3.42Å; V336-I360 HydrophobicContact CG2-CB 4.16Å; V336-I360 HydrophobicContact CG2-CG1 4Å; V336-N363 PolarHBondContact O-ND2 3.18Å
337	S	97.1	Very high	94.7	Very high	8 Å²	8	43 Å²	43	6%	0.056	21%	0.208	C	C	.	.			trans	-62.2	156.7	177.1	59.7	0	0	0	0	112.6	V313 G314 N335 N339 L359 D361	V313-S337 WeakPolarHBondContact CA-O 3.33Å; V313-S337 WeakPolarHBondContact CG1-OG 3.32Å; V313-S337 WeakPolarHBondContact CG2-OG 3.41Å; G314-S337 PolarHBondContact N-O 2.8Å; N335-S337 WeakPolarHBondContact OD1-CB 3.29Å; N335-S337 PolarHBondContact OD1-N 3.22Å; N335-S337 VanDerWaalsContact OD1-N 3.1Å; N335-S337 PolarHBondContact OD1-OG 2.7Å; S337-N339 VanDerWaalsContact C-N 3.32Å; S337-N339 PolarHBondContact O-N 3.27Å; S337-N339 PolarHBondContact O-ND2 3.47Å; S337-L359 PolarHBondContact N-O 3.14Å; S337-D361 VanDerWaalsContact CA-O 3.29Å; S337-D361 WeakPolarHBondContact CA-O 3.45Å; S337-D361 WeakPolarHBondContact CB-OD1 3.35Å
338	H	96.7	Very high	95.1	Very high	103 Å²	103	42.5 Å²	42.5	48%	0.477	20%	0.203	S	C	.	.	S	Bend	trans	56.5	40.3	177.9	-61.3	-86.8	0	0	0	114.1	V313 G314 D361 N362	V313-H338 HydrophobicContact CG1-CB 4.32Å; G314-H338 VanDerWaalsContact CA-O 3.27Å; G314-H338 WeakPolarHBondContact CA-O 3.25Å; H338-D361 PolarHBondContact N-O 3.34Å; H338-D361 VanDerWaalsContact N-O 3.09Å; H338-N362 WeakPolarHBondContact CA-O 3.3Å; H338-N362 HydrophobicContact CB-CB 4.37Å; H338-N362 VanDerWaalsContact CE1-CG 3.45Å; H338-N362 PolarHBondContact CE1-ND2 3.4Å; H338-N362 WeakPolarHBondContact ND1-CB 3.49Å; H338-N362 PolarHBondContact NE2-ND2 3.48Å
339	N	97.8	Very high	95.2	Very high	10 Å²	10	43.1 Å²	43.1	5%	0.053	21%	0.206	C	C	.	.	S	Bend	trans	-112	-163.3	176.9	-79.8	-69.5	0	0	0	111.4	L312 A315 Q316 L317 V336 S337 L341 N362 N363	L312-N339 PolarHBondContact O-ND2 3Å; A315-N339 WeakPolarHBondContact CA-OD1 3.1Å; A315-N339 PolarHBondContact N-OD1 3.41Å; Q316-N339 PolarHBondContact N-OD1 3.31Å; L317-N339 HydrophobicContact CB-CB 4.02Å; L317-N339 WeakPolarHBondContact CB-OD1 3.4Å; L317-N339 PolarHBondContact N-OD1 3.12Å; V336-N339 VanDerWaalsContact C-ND2 3.28Å; V336-N339 PolarHBondContact O-ND2 3.08Å; S337-N339 VanDerWaalsContact C-N 3.32Å; S337-N339 PolarHBondContact O-N 3.27Å; S337-N339 PolarHBondContact O-ND2 3.47Å; N339-L341 HydrophobicContact CB-CG 4.35Å; N339-N362 PolarHBondContact N-O 3.06Å; N339-N363 VanDerWaalsContact CA-OD1 3.24Å; N339-N363 WeakPolarHBondContact CA-OD1 3.43Å; N339-N363 WeakPolarHBondContact CB-OD1 3.36Å; N339-N363 PolarHBondContact N-OD1 3.33Å; N339-N363 PolarHBondContact O-OD1 2.91Å
340	R	96.9	Very high	95.3	Very high	167 Å²	167	39.1 Å²	39.1	63%	0.63	20%	0.195	S	C	*	.			trans	-121.3	30.1	179	-60.2	-173.8	-180	-168.8	0.5	111.4	L317 T318 N363	L317-R340 CarbonylContact O-C 3.52Å; L317-R340 VanDerWaalsContact O-CA 3.28Å; L317-R340 WeakPolarHBondContact O-CA 3.35Å; L317-R340 PolarHBondContact O-N 3.43Å; T318-R340 HydrophobicContact CG2-CB 4.2Å; R340-N363 PolarHBondContact N-OD1 3.26Å
341	L	96.7	Very high	95.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.197	C	C	.	.			trans	-70.7	132.2	-180	-66.8	173.5	0	0	0	110.7	L317 I320 V336 N339 N363 P364	L317-L341 HydrophobicContact CB-CD2 4.4Å; L317-L341 HydrophobicContact CD2-CD1 4.21Å; L317-L341 HydrophobicContact CD2-CD2 3.96Å; L317-L341 HydrophobicContact CD2-CG 4.35Å; L317-L341 HydrophobicContact CG-CD2 3.78Å; L317-L341 HydrophobicContact CG-CG 4.38Å; L317-L341 PolarHBondContact O-N 3.49Å; I320-L341 HydrophobicContact CD1-CD1 4.2Å; I320-L341 HydrophobicContact CD1-CD2 4.21Å; I320-L341 HydrophobicContact CG1-CD2 4.02Å; V336-L341 HydrophobicContact CB-CD1 3.97Å; V336-L341 HydrophobicContact CG2-CD1 3.89Å; N339-L341 HydrophobicContact CB-CG 4.35Å; L341-N363 HydrophobicContact CB-CB 4.34Å; L341-N363 WeakPolarHBondContact CB-OD1 3.42Å; L341-N363 PolarHBondContact N-OD1 3.19Å; L341-P364 CarbonylContact O-C 3.5Å; L341-P364 VanDerWaalsContact O-CD 3.31Å; L341-P364 WeakPolarHBondContact O-CD 3.49Å
342	D	94.2	Very high	94.9	Very high	52 Å²	52	40.4 Å²	40.4	28%	0.278	20%	0.199	S	C	.	.	S	Bend	trans	-86.4	-29.7	169.7	76.4	-41.7	0	0	0	111.5	L365 V366 R370	D342-L365 CarbonylContact O-C 3.44Å; D342-L365 WeakPolarHBondContact O-CA 3.46Å; D342-V366 HydrophobicContact CB-CG2 3.94Å; D342-V366 PolarHBondContact O-N 3.4Å; D342-R370 IonicContact OD2-CZ 3.86Å; D342-R370 IonicContact OD2-NH1 3.58Å; D342-R370 PolarHBondContact OD2-NH1 2.92Å; D342-R370 VanDerWaalsContact OD2-NH1 3.17Å; D342-R370 IonicContact OD2-NH2 3.2Å; D342-R370 PolarHBondContact OD2-NH2 2.92Å
343	T	95.1	Very high	94.6	Very high	13 Å²	13	44.4 Å²	44.4	8%	0.08	22%	0.219	C	C	.	.			trans	-153.1	169.8	-178.8	-161.8	0	0	0	0	112.1	E345 R370	T343-E345 HydrophobicContact CG2-CG 4.02Å; T343-R370 WeakPolarHBondContact OG1-CB 3.46Å
344	L	95.6	Very high	94.2	Very high	2 Å²	2	45 Å²	45	1%	0.01	23%	0.226	C	C	.	.			trans	-140.1	100.1	167.8	-179.8	64.6	0	0	0	108.6	I320 L334 V348 F349 L358 I360 L371 W373 I374	I320-L344 HydrophobicContact CD1-CD1 3.95Å; L334-L344 HydrophobicContact CD2-CD2 4.29Å; L344-V348 HydrophobicContact CD1-CG1 4.43Å; L344-V348 HydrophobicContact CD1-CG2 4.4Å; L344-F349 HydrophobicContact CD1-CE2 4.04Å; L344-F349 HydrophobicContact CD1-CZ 4.2Å; L344-F349 HydrophobicContact CD2-CE2 4.09Å; L344-F349 HydrophobicContact CD2-CZ 3.99Å; L344-F349 HydrophobicContact CG-CE2 3.99Å; L344-F349 HydrophobicContact CG-CZ 4.31Å; L344-L358 HydrophobicContact CD2-CD1 3.9Å; L344-L358 HydrophobicContact CD2-CD2 4.16Å; L344-I360 HydrophobicContact CB-CD1 3.74Å; L344-I360 HydrophobicContact CD2-CD1 3.87Å; L344-I360 HydrophobicContact CG-CD1 4.46Å; L344-L371 HydrophobicContact CB-CD2 4.42Å; L344-W373 HydrophobicContact CD2-CZ2 4.28Å; L344-W373 HydrophobicContact CG-CZ2 4.21Å; L344-W373 PolarHBondContact O-NE1 3.41Å; L344-I374 HydrophobicContact CB-CD1 4.21Å; L344-I374 HydrophobicContact CD2-CD1 4.24Å
345	E	93.5	Very high	94	Very high	63 Å²	63	45.5 Å²	45.5	29%	0.294	23%	0.229	S	C	.	.			trans	-76.7	145.5	-174.6	-60.8	-171.4	-169.9	0	0	112.1	T343 G347 V348 R370	T343-E345 HydrophobicContact CG2-CG 4.02Å; E345-G347 PolarHBondContact O-N 3.42Å; E345-V348 HydrophobicContact CB-CG2 4.29Å; E345-V348 VanDerWaalsContact O-CB 3.29Å; E345-V348 WeakPolarHBondContact O-CB 3.26Å; E345-V348 VanDerWaalsContact O-CG2 3.3Å; E345-V348 WeakPolarHBondContact O-CG2 3.46Å; E345-V348 PolarHBondContact O-N 3.28Å; E345-V348 VanDerWaalsContact O-N 3.11Å; E345-R370 HydrophobicContact CG-CB 4.34Å; E345-R370 HydrophobicContact CG-CG 4.42Å; E345-R370 WeakPolarHBondContact OE1-CD 3.48Å
346	K	93.3	Very high	93.9	Very high	116 Å²	116	49.2 Å²	49.2	50%	0.504	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-57	-34.2	175.6	-170.7	-179.1	177.6	-178.7	0	112.1	V348 F349 P352 W373	K346-V348 PolarHBondContact O-N 3.04Å; K346-F349 PolarHBondContact O-N 3.38Å; K346-P352 HydrophobicContact CG-CB 4.48Å; K346-P352 HydrophobicContact CG-CG 3.97Å; K346-W373 HydrophobicContact CB-CB 4.41Å; K346-W373 HydrophobicContact CB-CD2 4.18Å; K346-W373 HydrophobicContact CB-CG 3.84Å; K346-W373 HydrophobicContact CD-CB 4.3Å; K346-W373 HydrophobicContact CG-CD2 4.4Å; K346-W373 HydrophobicContact CG-CG 4.28Å
347	G	92.1	Very high	93.8	Very high	33 Å²	33	50.8 Å²	50.8	34%	0.34	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-67.5	-9	-179.4	0	0	0	0	0	114.8	Y323 E345 F349	Y323-G347 PolarHBondContact N-O 3.41Å; E345-G347 PolarHBondContact O-N 3.42Å; G347-F349 VanDerWaalsContact C-N 3.27Å
348	V	94.9	Very high	93.8	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.012	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-66.2	-32.8	172.1	173.9	0	0	0	0	111.3	I320 A324 F325 L344 E345 K346	I320-V348 HydrophobicContact CB-CG2 4.49Å; I320-V348 HydrophobicContact CG2-CB 4.46Å; I320-V348 HydrophobicContact CG2-CG1 3.51Å; I320-V348 HydrophobicContact CG2-CG2 4.05Å; A324-V348 HydrophobicContact CB-CG1 4.25Å; F325-V348 WeakPolarHBondContact CA-O 3.45Å; F325-V348 HydrophobicContact CB-CG1 4.42Å; F325-V348 WeakPolarHBondContact CB-O 3.39Å; F325-V348 HydrophobicContact CD2-CG1 3.39Å; F325-V348 HydrophobicContact CE2-CG1 3.69Å; F325-V348 HydrophobicContact CG-CG1 3.99Å; F325-V348 PolarHBondContact N-O 2.02Å; L344-V348 HydrophobicContact CD1-CG1 4.43Å; L344-V348 HydrophobicContact CD1-CG2 4.4Å; E345-V348 HydrophobicContact CB-CG2 4.29Å; E345-V348 VanDerWaalsContact O-CB 3.29Å; E345-V348 WeakPolarHBondContact O-CB 3.26Å; E345-V348 VanDerWaalsContact O-CG2 3.3Å; E345-V348 WeakPolarHBondContact O-CG2 3.46Å; E345-V348 PolarHBondContact O-N 3.28Å; E345-V348 VanDerWaalsContact O-N 3.11Å; K346-V348 PolarHBondContact O-N 3.04Å
349	F	93.8	Very high	93.8	Very high	19 Å²	19	47.1 Å²	47.1	8%	0.083	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-97.3	144	-170.7	-60.8	-88.9	0	0	0	112.8	F325 L331 L334 L344 K346 G347 P352 L355 W373	F325-F349 HydrophobicContact CB-CD1 4.45Å; F325-F349 AromaticContact CD2-CD1 3.91Å; F325-F349 HydrophobicContact CD2-CD1 3.91Å; F325-F349 AromaticContact CD2-CE1 3.64Å; F325-F349 HydrophobicContact CD2-CE1 3.64Å; F325-F349 HydrophobicContact CD2-CZ 4.13Å; F325-F349 HydrophobicContact CE2-CE1 4.18Å; F325-F349 HydrophobicContact CE2-CZ 4.35Å; L331-F349 HydrophobicContact CD2-CD1 4.42Å; L331-F349 HydrophobicContact CD2-CE1 4.15Å; L334-F349 HydrophobicContact CD2-CE1 3.86Å; L334-F349 HydrophobicContact CD2-CZ 3.64Å; L344-F349 HydrophobicContact CD1-CE2 4.04Å; L344-F349 HydrophobicContact CD1-CZ 4.2Å; L344-F349 HydrophobicContact CD2-CE2 4.09Å; L344-F349 HydrophobicContact CD2-CZ 3.99Å; L344-F349 HydrophobicContact CG-CE2 3.99Å; L344-F349 HydrophobicContact CG-CZ 4.31Å; K346-F349 PolarHBondContact O-N 3.38Å; G347-F349 VanDerWaalsContact C-N 3.27Å; F349-P352 HydrophobicContact CB-CB 3.94Å; F349-P352 HydrophobicContact CB-CG 4.38Å; F349-P352 HydrophobicContact CD2-CB 4.37Å; F349-P352 HydrophobicContact CG-CB 4.22Å; F349-L355 HydrophobicContact CE1-CD2 4.41Å; F349-L355 HydrophobicContact CZ-CD2 4.45Å; F349-W373 HydrophobicContact CD2-CH2 4.27Å; F349-W373 HydrophobicContact CD2-CZ2 4.3Å; F349-W373 AromaticContact CE2-CH2 3.77Å; F349-W373 HydrophobicContact CE2-CH2 3.77Å; F349-W373 AromaticContact CE2-CZ2 3.76Å; F349-W373 HydrophobicContact CE2-CZ2 3.76Å; F349-W373 HydrophobicContact CZ-CH2 4.37Å
350	Q	90.9	Very high	93.7	Very high	93 Å²	93	46.7 Å²	46.7	44%	0.435	24%	0.236	S	C	.	.	S	Bend	trans	-70.9	-45	165.5	-179.5	64.9	43.3	0	0	112	Q326 R329	Q326-Q350 VanDerWaalsContact CG-OE1 3.27Å; R329-Q350 HydrophobicContact CG-CG 4.37Å
351	S	89.1	Confident	93.7	Very high	48 Å²	48	39.4 Å²	39.4	34%	0.336	21%	0.21	S	C	.	.			trans	-139.7	83.1	-178.3	-170.1	0	0	0	0	110.2	E353 A354	S351-E353 PolarHBondContact O-N 3.36Å; S351-A354 PolarHBondContact O-N 3.26Å
352	P	89.8	Confident	93.6	Very high	13 Å²	13	43.9 Å²	43.9	8%	0.084	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	1	178.9	30.2	-35.9	0	0	0	113.3	K346 F349 W373 K377	K346-P352 HydrophobicContact CG-CB 4.48Å; K346-P352 HydrophobicContact CG-CG 3.97Å; F349-P352 HydrophobicContact CB-CB 3.94Å; F349-P352 HydrophobicContact CB-CG 4.38Å; F349-P352 HydrophobicContact CD2-CB 4.37Å; F349-P352 HydrophobicContact CG-CB 4.22Å; P352-W373 HydrophobicContact CB-CZ3 4.28Å; P352-K377 PolarHBondContact O-NZ 3.25Å
353	E	88.8	Confident	93.7	Very high	155 Å²	155	42 Å²	42	72%	0.724	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-22.4	174.6	-68.4	173.6	-168.2	0	0	112.7	S351 L355	S351-E353 PolarHBondContact O-N 3.36Å; E353-L355 PolarHBondContact O-N 2.6Å
354	A	90.5	Very high	93.8	Very high	32 Å²	32	44.2 Å²	44.2	26%	0.264	24%	0.238	S	C	.	.	S	Bend	trans	-77.4	-11.8	175.6	0	0	0	0	0	113.3	L331 S351 E356	L331-A354 CarbonylContact O-C 3.05Å; S351-A354 PolarHBondContact O-N 3.26Å; A354-E356 PolarHBondContact O-N 3.49Å
355	L	93.3	Very high	93.8	Very high	10 Å²	10	44.2 Å²	44.2	5%	0.052	24%	0.238	C	C	.	.			trans	-76	118.8	-176.6	-165.4	73.7	0	0	0	110.5	K332 L334 F349 E353 L358	K332-L355 WeakPolarHBondContact O-CD1 3.37Å; L334-L355 HydrophobicContact CB-CD1 3.96Å; F349-L355 HydrophobicContact CE1-CD2 4.41Å; F349-L355 HydrophobicContact CZ-CD2 4.45Å; E353-L355 PolarHBondContact O-N 2.6Å; L355-L358 HydrophobicContact CD2-CB 3.96Å; L355-L358 HydrophobicContact CD2-CD1 4.24Å; L355-L358 HydrophobicContact CD2-CD2 4.35Å; L355-L358 HydrophobicContact CD2-CG 4.4Å
356	E	94.4	Very high	93.8	Very high	95 Å²	95	43 Å²	43	44%	0.444	23%	0.234	S	C	.	.			trans	-99.4	-40.4	-179.3	-67.3	170.6	-167.2	0	0	110.7	K332 A354 L382	K332-E356 IonicContact NZ-OE1 3.4Å; K332-E356 PolarHBondContact NZ-OE1 3.05Å; K332-E356 IonicContact NZ-OE2 3.43Å; K332-E356 PolarHBondContact O-N 3.32Å; A354-E356 PolarHBondContact O-N 3.49Å; E356-L382 PolarHBondContact O-N 3.14Å
357	V	96.1	Very high	93.8	Very high	33 Å²	33	37.5 Å²	37.5	20%	0.2	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	125.7	-176.7	-174.2	0	0	0	0	109.9	K332 V333 L334 L359 L382	K332-V357 PolarHBondContact O-N 3.25Å; V333-V357 WeakPolarHBondContact CA-O 3.36Å; V333-V357 HydrophobicContact CB-CB 4.41Å; V333-V357 HydrophobicContact CG1-CB 4.12Å; V333-V357 HydrophobicContact CG1-CG1 4.28Å; V333-V357 HydrophobicContact CG2-CB 4.1Å; V333-V357 HydrophobicContact CG2-CG2 4.21Å; L334-V357 PolarHBondContact N-O 3.49Å; V357-L359 HydrophobicContact CG1-CD2 4.07Å; V357-L359 HydrophobicContact CG1-CG 4.07Å; V357-L382 WeakPolarHBondContact CA-O 3.49Å; V357-L382 HydrophobicContact CG2-CB 4.22Å; V357-L382 HydrophobicContact CG2-CD1 4.3Å
358	L	96.5	Very high	93.9	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	109.7	174.6	178.8	59.4	0	0	0	109.8	L334 L344 L355 I360 W373 I374 I381 L382 F383	L334-L358 HydrophobicContact CB-CD1 4.11Å; L334-L358 HydrophobicContact CD2-CD1 3.91Å; L334-L358 HydrophobicContact CG-CD1 4.17Å; L334-L358 WeakPolarHBondContact O-CA 2.98Å; L344-L358 HydrophobicContact CD2-CD1 3.9Å; L344-L358 HydrophobicContact CD2-CD2 4.16Å; L355-L358 HydrophobicContact CD2-CB 3.96Å; L355-L358 HydrophobicContact CD2-CD1 4.24Å; L355-L358 HydrophobicContact CD2-CD2 4.35Å; L355-L358 HydrophobicContact CD2-CG 4.4Å; L358-I360 HydrophobicContact CD1-CB 4.47Å; L358-I360 HydrophobicContact CD2-CG2 4.41Å; L358-I360 HydrophobicContact CG-CB 4.35Å; L358-I360 HydrophobicContact CG-CG2 4.25Å; L358-W373 HydrophobicContact CD2-CH2 4.49Å; L358-I374 HydrophobicContact CD2-CD1 3.98Å; L358-I374 HydrophobicContact CD2-CG1 4.46Å; L358-I374 HydrophobicContact CD2-CG2 4.1Å; L358-I381 HydrophobicContact CB-CG2 3.5Å; L358-I381 VanDerWaalsContact CB-CG2 3.5Å; L358-L382 PolarHBondContact N-O 2.95Å; L358-F383 HydrophobicContact CD2-CE1 4.44Å; L358-F383 WeakPolarHBondContact O-CA 3.08Å; L358-F383 WeakPolarHBondContact O-CD1 3.4Å
359	L	96.9	Very high	93.7	Very high	34 Å²	34	38 Å²	38	18%	0.178	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	105.1	174.5	-51.7	176.8	0	0	0	108.1	L334 N335 V336 S337 V357 F383	L334-L359 PolarHBondContact O-N 2.86Å; N335-L359 HydrophobicContact CB-CB 4.09Å; N335-L359 HydrophobicContact CB-CD1 4.04Å; N335-L359 HydrophobicContact CB-CG 4.43Å; N335-L359 VanDerWaalsContact ND2-CD1 3.33Å; N335-L359 WeakPolarHBondContact ND2-CD1 3.39Å; N335-L359 WeakPolarHBondContact OD1-CB 3.4Å; V336-L359 CarbonylContact C-O 3.44Å; V336-L359 WeakPolarHBondContact CG2-O 3.34Å; V336-L359 PolarHBondContact N-O 3.42Å; S337-L359 PolarHBondContact N-O 3.14Å; V357-L359 HydrophobicContact CG1-CD2 4.07Å; V357-L359 HydrophobicContact CG1-CG 4.07Å; L359-F383 VanDerWaalsContact CD2-O 3.23Å; L359-F383 WeakPolarHBondContact CD2-O 3.15Å
