A0A087XIT6_POEFO Loading...

tetrahydrofolate synthase

AlphaFold DB , UniProt , Accession A0A087XIT6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 679 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	29.7	Very low	33	Very low	235 Å²	235	166.5 Å²	166.5	100%	1.158	84%	0.838	S	S	*	*				0	77.7	0	-77.1	174.4	71.9	0	0	108.4
2	M	36.9	Very low	33	Very low	187 Å²	187	166.8 Å²	166.8	92%	0.921	83%	0.834	S	S	*	*				73.3	41.9	72.1	-151.8	166.8	131.9	0	0	113
3	A	35	Very low	33.1	Very low	86 Å²	86	163 Å²	163	71%	0.711	83%	0.833	S	S	*	*	S	Bend	trans	-148.5	6.4	165.4	0	0	0	0	0	115.4
4	C	34.6	Very low	33.3	Very low	125 Å²	125	157.5 Å²	157.5	85%	0.845	82%	0.824	S	S	*	*	S	Bend	trans	-117.3	-0.5	175.8	-94	0	0	0	0	115.1
5	L	30.3	Very low	33.2	Very low	160 Å²	160	160.7 Å²	160.7	84%	0.838	83%	0.829	S	S	*	*	S	Bend	trans	-102	7.8	178	-134.1	83.8	0	0	0	114.3
6	L	30.9	Very low	33.3	Very low	139 Å²	139	155.5 Å²	155.5	73%	0.728	83%	0.828	S	S	*	*	S	Bend	trans	-118.4	11.1	-173.7	-104.1	155.6	0	0	0	115
7	R	33.6	Very low	33.4	Very low	241 Å²	241	152.4 Å²	152.4	91%	0.909	83%	0.829	S	S	*	*	S	Bend	trans	-106.6	3.1	167.9	-72.8	-173.2	-174.9	-176.6	2.5	114.2
8	V	35.1	Very low	33.4	Very low	122 Å²	122	148.8 Å²	148.8	74%	0.739	82%	0.817	S	S	*	*	S	Bend	trans	-98.8	-5.2	178.7	177.7	0	0	0	0	112.5
9	L	31.2	Very low	33.4	Very low	124 Å²	124	147.3 Å²	147.3	65%	0.649	82%	0.817	S	S	*	*	S	Bend	trans	-121.5	21.2	-177.5	-81.6	165.9	0	0	0	115.7
10	Q	33.5	Very low	33.4	Very low	177 Å²	177	145 Å²	145	83%	0.827	81%	0.811	S	S	*	*	S	Bend	trans	-132.1	34	173.1	-102.1	-174.2	-10.5	0	0	114.1
11	R	31.9	Very low	33.4	Very low	236 Å²	236	145.5 Å²	145.5	89%	0.891	81%	0.807	S	S	*	*	S	Bend	trans	-129.6	23.4	159.3	-80.8	-170.2	174.6	-169.1	-1.3	112.8
12	Q	33	Very low	33.6	Very low	169 Å²	169	144.1 Å²	144.1	79%	0.79	79%	0.789	S	S	*	*	S	Bend	trans	-103	67.4	164.4	-76.2	-169.8	-13.6	0	0	109.7
13	S	35.3	Very low	33.4	