360	I	96.1	Very high	93.7	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	21%	0.211	C	C	.	.			trans	-130.1	11.6	-177.2	-166.7	170.9	0	0	0	111.7	V336 L344 L358 N363 L365 P388	V336-I360 HydrophobicContact CG2-CB 4.16Å; V336-I360 HydrophobicContact CG2-CG1 4Å; L344-I360 HydrophobicContact CB-CD1 3.74Å; L344-I360 HydrophobicContact CD2-CD1 3.87Å; L344-I360 HydrophobicContact CG-CD1 4.46Å; L358-I360 HydrophobicContact CD1-CB 4.47Å; L358-I360 HydrophobicContact CD2-CG2 4.41Å; L358-I360 HydrophobicContact CG-CB 4.35Å; L358-I360 HydrophobicContact CG-CG2 4.25Å; I360-N363 PolarHBondContact O-ND2 3.13Å; I360-N363 VanDerWaalsContact O-ND2 3.13Å; I360-L365 HydrophobicContact CD1-CD1 4.46Å; I360-L365 HydrophobicContact CD1-CD2 3.9Å; I360-L365 HydrophobicContact CG1-CD1 4.28Å; I360-L365 HydrophobicContact CG1-CD2 4.07Å; I360-L365 HydrophobicContact CG2-CD1 4.44Å; I360-P388 HydrophobicContact CG2-CB 3.84Å; I360-P388 HydrophobicContact CG2-CG 3.54Å
361	D	95.3	Very high	93.9	Very high	14 Å²	14	34.3 Å²	34.3	8%	0.075	19%	0.19	C	C	.	.			trans	-60	163.4	174.3	64.4	-70.3	0	0	0	111.8	S337 H338 N363	S337-D361 VanDerWaalsContact CA-O 3.29Å; S337-D361 WeakPolarHBondContact CA-O 3.45Å; S337-D361 WeakPolarHBondContact CB-OD1 3.35Å; H338-D361 PolarHBondContact N-O 3.34Å; H338-D361 VanDerWaalsContact N-O 3.09Å; D361-N363 VanDerWaalsContact C-N 3.3Å; D361-N363 PolarHBondContact O-N 2.92Å; D361-N363 PolarHBondContact O-ND2 2.94Å; D361-N363 VanDerWaalsContact O-ND2 3.08Å
362	N	95.9	Very high	94	Very high	93 Å²	93	33.7 Å²	33.7	50%	0.497	18%	0.182	S	C	.	.	S	Bend	trans	55	43.8	-179.3	-66.7	-69	0	0	0	113.4	H338 N339	H338-N362 WeakPolarHBondContact CA-O 3.3Å; H338-N362 HydrophobicContact CB-CB 4.37Å; H338-N362 VanDerWaalsContact CE1-CG 3.45Å; H338-N362 PolarHBondContact CE1-ND2 3.4Å; H338-N362 WeakPolarHBondContact ND1-CB 3.49Å; H338-N362 PolarHBondContact NE2-ND2 3.48Å; N339-N362 PolarHBondContact N-O 3.06Å
363	N	96.8	Very high	94.1	Very high	14 Å²	14	34 Å²	34	8%	0.075	18%	0.182	C	C	.	.	S	Bend	trans	-126.5	146.7	171	-80.4	-83.8	0	0	0	110	V336 N339 R340 L341 I360 D361 L365	V336-N363 PolarHBondContact O-ND2 3.18Å; N339-N363 VanDerWaalsContact CA-OD1 3.24Å; N339-N363 WeakPolarHBondContact CA-OD1 3.43Å; N339-N363 WeakPolarHBondContact CB-OD1 3.36Å; N339-N363 PolarHBondContact N-OD1 3.33Å; N339-N363 PolarHBondContact O-OD1 2.91Å; R340-N363 PolarHBondContact N-OD1 3.26Å; L341-N363 HydrophobicContact CB-CB 4.34Å; L341-N363 WeakPolarHBondContact CB-OD1 3.42Å; L341-N363 PolarHBondContact N-OD1 3.19Å; I360-N363 PolarHBondContact O-ND2 3.13Å; I360-N363 VanDerWaalsContact O-ND2 3.13Å; D361-N363 VanDerWaalsContact C-N 3.3Å; D361-N363 PolarHBondContact O-N 2.92Å; D361-N363 PolarHBondContact O-ND2 2.94Å; D361-N363 VanDerWaalsContact O-ND2 3.08Å; N363-L365 HydrophobicContact CB-CD2 3.85Å; N363-L365 HydrophobicContact CB-CG 3.93Å; N363-L365 PolarHBondContact O-N 2.66Å
364	P	96	Very high	94.3	Very high	59 Å²	59	26.6 Å²	26.6	38%	0.383	15%	0.147	S	C	.	.			trans	-76	61	177	33.9	-37.2	0	0	0	112.1	L341 V366	L341-P364 CarbonylContact O-C 3.5Å; L341-P364 VanDerWaalsContact O-CD 3.31Å; L341-P364 WeakPolarHBondContact O-CD 3.49Å; P364-V366 PolarHBondContact O-N 3.33Å
365	L	95.7	Very high	94.3	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	131.2	-171.8	-61	175.1	0	0	0	112.3	D342 I360 N363 L371 P388 S391 T392 F401	D342-L365 CarbonylContact O-C 3.44Å; D342-L365 WeakPolarHBondContact O-CA 3.46Å; I360-L365 HydrophobicContact CD1-CD1 4.46Å; I360-L365 HydrophobicContact CD1-CD2 3.9Å; I360-L365 HydrophobicContact CG1-CD1 4.28Å; I360-L365 HydrophobicContact CG1-CD2 4.07Å; I360-L365 HydrophobicContact CG2-CD1 4.44Å; N363-L365 HydrophobicContact CB-CD2 3.85Å; N363-L365 HydrophobicContact CB-CG 3.93Å; N363-L365 PolarHBondContact O-N 2.66Å; L365-L371 HydrophobicContact CB-CD1 4.06Å; L365-P388 HydrophobicContact CD1-CB 4.17Å; L365-S391 WeakPolarHBondContact O-CB 3.09Å; L365-S391 PolarHBondContact O-N 3Å; L365-T392 PolarHBondContact O-N 3.01Å; L365-F401 HydrophobicContact CD1-CE1 4.39Å; L365-F401 HydrophobicContact CD1-CZ 3.95Å
366	V	94.2	Very high	94.2	Very high	37 Å²	37	30.7 Å²	30.7	22%	0.224	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	103.9	171.9	-179.3	0	0	0	0	107.7	D342 P364 D368 L371 T392	D342-V366 HydrophobicContact CB-CG2 3.94Å; D342-V366 PolarHBondContact O-N 3.4Å; P364-V366 PolarHBondContact O-N 3.33Å; V366-D368 VanDerWaalsContact C-N 3.25Å; V366-D368 HydrophobicContact CG1-CB 4.46Å; V366-D368 WeakPolarHBondContact CG1-OD2 3.44Å; V366-D368 PolarHBondContact O-N 2.99Å; V366-L371 WeakPolarHBondContact O-CD1 3.49Å; V366-T392 WeakPolarHBondContact CA-OG1 3.12Å; V366-T392 WeakPolarHBondContact CG1-OG1 3.22Å; V366-T392 WeakPolarHBondContact CG2-OG1 3.5Å
367	C	93.2	Very high	93.9	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.007	15%	0.151	C	C	.	.			trans	-81.3	70.8	-176.7	-72.9	0	0	0	0	112.1	C390 T392 I396	C367-C390 HydrophobicContact CB-CB 3.72Å; C367-C390 WeakPolarHBondContact CB-SG 3.34Å; C367-C390 WeakPolarHBondContact SG-CA 3.32Å; C367-C390 WeakPolarHBondContact SG-CB 3.25Å; C367-C390 CovalentContact SG-SG 2.02Å; C367-C390 PolarHBondContact SG-SG 3.34Å; C367-T392 WeakPolarHBondContact CB-O 3.19Å; C367-T392 PolarHBondContact N-O 3.13Å; C367-I396 HydrophobicContact CB-CD1 3.71Å
368	D	92.8	Very high	93.5	Very high	3 Å²	3	27.6 Å²	27.6	2%	0.016	14%	0.143	C	C	.	.	S	Bend	trans	-106.2	-176.4	169.6	65.4	47.2	0	0	0	111.3	V366 R370 L371 V413 T445 P446	V366-D368 VanDerWaalsContact C-N 3.25Å; V366-D368 HydrophobicContact CG1-CB 4.46Å; V366-D368 WeakPolarHBondContact CG1-OD2 3.44Å; V366-D368 PolarHBondContact O-N 2.99Å; D368-R370 PolarHBondContact O-N 3.43Å; D368-R370 WeakPolarHBondContact OD1-CB 3.48Å; D368-R370 WeakPolarHBondContact OD1-CG 3.48Å; D368-R370 PolarHBondContact OD1-N 2.97Å; D368-R370 IonicContact OD1-NE 3.08Å; D368-R370 PolarHBondContact OD1-NE 2.77Å; D368-R370 VanDerWaalsContact OD1-NE 3.08Å; D368-R370 IonicContact OD2-CZ 2.64Å; D368-R370 IonicContact OD2-NE 2.74Å; D368-R370 PolarHBondContact OD2-NE 3.48Å; D368-R370 VanDerWaalsContact OD2-NE 3.08Å; D368-R370 IonicContact OD2-NH2 3.06Å; D368-R370 PolarHBondContact OD2-NH2 2.99Å; D368-L371 PolarHBondContact O-N 2.83Å; D368-V413 WeakPolarHBondContact O-CG1 3.36Å; D368-T445 HydrophobicContact CB-CG2 3.9Å; D368-P446 WeakPolarHBondContact OD2-CG 3.38Å
369	C	92.3	Very high	93	Very high	44 Å²	44	34 Å²	34	30%	0.297	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-56.6	-19.1	-177.5	73.9	0	0	0	0	114.8	L371 M372 C415	C369-L371 PolarHBondContact O-N 2.96Å; C369-M372 WeakPolarHBondContact O-CB 3.33Å; C369-M372 PolarHBondContact O-N 2.98Å; C369-M372 VanDerWaalsContact O-N 3.16Å; C369-C415 VanDerWaalsContact CA-SG 3.52Å; C369-C415 HydrophobicContact CB-CB 3.75Å; C369-C415 WeakPolarHBondContact CB-SG 3.3Å; C369-C415 PolarHBondContact N-SG 2.95Å; C369-C415 WeakPolarHBondContact SG-CB 3.39Å; C369-C415 CovalentContact SG-SG 2Å; C369-C415 PolarHBondContact SG-SG 3.4Å
370	R	93.5	Very high	92.7	Very high	34 Å²	34	37.1 Å²	37.1	13%	0.128	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-63.1	-31.2	176.2	-64.9	179.1	-68.5	167.3	2.7	112.3	D342 T343 E345 D368 W373 P446 T496	D342-R370 IonicContact OD2-CZ 3.86Å; D342-R370 IonicContact OD2-NH1 3.58Å; D342-R370 PolarHBondContact OD2-NH1 2.92Å; D342-R370 VanDerWaalsContact OD2-NH1 3.17Å; D342-R370 IonicContact OD2-NH2 3.2Å; D342-R370 PolarHBondContact OD2-NH2 2.92Å; T343-R370 WeakPolarHBondContact OG1-CB 3.46Å; E345-R370 HydrophobicContact CG-CB 4.34Å; E345-R370 HydrophobicContact CG-CG 4.42Å; E345-R370 WeakPolarHBondContact OE1-CD 3.48Å; D368-R370 PolarHBondContact O-N 3.43Å; D368-R370 WeakPolarHBondContact OD1-CB 3.48Å; D368-R370 WeakPolarHBondContact OD1-CG 3.48Å; D368-R370 PolarHBondContact OD1-N 2.97Å; D368-R370 IonicContact OD1-NE 3.08Å; D368-R370 PolarHBondContact OD1-NE 2.77Å; D368-R370 VanDerWaalsContact OD1-NE 3.08Å; D368-R370 IonicContact OD2-CZ 2.64Å; D368-R370 IonicContact OD2-NE 2.74Å; D368-R370 PolarHBondContact OD2-NE 3.48Å; D368-R370 VanDerWaalsContact OD2-NE 3.08Å; D368-R370 IonicContact OD2-NH2 3.06Å; D368-R370 PolarHBondContact OD2-NH2 2.99Å; R370-W373 PolarHBondContact O-NE1 3.37Å; R370-P446 HydrophobicContact CG-CG 4Å; R370-T496 HydrophobicContact CG-CG2 3.89Å
371	L	93.8	Very high	92.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-91.5	-0.1	178	-64.3	-177.4	0	0	0	113.3	L344 L365 V366 D368 C369 W373 I374 L375 F401	L344-L371 HydrophobicContact CB-CD2 4.42Å; L365-L371 HydrophobicContact CB-CD1 4.06Å; V366-L371 WeakPolarHBondContact O-CD1 3.49Å; D368-L371 PolarHBondContact O-N 2.83Å; C369-L371 PolarHBondContact O-N 2.96Å; L371-W373 PolarHBondContact O-N 2.89Å; L371-I374 HydrophobicContact CD2-CD1 3.85Å; L371-I374 PolarHBondContact O-N 2.89Å; L371-L375 PolarHBondContact O-N 2.81Å; L371-F401 HydrophobicContact CD1-CZ 4.36Å
372	M	91.9	Very high	92.4	Very high	34 Å²	34	42.4 Å²	42.4	17%	0.167	23%	0.225	C	C	.	.	H	α-helix	trans	-55.7	-39.4	-177	-173.2	64.3	72.3	0	0	112.3	C369 I374 L375 Q376 L409 V413	C369-M372 WeakPolarHBondContact O-CB 3.33Å; C369-M372 PolarHBondContact O-N 2.98Å; C369-M372 VanDerWaalsContact O-N 3.16Å; M372-I374 VanDerWaalsContact C-N 3.27Å; M372-I374 PolarHBondContact O-N 3.15Å; M372-L375 PolarHBondContact O-N 2.74Å; M372-Q376 HydrophobicContact CG-CG 4.28Å; M372-Q376 WeakPolarHBondContact O-CB 3.5Å; M372-Q376 VanDerWaalsContact O-CG 3.26Å; M372-Q376 WeakPolarHBondContact O-CG 3.28Å; M372-Q376 PolarHBondContact O-N 3.43Å; M372-Q376 HydrophobicContact SD-CG 4.43Å; M372-L409 HydrophobicContact SD-CB 4.18Å; M372-V413 HydrophobicContact CE-CB 3.73Å; M372-V413 HydrophobicContact CE-CG1 3.73Å; M372-V413 WeakPolarHBondContact CE-O 3.34Å
373	W	91.8	Very high	92.1	Very high	20 Å²	20	38.1 Å²	38.1	8%	0.076	20%	0.202	C	C	.	.	H	α-helix	trans	-64.2	-31.4	-179.6	74.7	-87.4	0	0	0	112.9	L344 K346 F349 P352 L358 R370 L371 K377 I381	L344-W373 HydrophobicContact CD2-CZ2 4.28Å; L344-W373 HydrophobicContact CG-CZ2 4.21Å; L344-W373 PolarHBondContact O-NE1 3.41Å; K346-W373 HydrophobicContact CB-CB 4.41Å; K346-W373 HydrophobicContact CB-CD2 4.18Å; K346-W373 HydrophobicContact CB-CG 3.84Å; K346-W373 HydrophobicContact CD-CB 4.3Å; K346-W373 HydrophobicContact CG-CD2 4.4Å; K346-W373 HydrophobicContact CG-CG 4.28Å; F349-W373 HydrophobicContact CD2-CH2 4.27Å; F349-W373 HydrophobicContact CD2-CZ2 4.3Å; F349-W373 AromaticContact CE2-CH2 3.77Å; F349-W373 HydrophobicContact CE2-CH2 3.77Å; F349-W373 AromaticContact CE2-CZ2 3.76Å; F349-W373 HydrophobicContact CE2-CZ2 3.76Å; F349-W373 HydrophobicContact CZ-CH2 4.37Å; P352-W373 HydrophobicContact CB-CZ3 4.28Å; L358-W373 HydrophobicContact CD2-CH2 4.49Å; R370-W373 PolarHBondContact O-NE1 3.37Å; L371-W373 PolarHBondContact O-N 2.89Å; W373-K377 HydrophobicContact CE3-CD 4.5Å; W373-K377 WeakPolarHBondContact O-CB 3.5Å; W373-K377 WeakPolarHBondContact O-CG 3.46Å; W373-K377 PolarHBondContact O-N 3.41Å; W373-I381 HydrophobicContact CZ3-CD1 4.28Å
374	I	93.4	Very high	91.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-74.3	-46.1	176.9	-54.3	-176.1	0	0	0	109.5	L344 L358 L371 M372 Q376 K377 K378 F383 F401	L344-I374 HydrophobicContact CB-CD1 4.21Å; L344-I374 HydrophobicContact CD2-CD1 4.24Å; L358-I374 HydrophobicContact CD2-CD1 3.98Å; L358-I374 HydrophobicContact CD2-CG1 4.46Å; L358-I374 HydrophobicContact CD2-CG2 4.1Å; L371-I374 HydrophobicContact CD2-CD1 3.85Å; L371-I374 PolarHBondContact O-N 2.89Å; M372-I374 VanDerWaalsContact C-N 3.27Å; M372-I374 PolarHBondContact O-N 3.15Å; I374-Q376 VanDerWaalsContact C-N 3.3Å; I374-Q376 PolarHBondContact O-N 3.27Å; I374-K377 CarbonylContact O-C 3.51Å; I374-K377 WeakPolarHBondContact O-CA 3Å; I374-K377 PolarHBondContact O-N 2.9Å; I374-K378 PolarHBondContact O-N 2.98Å; I374-F383 HydrophobicContact CG2-CE1 3.75Å; I374-F383 HydrophobicContact CG2-CZ 3.82Å; I374-F401 HydrophobicContact CB-CE2 4.39Å; I374-F401 HydrophobicContact CG2-CD2 4.09Å; I374-F401 HydrophobicContact CG2-CE2 3.83Å
375	L	91.4	Very high	91.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.4	-34.2	179.8	-70.6	169.4	0	0	0	112.6	L371 M372 K377 K378 F401 F404 L409 V413	L371-L375 PolarHBondContact O-N 2.81Å; M372-L375 PolarHBondContact O-N 2.74Å; L375-K377 VanDerWaalsContact C-N 3.29Å; L375-K378 WeakPolarHBondContact O-CB 3.19Å; L375-K378 WeakPolarHBondContact O-CD 3.29Å; L375-K378 WeakPolarHBondContact O-CG 3.35Å; L375-F401 HydrophobicContact CD2-CB 3.95Å; L375-F401 HydrophobicContact CD2-CD1 3.83Å; L375-F401 HydrophobicContact CD2-CD2 3.61Å; L375-F401 HydrophobicContact CD2-CE1 4.21Å; L375-F401 HydrophobicContact CD2-CE2 3.99Å; L375-F401 HydrophobicContact CD2-CG 3.51Å; L375-F401 HydrophobicContact CD2-CZ 4.28Å; L375-F401 HydrophobicContact CG-CD2 4.35Å; L375-F401 HydrophobicContact CG-CE2 4.35Å; L375-F404 HydrophobicContact CD2-CD2 4.24Å; L375-L409 HydrophobicContact CB-CD1 4.4Å; L375-L409 HydrophobicContact CB-CD2 3.95Å; L375-L409 HydrophobicContact CD1-CD2 4.07Å; L375-L409 HydrophobicContact CG-CD2 4.45Å; L375-V413 HydrophobicContact CD1-CB 4.4Å; L375-V413 HydrophobicContact CD1-CG1 4.13Å; L375-V413 HydrophobicContact CD1-CG2 3.67Å
376	Q	90.4	Very high	91	Very high	128 Å²	128	47.9 Å²	47.9	60%	0.598	27%	0.265	S	S	*	.	H	α-helix	trans	-68	-29	171.8	-74.6	174.9	-20	0	0	112.6	M372 I374	M372-Q376 HydrophobicContact CG-CG 4.28Å; M372-Q376 WeakPolarHBondContact O-CB 3.5Å; M372-Q376 VanDerWaalsContact O-CG 3.26Å; M372-Q376 WeakPolarHBondContact O-CG 3.28Å; M372-Q376 PolarHBondContact O-N 3.43Å; M372-Q376 HydrophobicContact SD-CG 4.43Å; I374-Q376 VanDerWaalsContact C-N 3.3Å; I374-Q376 PolarHBondContact O-N 3.27Å
377	K	88.6	Confident	90.9	Very high	55 Å²	55	48.1 Å²	48.1	24%	0.239	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	10	179.4	-72.6	-167	173.3	-161.3	0	114.1	P352 W373 I374 L375 H379 S380 I381	P352-K377 PolarHBondContact O-NZ 3.25Å; W373-K377 HydrophobicContact CE3-CD 4.5Å; W373-K377 WeakPolarHBondContact O-CB 3.5Å; W373-K377 WeakPolarHBondContact O-CG 3.46Å; W373-K377 PolarHBondContact O-N 3.41Å; I374-K377 CarbonylContact O-C 3.51Å; I374-K377 WeakPolarHBondContact O-CA 3Å; I374-K377 PolarHBondContact O-N 2.9Å; L375-K377 VanDerWaalsContact C-N 3.29Å; K377-H379 PolarHBondContact O-N 3.1Å; K377-S380 PolarHBondContact O-N 3.01Å; K377-I381 HydrophobicContact CB-CD1 3.62Å; K377-I381 HydrophobicContact CB-CG1 4.02Å; K377-I381 HydrophobicContact CD-CD1 3.95Å; K377-I381 HydrophobicContact CG-CD1 4.47Å; K377-I381 PolarHBondContact O-N 3.18Å
378	K	87	Confident	90.9	Very high	7 Å²	7	48 Å²	48	3%	0.03	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-21.4	-172.9	72.8	-173.9	179.1	-137.6	0	115.4	I374 L375 F383 F404	I374-K378 PolarHBondContact O-N 2.98Å; L375-K378 WeakPolarHBondContact O-CB 3.19Å; L375-K378 WeakPolarHBondContact O-CD 3.29Å; L375-K378 WeakPolarHBondContact O-CG 3.35Å; K378-F383 HydrophobicContact CB-CE2 3.87Å; K378-F383 HydrophobicContact CB-CZ 4.3Å; K378-F404 PolarHBondContact NZ-O 2.93Å
379	H	86.9	Confident	91	Very high	136 Å²	136	52.9 Å²	52.9	63%	0.63	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-19.4	177	-65	-57.8	0	0	0	113.1	K377 E406	K377-H379 PolarHBondContact O-N 3.1Å; H379-E406 IonicContact CD2-OE1 2.82Å; H379-E406 IonicContact NE2-OE1 3.29Å
380	S	89.5	Confident	91.1	Very high	98 Å²	98	50.9 Å²	50.9	69%	0.685	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-26.5	-179.8	-52.3	0	0	0	0	112.7	K377	K377-S380 PolarHBondContact O-N 3.01Å
381	I	90.9	Very high	91.1	Very high	8 Å²	8	51.2 Å²	51.2	4%	0.041	28%	0.28	C	S	.	.	S	Bend	trans	-99.5	133.1	-179.6	-63.5	173.5	0	0	0	109.6	L358 W373 K377 F383	L358-I381 HydrophobicContact CB-CG2 3.5Å; L358-I381 VanDerWaalsContact CB-CG2 3.5Å; W373-I381 HydrophobicContact CZ3-CD1 4.28Å; K377-I381 HydrophobicContact CB-CD1 3.62Å; K377-I381 HydrophobicContact CB-CG1 4.02Å; K377-I381 HydrophobicContact CD-CD1 3.95Å; K377-I381 HydrophobicContact CG-CD1 4.47Å; K377-I381 PolarHBondContact O-N 3.18Å; I381-F383 HydrophobicContact CB-CZ 4.45Å; I381-F383 HydrophobicContact CG2-CD1 4.41Å; I381-F383 HydrophobicContact CG2-CE1 4.11Å; I381-F383 HydrophobicContact CG2-CZ 4.43Å
382	L	93.9	Very high	91	Very high	118 Å²	118	53.6 Å²	53.6	62%	0.618	29%	0.294	S	S	*	.	B	Isolated β-bridge	trans	-83.1	121.2	173.2	-66.3	170.8	0	0	0	110.2	E356 V357 L358	E356-L382 PolarHBondContact O-N 3.14Å; V357-L382 WeakPolarHBondContact CA-O 3.49Å; V357-L382 HydrophobicContact CG2-CB 4.22Å; V357-L382 HydrophobicContact CG2-CD1 4.3Å; L358-L382 PolarHBondContact N-O 2.95Å
383	F	91.1	Very high	90.9	Very high	3 Å²	3	55.1 Å²	55.1	1%	0.013	31%	0.307	C	S	.	.			trans	-94.6	5.1	178.4	-62.3	-66.5	0	0	0	114.6	L358 L359 I374 K378 I381 S386 P388 F401	L358-F383 HydrophobicContact CD2-CE1 4.44Å; L358-F383 WeakPolarHBondContact O-CA 3.08Å; L358-F383 WeakPolarHBondContact O-CD1 3.4Å; L359-F383 VanDerWaalsContact CD2-O 3.23Å; L359-F383 WeakPolarHBondContact CD2-O 3.15Å; I374-F383 HydrophobicContact CG2-CE1 3.75Å; I374-F383 HydrophobicContact CG2-CZ 3.82Å; K378-F383 HydrophobicContact CB-CE2 3.87Å; K378-F383 HydrophobicContact CB-CZ 4.3Å; I381-F383 HydrophobicContact CB-CZ 4.45Å; I381-F383 HydrophobicContact CG2-CD1 4.41Å; I381-F383 HydrophobicContact CG2-CE1 4.11Å; I381-F383 HydrophobicContact CG2-CZ 4.43Å; F383-S386 VanDerWaalsContact O-O 3.13Å; F383-P388 HydrophobicContact CB-CG 4.28Å; F383-P388 HydrophobicContact CD1-CG 3.69Å; F383-P388 HydrophobicContact CE1-CG 4.26Å; F383-P388 HydrophobicContact CG-CG 4.08Å; F383-F401 HydrophobicContact CE1-CD2 4.47Å; F383-F401 HydrophobicContact CZ-CD2 4.24Å
384	G	86.4	Confident	90.7	Very high	38 Å²	38	60.4 Å²	60.4	39%	0.392	33%	0.332	S	S	.	.			trans	71.6	-163.3	-174	0	0	0	0	0	113.5	Q387	G384-Q387 PolarHBondContact O-NE2 2.9Å
385	D	86.1	Confident	90.4	Very high	175 Å²	175	64 Å²	64	94%	0.936	37%	0.369	S	S	*	.	S	Bend	trans	-72	-40	-174.9	-61.7	-33.2	0	0	0	112.2
386	S	91.1	Very high	90.4	Very high	67 Å²	67	64.2 Å²	64.2	47%	0.469	37%	0.37	S	S	.	.	S	Bend	trans	-92.4	128.1	178	-64.6	0	0	0	0	110.8	F383	F383-S386 VanDerWaalsContact O-O 3.13Å
387	Q	92.1	Very high	90.5	Very high	41 Å²	41	65.4 Å²	65.4	19%	0.192	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-83.8	142.6	-179.1	-67.9	-59.7	-63	0	0	111.9	G384 P400 K402	G384-Q387 PolarHBondContact O-NE2 2.9Å; Q387-P400 HydrophobicContact CB-CB 3.74Å; Q387-P400 HydrophobicContact CG-CB 4.42Å; Q387-K402 HydrophobicContact CG-CD 4.32Å; Q387-K402 VanDerWaalsContact OE1-CG 3.27Å
388	P	94.3	Very high	90.6	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-64.8	137	168.5	-21.3	32.6	0	0	0	111.2	I360 L365 F383 P400 F401	I360-P388 HydrophobicContact CG2-CB 3.84Å; I360-P388 HydrophobicContact CG2-CG 3.54Å; L365-P388 HydrophobicContact CD1-CB 4.17Å; F383-P388 HydrophobicContact CB-CG 4.28Å; F383-P388 HydrophobicContact CD1-CG 3.69Å; F383-P388 HydrophobicContact CE1-CG 4.26Å; F383-P388 HydrophobicContact CG-CG 4.08Å; P388-P400 WeakPolarHBondContact O-CA 3.31Å; P388-F401 HydrophobicContact CB-CD1 4.1Å; P388-F401 HydrophobicContact CB-CD2 4.04Å; P388-F401 HydrophobicContact CB-CE1 4.14Å; P388-F401 HydrophobicContact CB-CE2 4.09Å; P388-F401 HydrophobicContact CB-CG 4.05Å; P388-F401 HydrophobicContact CB-CZ 4.14Å; P388-F401 HydrophobicContact CG-CD2 4.41Å; P388-F401 WeakPolarHBondContact O-CD1 3.41Å; P388-F401 PolarHBondContact O-N 3.07Å
389	E	94.4	Very high	90.7	Very high	105 Å²	105	67.1 Å²	67.1	49%	0.491	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-120.1	147.6	-179.4	-67	177.7	-167.6	0	0	110.9	P400	E389-P400 HydrophobicContact CG-CB 4.47Å
390	C	93.9	Very high	91	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.014	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	129.9	172.4	-62.8	0	0	0	0	110.4	C367 I396 R397 G398 R399	C367-C390 HydrophobicContact CB-CB 3.72Å; C367-C390 WeakPolarHBondContact CB-SG 3.34Å; C367-C390 WeakPolarHBondContact SG-CA 3.32Å; C367-C390 WeakPolarHBondContact SG-CB 3.25Å; C367-C390 CovalentContact SG-SG 2.02Å; C367-C390 PolarHBondContact SG-SG 3.34Å; C390-I396 HydrophobicContact CB-CD1 4.31Å; C390-I396 HydrophobicContact CB-CG1 4.06Å; C390-I396 WeakPolarHBondContact CB-O 3.47Å; C390-R397 CarbonylContact O-C 3.29Å; C390-R397 VanDerWaalsContact O-CA 3.29Å; C390-R397 WeakPolarHBondContact O-CA 3.19Å; C390-G398 PolarHBondContact O-N 2.81Å; C390-R399 PolarHBondContact N-O 3.15Å
391	S	94.4	Very high	91.1	Very high	41 Å²	41	57 Å²	57	29%	0.287	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-34.1	169.4	-176.5	0	0	0	0	112	L365 R397	L365-S391 WeakPolarHBondContact O-CB 3.09Å; L365-S391 PolarHBondContact O-N 3Å; S391-R397 WeakPolarHBondContact O-CG 3.47Å
392	T	90.9	Very high	91	Very high	49 Å²	49	62.3 Å²	62.3	30%	0.301	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	155.7	177.7	60.4	0	0	0	0	109.7	L365 V366 C367	L365-T392 PolarHBondContact O-N 3.01Å; V366-T392 WeakPolarHBondContact CA-OG1 3.12Å; V366-T392 WeakPolarHBondContact CG1-OG1 3.22Å; V366-T392 WeakPolarHBondContact CG2-OG1 3.5Å; C367-T392 WeakPolarHBondContact CB-O 3.19Å; C367-T392 PolarHBondContact N-O 3.13Å
393	P	90.6	Very high	90.8	Very high	66 Å²	66	62.1 Å²	62.1	43%	0.429	35%	0.349	S	S	.	.	S	Bend	cis	-70.3	162.3	-4.6	28.9	-35.5	0	0	0	113.9	G395 I396 R397	P393-G395 PolarHBondContact O-N 3.13Å; P393-G395 VanDerWaalsContact O-N 3.07Å; P393-I396 HydrophobicContact CG-CD1 4.21Å; P393-I396 HydrophobicContact CG-CG1 4.04Å; P393-I396 PolarHBondContact O-N 3.12Å; P393-R397 PolarHBondContact O-N 2.84Å
394	E	88	Confident	90.6	Very high	131 Å²	131	62.1 Å²	62.1	61%	0.612	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-54.6	-30.3	-175.8	-69	-64.5	159.7	0	0	113.8	I396 R397	E394-I396 PolarHBondContact O-N 3.37Å; E394-R397 PolarHBondContact O-N 2.92Å; E394-R397 IonicContact OE1-NH1 3.28Å; E394-R397 PolarHBondContact OE1-NH1 2.85Å; E394-R397 WeakPolarHBondContact OE2-CD 3.08Å; E394-R397 IonicContact OE2-NH1 3.2Å; E394-R397 PolarHBondContact OE2-NH1 3.07Å
395	G	87	Confident	90.7	Very high	75 Å²	75	67.3 Å²	67.3	77%	0.773	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-66.3	-16.1	178.7	0	0	0	0	0	115.3	P393	P393-G395 PolarHBondContact O-N 3.13Å; P393-G395 VanDerWaalsContact O-N 3.07Å
396	I	89.9	Confident	90.6	Very high	6 Å²	6	64.7 Å²	64.7	3%	0.031	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-129.3	17.5	178.6	64.8	178.6	0	0	0	112.6	C367 C390 P393 E394 R399 F404 Y412	C367-I396 HydrophobicContact CB-CD1 3.71Å; C390-I396 HydrophobicContact CB-CD1 4.31Å; C390-I396 HydrophobicContact CB-CG1 4.06Å; C390-I396 WeakPolarHBondContact CB-O 3.47Å; P393-I396 HydrophobicContact CG-CD1 4.21Å; P393-I396 HydrophobicContact CG-CG1 4.04Å; P393-I396 PolarHBondContact O-N 3.12Å; E394-I396 PolarHBondContact O-N 3.37Å; I396-R399 VanDerWaalsContact O-CB 3.28Å; I396-R399 WeakPolarHBondContact O-CB 3.3Å; I396-R399 PolarHBondContact O-N 3.38Å; I396-F404 HydrophobicContact CB-CE1 4.14Å; I396-F404 HydrophobicContact CB-CZ 4.01Å; I396-F404 HydrophobicContact CD1-CE1 3.93Å; I396-F404 HydrophobicContact CD1-CZ 3.94Å; I396-F404 HydrophobicContact CG1-CZ 4.41Å; I396-F404 HydrophobicContact CG2-CE1 4.08Å; I396-F404 HydrophobicContact CG2-CZ 4.45Å; I396-Y412 HydrophobicContact CG2-CD1 3.42Å; I396-Y412 VanDerWaalsContact CG2-CD1 3.42Å; I396-Y412 HydrophobicContact CG2-CE1 4.05Å; I396-Y412 HydrophobicContact CG2-CG 3.95Å
397	R	92.4	Very high	90.2	Very high	152 Å²	152	65.8 Å²	65.8	57%	0.574	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	135.8	-178.1	-178.9	173.9	176.6	-178.5	-0.6	111.6	C390 S391 P393 E394 R399	C390-R397 CarbonylContact O-C 3.29Å; C390-R397 VanDerWaalsContact O-CA 3.29Å; C390-R397 WeakPolarHBondContact O-CA 3.19Å; S391-R397 WeakPolarHBondContact O-CG 3.47Å; P393-R397 PolarHBondContact O-N 2.84Å; E394-R397 PolarHBondContact O-N 2.92Å; E394-R397 IonicContact OE1-NH1 3.28Å; E394-R397 PolarHBondContact OE1-NH1 2.85Å; E394-R397 WeakPolarHBondContact OE2-CD 3.08Å; E394-R397 IonicContact OE2-NH1 3.2Å; E394-R397 PolarHBondContact OE2-NH1 3.07Å; R397-R399 PolarHBondContact O-N 2.79Å
398	G	91.3	Very high	89.8	Confident	37 Å²	37	67.2 Å²	67.2	38%	0.381	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	3.5	-178.5	0	0	0	0	0	114.3	C390	C390-G398 PolarHBondContact O-N 2.81Å
399	R	90.4	Very high	89.4	Confident	61 Å²	61	67.8 Å²	67.8	23%	0.23	37%	0.367	C	S	.	.			trans	-81.2	126.5	179.6	-168.5	175.2	-178.6	175.8	-1.1	110.2	C390 I396 R397 E403 F404	C390-R399 PolarHBondContact N-O 3.15Å; I396-R399 VanDerWaalsContact O-CB 3.28Å; I396-R399 WeakPolarHBondContact O-CB 3.3Å; I396-R399 PolarHBondContact O-N 3.38Å; R397-R399 PolarHBondContact O-N 2.79Å; R399-E403 HydrophobicContact CG-CB 4.22Å; R399-E403 PolarHBondContact NH2-O 2.91Å; R399-F404 HydrophobicContact CB-CE2 4.1Å; R399-F404 HydrophobicContact CB-CZ 4.04Å; R399-F404 HydrophobicContact CG-CD2 4.46Å; R399-F404 HydrophobicContact CG-CE2 3.89Å; R399-F404 HydrophobicContact CG-CZ 4.04Å
400	P	92.1	Very high	88.8	Confident	22 Å²	22	67.1 Å²	67.1	14%	0.143	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-75.2	150.3	179	30.2	-35	0	0	0	111.9	Q387 P388 E389 K402 E403 F404	Q387-P400 HydrophobicContact CB-CB 3.74Å; Q387-P400 HydrophobicContact CG-CB 4.42Å; P388-P400 WeakPolarHBondContact O-CA 3.31Å; E389-P400 HydrophobicContact CG-CB 4.47Å; P400-K402 VanDerWaalsContact C-N 3.29Å; P400-K402 PolarHBondContact O-N 3.43Å; P400-E403 HydrophobicContact CG-CB 4.25Å; P400-E403 HydrophobicContact CG-CG 3.73Å; P400-E403 WeakPolarHBondContact CG-OE1 3.41Å; P400-E403 PolarHBondContact O-N 2.81Å; P400-E403 VanDerWaalsContact O-N 3.08Å; P400-F404 WeakPolarHBondContact O-CD2 3.32Å
401	F	91.9	Very high	88.3	Confident	1 Å²	1	75.3 Å²	75.3	0%	0.004	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-58.4	-36.1	-173.8	-81.5	21.8	0	0	0	114	L365 L371 I374 L375 F383 P388 E403 F404	L365-F401 HydrophobicContact CD1-CE1 4.39Å; L365-F401 HydrophobicContact CD1-CZ 3.95Å; L371-F401 HydrophobicContact CD1-CZ 4.36Å; I374-F401 HydrophobicContact CB-CE2 4.39Å; I374-F401 HydrophobicContact CG2-CD2 4.09Å; I374-F401 HydrophobicContact CG2-CE2 3.83Å; L375-F401 HydrophobicContact CD2-CB 3.95Å; L375-F401 HydrophobicContact CD2-CD1 3.83Å; L375-F401 HydrophobicContact CD2-CD2 3.61Å; L375-F401 HydrophobicContact CD2-CE1 4.21Å; L375-F401 HydrophobicContact CD2-CE2 3.99Å; L375-F401 HydrophobicContact CD2-CG 3.51Å; L375-F401 HydrophobicContact CD2-CZ 4.28Å; L375-F401 HydrophobicContact CG-CD2 4.35Å; L375-F401 HydrophobicContact CG-CE2 4.35Å; F383-F401 HydrophobicContact CE1-CD2 4.47Å; F383-F401 HydrophobicContact CZ-CD2 4.24Å; P388-F401 HydrophobicContact CB-CD1 4.1Å; P388-F401 HydrophobicContact CB-CD2 4.04Å; P388-F401 HydrophobicContact CB-CE1 4.14Å; P388-F401 HydrophobicContact CB-CE2 4.09Å; P388-F401 HydrophobicContact CB-CG 4.05Å; P388-F401 HydrophobicContact CB-CZ 4.14Å; P388-F401 HydrophobicContact CG-CD2 4.41Å; P388-F401 WeakPolarHBondContact O-CD1 3.41Å; P388-F401 PolarHBondContact O-N 3.07Å; F401-E403 PolarHBondContact O-N 3.1Å; F401-F404 PolarHBondContact O-N 3.4Å
402	K	88.3	Confident	87.7	Confident	118 Å²	118	76.9 Å²	76.9	51%	0.513	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-64	-24.7	179.2	-77.9	177.6	-178.3	167.9	0	113.8	Q387 P400 F404	Q387-K402 HydrophobicContact CG-CD 4.32Å; Q387-K402 VanDerWaalsContact OE1-CG 3.27Å; P400-K402 VanDerWaalsContact C-N 3.29Å; P400-K402 PolarHBondContact O-N 3.43Å; K402-F404 VanDerWaalsContact C-N 3.34Å
403	E	89.3	Confident	87.6	Confident	115 Å²	115	74.7 Å²	74.7	54%	0.537	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-81.6	-11.5	-178.2	-75.5	179.7	-158.2	0	0	114.1	R399 P400 F401 K405	R399-E403 HydrophobicContact CG-CB 4.22Å; R399-E403 PolarHBondContact NH2-O 2.91Å; P400-E403 HydrophobicContact CG-CB 4.25Å; P400-E403 HydrophobicContact CG-CG 3.73Å; P400-E403 WeakPolarHBondContact CG-OE1 3.41Å; P400-E403 PolarHBondContact O-N 2.81Å; P400-E403 VanDerWaalsContact O-N 3.08Å; F401-E403 PolarHBondContact O-N 3.1Å; E403-K405 PolarHBondContact O-N 3.43Å
404	F	88.5	Confident	87.5	Confident	3 Å²	3	74.8 Å²	74.8	1%	0.013	39%	0.392	C	S	.	.			trans	-72.7	120.8	178	-73.1	-90.8	0	0	0	110.3	L375 K378 I396 R399 P400 F401 K402 L409 Y412	L375-F404 HydrophobicContact CD2-CD2 4.24Å; K378-F404 PolarHBondContact NZ-O 2.93Å; I396-F404 HydrophobicContact CB-CE1 4.14Å; I396-F404 HydrophobicContact CB-CZ 4.01Å; I396-F404 HydrophobicContact CD1-CE1 3.93Å; I396-F404 HydrophobicContact CD1-CZ 3.94Å; I396-F404 HydrophobicContact CG1-CZ 4.41Å; I396-F404 HydrophobicContact CG2-CE1 4.08Å; I396-F404 HydrophobicContact CG2-CZ 4.45Å; R399-F404 HydrophobicContact CB-CE2 4.1Å; R399-F404 HydrophobicContact CB-CZ 4.04Å; R399-F404 HydrophobicContact CG-CD2 4.46Å; R399-F404 HydrophobicContact CG-CE2 3.89Å; R399-F404 HydrophobicContact CG-CZ 4.04Å; P400-F404 WeakPolarHBondContact O-CD2 3.32Å; F401-F404 PolarHBondContact O-N 3.4Å; K402-F404 VanDerWaalsContact C-N 3.34Å; F404-L409 HydrophobicContact CB-CD2 3.76Å; F404-L409 HydrophobicContact CD1-CD2 4.31Å; F404-L409 HydrophobicContact CG-CD2 4.27Å; F404-Y412 HydrophobicContact CD1-CD2 4.39Å; F404-Y412 HydrophobicContact CE1-CG 4.49Å
405	K	87.3	Confident	87.7	Confident	147 Å²	147	70 Å²	70	64%	0.639	37%	0.373	S	S	*	.			trans	-74.8	133.7	172.2	-65	-177.2	179.1	-178.4	0	109.7	E403 A407 L408 L409	E403-K405 PolarHBondContact O-N 3.43Å; K405-A407 VanDerWaalsContact C-N 3.28Å; K405-A407 PolarHBondContact O-N 2.94Å; K405-L408 PolarHBondContact O-N 2.85Å; K405-L409 PolarHBondContact O-N 3.31Å
406	E	83.6	Confident	88.1	Confident	119 Å²	119	69.7 Å²	69.7	56%	0.556	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-56.5	-41.2	-177	-68.7	178.8	173.7	0	0	112.7	H379 L408 L409	H379-E406 IonicContact CD2-OE1 2.82Å; H379-E406 IonicContact NE2-OE1 3.29Å; E406-L408 PolarHBondContact O-N 2.97Å; E406-L408 VanDerWaalsContact O-N 3.08Å; E406-L409 PolarHBondContact O-N 2.96Å
407	A	83.9	Confident	88.2	Confident	91 Å²	91	76.2 Å²	76.2	75%	0.752	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-60.5	-19.6	178.7	0	0	0	0	0	114.6	K405	K405-A407 VanDerWaalsContact C-N 3.28Å; K405-A407 PolarHBondContact O-N 2.94Å
408	L	84.3	Confident	88.4	Confident	71 Å²	71	69.3 Å²	69.3	37%	0.372	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-110.8	0.5	-177.2	-59.6	175.9	0	0	0	113.1	K405 E406 S410 Y411 Y412	K405-L408 PolarHBondContact O-N 2.85Å; E406-L408 PolarHBondContact O-N 2.97Å; E406-L408 VanDerWaalsContact O-N 3.08Å; L408-S410 VanDerWaalsContact C-N 3.29Å; L408-S410 PolarHBondContact O-N 3.49Å; L408-Y411 WeakPolarHBondContact O-CB 3.35Å; L408-Y411 PolarHBondContact O-N 3.31Å; L408-Y412 HydrophobicContact CB-CD2 3.86Å; L408-Y412 HydrophobicContact CB-CE2 3.59Å; L408-Y412 HydrophobicContact CD1-CE2 4.02Å; L408-Y412 HydrophobicContact CG-CE2 4.4Å; L408-Y412 WeakPolarHBondContact O-CD2 3.4Å; L408-Y412 PolarHBondContact O-N 3.47Å
409	L	84.6	Confident	88.5	Confident	11 Å²	11	74.5 Å²	74.5	6%	0.058	37%	0.371	C	S	.	.	H	α-helix	trans	-59.9	-40.7	-179.1	-77.1	173.9	0	0	0	112	M372 L375 F404 K405 E406 Y411 Y412 V413	M372-L409 HydrophobicContact SD-CB 4.18Å; L375-L409 HydrophobicContact CB-CD1 4.4Å; L375-L409 HydrophobicContact CB-CD2 3.95Å; L375-L409 HydrophobicContact CD1-CD2 4.07Å; L375-L409 HydrophobicContact CG-CD2 4.45Å; F404-L409 HydrophobicContact CB-CD2 3.76Å; F404-L409 HydrophobicContact CD1-CD2 4.31Å; F404-L409 HydrophobicContact CG-CD2 4.27Å; K405-L409 PolarHBondContact O-N 3.31Å; E406-L409 PolarHBondContact O-N 2.96Å; L409-Y411 PolarHBondContact O-N 2.93Å; L409-Y412 PolarHBondContact O-N 3.41Å; L409-V413 WeakPolarHBondContact O-CB 3.38Å; L409-V413 PolarHBondContact O-N 2.94Å
410	S	82	Confident	88.6	Confident	91 Å²	91	72 Å²	72	64%	0.636	36%	0.362	S	S	*	.	H	α-helix	trans	-65.2	-17.2	177.2	54.3	0	0	0	0	114	L408 T414	L408-S410 VanDerWaalsContact C-N 3.29Å; L408-S410 PolarHBondContact O-N 3.49Å; S410-T414 WeakPolarHBondContact O-CG2 3.28Å
411	Y	83.3	Confident	88.6	Confident	175 Å²	175	78 Å²	78	69%	0.686	38%	0.382	S	S	*	.	H	α-helix	trans	-88.6	-45.2	176.3	-178.3	-99.8	0	0	0	111.7	L408 L409	L408-Y411 WeakPolarHBondContact O-CB 3.35Å; L408-Y411 PolarHBondContact O-N 3.31Å; L409-Y411 PolarHBondContact O-N 2.93Å
412	Y	82.4	Confident	88.3	Confident	74 Å²	74	80.1 Å²	80.1	29%	0.29	39%	0.392	S	S	.	.	H	α-helix	trans	-81.1	-33.4	-176.1	-67.5	-63.7	0	0	0	113.7	I396 F404 L408 L409	I396-Y412 HydrophobicContact CG2-CD1 3.42Å; I396-Y412 VanDerWaalsContact CG2-CD1 3.42Å; I396-Y412 HydrophobicContact CG2-CE1 4.05Å; I396-Y412 HydrophobicContact CG2-CG 3.95Å; F404-Y412 HydrophobicContact CD1-CD2 4.39Å; F404-Y412 HydrophobicContact CE1-CG 4.49Å; L408-Y412 HydrophobicContact CB-CD2 3.86Å; L408-Y412 HydrophobicContact CB-CE2 3.59Å; L408-Y412 HydrophobicContact CD1-CE2 4.02Å; L408-Y412 HydrophobicContact CG-CE2 4.4Å; L408-Y412 WeakPolarHBondContact O-CD2 3.4Å; L408-Y412 PolarHBondContact O-N 3.47Å; L409-Y412 PolarHBondContact O-N 3.41Å
413	V	87.8	Confident	87.6	Confident	2 Å²	2	81.5 Å²	81.5	1%	0.012	41%	0.405	C	S	.	.	S	Bend	trans	-117.9	89.5	-168.4	-176	0	0	0	0	108.3	D368 M372 L375 L409	D368-V413 WeakPolarHBondContact O-CG1 3.36Å; M372-V413 HydrophobicContact CE-CB 3.73Å; M372-V413 HydrophobicContact CE-CG1 3.73Å; M372-V413 WeakPolarHBondContact CE-O 3.34Å; L375-V413 HydrophobicContact CD1-CB 4.4Å; L375-V413 HydrophobicContact CD1-CG1 4.13Å; L375-V413 HydrophobicContact CD1-CG2 3.67Å; L409-V413 WeakPolarHBondContact O-CB 3.38Å; L409-V413 PolarHBondContact O-N 2.94Å
414	T	89.5	Confident	86.9	Confident	69 Å²	69	84.3 Å²	84.3	42%	0.423	42%	0.415	S	S	.	.			trans	-126.7	157.3	-174.5	59.1	0	0	0	0	111.3	S410	S410-T414 WeakPolarHBondContact O-CG2 3.28Å
415	C	93.1	Very high	86.5	Confident	31 Å²	31	89.1 Å²	89.1	21%	0.209	45%	0.445	C	S	.	.			trans	-121.2	141.7	167	-71.3	0	0	0	0	109.4	C369 T445 A497	C369-C415 VanDerWaalsContact CA-SG 3.52Å; C369-C415 HydrophobicContact CB-CB 3.75Å; C369-C415 WeakPolarHBondContact CB-SG 3.3Å; C369-C415 PolarHBondContact N-SG 2.95Å; C369-C415 WeakPolarHBondContact SG-CB 3.39Å; C369-C415 CovalentContact SG-SG 2Å; C369-C415 PolarHBondContact SG-SG 3.4Å; C415-T445 CarbonylContact C-O 3.56Å; C415-T445 WeakPolarHBondContact CA-O 3.27Å; C415-T445 WeakPolarHBondContact CB-O 3.47Å; C415-A497 HydrophobicContact CB-CB 3.8Å
416	T	93.4	Very high	86.5	Confident	68 Å²	68	83.7 Å²	83.7	42%	0.417	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	131.8	176.6	54.2	0	0	0	0	108.3	T445 N495	T416-T445 PolarHBondContact N-O 3.05Å; T416-T445 PolarHBondContact O-N 2.98Å; T416-T445 WeakPolarHBondContact OG1-CB 3.29Å; T416-T445 PolarHBondContact OG1-N 3Å; T416-T445 PolarHBondContact OG1-OG1 3.08Å; T416-N495 PolarHBondContact O-ND2 3.24Å
417	K	93.6	Very high	86.8	Confident	143 Å²	143	83 Å²	83	62%	0.622	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.1	147.6	175.8	-77.9	-176.4	176	-177	0	110.1	K419 A497	K417-K419 PolarHBondContact O-N 3.08Å; K417-A497 WeakPolarHBondContact CE-O 3.27Å; K417-A497 HydrophobicContact CG-CB 3.93Å; K417-A497 VanDerWaalsContact CG-O 3.26Å; K417-A497 WeakPolarHBondContact CG-O 3.35Å
418	P	95.2	Very high	87.2	Confident	7 Å²	7	80.7 Å²	80.7	5%	0.045	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	140.9	174.4	-21.2	35.6	0	0	0	109.7	E443 P448 A493 N495 G498 D500	P418-E443 CarbonylContact C-O 3.57Å; P418-E443 WeakPolarHBondContact CA-O 3.5Å; P418-P448 HydrophobicContact CB-CB 3.91Å; P418-P448 HydrophobicContact CB-CG 3.67Å; P418-P448 HydrophobicContact CG-CB 4.01Å; P418-P448 HydrophobicContact CG-CG 3.94Å; P418-A493 HydrophobicContact CB-CB 4.06Å; P418-N495 VanDerWaalsContact CD-OD1 3.27Å; P418-N495 WeakPolarHBondContact CD-OD1 3.49Å; P418-N495 HydrophobicContact CG-CB 4.08Å; P418-G498 WeakPolarHBondContact CD-O 3.5Å; P418-G498 VanDerWaalsContact CG-O 3.3Å; P418-G498 WeakPolarHBondContact CG-O 3.44Å; P418-D500 HydrophobicContact CB-CB 4.29Å; P418-D500 WeakPolarHBondContact O-CB 3.46Å
419	K	94.3	Very high	87.6	Confident	145 Å²	145	81 Å²	81	63%	0.63	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.3	115.6	169.9	-173.4	177.7	-179.1	-178.8	0	108	K417 R421 A442 E443 D500	K417-K419 PolarHBondContact O-N 3.08Å; K419-R421 PolarHBondContact O-N 3.38Å; K419-A442 WeakPolarHBondContact O-CA 3.38Å; K419-E443 PolarHBondContact N-O 3.28Å; K419-E443 PolarHBondContact O-N 2.95Å; K419-D500 WeakPolarHBondContact CA-OD2 3.37Å
420	I	93.4	Very high	88	Confident	9 Å²	9	81.2 Å²	81.2	5%	0.046	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	127.7	176.1	-63.8	170	0	0	0	107.9	E422 A442 A493 D500 L502	I420-E422 HydrophobicContact CG2-CB 4.2Å; I420-E422 VanDerWaalsContact CG2-OE2 3.27Å; I420-E422 WeakPolarHBondContact CG2-OE2 3.43Å; I420-E422 PolarHBondContact O-N 3.14Å; I420-A442 HydrophobicContact CG1-CB 4.2Å; I420-A493 HydrophobicContact CD1-CB 4.16Å; I420-A493 HydrophobicContact CG1-CB 3.89Å; I420-D500 HydrophobicContact CD1-CB 4.23Å; I420-D500 HydrophobicContact CG1-CB 4.17Å; I420-D500 PolarHBondContact N-OD2 3.29Å; I420-L502 HydrophobicContact CD1-CB 3.77Å; I420-L502 HydrophobicContact CG2-CB 4.18Å; I420-L502 HydrophobicContact CG2-CD2 4.05Å
421	R	90.6	Very high	88.5	Confident	147 Å²	147	80.5 Å²	80.5	56%	0.555	40%	0.397	S	S	*	.	S	Bend	trans	-69.5	-24.6	-176.4	-72.4	-174.9	171.6	178.8	-1.7	112.3	K419 N423 S441 E443	K419-R421 PolarHBondContact O-N 3.38Å; R421-N423 PolarHBondContact O-N 3.44Å; R421-N423 PolarHBondContact O-OD1 3.08Å; R421-S441 WeakPolarHBondContact CB-O 3.5Å; R421-S441 WeakPolarHBondContact CG-O 3.45Å; R421-S441 PolarHBondContact N-O 3.18Å; R421-E443 HydrophobicContact CG-CG 4.13Å; R421-E443 IonicContact CZ-OE1 3.03Å; R421-E443 IonicContact NE-OE1 2.71Å; R421-E443 PolarHBondContact NE-OE1 3.09Å; R421-E443 IonicContact NH2-OE1 2.62Å; R421-E443 PolarHBondContact NH2-OE1 3.13Å
422	E	86.8	Confident	89	Confident	46 Å²	46	76.4 Å²	76.4	22%	0.215	38%	0.384	C	S	.	.			trans	-79.7	110	179.9	-67.1	80.4	-171.5	0	0	111.3	I420 K424 S441 L502	I420-E422 HydrophobicContact CG2-CB 4.2Å; I420-E422 VanDerWaalsContact CG2-OE2 3.27Å; I420-E422 WeakPolarHBondContact CG2-OE2 3.43Å; I420-E422 PolarHBondContact O-N 3.14Å; E422-K424 PolarHBondContact O-N 2.72Å; E422-S441 PolarHBondContact OE1-N 3.05Å; E422-S441 PolarHBondContact OE2-N 3.33Å; E422-L502 HydrophobicContact CB-CD2 3.82Å
423	N	72.5	Confident	89.3	Confident	147 Å²	147	74.8 Å²	74.8	79%	0.786	39%	0.389	S	S	*	.			trans	-85.4	-6.6	-172	-52	-17.5	0	0	0	114.2	R421	R421-N423 PolarHBondContact O-N 3.44Å; R421-N423 PolarHBondContact O-OD1 3.08Å
424	K	75.8	Confident	89.6	Confident	174 Å²	174	80.3 Å²	80.3	76%	0.757	42%	0.415	S	S	*	.	S	Bend	trans	-127.3	143	-174.6	-70.6	-176	179	-179.3	0	110.4	E422 Q426	E422-K424 PolarHBondContact O-N 2.72Å; K424-Q426 PolarHBondContact O-N 3.2Å
425	T	79.2	Confident	89.8	Confident	105 Å²	105	81.7 Å²	81.7	64%	0.644	42%	0.417	S	S	*	.			trans	-54.4	126.1	167.7	43.3	0	0	0	0	109.2
426	Q	87.4	Confident	89.8	Confident	33 Å²	33	80.4 Å²	80.4	15%	0.154	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	132.2	178.6	-73.4	173.9	44.1	0	0	108.8	K424 R439 M503 A504 S505	K424-Q426 PolarHBondContact O-N 3.2Å; Q426-R439 PolarHBondContact NE2-O 2.98Å; Q426-M503 PolarHBondContact N-O 3.33Å; Q426-A504 HydrophobicContact CB-CB 3.91Å; Q426-A504 CarbonylContact O-C 3.49Å; Q426-A504 WeakPolarHBondContact O-CA 3.49Å; Q426-S505 PolarHBondContact O-N 2.95Å
427	T	90	Very high	89.8	Confident	103 Å²	103	81.8 Å²	81.8	63%	0.632	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	111.3	171.6	-51	0	0	0	0	107.4	S505	T427-S505 WeakPolarHBondContact CA-O 3.49Å
428	I	92	Very high	89.8	Confident	43 Å²	43	75 Å²	75	22%	0.221	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	132.9	-177.3	-55.1	-173.3	0	0	0	108.4	M437 L438 S505 L506 A507	I428-M437 WeakPolarHBondContact CD1-O 3.41Å; I428-L438 HydrophobicContact CD1-CD2 3.56Å; I428-L438 HydrophobicContact CD1-CG 4.26Å; I428-L438 HydrophobicContact CG1-CD2 4.11Å; I428-S505 PolarHBondContact N-O 3.19Å; I428-L506 HydrophobicContact CB-CD1 4.13Å; I428-L506 HydrophobicContact CG2-CD1 4.14Å; I428-L506 WeakPolarHBondContact O-CA 3.48Å; I428-A507 PolarHBondContact O-N 2.97Å
429	T	92.6	Very high	89.7	Confident	77 Å²	77	82.1 Å²	82.1	47%	0.472	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126.5	174	-40.6	0	0	0	0	108.5	A507 K509	T429-A507 VanDerWaalsContact CA-O 3.29Å; T429-A507 WeakPolarHBondContact CA-O 3.41Å; T429-A507 HydrophobicContact CG2-CB 4.14Å; T429-K509 HydrophobicContact CG2-CD 3.91Å; T429-K509 VanDerWaalsContact CG2-CE 3.46Å; T429-K509 HydrophobicContact CG2-CG 3.97Å
430	V	94.3	Very high	89.7	Confident	16 Å²	16	75.2 Å²	75.2	10%	0.097	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	146.7	-175.2	74.8	0	0	0	0	109.5	Q434 A436 A481 L506 A507 V508 K509	V430-Q434 HydrophobicContact CG2-CB 3.47Å; V430-Q434 VanDerWaalsContact CG2-CB 3.47Å; V430-A436 HydrophobicContact CB-CB 4.48Å; V430-A436 HydrophobicContact CG1-CB 4.28Å; V430-A436 HydrophobicContact CG2-CB 4.44Å; V430-A481 HydrophobicContact CG1-CB 3.52Å; V430-L506 HydrophobicContact CG1-CD1 4Å; V430-A507 PolarHBondContact N-O 3.4Å; V430-V508 HydrophobicContact CG1-CB 4.5Å; V430-V508 HydrophobicContact CG1-CG1 4.45Å; V430-V508 HydrophobicContact CG1-CG2 3.94Å; V430-V508 CarbonylContact O-C 3.5Å; V430-V508 VanDerWaalsContact O-CA 3.24Å; V430-V508 WeakPolarHBondContact O-CA 3.44Å; V430-K509 PolarHBondContact O-N 3.18Å
431	D	92.3	Very high	89.7	Confident	77 Å²	77	76.3 Å²	76.3	41%	0.412	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	151.5	173.6	-59.8	-50.1	0	0	0	110.2	G433 Q434 K509	D431-G433 PolarHBondContact O-N 3.27Å; D431-Q434 HydrophobicContact CB-CG 4.25Å; D431-Q434 WeakPolarHBondContact O-CB 3.45Å; D431-Q434 PolarHBondContact O-N 3.05Å; D431-Q434 VanDerWaalsContact O-N 3.08Å; D431-K509 WeakPolarHBondContact OD1-CB 3.49Å
432	E	92.6	Very high	89.8	Confident	89 Å²	89	70.2 Å²	70.2	42%	0.416	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	132.8	177.2	-174.1	167	-150	0	0	111.3	Q434 V508 K509 S510	E432-Q434 VanDerWaalsContact C-N 3.34Å; E432-V508 HydrophobicContact CB-CG1 4.15Å; E432-K509 PolarHBondContact N-O 2.93Å; E432-S510 PolarHBondContact OE2-OG 3.1Å
433	G	89.2	Confident	90	Very high	40 Å²	40	72.9 Å²	72.9	41%	0.412	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	-12.3	-176.4	0	0	0	0	0	115.6	D431 A481	D431-G433 PolarHBondContact O-N 3.27Å; G433-A481 PolarHBondContact N-O 2.8Å
434	Q	93.1	Very high	90.9	Very high	118 Å²	118	66.8 Å²	66.8	55%	0.551	35%	0.351	S	S	*	.	S	Bend	trans	-83.5	161.5	178.7	-68	-68	-33.5	0	0	112.7	V430 D431 E432 A481	V430-Q434 HydrophobicContact CG2-CB 3.47Å; V430-Q434 VanDerWaalsContact CG2-CB 3.47Å; D431-Q434 HydrophobicContact CB-CG 4.25Å; D431-Q434 WeakPolarHBondContact O-CB 3.45Å; D431-Q434 PolarHBondContact O-N 3.05Å; D431-Q434 VanDerWaalsContact O-N 3.08Å; E432-Q434 VanDerWaalsContact C-N 3.34Å; Q434-A481 WeakPolarHBondContact O-CB 3.37Å; Q434-A481 PolarHBondContact O-N 3.48Å
435	Q	94.1	Very high	91.6	Very high	98 Å²	98	61.4 Å²	61.4	46%	0.458	33%	0.333	S	S	.	.			trans	-80.8	136.4	177.7	-171.9	-173.8	12.1	0	0	111.1	E477 I478	Q435-E477 HydrophobicContact CG-CG 4.38Å; Q435-E477 PolarHBondContact NE2-OE1 2.95Å; Q435-I478 CarbonylContact C-O 3.54Å; Q435-I478 VanDerWaalsContact CA-O 3.25Å; Q435-I478 WeakPolarHBondContact CA-O 3.44Å; Q435-I478 WeakPolarHBondContact CG-O 3.47Å
436	A	93.6	Very high	92.3	Very high	4 Å²	4	57 Å²	57	3%	0.033	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	143.1	173.2	0	0	0	0	0	111.5	V430 I478 L506	V430-A436 HydrophobicContact CB-CB 4.48Å; V430-A436 HydrophobicContact CG1-CB 4.28Å; V430-A436 HydrophobicContact CG2-CB 4.44Å; A436-I478 HydrophobicContact CB-CB 4.22Å; A436-I478 HydrophobicContact CB-CD1 4.43Å; A436-I478 HydrophobicContact CB-CG1 4.49Å; A436-I478 PolarHBondContact N-O 3.49Å; A436-I478 PolarHBondContact O-N 2.55Å; A436-L506 HydrophobicContact CB-CD1 3.93Å
437	M	93.8	Very high	92.4	Very high	97 Å²	97	64.9 Å²	64.9	48%	0.478	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	115.9	178.9	-72.9	-169.1	-79.6	0	0	111.2	I428 T475 L476 E477	I428-M437 WeakPolarHBondContact CD1-O 3.41Å; M437-T475 HydrophobicContact CB-CG2 4.2Å; M437-L476 CarbonylContact C-O 3.57Å; M437-L476 WeakPolarHBondContact CA-O 3.48Å; M437-E477 HydrophobicContact CG-CG 4.42Å
438	L	93.8	Very high	92.5	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	112.8	177.9	-60	158.1	0	0	0	108.2	I428 W452 T475 L476 I478 Y489 A504	I428-L438 HydrophobicContact CD1-CD2 3.56Å; I428-L438 HydrophobicContact CD1-CG 4.26Å; I428-L438 HydrophobicContact CG1-CD2 4.11Å; L438-W452 HydrophobicContact CB-CH2 3.63Å; L438-W452 HydrophobicContact CB-CZ2 3.96Å; L438-W452 HydrophobicContact CB-CZ3 4.19Å; L438-W452 VanDerWaalsContact O-CZ2 3.27Å; L438-W452 WeakPolarHBondContact O-CZ2 3.49Å; L438-T475 CarbonylContact O-C 3.54Å; L438-T475 WeakPolarHBondContact O-CA 3.05Å; L438-T475 WeakPolarHBondContact O-CG2 3.3Å; L438-L476 HydrophobicContact CB-CB 4.27Å; L438-L476 HydrophobicContact CD1-CD2 3.85Å; L438-L476 HydrophobicContact CD1-CG 4.36Å; L438-L476 PolarHBondContact N-O 2.85Å; L438-L476 PolarHBondContact O-N 2.88Å; L438-I478 HydrophobicContact CD1-CD1 4.35Å; L438-Y489 HydrophobicContact CD1-CD1 4.2Å; L438-Y489 HydrophobicContact CD1-CD2 3.95Å; L438-Y489 HydrophobicContact CD1-CE2 4.41Å; L438-Y489 HydrophobicContact CD1-CG 3.86Å; L438-A504 HydrophobicContact CD2-CB 3.72Å
439	R	93.6	Very high	92.6	Very high	157 Å²	157	62.4 Å²	62.4	59%	0.592	33%	0.325	S	S	*	.			trans	-83.2	142.3	-174.1	-65.8	-177.7	-179.7	174.6	0.7	110.9	Q426 T475	Q426-R439 PolarHBondContact NE2-O 2.98Å; R439-T475 HydrophobicContact CG-CG2 4.16Å
440	C	92.7	Very high	92.6	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.311	C	S	.	.			trans	-155.5	82.5	170.7	-174.3	0	0	0	0	109.9	V450 W452 G474 C491	C440-V450 HydrophobicContact CB-CG1 4.32Å; C440-W452 HydrophobicContact CB-CH2 4.05Å; C440-W452 HydrophobicContact CB-CZ2 3.34Å; C440-G474 CarbonylContact O-C 3.27Å; C440-G474 WeakPolarHBondContact O-CA 3.44Å; C440-C491 HydrophobicContact CB-CB 3.68Å; C440-C491 WeakPolarHBondContact CB-SG 3.06Å; C440-C491 WeakPolarHBondContact SG-CB 3.33Å; C440-C491 CovalentContact SG-SG 2.01Å; C440-C491 PolarHBondContact SG-SG 2.98Å
441	S	92.9	Very high	92.7	Very high	31 Å²	31	60.5 Å²	60.5	22%	0.217	31%	0.314	C	S	.	.			trans	-94.7	118.9	178.1	-179.2	0	0	0	0	109.1	R421 E422	R421-S441 WeakPolarHBondContact CB-O 3.5Å; R421-S441 WeakPolarHBondContact CG-O 3.45Å; R421-S441 PolarHBondContact N-O 3.18Å; E422-S441 PolarHBondContact OE1-N 3.05Å; E422-S441 PolarHBondContact OE2-N 3.33Å
442	A	92.8	Very high	92.8	Very high	20 Å²	20	56.9 Å²	56.9	17%	0.165	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	140.9	177.5	0	0	0	0	0	112.4	K419 I420 P448 V450 A493	K419-A442 WeakPolarHBondContact O-CA 3.38Å; I420-A442 HydrophobicContact CG1-CB 4.2Å; A442-P448 HydrophobicContact CB-CB 4.12Å; A442-P448 HydrophobicContact CB-CG 4.1Å; A442-V450 HydrophobicContact CB-CG2 4.46Å; A442-A493 HydrophobicContact CB-CB 3.43Å; A442-A493 VanDerWaalsContact CB-CB 3.43Å
443	E	92.9	Very high	92.9	Very high	101 Å²	101	55.7 Å²	55.7	47%	0.472	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	152.4	167.1	-66.9	-178.4	174.3	0	0	110.2	P418 K419 R421	P418-E443 CarbonylContact C-O 3.57Å; P418-E443 WeakPolarHBondContact CA-O 3.5Å; K419-E443 PolarHBondContact N-O 3.28Å; K419-E443 PolarHBondContact O-N 2.95Å; R421-E443 HydrophobicContact CG-CG 4.13Å; R421-E443 IonicContact CZ-OE1 3.03Å; R421-E443 IonicContact NE-OE1 2.71Å; R421-E443 PolarHBondContact NE-OE1 3.09Å; R421-E443 IonicContact NH2-OE1 2.62Å; R421-E443 PolarHBondContact NH2-OE1 3.13Å
444	G	91.3	Very high	93	Very high	19 Å²	19	54.3 Å²	54.3	20%	0.196	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.1	162.1	177.5	0	0	0	0	0	110.9	P446 R447	G444-P446 CarbonylContact C-O 3.42Å; G444-P446 VanDerWaalsContact C-O 3.24Å; G444-P446 CarbonylContact O-C 3.51Å; G444-P446 VanDerWaalsContact O-C 3.29Å; G444-P446 VanDerWaalsContact O-O 3.12Å; G444-R447 PolarHBondContact O-N 3.45Å
445	T	90.4	Very high	92.9	Very high	62 Å²	62	51 Å²	51	38%	0.38	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	116.4	177.4	-55.8	0	0	0	0	107.9	D368 C415 T416 N495	D368-T445 HydrophobicContact CB-CG2 3.9Å; C415-T445 CarbonylContact C-O 3.56Å; C415-T445 WeakPolarHBondContact CA-O 3.27Å; C415-T445 WeakPolarHBondContact CB-O 3.47Å; T416-T445 PolarHBondContact N-O 3.05Å; T416-T445 PolarHBondContact O-N 2.98Å; T416-T445 WeakPolarHBondContact OG1-CB 3.29Å; T416-T445 PolarHBondContact OG1-N 3Å; T416-T445 PolarHBondContact OG1-OG1 3.08Å; T445-N495 PolarHBondContact O-ND2 3.08Å
446	P	92.7	Very high	92.6	Very high	12 Å²	12	52.8 Å²	52.8	8%	0.078	27%	0.266	C	S	.	.	S	Bend	cis	-66.1	164.9	-2	-10.6	26.6	0	0	0	111.8	D368 R370 G444 P448 N495 T496	D368-P446 WeakPolarHBondContact OD2-CG 3.38Å; R370-P446 HydrophobicContact CG-CG 4Å; G444-P446 CarbonylContact C-O 3.42Å; G444-P446 VanDerWaalsContact C-O 3.24Å; G444-P446 CarbonylContact O-C 3.51Å; G444-P446 VanDerWaalsContact O-C 3.29Å; G444-P446 VanDerWaalsContact O-O 3.12Å; P446-P448 WeakPolarHBondContact O-CD 3.26Å; P446-N495 WeakPolarHBondContact O-CB 3.36Å; P446-N495 PolarHBondContact O-ND2 3.09Å; P446-T496 WeakPolarHBondContact CD-OG1 3.21Å
447	R	90.1	Very high	92.4	Very high	199 Å²	199	62.9 Å²	62.9	75%	0.751	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-53	122	179.2	-177.3	175.9	175.7	-179.5	-2.6	110.2	G444 N472	G444-R447 PolarHBondContact O-N 3.45Å; R447-N472 PolarHBondContact NH2-O 3.46Å; R447-N472 VanDerWaalsContact NH2-O 3.16Å
448	P	92.5	Very high	92.2	Very high	14 Å²	14	66.2 Å²	66.2	9%	0.091	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-66.3	141.9	-175.3	-21.4	32.6	0	0	0	113.2	P418 A442 P446 A493 S494	P418-P448 HydrophobicContact CB-CB 3.91Å; P418-P448 HydrophobicContact CB-CG 3.67Å; P418-P448 HydrophobicContact CG-CB 4.01Å; P418-P448 HydrophobicContact CG-CG 3.94Å; A442-P448 HydrophobicContact CB-CB 4.12Å; A442-P448 HydrophobicContact CB-CG 4.1Å; P446-P448 WeakPolarHBondContact O-CD 3.26Å; P448-A493 HydrophobicContact CB-CB 4.38Å; P448-S494 WeakPolarHBondContact CA-O 3.3Å
449	S	92.8	Very high	92.1	Very high	80 Å²	80	70.4 Å²	70.4	56%	0.559	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	135.2	164.2	64.9	0	0	0	0	109.5	A493 S494	S449-A493 CarbonylContact O-C 3.49Å; S449-A493 WeakPolarHBondContact O-CA 3.07Å; S449-S494 PolarHBondContact N-O 2.9Å; S449-S494 PolarHBondContact O-N 3Å; S449-S494 PolarHBondContact OG-O 2.91Å
450	V	94.3	Very high	92	Very high	27 Å²	27	63.4 Å²	63.4	16%	0.164	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	131.2	-179.4	178.8	0	0	0	0	109.9	C440 A442 C491 A493	C440-V450 HydrophobicContact CB-CG1 4.32Å; A442-V450 HydrophobicContact CB-CG2 4.46Å; V450-C491 VanDerWaalsContact CG1-SG 3.51Å; V450-A493 HydrophobicContact CG2-CB 4.33Å
451	S	94.6	Very high	91.8	Very high	25 Å²	25	65.7 Å²	65.7	18%	0.175	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	155.1	174.7	61.6	0	0	0	0	110.5	L460 L492	S451-L460 WeakPolarHBondContact CA-O 3.39Å; S451-L492 PolarHBondContact N-O 2.79Å; S451-L492 PolarHBondContact O-N 3.01Å; S451-L492 PolarHBondContact OG-O 2.85Å
452	W	94.9	Very high	91.3	Very high	1 Å²	1	67.6 Å²	67.6	0%	0.004	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	134	-179.2	-74.7	87.7	0	0	0	111.3	L438 C440 V459 L460 G474 L476 L490 C491 A504	L438-W452 HydrophobicContact CB-CH2 3.63Å; L438-W452 HydrophobicContact CB-CZ2 3.96Å; L438-W452 HydrophobicContact CB-CZ3 4.19Å; L438-W452 VanDerWaalsContact O-CZ2 3.27Å; L438-W452 WeakPolarHBondContact O-CZ2 3.49Å; C440-W452 HydrophobicContact CB-CH2 4.05Å; C440-W452 HydrophobicContact CB-CZ2 3.34Å; W452-V459 CarbonylContact O-C 3.6Å; W452-V459 WeakPolarHBondContact O-CA 3.38Å; W452-L460 HydrophobicContact CB-CB 4.16Å; W452-L460 HydrophobicContact CB-CD1 4.47Å; W452-L460 PolarHBondContact N-O 3.31Å; W452-L460 PolarHBondContact O-N 2.84Å; W452-G474 PolarHBondContact NE1-O 3.48Å; W452-L476 HydrophobicContact CB-CD2 4.07Å; W452-L476 HydrophobicContact CD2-CB 3.88Å; W452-L476 HydrophobicContact CD2-CD2 4.04Å; W452-L476 HydrophobicContact CE3-CD2 4.3Å; W452-L476 HydrophobicContact CG-CB 3.89Å; W452-L476 HydrophobicContact CG-CD2 3.98Å; W452-L476 HydrophobicContact CG-CG 4.47Å; W452-L476 HydrophobicContact CZ2-CB 4.19Å; W452-L490 CarbonylContact C-O 3.43Å; W452-L490 WeakPolarHBondContact CA-O 3.28Å; W452-C491 HydrophobicContact CD2-CB 3.95Å; W452-C491 HydrophobicContact CE3-CB 3.81Å; W452-C491 HydrophobicContact CH2-CB 3.74Å; W452-C491 HydrophobicContact CZ2-CB 3.86Å; W452-C491 HydrophobicContact CZ3-CB 3.7Å; W452-A504 HydrophobicContact CH2-CB 4.15Å; W452-A504 HydrophobicContact CZ3-CB 3.95Å
453	L	94.8	Very high	90.4	Very high	65 Å²	65	76.3 Å²	76.3	34%	0.34	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	118.3	168.6	-170.7	70.4	0	0	0	108.9	V459 Y489 L490	L453-V459 HydrophobicContact CD1-CG2 3.98Å; L453-Y489 WeakPolarHBondContact O-CA 3.36Å; L453-L490 HydrophobicContact CB-CB 4.15Å; L453-L490 PolarHBondContact N-O 3.24Å; L453-L490 PolarHBondContact O-N 3.1Å
454	S	92.5	Very high	89.5	Confident	11 Å²	11	74.4 Å²	74.4	8%	0.077	36%	0.36	C	S	.	.			trans	-73.4	162.2	174.9	62.7	0	0	0	0	112.1	R456 R457 R458	S454-R456 PolarHBondContact O-N 3Å; S454-R457 WeakPolarHBondContact O-CA 3.35Å; S454-R457 PolarHBondContact O-N 3.28Å; S454-R458 PolarHBondContact N-O 3.02Å; S454-R458 WeakPolarHBondContact OG-CA 3.41Å; S454-R458 VanDerWaalsContact OG-CB 3.28Å; S454-R458 WeakPolarHBondContact OG-CB 3.42Å; S454-R458 PolarHBondContact OG-N 2.83Å; S454-R458 PolarHBondContact OG-O 3.19Å
455	P	89.9	Confident	88.6	Confident	49 Å²	49	81.3 Å²	81.3	32%	0.318	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-26.2	174.7	-25.2	32.7	0	0	0	113.3	R457 Y489	P455-R457 VanDerWaalsContact C-N 3.27Å; P455-R457 PolarHBondContact O-N 2.93Å; P455-Y489 HydrophobicContact CG-CD2 4.03Å; P455-Y489 HydrophobicContact CG-CE2 3.69Å
456	R	88.5	Confident	88.2	Confident	134 Å²	134	80.1 Å²	80.1	51%	0.506	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	15.2	177.2	-64.8	-179.2	167.4	-167.2	-16.3	113.7	S454 R458 Q484	S454-R456 PolarHBondContact O-N 3Å; R456-R458 PolarHBondContact O-N 3.17Å; R456-R458 VanDerWaalsContact O-N 3.16Å; R456-Q484 VanDerWaalsContact NH2-CB 3.34Å; R456-Q484 VanDerWaalsContact NH2-CD 3.3Å
457	R	89.1	Confident	88	Confident	216 Å²	216	82.8 Å²	82.8	82%	0.815	40%	0.396	S	S	*	.	S	Bend	trans	59.2	20.5	-178.5	-55.8	-174.6	175.7	-168.6	-1.2	115	S454 P455	S454-R457 WeakPolarHBondContact O-CA 3.35Å; S454-R457 PolarHBondContact O-N 3.28Å; P455-R457 VanDerWaalsContact C-N 3.27Å; P455-R457 PolarHBondContact O-N 2.93Å
458	R	90.2	Very high	88	Confident	167 Å²	167	75.1 Å²	75.1	63%	0.63	37%	0.369	S	S	*	.			trans	-82.2	130.2	170.5	-55.9	-177.9	175.3	-171.5	-2.3	109.5	S454 R456	S454-R458 PolarHBondContact N-O 3.02Å; S454-R458 WeakPolarHBondContact OG-CA 3.41Å; S454-R458 VanDerWaalsContact OG-CB 3.28Å; S454-R458 WeakPolarHBondContact OG-CB 3.42Å; S454-R458 PolarHBondContact OG-N 2.83Å; S454-R458 PolarHBondContact OG-O 3.19Å; R456-R458 PolarHBondContact O-N 3.17Å; R456-R458 VanDerWaalsContact O-N 3.16Å
459	V	91.4	Very high	87.9	Confident	88 Å²	88	76.6 Å²	76.6	53%	0.533	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	127.7	172	-177.5	0	0	0	0	108.9	W452 L453 T461	W452-V459 CarbonylContact O-C 3.6Å; W452-V459 WeakPolarHBondContact O-CA 3.38Å; L453-V459 HydrophobicContact CD1-CG2 3.98Å; V459-T461 HydrophobicContact CG1-CG2 4.15Å
460	L	91	Very high	87.9	Confident	10 Å²	10	73.3 Å²	73.3	5%	0.052	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	128.9	179.4	-54.6	170.7	0	0	0	108	S451 W452 L468 V470 L476	S451-L460 WeakPolarHBondContact CA-O 3.39Å; W452-L460 HydrophobicContact CB-CB 4.16Å; W452-L460 HydrophobicContact CB-CD1 4.47Å; W452-L460 PolarHBondContact N-O 3.31Å; W452-L460 PolarHBondContact O-N 2.84Å; L460-L468 HydrophobicContact CD1-CB 4.2Å; L460-L468 HydrophobicContact CD1-CD2 3.96Å; L460-L468 HydrophobicContact CD2-CB 4.34Å; L460-V470 HydrophobicContact CB-CG2 4.02Å; L460-L476 HydrophobicContact CD1-CD1 3.84Å; L460-L476 HydrophobicContact CD1-CD2 3.97Å
461	T	88.8	Confident	87.7	Confident	48 Å²	48	75.8 Å²	75.8	29%	0.294	36%	0.361	S	S	.	.			trans	-127.9	174.2	-179.1	66.3	0	0	0	0	109.7	V459 R463 N464	V459-T461 HydrophobicContact CG1-CG2 4.15Å; T461-R463 PolarHBondContact O-N 3.46Å; T461-R463 VanDerWaalsContact O-N 3.11Å; T461-R463 PolarHBondContact OG1-N 3.32Å; T461-N464 PolarHBondContact N-OD1 3.17Å; T461-N464 WeakPolarHBondContact O-CB 3.39Å; T461-N464 PolarHBondContact O-N 3.23Å; T461-N464 VanDerWaalsContact O-N 3.1Å; T461-N464 PolarHBondContact O-OD1 2.64Å; T461-N464 PolarHBondContact OG1-OD1 2.85Å
462	S	81.4	Confident	87.2	Confident	71 Å²	71	81.3 Å²	81.3	50%	0.497	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.3	174.5	56	0	0	0	0	114.1
463	R	75.5	Confident	86.9	Confident	204 Å²	204	85.6 Å²	85.6	77%	0.77	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-11	176.6	-59.6	-173	-174.1	-156.3	3.2	113.6	T461 H465	T461-R463 PolarHBondContact O-N 3.46Å; T461-R463 VanDerWaalsContact O-N 3.11Å; T461-R463 PolarHBondContact OG1-N 3.32Å; R463-H465 PolarHBondContact O-CD2 3.48Å; R463-H465 PolarHBondContact O-N 3.43Å
464	N	73.3	Confident	86.6	Confident	61 Å²	61	82.6 Å²	82.6	33%	0.326	40%	0.397	S	S	.	.			trans	-79.9	112.7	-179.6	-69.1	78.2	0	0	0	110.1	T461	T461-N464 PolarHBondContact N-OD1 3.17Å; T461-N464 WeakPolarHBondContact O-CB 3.39Å; T461-N464 PolarHBondContact O-N 3.23Å; T461-N464 VanDerWaalsContact O-N 3.1Å; T461-N464 PolarHBondContact O-OD1 2.64Å; T461-N464 PolarHBondContact OG1-OD1 2.85Å
465	H	71.1	Confident	86.6	Confident	163 Å²	163	82.6 Å²	82.6	76%	0.755	40%	0.397	S	S	*	.			trans	-103.7	119.3	173.5	-59.8	-71.7	0	0	0	109.5	R463	R463-H465 PolarHBondContact O-CD2 3.48Å; R463-H465 PolarHBondContact O-N 3.43Å
466	G	82.1	Confident	86.8	Confident	38 Å²	38	80.3 Å²	80.3	39%	0.392	38%	0.382	S	S	.	.	S	Bend	trans	170.7	-149.2	-177.5	0	0	0	0	0	113.4	M469	G466-M469 WeakPolarHBondContact O-CG 3.32Å
467	R	89.8	Confident	87.1	Confident	68 Å²	68	75.1 Å²	75.1	26%	0.257	36%	0.363	S	S	.	.	S	Bend	trans	-69.6	-33	175.3	-170.5	171.2	68.8	60.6	-0.8	112.7	I478 K479 S480 E482 D485	R467-I478 VanDerWaalsContact NH1-CG2 3.33Å; R467-I478 WeakPolarHBondContact O-CA 3.46Å; R467-K479 PolarHBondContact O-N 3.42Å; R467-S480 VanDerWaalsContact CD-O 3.24Å; R467-S480 WeakPolarHBondContact CD-O 3.42Å; R467-S480 PolarHBondContact NH1-O 3.16Å; R467-E482 IonicContact CZ-OE1 3.71Å; R467-E482 VanDerWaalsContact CZ-OE1 3.29Å; R467-E482 IonicContact NE-OE1 3.7Å; R467-E482 PolarHBondContact NE-OE1 3.18Å; R467-E482 IonicContact NH2-OE1 3.35Å; R467-E482 PolarHBondContact NH2-OE1 3.16Å; R467-E482 IonicContact NH2-OE2 3.37Å; R467-E482 PolarHBondContact NH2-OE2 3.48Å; R467-D485 IonicContact CZ-OD1 3.47Å; R467-D485 IonicContact CZ-OD2 3.84Å; R467-D485 IonicContact NH1-OD1 2.7Å; R467-D485 IonicContact NH1-OD2 3.75Å; R467-D485 PolarHBondContact NH1-OD2 3.4Å; R467-D485 VanDerWaalsContact NH2-CG 3.31Å; R467-D485 IonicContact NH2-OD1 2.86Å; R467-D485 PolarHBondContact NH2-OD1 3.33Å; R467-D485 IonicContact NH2-OD2 3.68Å; R467-D485 PolarHBondContact NH2-OD2 3.05Å
468	L	89.8	Confident	87.3	Confident	37 Å²	37	64.9 Å²	64.9	19%	0.194	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	120.9	174.5	-69.8	133.1	0	0	0	108.7	L460 L476 E477 I478 Y489	L460-L468 HydrophobicContact CD1-CB 4.2Å; L460-L468 HydrophobicContact CD1-CD2 3.96Å; L460-L468 HydrophobicContact CD2-CB 4.34Å; L468-L476 HydrophobicContact CB-CD1 4.36Å; L468-L476 HydrophobicContact CD2-CD1 4.24Å; L468-E477 CarbonylContact C-O 3.24Å; L468-E477 WeakPolarHBondContact CA-O 3.4Å; L468-I478 HydrophobicContact CD2-CD1 3.99Å; L468-I478 HydrophobicContact CD2-CG1 3.76Å; L468-I478 HydrophobicContact CD2-CG2 4.37Å; L468-Y489 HydrophobicContact CD2-CE1 4.43Å
469	M	90.2	Very high	87.4	Confident	46 Å²	46	62 Å²	62	23%	0.227	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	136.4	-176.6	-69.9	-176.9	55	0	0	111.2	G466 L476 E477 K479	G466-M469 WeakPolarHBondContact O-CG 3.32Å; M469-L476 WeakPolarHBondContact O-CA 3.39Å; M469-E477 PolarHBondContact N-O 2.97Å; M469-E477 PolarHBondContact O-N 3.4Å; M469-K479 VanDerWaalsContact SD-CE 3.56Å; M469-K479 PolarHBondContact SD-NZ 3.39Å
470	V	92.2	Very high	87.4	Confident	11 Å²	11	60.1 Å²	60.1	7%	0.067	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	120.1	174.6	-175.1	0	0	0	0	109.4	L460 T475 L476	L460-V470 HydrophobicContact CB-CG2 4.02Å; V470-T475 WeakPolarHBondContact CA-O 3.46Å; V470-L476 HydrophobicContact CG2-CD1 4.07Å
471	H	90.1	Very high	87.5	Confident	78 Å²	78	59.6 Å²	59.6	36%	0.361	31%	0.305	S	S	.	.			trans	-76	163.1	179	-74.5	-79.1	0	0	0	112.6	N473 G474 T475 E477	H471-N473 VanDerWaalsContact CB-OD1 3.25Å; H471-N473 WeakPolarHBondContact CB-OD1 3.48Å; H471-N473 PolarHBondContact O-N 2.89Å; H471-N473 VanDerWaalsContact O-N 3.12Å; H471-G474 WeakPolarHBondContact O-CA 3.37Å; H471-G474 PolarHBondContact O-N 3.05Å; H471-T475 PolarHBondContact N-O 3.4Å; H471-E477 IonicContact CD2-OE2 2.72Å; H471-E477 IonicContact CE1-OE2 3.49Å; H471-E477 PolarHBondContact CE1-OE2 3.37Å; H471-E477 IonicContact NE2-OE2 2.85Å; H471-E477 PolarHBondContact NE2-OE2 2.95Å
472	N	85.6	Confident	87.7	Confident	142 Å²	142	60.7 Å²	60.7	76%	0.759	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-18.6	177.9	-73	-10.1	0	0	0	114.4	R447 G474	R447-N472 PolarHBondContact NH2-O 3.46Å; R447-N472 VanDerWaalsContact NH2-O 3.16Å; N472-G474 VanDerWaalsContact C-N 3.29Å
473	N	87.2	Confident	88.1	Confident	90 Å²	90	61.3 Å²	61.3	48%	0.481	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	2	172.8	69.9	-3.2	0	0	0	112.8	H471 T475	H471-N473 VanDerWaalsContact CB-OD1 3.25Å; H471-N473 WeakPolarHBondContact CB-OD1 3.48Å; H471-N473 PolarHBondContact O-N 2.89Å; H471-N473 VanDerWaalsContact O-N 3.12Å; N473-T475 PolarHBondContact ND2-OG1 3.45Å; N473-T475 WeakPolarHBondContact OD1-CB 3.18Å; N473-T475 PolarHBondContact OD1-N 2.88Å; N473-T475 PolarHBondContact OD1-OG1 3.27Å
474	G	89.5	Confident	88.7	Confident	3 Å²	3	56.8 Å²	56.8	3%	0.031	29%	0.291	C	S	.	.	S	Bend	trans	85.8	-0.6	-178.4	0	0	0	0	0	115.4	C440 W452 H471 N472	C440-G474 CarbonylContact O-C 3.27Å; C440-G474 WeakPolarHBondContact O-CA 3.44Å; W452-G474 PolarHBondContact NE1-O 3.48Å; H471-G474 WeakPolarHBondContact O-CA 3.37Å; H471-G474 PolarHBondContact O-N 3.05Å; N472-G474 VanDerWaalsContact C-N 3.29Å
475	T	92.1	Very high	89.6	Confident	11 Å²	11	54.3 Å²	54.3	7%	0.067	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-72.8	129.4	179	-57.3	0	0	0	0	111	M437 L438 R439 V470 H471 N473	M437-T475 HydrophobicContact CB-CG2 4.2Å; L438-T475 CarbonylContact O-C 3.54Å; L438-T475 WeakPolarHBondContact O-CA 3.05Å; L438-T475 WeakPolarHBondContact O-CG2 3.3Å; R439-T475 HydrophobicContact CG-CG2 4.16Å; V470-T475 WeakPolarHBondContact CA-O 3.46Å; H471-T475 PolarHBondContact N-O 3.4Å; N473-T475 PolarHBondContact ND2-OG1 3.45Å; N473-T475 WeakPolarHBondContact OD1-CB 3.18Å; N473-T475 PolarHBondContact OD1-N 2.88Å; N473-T475 PolarHBondContact OD1-OG1 3.27Å
476	L	93.9	Very high	90.7	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	120.4	170.3	171.5	63	0	0	0	109.8	M437 L438 W452 L460 L468 M469 V470 I478 Y489	M437-L476 CarbonylContact C-O 3.57Å; M437-L476 WeakPolarHBondContact CA-O 3.48Å; L438-L476 HydrophobicContact CB-CB 4.27Å; L438-L476 HydrophobicContact CD1-CD2 3.85Å; L438-L476 HydrophobicContact CD1-CG 4.36Å; L438-L476 PolarHBondContact N-O 2.85Å; L438-L476 PolarHBondContact O-N 2.88Å; W452-L476 HydrophobicContact CB-CD2 4.07Å; W452-L476 HydrophobicContact CD2-CB 3.88Å; W452-L476 HydrophobicContact CD2-CD2 4.04Å; W452-L476 HydrophobicContact CE3-CD2 4.3Å; W452-L476 HydrophobicContact CG-CB 3.89Å; W452-L476 HydrophobicContact CG-CD2 3.98Å; W452-L476 HydrophobicContact CG-CG 4.47Å; W452-L476 HydrophobicContact CZ2-CB 4.19Å; L460-L476 HydrophobicContact CD1-CD1 3.84Å; L460-L476 HydrophobicContact CD1-CD2 3.97Å; L468-L476 HydrophobicContact CB-CD1 4.36Å; L468-L476 HydrophobicContact CD2-CD1 4.24Å; M469-L476 WeakPolarHBondContact O-CA 3.39Å; V470-L476 HydrophobicContact CG2-CD1 4.07Å; L476-I478 HydrophobicContact CG-CG1 4.49Å; L476-Y489 HydrophobicContact CD2-CD1 3.59Å; L476-Y489 HydrophobicContact CD2-CE1 3.82Å; L476-Y489 HydrophobicContact CD2-CG 4.48Å
477	E	93.9	Very high	91.3	Very high	26 Å²	26	47.9 Å²	47.9	12%	0.121	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	131.8	173.9	-175.4	-168.9	171.6	0	0	110.3	Q435 M437 L468 M469 H471	Q435-E477 HydrophobicContact CG-CG 4.38Å; Q435-E477 PolarHBondContact NE2-OE1 2.95Å; M437-E477 HydrophobicContact CG-CG 4.42Å; L468-E477 CarbonylContact C-O 3.24Å; L468-E477 WeakPolarHBondContact CA-O 3.4Å; M469-E477 PolarHBondContact N-O 2.97Å; M469-E477 PolarHBondContact O-N 3.4Å; H471-E477 IonicContact CD2-OE2 2.72Å; H471-E477 IonicContact CE1-OE2 3.49Å; H471-E477 PolarHBondContact CE1-OE2 3.37Å; H471-E477 IonicContact NE2-OE2 2.85Å; H471-E477 PolarHBondContact NE2-OE2 2.95Å
478	I	94.2	Very high	91.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	107.3	172.1	-46.8	-175.3	0	0	0	106.6	Q435 A436 L438 R467 L468 L476 S480 L506	Q435-I478 CarbonylContact C-O 3.54Å; Q435-I478 VanDerWaalsContact CA-O 3.25Å; Q435-I478 WeakPolarHBondContact CA-O 3.44Å; Q435-I478 WeakPolarHBondContact CG-O 3.47Å; A436-I478 HydrophobicContact CB-CB 4.22Å; A436-I478 HydrophobicContact CB-CD1 4.43Å; A436-I478 HydrophobicContact CB-CG1 4.49Å; A436-I478 PolarHBondContact N-O 3.49Å; A436-I478 PolarHBondContact O-N 2.55Å; L438-I478 HydrophobicContact CD1-CD1 4.35Å; R467-I478 VanDerWaalsContact NH1-CG2 3.33Å; R467-I478 WeakPolarHBondContact O-CA 3.46Å; L468-I478 HydrophobicContact CD2-CD1 3.99Å; L468-I478 HydrophobicContact CD2-CG1 3.76Å; L468-I478 HydrophobicContact CD2-CG2 4.37Å; L476-I478 HydrophobicContact CG-CG1 4.49Å; I478-S480 PolarHBondContact O-N 3Å; I478-L506 HydrophobicContact CD1-CD2 3.49Å; I478-L506 VanDerWaalsContact CD1-CD2 3.49Å
479	K	91.8	Very high	91.7	Very high	107 Å²	107	47 Å²	47	47%	0.465	25%	0.252	S	S	.	.	S	Bend	trans	-66.5	-39.3	-172.8	-70.1	-178.9	178.2	173.7	0	113.8	R467 M469	R467-K479 PolarHBondContact O-N 3.42Å; M469-K479 VanDerWaalsContact SD-CE 3.56Å; M469-K479 PolarHBondContact SD-NZ 3.39Å
480	S	92.2	Very high	91.9	Very high	48 Å²	48	47.2 Å²	47.2	34%	0.336	25%	0.254	S	S	.	.	S	Bend	trans	-139.5	110.2	178.4	175.2	0	0	0	0	107.6	R467 I478	R467-S480 VanDerWaalsContact CD-O 3.24Å; R467-S480 WeakPolarHBondContact CD-O 3.42Å; R467-S480 PolarHBondContact NH1-O 3.16Å; I478-S480 PolarHBondContact O-N 3Å
481	A	92.8	Very high	92.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.251	C	S	.	.			trans	-76.2	128.3	-178.2	0	0	0	0	0	111.3	V430 G433 Q434 V508	V430-A481 HydrophobicContact CG1-CB 3.52Å; G433-A481 PolarHBondContact N-O 2.8Å; Q434-A481 WeakPolarHBondContact O-CB 3.37Å; Q434-A481 PolarHBondContact O-N 3.48Å; A481-V508 HydrophobicContact CB-CG1 4.22Å; A481-V508 HydrophobicContact CB-CG2 4.03Å
482	E	92.4	Very high	92.3	Very high	70 Å²	70	45.7 Å²	45.7	33%	0.327	25%	0.248	S	C	.	.			trans	-105	153.5	173.4	-66.9	165.7	-152.7	0	0	109.7	R467 Q484 D485 V508	R467-E482 IonicContact CZ-OE1 3.71Å; R467-E482 VanDerWaalsContact CZ-OE1 3.29Å; R467-E482 IonicContact NE-OE1 3.7Å; R467-E482 PolarHBondContact NE-OE1 3.18Å; R467-E482 IonicContact NH2-OE1 3.35Å; R467-E482 PolarHBondContact NH2-OE1 3.16Å; R467-E482 IonicContact NH2-OE2 3.37Å; R467-E482 PolarHBondContact NH2-OE2 3.48Å; E482-Q484 HydrophobicContact CB-CB 4.44Å; E482-Q484 PolarHBondContact O-N 2.7Å; E482-D485 PolarHBondContact N-OD2 3.3Å; E482-D485 WeakPolarHBondContact O-CB 3.46Å; E482-D485 PolarHBondContact O-N 3.35Å; E482-V508 WeakPolarHBondContact O-CG2 3.33Å
483	I	89.7	Confident	92.7	Very high	84 Å²	84	39 Å²	39	43%	0.431	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-51	-36.7	175.6	-63.2	167.9	0	0	0	111.2	D485 S486	I483-D485 PolarHBondContact O-N 2.98Å; I483-S486 VanDerWaalsContact O-CB 3.32Å; I483-S486 WeakPolarHBondContact O-CB 3.43Å; I483-S486 PolarHBondContact O-N 2.97Å; I483-S486 VanDerWaalsContact O-N 3.16Å; I483-S486 PolarHBondContact O-OG 3.15Å; I483-S486 VanDerWaalsContact O-OG 3.11Å
484	Q	89.8	Confident	93.1	Very high	110 Å²	110	36.7 Å²	36.7	51%	0.514	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-64.2	-18.6	178.9	-69.5	-169.9	28.9	0	0	115.2	R456 E482 S486	R456-Q484 VanDerWaalsContact NH2-CB 3.34Å; R456-Q484 VanDerWaalsContact NH2-CD 3.3Å; E482-Q484 HydrophobicContact CB-CB 4.44Å; E482-Q484 PolarHBondContact O-N 2.7Å; Q484-S486 VanDerWaalsContact C-N 3.32Å
485	D	91.5	Very high	93.3	Very high	9 Å²	9	37.6 Å²	37.6	5%	0.048	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-83.7	-11.6	177.6	-61.2	-38.4	0	0	0	112.6	R467 E482 I483 Y489 L506	R467-D485 IonicContact CZ-OD1 3.47Å; R467-D485 IonicContact CZ-OD2 3.84Å; R467-D485 IonicContact NH1-OD1 2.7Å; R467-D485 IonicContact NH1-OD2 3.75Å; R467-D485 PolarHBondContact NH1-OD2 3.4Å; R467-D485 VanDerWaalsContact NH2-CG 3.31Å; R467-D485 IonicContact NH2-OD1 2.86Å; R467-D485 PolarHBondContact NH2-OD1 3.33Å; R467-D485 IonicContact NH2-OD2 3.68Å; R467-D485 PolarHBondContact NH2-OD2 3.05Å; E482-D485 PolarHBondContact N-OD2 3.3Å; E482-D485 WeakPolarHBondContact O-CB 3.46Å; E482-D485 PolarHBondContact O-N 3.35Å; I483-D485 PolarHBondContact O-N 2.98Å; D485-Y489 VanDerWaalsContact O-CE2 3.26Å; D485-Y489 WeakPolarHBondContact O-CE2 3.14Å; D485-Y489 PolarHBondContact O-OH 3.04Å; D485-L506 HydrophobicContact CB-CD2 4.22Å
486	S	94	Very high	93.3	Very high	43 Å²	43	40.5 Å²	40.5	30%	0.301	23%	0.225	S	C	.	.			trans	-60.5	137.8	178	-63	0	0	0	0	111.1	I483 Q484 L506 V508	I483-S486 VanDerWaalsContact O-CB 3.32Å; I483-S486 WeakPolarHBondContact O-CB 3.43Å; I483-S486 PolarHBondContact O-N 2.97Å; I483-S486 VanDerWaalsContact O-N 3.16Å; I483-S486 PolarHBondContact O-OG 3.15Å; I483-S486 VanDerWaalsContact O-OG 3.11Å; Q484-S486 VanDerWaalsContact C-N 3.32Å; S486-L506 CarbonylContact C-O 3.6Å; S486-L506 WeakPolarHBondContact CA-O 2.98Å; S486-V508 WeakPolarHBondContact OG-CB 3.38Å; S486-V508 WeakPolarHBondContact OG-CG2 3.21Å; S486-V508 PolarHBondContact OG-N 2.82Å
487	G	93.8	Very high	93.2	Very high	23 Å²	23	42 Å²	42	24%	0.237	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	143.9	-168.8	177.6	0	0	0	0	0	112.7	L506	G487-L506 PolarHBondContact N-O 2.95Å; G487-L506 PolarHBondContact O-N 3.32Å
488	V	94.6	Very high	93.2	Very high	83 Å²	83	41.9 Å²	41.9	50%	0.503	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	121.8	-178.8	-175.4	0	0	0	0	110	M503	V488-M503 HydrophobicContact CG1-CB 4.21Å; V488-M503 HydrophobicContact CG1-CG 4.41Å
489	Y	95.1	Very high	93.2	Very high	3 Å²	3	46.9 Å²	46.9	1%	0.012	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	141.7	169.4	-70.1	-102.3	0	0	0	109.4	L438 L453 P455 L468 L476 D485 M503 A504 L506	L438-Y489 HydrophobicContact CD1-CD1 4.2Å; L438-Y489 HydrophobicContact CD1-CD2 3.95Å; L438-Y489 HydrophobicContact CD1-CE2 4.41Å; L438-Y489 HydrophobicContact CD1-CG 3.86Å; L453-Y489 WeakPolarHBondContact O-CA 3.36Å; P455-Y489 HydrophobicContact CG-CD2 4.03Å; P455-Y489 HydrophobicContact CG-CE2 3.69Å; L468-Y489 HydrophobicContact CD2-CE1 4.43Å; L476-Y489 HydrophobicContact CD2-CD1 3.59Å; L476-Y489 HydrophobicContact CD2-CE1 3.82Å; L476-Y489 HydrophobicContact CD2-CG 4.48Å; D485-Y489 VanDerWaalsContact O-CE2 3.26Å; D485-Y489 WeakPolarHBondContact O-CE2 3.14Å; D485-Y489 PolarHBondContact O-OH 3.04Å; Y489-M503 WeakPolarHBondContact O-CA 3.43Å; Y489-A504 PolarHBondContact N-O 3.11Å; Y489-A504 PolarHBondContact O-N 3.15Å; Y489-L506 HydrophobicContact CD2-CB 4.18Å; Y489-L506 HydrophobicContact CE2-CB 3.93Å; Y489-L506 HydrophobicContact CE2-CD2 3.95Å
490	L	94.4	Very high	93.4	Very high	51 Å²	51	44.2 Å²	44.2	27%	0.267	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	115.8	174.3	-177.6	72.5	0	0	0	109	W452 L453 M503	W452-L490 CarbonylContact C-O 3.43Å; W452-L490 WeakPolarHBondContact CA-O 3.28Å; L453-L490 HydrophobicContact CB-CB 4.15Å; L453-L490 PolarHBondContact N-O 3.24Å; L453-L490 PolarHBondContact O-N 3.1Å; L490-M503 HydrophobicContact CD1-CE 4.46Å; L490-M503 HydrophobicContact CD1-CG 3.81Å
491	C	94.9	Very high	93.5	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	133.8	166	-176.8	0	0	0	0	109.6	C440 V450 W452 T501 L502	C440-C491 HydrophobicContact CB-CB 3.68Å; C440-C491 WeakPolarHBondContact CB-SG 3.06Å; C440-C491 WeakPolarHBondContact SG-CB 3.33Å; C440-C491 CovalentContact SG-SG 2.01Å; C440-C491 PolarHBondContact SG-SG 2.98Å; V450-C491 VanDerWaalsContact CG1-SG 3.51Å; W452-C491 HydrophobicContact CD2-CB 3.95Å; W452-C491 HydrophobicContact CE3-CB 3.81Å; W452-C491 HydrophobicContact CH2-CB 3.74Å; W452-C491 HydrophobicContact CZ2-CB 3.86Å; W452-C491 HydrophobicContact CZ3-CB 3.7Å; C491-T501 WeakPolarHBondContact O-CA 3.43Å; C491-L502 HydrophobicContact CB-CB 4.27Å; C491-L502 PolarHBondContact N-O 3.06Å; C491-L502 PolarHBondContact O-N 3.32Å
492	L	94.9	Very high	93.5	Very high	57 Å²	57	46.2 Å²	46.2	30%	0.298	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	111.7	172	174.8	67.7	0	0	0	108.6	S451 N499 T501	S451-L492 PolarHBondContact N-O 2.79Å; S451-L492 PolarHBondContact O-N 3.01Å; S451-L492 PolarHBondContact OG-O 2.85Å; L492-N499 HydrophobicContact CD1-CB 3.85Å; L492-T501 HydrophobicContact CD1-CG2 3.61Å
493	A	95.1	Very high	93.6	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	127.6	168.7	0	0	0	0	0	109.2	P418 I420 A442 P448 S449 V450 N499 D500	P418-A493 HydrophobicContact CB-CB 4.06Å; I420-A493 HydrophobicContact CD1-CB 4.16Å; I420-A493 HydrophobicContact CG1-CB 3.89Å; A442-A493 HydrophobicContact CB-CB 3.43Å; A442-A493 VanDerWaalsContact CB-CB 3.43Å; P448-A493 HydrophobicContact CB-CB 4.38Å; S449-A493 CarbonylContact O-C 3.49Å; S449-A493 WeakPolarHBondContact O-CA 3.07Å; V450-A493 HydrophobicContact CG2-CB 4.33Å; A493-N499 CarbonylContact O-C 3.35Å; A493-N499 WeakPolarHBondContact O-CA 3.46Å; A493-D500 PolarHBondContact N-O 3.33Å; A493-D500 PolarHBondContact O-N 3.17Å
494	S	94.7	Very high	93.8	Very high	42 Å²	42	44.4 Å²	44.4	29%	0.294	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	136.3	-172.1	-171.4	0	0	0	0	112.5	P448 S449	P448-S494 WeakPolarHBondContact CA-O 3.3Å; S449-S494 PolarHBondContact N-O 2.9Å; S449-S494 PolarHBondContact O-N 3Å; S449-S494 PolarHBondContact OG-O 2.91Å
495	N	94	Very high	94	Very high	23 Å²	23	41.3 Å²	41.3	12%	0.123	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	-175	167	76.3	7.6	0	0	0	110.3	T416 P418 T445 P446 A497 G498	T416-N495 PolarHBondContact O-ND2 3.24Å; P418-N495 VanDerWaalsContact CD-OD1 3.27Å; P418-N495 WeakPolarHBondContact CD-OD1 3.49Å; P418-N495 HydrophobicContact CG-CB 4.08Å; T445-N495 PolarHBondContact O-ND2 3.08Å; P446-N495 WeakPolarHBondContact O-CB 3.36Å; P446-N495 PolarHBondContact O-ND2 3.09Å; N495-A497 PolarHBondContact O-N 3.03Å; N495-A497 WeakPolarHBondContact OD1-CA 3.23Å; N495-A497 WeakPolarHBondContact OD1-CB 3.42Å; N495-A497 PolarHBondContact OD1-N 3.28Å; N495-G498 PolarHBondContact N-O 3.07Å; N495-G498 PolarHBondContact O-N 3.29Å; N495-G498 PolarHBondContact OD1-N 3.24Å; N495-G498 PolarHBondContact OD1-O 3.36Å
496	T	90.9	Very high	94.1	Very high	72 Å²	72	41 Å²	41	44%	0.442	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-20.5	-178.3	53.1	0	0	0	0	114.6	R370 P446	R370-T496 HydrophobicContact CG-CG2 3.89Å; P446-T496 WeakPolarHBondContact CD-OG1 3.21Å
497	A	92.3	Very high	94.1	Very high	31 Å²	31	40.9 Å²	40.9	26%	0.256	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-21.3	176.2	0	0	0	0	0	113.1	C415 K417 N495	C415-A497 HydrophobicContact CB-CB 3.8Å; K417-A497 WeakPolarHBondContact CE-O 3.27Å; K417-A497 HydrophobicContact CG-CB 3.93Å; K417-A497 VanDerWaalsContact CG-O 3.26Å; K417-A497 WeakPolarHBondContact CG-O 3.35Å; N495-A497 PolarHBondContact O-N 3.03Å; N495-A497 WeakPolarHBondContact OD1-CA 3.23Å; N495-A497 WeakPolarHBondContact OD1-CB 3.42Å; N495-A497 PolarHBondContact OD1-N 3.28Å
498	G	93.4	Very high	94.1	Very high	23 Å²	23	40.6 Å²	40.6	24%	0.237	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.9	-159.1	177.7	0	0	0	0	0	112.8	P418 N495	P418-G498 WeakPolarHBondContact CD-O 3.5Å; P418-G498 VanDerWaalsContact CG-O 3.3Å; P418-G498 WeakPolarHBondContact CG-O 3.44Å; N495-G498 PolarHBondContact N-O 3.07Å; N495-G498 PolarHBondContact O-N 3.29Å; N495-G498 PolarHBondContact OD1-N 3.24Å; N495-G498 PolarHBondContact OD1-O 3.36Å
499	N	95.3	Very high	93.9	Very high	105 Å²	105	42.3 Å²	42.3	56%	0.561	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-132.5	159.9	-177.6	56.6	-0.7	0	0	0	111.8	L492 A493	L492-N499 HydrophobicContact CD1-CB 3.85Å; A493-N499 CarbonylContact O-C 3.35Å; A493-N499 WeakPolarHBondContact O-CA 3.46Å
500	D	94.8	Very high	93.3	Very high	51 Å²	51	44.2 Å²	44.2	27%	0.273	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	153.1	169.3	-168.9	16.5	0	0	0	109	P418 K419 I420 A493	P418-D500 HydrophobicContact CB-CB 4.29Å; P418-D500 WeakPolarHBondContact O-CB 3.46Å; K419-D500 WeakPolarHBondContact CA-OD2 3.37Å; I420-D500 HydrophobicContact CD1-CB 4.23Å; I420-D500 HydrophobicContact CG1-CB 4.17Å; I420-D500 PolarHBondContact N-OD2 3.29Å; A493-D500 PolarHBondContact N-O 3.33Å; A493-D500 PolarHBondContact O-N 3.17Å
501	T	94.4	Very high	91.9	Very high	74 Å²	74	47.8 Å²	47.8	45%	0.454	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	143	-171.8	55.6	0	0	0	0	112.7	C491 L492	C491-T501 WeakPolarHBondContact O-CA 3.43Å; L492-T501 HydrophobicContact CD1-CG2 3.61Å
502	L	93.6	Very high	90.1	Very high	17 Å²	17	50.2 Å²	50.2	9%	0.089	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	132.6	177.4	179.4	75.1	0	0	0	110.2	I420 E422 C491	I420-L502 HydrophobicContact CD1-CB 3.77Å; I420-L502 HydrophobicContact CG2-CB 4.18Å; I420-L502 HydrophobicContact CG2-CD2 4.05Å; E422-L502 HydrophobicContact CB-CD2 3.82Å; C491-L502 HydrophobicContact CB-CB 4.27Å; C491-L502 PolarHBondContact N-O 3.06Å; C491-L502 PolarHBondContact O-N 3.32Å
503	M	93.7	Very high	88.1	Confident	116 Å²	116	51.2 Å²	51.2	57%	0.571	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	135.8	172	-65.5	-177.1	-174.1	0	0	111.1	Q426 V488 Y489 L490	Q426-M503 PolarHBondContact N-O 3.33Å; V488-M503 HydrophobicContact CG1-CB 4.21Å; V488-M503 HydrophobicContact CG1-CG 4.41Å; Y489-M503 WeakPolarHBondContact O-CA 3.43Å; L490-M503 HydrophobicContact CD1-CE 4.46Å; L490-M503 HydrophobicContact CD1-CG 3.81Å
504	A	94.3	Very high	86	Confident	0 Å²	0	58 Å²	58	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	124.4	174.3	0	0	0	0	0	110.2	Q426 L438 W452 Y489	Q426-A504 HydrophobicContact CB-CB 3.91Å; Q426-A504 CarbonylContact O-C 3.49Å; Q426-A504 WeakPolarHBondContact O-CA 3.49Å; L438-A504 HydrophobicContact CD2-CB 3.72Å; W452-A504 HydrophobicContact CH2-CB 4.15Å; W452-A504 HydrophobicContact CZ3-CB 3.95Å; Y489-A504 PolarHBondContact N-O 3.11Å; Y489-A504 PolarHBondContact O-N 3.15Å
505	S	94	Very high	83.7	Confident	44 Å²	44	65.5 Å²	65.5	31%	0.308	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	128.1	178.7	-172.2	0	0	0	0	110.5	Q426 T427 I428	Q426-S505 PolarHBondContact O-N 2.95Å; T427-S505 WeakPolarHBondContact CA-O 3.49Å; I428-S505 PolarHBondContact N-O 3.19Å
506	L	95	Very high	81.4	Confident	2 Å²	2	67.7 Å²	67.7	1%	0.01	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.9	173.9	-178.5	69.3	0	0	0	109.6	I428 V430 A436 I478 D485 S486 G487 Y489 V508	I428-L506 HydrophobicContact CB-CD1 4.13Å; I428-L506 HydrophobicContact CG2-CD1 4.14Å; I428-L506 WeakPolarHBondContact O-CA 3.48Å; V430-L506 HydrophobicContact CG1-CD1 4Å; A436-L506 HydrophobicContact CB-CD1 3.93Å; I478-L506 HydrophobicContact CD1-CD2 3.49Å; I478-L506 VanDerWaalsContact CD1-CD2 3.49Å; D485-L506 HydrophobicContact CB-CD2 4.22Å; S486-L506 CarbonylContact C-O 3.6Å; S486-L506 WeakPolarHBondContact CA-O 2.98Å; G487-L506 PolarHBondContact N-O 2.95Å; G487-L506 PolarHBondContact O-N 3.32Å; Y489-L506 HydrophobicContact CD2-CB 4.18Å; Y489-L506 HydrophobicContact CE2-CB 3.93Å; Y489-L506 HydrophobicContact CE2-CD2 3.95Å; L506-V508 HydrophobicContact CD2-CG2 4.24Å; L506-V508 HydrophobicContact CG-CG2 4.22Å
507	A	93.8	Very high	78.9	Confident	41 Å²	41	72 Å²	72	34%	0.339	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	117.2	172.6	0	0	0	0	0	110.1	I428 T429 V430	I428-A507 PolarHBondContact O-N 2.97Å; T429-A507 VanDerWaalsContact CA-O 3.29Å; T429-A507 WeakPolarHBondContact CA-O 3.41Å; T429-A507 HydrophobicContact CG2-CB 4.14Å; V430-A507 PolarHBondContact N-O 3.4Å
508	V	93.6	Very high	76.4	Confident	17 Å²	17	81.2 Å²	81.2	10%	0.103	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	120.5	177.5	-173.3	0	0	0	0	109.6	V430 E432 A481 E482 S486 L506	V430-V508 HydrophobicContact CG1-CB 4.5Å; V430-V508 HydrophobicContact CG1-CG1 4.45Å; V430-V508 HydrophobicContact CG1-CG2 3.94Å; V430-V508 CarbonylContact O-C 3.5Å; V430-V508 VanDerWaalsContact O-CA 3.24Å; V430-V508 WeakPolarHBondContact O-CA 3.44Å; E432-V508 HydrophobicContact CB-CG1 4.15Å; A481-V508 HydrophobicContact CB-CG1 4.22Å; A481-V508 HydrophobicContact CB-CG2 4.03Å; E482-V508 WeakPolarHBondContact O-CG2 3.33Å; S486-V508 WeakPolarHBondContact OG-CB 3.38Å; S486-V508 WeakPolarHBondContact OG-CG2 3.21Å; S486-V508 PolarHBondContact OG-N 2.82Å; L506-V508 HydrophobicContact CD2-CG2 4.24Å; L506-V508 HydrophobicContact CG-CG2 4.22Å
509	K	89.9	Confident	73.9	Confident	120 Å²	120	86 Å²	86	52%	0.522	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	126	176.8	-72.6	176.3	174.4	168.1	0	109.9	T429 V430 D431 E432	T429-K509 HydrophobicContact CG2-CD 3.91Å; T429-K509 VanDerWaalsContact CG2-CE 3.46Å; T429-K509 HydrophobicContact CG2-CG 3.97Å; V430-K509 PolarHBondContact O-N 3.18Å; D431-K509 WeakPolarHBondContact OD1-CB 3.49Å; E432-K509 PolarHBondContact N-O 2.93Å
510	S	81.6	Confident	71.4	Confident	43 Å²	43	89.9 Å²	89.9	30%	0.301	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-85.9	135.2	168.4	-174.4	0	0	0	0	109.9	E432 G512 S513	E432-S510 PolarHBondContact OE2-OG 3.1Å; S510-G512 PolarHBondContact O-N 3.28Å; S510-G512 VanDerWaalsContact O-N 3.11Å; S510-G512 PolarHBondContact OG-N 3.26Å; S510-S513 PolarHBondContact O-N 3.36Å; S510-S513 PolarHBondContact O-OG 3.33Å
511	L	65.4	Low	68.8	Low	126 Å²	126	96.4 Å²	96.4	66%	0.66	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-60.6	-16.6	172.8	-115.5	80.9	0	0	0	112.7	S513	L511-S513 VanDerWaalsContact C-N 3.3Å; L511-S513 PolarHBondContact O-N 2.82Å
512	G	58.4	Low	65.8	Low	50 Å²	50	102.4 Å²	102.4	52%	0.515	53%	0.527	S	S	.	.	G	3₁₀ helix	trans	-70.3	-15.7	179.2	0	0	0	0	0	115.4	S510	S510-G512 PolarHBondContact O-N 3.28Å; S510-G512 VanDerWaalsContact O-N 3.11Å; S510-G512 PolarHBondContact OG-N 3.26Å
513	S	51.8	Low	62.9	Low	78 Å²	78	107.8 Å²	107.8	55%	0.545	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-81.5	-14.5	-177.9	72.8	0	0	0	0	114.3	S510 L511 Y515	S510-S513 PolarHBondContact O-N 3.36Å; S510-S513 PolarHBondContact O-OG 3.33Å; L511-S513 VanDerWaalsContact C-N 3.3Å; L511-S513 PolarHBondContact O-N 2.82Å; S513-Y515 VanDerWaalsContact C-N 3.3Å; S513-Y515 PolarHBondContact O-N 3.06Å
514	L	50.4	Low	59.9	Low	144 Å²	144	108.2 Å²	108.2	75%	0.754	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-77.4	-14.2	176.4	-74	166.2	0	0	0	113.3
515	Y	46.9	Very low	57.3	Low	198 Å²	198	112.7 Å²	112.7	78%	0.776	60%	0.595	S	S	*	*	S	Bend	trans	-104.2	-9.4	179.3	-75.4	-84.3	0	0	0	114.5	S513 N517	S513-Y515 VanDerWaalsContact C-N 3.3Å; S513-Y515 PolarHBondContact O-N 3.06Å; Y515-N517 PolarHBondContact O-N 3.09Å
516	A	44.8	Very low	54.4	Low	70 Å²	70	117.8 Å²	117.8	58%	0.579	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-15.4	-178.3	0	0	0	0	0	114.3
517	N	39.4	Very low	51.3	Low	161 Å²	161	125.7 Å²	125.7	86%	0.861	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	14.8	-178.4	-80.1	-5.4	0	0	0	114.6	Y515	Y515-N517 PolarHBondContact O-N 3.09Å
518	R	40.8	Very low	48.3	Very low	226 Å²	226	128 Å²	128	85%	0.853	68%	0.68	S	S	*	*	S	Bend	trans	-114.2	10.8	-177	-143.3	-178.8	-163.3	171	6.1	116.6
519	T	40.9	Very low	45.4	Very low	123 Å²	123	133.6 Å²	133.6	76%	0.755	71%	0.714	S	S	*	*	S	Bend	trans	-139.7	58.1	177.2	57.4	0	0	0	0	112.8
520	Q	41.3	Very low	42.5	Very low	186 Å²	186	132.8 Å²	132.8	87%	0.869	73%	0.729	S	S	*	*			trans	-146.5	68.8	155.2	-74.3	-161.6	-6.2	0	0	109.8
521	H	40.2	Very low	40.3	Very low	189 Å²	189	138.4 Å²	138.4	88%	0.875	76%	0.756	S	S	*	*			trans	-162.8	86.5	154.9	-98.1	-52	0	0	0	109.1
522	Y	30.8	Very low	38.7	Very low	200 Å²	200	141.6 Å²	141.6	78%	0.784	77%	0.768	S	S	*	*			trans	-151.6	96.1	150.4	-162.7	-94.1	0	0	0	107.4	D524	Y522-D524 HydrophobicContact CD1-CB 4.47Å; Y522-D524 HydrophobicContact CE1-CB 4.02Å
523	T	33.2	Very low	37.9	Very low	130 Å²	130	146.1 Å²	146.1	80%	0.798	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-90.4	119.2	165.6	44.6	0	0	0	0	107.4
524	D	31.7	Very low	36.8	Very low	124 Å²	124	146.7 Å²	146.7	66%	0.663	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-99.3	126.2	165.7	-142.2	-18.9	0	0	0	108.2	Y522	Y522-D524 HydrophobicContact CD1-CB 4.47Å; Y522-D524 HydrophobicContact CE1-CB 4.02Å
525	P	39	Very low	36.1	Very low	95 Å²	95	147.5 Å²	147.5	62%	0.617	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-93.2	123.1	179.1	33.5	-24.9	0	0	0	109.5
526	N	32.8	Very low	35.4	Very low	151 Å²	151	146.2 Å²	146.2	81%	0.807	81%	0.805	S	S	*	*			trans	160	101.9	141.6	-79.9	-23.8	0	0	0	110.5
527	N	30.1	Very low	34.8	Very low	168 Å²	168	147.8 Å²	147.8	90%	0.898	81%	0.812	S	S	*	*				-179.1	113.7	124.8	-92.1	-13.8	0	0	0	110.2
528	A	31.3	Very low	34.9	Very low	89 Å²	89	148 Å²	148	74%	0.736	81%	0.812	S	S	*	*			trans	-68.8	155.4	159.2	0	0	0	0	0	108.1
529	T	33.2	Very low	34.6	Very low	135 Å²	135	140.6 Å²	140.6	83%	0.828	81%	0.806	S	S	*	*			cis	-166.7	143.4	29.6	37.3	0	0	0	0	107.3
530	A	29.3	Very low	34.8	Very low	102 Å²	102	141.6 Å²	141.6	84%	0.843	81%	0.806	S	S	*	*			trans	-175	125.1	140.3	0	0	0	0	0	109.9
531	N	35.4	Very low	35.1	Very low	161 Å²	161	137.5 Å²	137.5	86%	0.861	79%	0.79	S	S	*	*			trans	-66	131.8	167	-78.4	-25.3	0	0	0	109.8
532	E	30.7	Very low	35.6	Very low	193 Å²	193	134.5 Å²	134.5	90%	0.902	78%	0.78	S	S	*	*			trans	-164.7	124.3	143.9	-111.1	168.5	-156.6	0	0	110.3
533	T	41.7	Very low	36.4	Very low	145 Å²	145	132.8 Å²	132.8	89%	0.89	78%	0.776	S	S	*	*			trans	-69.3	119.5	167	40.4	0	0	0	0	109.8
534	A	29.8	Very low	37.1	Very low	90 Å²	90	131.3 Å²	131.3	74%	0.744	77%	0.767	S	S	*	*			trans	-157.8	128.7	159.7	0	0	0	0	0	112.4
535	N	34.4	Very low	38	Very low	162 Å²	162	130.1 Å²	130.1	87%	0.866	76%	0.76	S	S	*	*			trans	-50.6	136.2	169	-69.7	-34.4	0	0	0	111.9
536	I	33.6	Very low	38.4	Very low	170 Å²	170	131.4 Å²	131.4	87%	0.872	76%	0.761	S	S	*	*			trans	-99.3	100.6	167.1	-60.5	176	0	0	0	108.5
537	S	30.8	Very low	39.3	Very low	103 Å²	103	128.7 Å²	128.7	72%	0.72	75%	0.75	S	S	*	*			trans	-75.6	139.5	161.3	49.1	0	0	0	0	110	G539	S537-G539 PolarHBondContact O-N 3.17Å; S537-G539 VanDerWaalsContact O-N 3.14Å
538	L	41.7	Very low	40.2	Very low	166 Å²	166	125 Å²	125	87%	0.869	74%	0.737	S	S	*	*			trans	-69.2	102.4	168.4	-119.9	99.4	0	0	0	108.9
539	G	34.9	Very low	41.4	Very low	71 Å²	71	125.1 Å²	125.1	73%	0.732	73%	0.728	S	S	*	*			trans	-97.1	93.9	170.2	0	0	0	0	0	111	S537 D541	S537-G539 PolarHBondContact O-N 3.17Å; S537-G539 VanDerWaalsContact O-N 3.14Å; G539-D541 PolarHBondContact O-N 3.48Å
540	L	44.9	Very low	42.3	Very low	144 Å²	144	121 Å²	121	75%	0.754	71%	0.708	S	S	*	*			trans	-74.2	111.9	160.3	-90.1	141	0	0	0	107.8	L542	L540-L542 PolarHBondContact O-N 3.23Å
541	D	48.8	Very low	43.5	Very low	99 Å²	99	122.7 Å²	122.7	53%	0.529	70%	0.7	S	S	.	*			trans	-66.8	110.8	-178.5	-173.4	2.9	0	0	0	111.5	G539 K543 T544	G539-D541 PolarHBondContact O-N 3.48Å; D541-K543 PolarHBondContact O-N 2.79Å; D541-K543 VanDerWaalsContact O-N 3.13Å; D541-K543 WeakPolarHBondContact OD1-CB 3.21Å; D541-K543 PolarHBondContact OD1-N 3.41Å; D541-K543 VanDerWaalsContact OD1-N 3.1Å; D541-T544 PolarHBondContact O-N 2.75Å; D541-T544 VanDerWaalsContact O-N 3.08Å; D541-T544 PolarHBondContact O-OG1 2.87Å
542	L	50.1	Low	44.4	Very low	126 Å²	126	117 Å²	117	66%	0.66	68%	0.679	S	S	*	*	H	α-helix	trans	-61.6	-15.6	179.8	-160.6	71.6	0	0	0	112.8	L540 T544	L540-L542 PolarHBondContact O-N 3.23Å; L542-T544 VanDerWaalsContact C-N 3.34Å
543	K	46.8	Very low	45.7	Very low	165 Å²	165	111.4 Å²	111.4	72%	0.717	66%	0.661	S	S	*	*	H	α-helix	trans	-71.2	-26.8	173	-81.2	-179.7	173.4	177.3	0	113.3	D541 V547	D541-K543 PolarHBondContact O-N 2.79Å; D541-K543 VanDerWaalsContact O-N 3.13Å; D541-K543 WeakPolarHBondContact OD1-CB 3.21Å; D541-K543 PolarHBondContact OD1-N 3.41Å; D541-K543 VanDerWaalsContact OD1-N 3.1Å; K543-V547 WeakPolarHBondContact O-CG2 3.25Å
544	T	48.4	Very low	46.4	Very low	98 Å²	98	112.6 Å²	112.6	60%	0.601	65%	0.654	S	S	*	*	H	α-helix	trans	-78.4	-29.2	-177.1	-32.6	0	0	0	0	112.1	D541 L542	D541-T544 PolarHBondContact O-N 2.75Å; D541-T544 VanDerWaalsContact O-N 3.08Å; D541-T544 PolarHBondContact O-OG1 2.87Å; L542-T544 VanDerWaalsContact C-N 3.34Å
545	I	51.5	Low	48.2	Very low	100 Å²	100	112.8 Å²	112.8	51%	0.513	65%	0.646	S	S	.	*	H	α-helix	trans	-79.8	-30.7	-179.7	-61.8	175.6	0	0	0	111.6	T549	I545-T549 PolarHBondContact O-N 2.96Å; I545-T549 PolarHBondContact O-OG1 2.85Å
546	L	46.9	Very low	49.7	Very low	122 Å²	122	112.1 Å²	112.1	64%	0.639	64%	0.635	S	S	*	*	H	α-helix	trans	-73.4	-31.3	178.2	-117.8	113.9	0	0	0	113.3	T549 A550	L546-T549 PolarHBondContact O-OG1 3.39Å; L546-A550 PolarHBondContact O-N 2.84Å
547	V	51.1	Low	51.5	Low	94 Å²	94	108.9 Å²	108.9	57%	0.57	62%	0.62	S	S	*	*	H	α-helix	trans	-75.6	-35.1	179	177.7	0	0	0	0	111.7	K543 M551	K543-V547 WeakPolarHBondContact O-CG2 3.25Å; V547-M551 PolarHBondContact O-N 3.3Å
548	S	49.7	Very low	53.6	Low	90 Å²	90	106 Å²	106	63%	0.629	61%	0.605	S	S	*	*	H	α-helix	trans	-70.8	-30.6	178	-176.2	0	0	0	0	113.4
549	T	55	Low	55.3	Low	91 Å²	91	102.4 Å²	102.4	56%	0.558	59%	0.59	S	S	*	*	H	α-helix	trans	-82.7	-29.7	-178.6	40.1	0	0	0	0	112.3	I545 L546 C553	I545-T549 PolarHBondContact O-N 2.96Å; I545-T549 PolarHBondContact O-OG1 2.85Å; L546-T549 PolarHBondContact O-OG1 3.39Å; T549-C553 PolarHBondContact O-N 3.34Å
550	A	53.5	Low	57.3	Low	48 Å²	48	101.8 Å²	101.8	40%	0.397	57%	0.573	S	S	.	*	H	α-helix	trans	-69.8	-43.4	174	0	0	0	0	0	112.7	L546 G552 C553 F554	L546-A550 PolarHBondContact O-N 2.84Å; A550-G552 VanDerWaalsContact C-N 3.34Å; A550-G552 PolarHBondContact O-N 3.41Å; A550-C553 PolarHBondContact O-N 3.19Å; A550-F554 VanDerWaalsContact O-CD2 3.25Å; A550-F554 WeakPolarHBondContact O-CD2 3.27Å; A550-F554 PolarHBondContact O-N 3.16Å
551	M	54.8	Low	58.7	Low	139 Å²	139	100 Å²	100	69%	0.685	56%	0.563	S	S	*	*	H	α-helix	trans	-66	-31.9	178.1	-88.6	176.8	67.5	0	0	113.5	V547 T555	V547-M551 PolarHBondContact O-N 3.3Å; M551-T555 PolarHBondContact O-OG1 3.49Å; M551-T555 VanDerWaalsContact O-OG1 3.08Å
552	G	54.4	Low	60	Low	40 Å²	40	101.5 Å²	101.5	41%	0.412	57%	0.565	S	S	.	*	H	α-helix	trans	-70.5	-29.5	175.2	0	0	0	0	0	113.8	A550 T555 F556	A550-G552 VanDerWaalsContact C-N 3.34Å; A550-G552 PolarHBondContact O-N 3.41Å; G552-T555 PolarHBondContact O-OG1 3.49Å; G552-F556 PolarHBondContact O-N 3.01Å
553	C	56.6	Low	61	Low	77 Å²	77	98.4 Å²	98.4	52%	0.52	55%	0.554	S	S	.	*	H	α-helix	trans	-78.4	-37.1	-176.9	-141.2	0	0	0	0	112.3	T549 A550 L557	T549-C553 PolarHBondContact O-N 3.34Å; A550-C553 PolarHBondContact O-N 3.19Å; C553-L557 PolarHBondContact O-N 3.42Å; C553-L557 VanDerWaalsContact O-N 3.09Å
554	F	57.7	Low	62.5	Low	169 Å²	169	97.3 Å²	97.3	74%	0.741	55%	0.549	S	S	*	.	H	α-helix	trans	-69.1	-34.3	176.2	-77.2	-72	0	0	0	113.2	A550 G558	A550-F554 VanDerWaalsContact O-CD2 3.25Å; A550-F554 WeakPolarHBondContact O-CD2 3.27Å; A550-F554 PolarHBondContact O-N 3.16Å; F554-G558 PolarHBondContact O-N 3.03Å; F554-G558 VanDerWaalsContact O-N 3.08Å
555	T	66.9	Low	63.8	Low	94 Å²	94	97.9 Å²	97.9	58%	0.577	55%	0.548	S	S	*	.	H	α-helix	trans	-72	-38	177	47.9	0	0	0	0	111.7	M551 G552 G558 V559	M551-T555 PolarHBondContact O-OG1 3.49Å; M551-T555 VanDerWaalsContact O-OG1 3.08Å; G552-T555 PolarHBondContact O-OG1 3.49Å; T555-G558 PolarHBondContact O-N 3Å; T555-V559 WeakPolarHBondContact O-CG2 3.28Å; T555-V559 PolarHBondContact O-N 3.24Å; T555-V559 VanDerWaalsContact O-N 3.12Å
556	F	65.2	Low	64.9	Low	148 Å²	148	97.6 Å²	97.6	65%	0.649	55%	0.547	S	S	*	.	H	α-helix	trans	-68.3	-44.3	176.2	-165.5	-98.3	0	0	0	112.7	G552 G558 V559 V560	G552-F556 PolarHBondContact O-N 3.01Å; F556-G558 VanDerWaalsContact C-N 3.33Å; F556-G558 PolarHBondContact O-N 3.06Å; F556-V559 PolarHBondContact O-N 3.39Å; F556-V560 HydrophobicContact CD1-CG2 4.25Å; F556-V560 HydrophobicContact CE1-CG2 4.04Å; F556-V560 HydrophobicContact CZ-CG2 4.47Å; F556-V560 VanDerWaalsContact O-CG2 3.32Å; F556-V560 WeakPolarHBondContact O-CG2 3.29Å; F556-V560 PolarHBondContact O-N 3.18Å; F556-V560 VanDerWaalsContact O-N 3.08Å
557	L	72.9	Confident	66.1	Low	103 Å²	103	96.7 Å²	96.7	54%	0.539	54%	0.542	S	S	.	.	H	α-helix	trans	-63.8	-37.5	175	-106.1	104.1	0	0	0	112.5	C553 V560 L561	C553-L557 PolarHBondContact O-N 3.42Å; C553-L557 VanDerWaalsContact O-N 3.09Å; L557-V560 PolarHBondContact O-N 3.02Å; L557-L561 WeakPolarHBondContact O-CB 3.36Å; L557-L561 PolarHBondContact O-N 3.06Å
558	G	74.8	Confident	67.1	Low	41 Å²	41	97.9 Å²	97.9	42%	0.423	54%	0.54	S	S	.	.	H	α-helix	trans	-62.5	-43	176.5	0	0	0	0	0	112.9	F554 T555 F556 F562	F554-G558 PolarHBondContact O-N 3.03Å; F554-G558 VanDerWaalsContact O-N 3.08Å; T555-G558 PolarHBondContact O-N 3Å; F556-G558 VanDerWaalsContact C-N 3.33Å; F556-G558 PolarHBondContact O-N 3.06Å; G558-F562 VanDerWaalsContact O-CB 3.3Å; G558-F562 WeakPolarHBondContact O-CB 3.49Å; G558-F562 PolarHBondContact O-N 3.32Å
559	V	76.1	Confident	68	Low	91 Å²	91	98.4 Å²	98.4	55%	0.552	54%	0.539	S	S	*	.	H	α-helix	trans	-67.8	-39.1	177.2	173.8	0	0	0	0	111.4	T555 F556 F562 C563	T555-V559 WeakPolarHBondContact O-CG2 3.28Å; T555-V559 PolarHBondContact O-N 3.24Å; T555-V559 VanDerWaalsContact O-N 3.12Å; F556-V559 PolarHBondContact O-N 3.39Å; V559-F562 PolarHBondContact O-N 3.48Å; V559-C563 WeakPolarHBondContact O-CB 3.46Å; V559-C563 PolarHBondContact O-N 3.04Å; V559-C563 PolarHBondContact O-SG 3.07Å
560	V	77.5	Confident	68	Low	59 Å²	59	102.4 Å²	102.4	36%	0.358	54%	0.544	S	S	.	.	H	α-helix	trans	-66.7	-44.4	177.4	173.7	0	0	0	0	111.2	F556 L557 F562 C563 F564	F556-V560 HydrophobicContact CD1-CG2 4.25Å; F556-V560 HydrophobicContact CE1-CG2 4.04Å; F556-V560 HydrophobicContact CZ-CG2 4.47Å; F556-V560 VanDerWaalsContact O-CG2 3.32Å; F556-V560 WeakPolarHBondContact O-CG2 3.29Å; F556-V560 PolarHBondContact O-N 3.18Å; F556-V560 VanDerWaalsContact O-N 3.08Å; L557-V560 PolarHBondContact O-N 3.02Å; V560-F562 VanDerWaalsContact C-N 3.34Å; V560-F562 PolarHBondContact O-N 3.44Å; V560-C563 PolarHBondContact O-N 3.14Å; V560-F564 HydrophobicContact CG1-CD2 3.92Å; V560-F564 HydrophobicContact CG1-CE2 4.06Å; V560-F564 WeakPolarHBondContact O-CD2 3.33Å; V560-F564 PolarHBondContact O-N 3.21Å
561	L	75.1	Confident	68.2	Low	107 Å²	107	104.5 Å²	104.5	56%	0.56	56%	0.555	S	S	*	*	H	α-helix	trans	-63.1	-38.5	175.2	-87.4	157.9	0	0	0	112.3	L557 F564 L565	L557-L561 WeakPolarHBondContact O-CB 3.36Å; L557-L561 PolarHBondContact O-N 3.06Å; L561-F564 PolarHBondContact O-N 3.47Å; L561-L565 PolarHBondContact O-N 3.14Å
562	F	74.4	Confident	68.2	Low	129 Å²	129	107.3 Å²	107.3	57%	0.566	56%	0.559	S	S	*	*	H	α-helix	trans	-65.3	-42.3	175	-173.9	-104.3	0	0	0	112.1	G558 V559 V560 L565 L566	G558-F562 VanDerWaalsContact O-CB 3.3Å; G558-F562 WeakPolarHBondContact O-CB 3.49Å; G558-F562 PolarHBondContact O-N 3.32Å; V559-F562 PolarHBondContact O-N 3.48Å; V560-F562 VanDerWaalsContact C-N 3.34Å; V560-F562 PolarHBondContact O-N 3.44Å; F562-L565 PolarHBondContact O-N 3.08Å; F562-L566 HydrophobicContact CD1-CD1 3.88Å; F562-L566 HydrophobicContact CE1-CD1 3.5Å; F562-L566 HydrophobicContact CE1-CG 4.23Å; F562-L566 HydrophobicContact CZ-CD1 4.09Å; F562-L566 HydrophobicContact CZ-CG 4.43Å; F562-L566 WeakPolarHBondContact O-CG 3.08Å; F562-L566 PolarHBondContact O-N 3.42Å
563	C	72.2	Confident	68	Low	62 Å²	62	108.3 Å²	108.3	42%	0.419	57%	0.569	S	S	.	*	H	α-helix	trans	-63.5	-39.4	173.6	-79.7	0	0	0	0	112.5	V559 V560 L566 L567	V559-C563 WeakPolarHBondContact O-CB 3.46Å; V559-C563 PolarHBondContact O-N 3.04Å; V559-C563 PolarHBondContact O-SG 3.07Å; V560-C563 PolarHBondContact O-N 3.14Å; C563-L566 PolarHBondContact O-N 3.06Å; C563-L567 WeakPolarHBondContact O-CG 3.37Å; C563-L567 PolarHBondContact O-N 3.24Å
564	F	77.4	Confident	67.7	Low	142 Å²	142	112.6 Å²	112.6	62%	0.623	58%	0.579	S	S	*	*	H	α-helix	trans	-66.4	-38.5	174.7	-94.2	-77.2	0	0	0	112.4	V560 L561 L567 F568	V560-F564 HydrophobicContact CG1-CD2 3.92Å; V560-F564 HydrophobicContact CG1-CE2 4.06Å; V560-F564 WeakPolarHBondContact O-CD2 3.33Å; V560-F564 PolarHBondContact O-N 3.21Å; L561-F564 PolarHBondContact O-N 3.47Å; F564-L567 PolarHBondContact O-N 3.33Å; F564-F568 VanDerWaalsContact O-CB 3.3Å; F564-F568 WeakPolarHBondContact O-CB 3.33Å; F564-F568 PolarHBondContact O-N 3.46Å
565	L	75.4	Confident	67.5	Low	109 Å²	109	107.3 Å²	107.3	57%	0.571	57%	0.572	S	S	*	*	H	α-helix	trans	-64.3	-41.9	173.7	-81	168.2	0	0	0	112	L561 F562 F568 V569	L561-L565 PolarHBondContact O-N 3.14Å; F562-L565 PolarHBondContact O-N 3.08Å; L565-F568 PolarHBondContact O-N 2.86Å; L565-V569 WeakPolarHBondContact O-CB 3.25Å; L565-V569 VanDerWaalsContact O-CG2 3.27Å; L565-V569 WeakPolarHBondContact O-CG2 3.49Å; L565-V569 PolarHBondContact O-N 3.44Å
566	L	74.4	Confident	66.6	Low	95 Å²	95	112.2 Å²	112.2	50%	0.497	59%	0.586	S	S	.	*	H	α-helix	trans	-63	-42.9	174.9	-74.9	174.4	0	0	0	112	F562 C563 F568 V569 W570	F562-L566 HydrophobicContact CD1-CD1 3.88Å; F562-L566 HydrophobicContact CE1-CD1 3.5Å; F562-L566 HydrophobicContact CE1-CG 4.23Å; F562-L566 HydrophobicContact CZ-CD1 4.09Å; F562-L566 HydrophobicContact CZ-CG 4.43Å; F562-L566 WeakPolarHBondContact O-CG 3.08Å; F562-L566 PolarHBondContact O-N 3.42Å; C563-L566 PolarHBondContact O-N 3.06Å; L566-F568 VanDerWaalsContact C-N 3.33Å; L566-F568 PolarHBondContact O-N 2.87Å; L566-V569 PolarHBondContact O-N 3.3Å; L566-W570 VanDerWaalsContact O-CB 3.26Å; L566-W570 WeakPolarHBondContact O-CB 3.42Å; L566-W570 PolarHBondContact O-N 3.34Å
567	L	72.1	Confident	65.5	Low	103 Å²	103	113.5 Å²	113.5	54%	0.539	59%	0.593	S	S	.	*	H	α-helix	trans	-66	-34.8	175.3	-72.7	171.8	0	0	0	112.3	C563 F564 W570 S571	C563-L567 WeakPolarHBondContact O-CG 3.37Å; C563-L567 PolarHBondContact O-N 3.24Å; F564-L567 PolarHBondContact O-N 3.33Å; L567-W570 PolarHBondContact O-N 3.1Å; L567-S571 WeakPolarHBondContact O-CB 3.08Å; L567-S571 PolarHBondContact O-N 3.45Å
568	F	71.9	Confident	63.9	Low	118 Å²	118	118.1 Å²	118.1	52%	0.518	61%	0.609	S	S	.	*	H	α-helix	trans	-72	-39.2	177.3	-159.2	-96.5	0	0	0	112.3	F564 L565 L566 S571 R572	F564-F568 VanDerWaalsContact O-CB 3.3Å; F564-F568 WeakPolarHBondContact O-CB 3.33Å; F564-F568 PolarHBondContact O-N 3.46Å; L565-F568 PolarHBondContact O-N 2.86Å; L566-F568 VanDerWaalsContact C-N 3.33Å; L566-F568 PolarHBondContact O-N 2.87Å; F568-S571 PolarHBondContact O-N 3.12Å; F568-R572 PolarHBondContact O-N 3.37Å
569	V	69.3	Low	62.2	Low	102 Å²	102	122.7 Å²	122.7	62%	0.618	62%	0.624	S	S	*	*	H	α-helix	trans	-66.1	-39.3	172.4	172.2	0	0	0	0	110.7	L565 L566 R572 G573	L565-V569 WeakPolarHBondContact O-CB 3.25Å; L565-V569 VanDerWaalsContact O-CG2 3.27Å; L565-V569 WeakPolarHBondContact O-CG2 3.49Å; L565-V569 PolarHBondContact O-N 3.44Å; L566-V569 PolarHBondContact O-N 3.3Å; V569-R572 PolarHBondContact O-N 3.17Å; V569-G573 PolarHBondContact O-N 3.3Å
570	W	55.3	Low	60	Low	175 Å²	175	124 Å²	124	66%	0.663	63%	0.627	S	S	*	*	H	α-helix	trans	-69.9	-34.1	176.4	-157.9	59.9	0	0	0	112.8	L566 L567 G573	L566-W570 VanDerWaalsContact O-CB 3.26Å; L566-W570 WeakPolarHBondContact O-CB 3.42Å; L566-W570 PolarHBondContact O-N 3.34Å; L567-W570 PolarHBondContact O-N 3.1Å; W570-G573 PolarHBondContact O-N 3Å
571	S	57.2	Low	58.2	Low	91 Å²	91	127.9 Å²	127.9	64%	0.636	65%	0.645	S	S	*	*	H	α-helix	trans	-68.3	-40.1	174	178.5	0	0	0	0	112.4	L567 F568	L567-S571 WeakPolarHBondContact O-CB 3.08Å; L567-S571 PolarHBondContact O-N 3.45Å; F568-S571 PolarHBondContact O-N 3.12Å
572	R	55.2	Low	56.2	Low	199 Å²	199	127.9 Å²	127.9	75%	0.751	65%	0.646	S	S	*	*	H	α-helix	trans	-76.1	-19.1	175.4	-91.3	-169.9	165.5	147.1	1.4	114.6	F568 V569 K574	F568-R572 PolarHBondContact O-N 3.37Å; V569-R572 PolarHBondContact O-N 3.17Å; R572-K574 PolarHBondContact O-N 3.26Å
573	G	49.9	Very low	54.7	Low	61 Å²	61	127.9 Å²	127.9	63%	0.629	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-10.4	179.1	0	0	0	0	0	115.8	V569 W570	V569-G573 PolarHBondContact O-N 3.3Å; W570-G573 PolarHBondContact O-N 3Å
574	K	51.6	Low	52.8	Low	166 Å²	166	133.2 Å²	133.2	72%	0.722	68%	0.675	S	S	*	*	S	Bend	trans	-101.6	44.7	179.8	-77.7	-171	176.5	176.3	0	113.5	R572	R572-K574 PolarHBondContact O-N 3.26Å
575	G	51.7	Low	51.1	Low	59 Å²	59	136.1 Å²	136.1	61%	0.608	68%	0.683	S	S	*	*	S	Bend	trans	-138.5	64.7	177	0	0	0	0	0	112.3
576	K	49.6	Very low	49.4	Very low	197 Å²	197	136.4 Å²	136.4	86%	0.857	69%	0.689	S	S	*	*			trans	138.7	74.5	160.1	-78.1	168.8	-177.9	-179	0	111.7
577	H	41.9	Very low	47.5	Very low	174 Å²	174	136.3 Å²	136.3	81%	0.806	69%	0.694	S	S	*	*			trans	-136.8	101.9	145.2	-87.8	-69.5	0	0	0	107.8	N579	H577-N579 PolarHBondContact O-N 3.2Å
578	K	39.4	Very low	45.6	Very low	200 Å²	200	143.4 Å²	143.4	87%	0.87	71%	0.713	S	S	*	*			trans	-65.2	107.5	159.1	-81.3	175.9	171.6	177.5	0	105.8	N580	K578-N580 VanDerWaalsContact C-N 3.28Å; K578-N580 PolarHBondContact O-N 2.76Å
579	N	37.7	Very low	43.9	Very low	138 Å²	138	143.5 Å²	143.5	74%	0.738	73%	0.729	S	S	*	*			trans	-75.5	87.1	169.3	-70.3	-6.9	0	0	0	107.9	H577 I581	H577-N579 PolarHBondContact O-N 3.2Å; N579-I581 PolarHBondContact O-N 2.78Å
580	N	30.6	Very low	42.3	Very low	117 Å²	117	148.7 Å²	148.7	63%	0.626	74%	0.743	S	S	*	*			trans	-73	112.6	152.8	-97.5	25	0	0	0	106.2	K578	K578-N580 VanDerWaalsContact C-N 3.28Å; K578-N580 PolarHBondContact O-N 2.76Å
581	I	40.4	Very low	41.2	Very low	141 Å²	141	145.3 Å²	145.3	72%	0.723	75%	0.746	S	S	*	*			trans	-89.7	101.3	166.1	-60.1	174.4	0	0	0	105.7	N579 V583	N579-I581 PolarHBondContact O-N 2.78Å; I581-V583 HydrophobicContact CG2-CG2 3.88Å; I581-V583 PolarHBondContact O-N 3.35Å
582	D	33.2	Very low	40	Very low	108 Å²	108	148.9 Å²	148.9	58%	0.578	76%	0.758	S	S	*	*			trans	-79	108.3	165.9	-81	-26.4	0	0	0	107.4	R607	D582-R607 IonicContact OD2-NH2 3.66Å
583	V	41.7	Very low	38.8	Very low	129 Å²	129	142.7 Å²	142.7	78%	0.782	76%	0.756	S	S	*	*			trans	-88.6	105.5	169.9	-178.9	0	0	0	0	107.6	I581	I581-V583 HydrophobicContact CG2-CG2 3.88Å; I581-V583 PolarHBondContact O-N 3.35Å
584	E	33.1	Very low	38	Very low	174 Å²	174	146.4 Å²	146.4	81%	0.813	77%	0.767	S	S	*	*			trans	-86.9	114.4	173.2	-165.7	170.9	-158.1	0	0	109.3
585	Y	41	Very low	37	Very low	203 Å²	203	145.9 Å²	145.9	80%	0.796	77%	0.772	S	S	*	*			trans	-87.6	110.1	174.6	-174.9	-94.6	0	0	0	109.4	P587	Y585-P587 HydrophobicContact CE1-CB 4.13Å
586	V	39.8	Very low	36.2	Very low	114 Å²	114	149 Å²	149	69%	0.691	78%	0.779	S	S	*	*			trans	-98.6	111.5	172.1	-177.9	0	0	0	0	108.8	R588	V586-R588 PolarHBondContact O-N 2.76Å
587	P	35.6	Very low	35.4	Very low	94 Å²	94	146.3 Å²	146.3	61%	0.61	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-70.7	130.6	174.1	26	-29.4	0	0	0	110.6	Y585 S589	Y585-P587 HydrophobicContact CE1-CB 4.13Å; P587-S589 PolarHBondContact O-N 2.94Å
588	R	32.4	Very low	34.8	Very low	251 Å²	251	143.6 Å²	143.6	95%	0.947	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-64.6	122.4	171.4	-106.4	176.9	167.8	163.4	-3.6	110	V586	V586-R588 PolarHBondContact O-N 2.76Å
589	S	35.3	Very low	34.5	Very low	121 Å²	121	139 Å²	139	85%	0.846	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-71	133	169.6	54.1	0	0	0	0	110.8	P587	P587-S589 PolarHBondContact O-N 2.94Å
590	K	35.4	Very low	34.3	Very low	211 Å²	211	142.2 Å²	142.2	92%	0.917	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-97.6	133.3	160.8	-83.3	-176.8	174.9	-179.8	0	108
591	S	32	Very low	34.4	Very low	103 Å²	103	140.1 Å²	140.1	72%	0.72	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-89.7	144.9	172.7	51.7	0	0	0	0	111.9
592	N	32.1	Very low	34.1	Very low	166 Å²	166	143.3 Å²	143.3	89%	0.888	80%	0.802	S	S	*	*			trans	75.9	122	164.5	-57	-5	0	0	0	117.1
593	G	31.5	Very low	34.2	Very low	69 Å²	69	142.6 Å²	142.6	71%	0.711	81%	0.811	S	S	*	*			cis	-174.9	173.1	-0.4	0	0	0	0	0	112.9
594	T	31.4	Very low	34.2	Very low	139 Å²	139	139.2 Å²	139.2	85%	0.853	80%	0.803	S	S	*	*			trans	77.3	98.8	164.3	61.4	0	0	0	0	121.9
595	N	32.2	Very low	34.3	Very low	155 Å²	155	137.4 Å²	137.4	83%	0.829	81%	0.806	S	S	*	*			trans	40.6	122.2	132.6	-69	0.8	0	0	0	122.6
596	V	33.6	Very low	34.3	Very low	124 Å²	124	138 Å²	138	75%	0.752	81%	0.807	S	S	*	*				167.9	123	95.6	167.8	0	0	0	0	111
597	D	32.5	Very low	34.1	Very low	142 Å²	142	142.4 Å²	142.4	76%	0.759	81%	0.811	S	S	*	*			trans	57.1	108.8	145.5	-59.6	-14.3	0	0	0	126.2
598	S	30.5	Very low	34.2	Very low	116 Å²	116	146.8 Å²	146.8	81%	0.811	82%	0.821	S	S	*	*				64.4	115.7	125.4	60.5	0	0	0	0	123.2
599	A	33.2	Very low	34.2	Very low	104 Å²	104	141.6 Å²	141.6	86%	0.86	81%	0.812	S	S	*	*				-169.7	133.7	116.1	0	0	0	0	0	111.2
600	E	32.1	Very low	34.1	Very low	205 Å²	205	145.1 Å²	145.1	96%	0.958	82%	0.817	S	S	*	*			trans	-67.7	149.4	-174.7	-70.2	170.2	128.3	0	0	114.8
601	G	32.8	Very low	33.7	Very low	73 Å²	73	144.8 Å²	144.8	75%	0.753	82%	0.816	S	S	*	*			trans	-178.5	72.6	168.9	0	0	0	0	0	111.7	A603	G601-A603 PolarHBondContact O-N 2.83Å
602	Q	34.5	Very low	33.6	Very low	209 Å²	209	149 Å²	149	98%	0.977	83%	0.827	S	S	*	*			trans	-56.2	114.2	174.9	-81.7	175	-18.2	0	0	111.5
603	A	35.4	Very low	33.7	Very low	93 Å²	93	153.7 Å²	153.7	77%	0.769	85%	0.846	S	S	*	*			trans	-126.3	101.9	162.2	0	0	0	0	0	108.6	G601	G601-A603 PolarHBondContact O-N 2.83Å
604	G	41.5	Very low	33.8	Very low	58 Å²	58	158 Å²	158	60%	0.598	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-62.1	159.3	171.9	0	0	0	0	0	112.1	R606	G604-R606 PolarHBondContact O-N 3.48Å; G604-R606 VanDerWaalsContact O-N 3.16Å
605	P	36.2	Very low	33.9	Very low	136 Å²	136	158.9 Å²	158.9	88%	0.883	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-63.8	118	-171.3	24.2	-31.7	0	0	0	111.4
606	R	41	Very low	34	Very low	216 Å²	216	159.2 Å²	159.2	82%	0.815	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-77.4	119.8	173.8	-72.5	-178.4	174.9	172.5	-1	109.8	G604 F608	G604-R606 PolarHBondContact O-N 3.48Å; G604-R606 VanDerWaalsContact O-N 3.16Å; R606-F608 HydrophobicContact CB-CE2 4.34Å
607	R	34.7	Very low	34	Very low	206 Å²	206	161.2 Å²	161.2	78%	0.777	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-79.8	121.3	171.6	-77.3	178.5	167.2	177.1	-8.7	110.2	D582	D582-R607 IonicContact OD2-NH2 3.66Å
608	F	38.3	Very low	34.1	Very low	185 Å²	185	162.4 Å²	162.4	81%	0.811	87%	0.867	S	S	*	*	P	Polyproline II helix	trans	-102.7	121.2	166.7	-77.3	-87.8	0	0	0	109.5	R606	R606-F608 HydrophobicContact CB-CE2 4.34Å
609	N	31.3	Very low	34.4	Very low	143 Å²	143	165.5 Å²	165.5	77%	0.765	87%	0.871	S	S	*	*			trans	-96.4	108.2	170.6	-84.1	-47.5	0	0	0	108.8
610	M	33.2	Very low	34.4	Very low	195 Å²	195	169.9 Å²	169.9	96%	0.961	87%	0.871	S	S	*	*			trans	-94.9	129.4	166.2	-97.9	173.8	115	0	0	109.7
611	K	28.6	Very low	34.6	Very low	204 Å²	204	167.2 Å²	167.2	89%	0.887	87%	0.865	S	S	*	*			trans	-103.2	111.6	175.5	-159.9	-179.3	-174.9	-173.9	0	106.9	M613	K611-M613 PolarHBondContact O-N 2.82Å
612	M	28.1	Very low	34.8	Very low	192 Å²	192	175.1 Å²	175.1	95%	0.946	87%	0.874	S	S	*	*			trans	-69.3	127.3	167	-81.9	-174.5	-167.1	0	0	108.3
613	M	34.6	Very low	34.8	Very low	264 Å²	264	172 Å²	172	100%	1.3	87%	0.865	S	S	*	*			trans	-79.7	0	161.5	-83.5	-174.2	157.5	0	0	109.8	K611	K611-M613 PolarHBondContact O-N 2.82Å

Retrieved 613 of 613 residues in 213.7 ms (Link to these results)

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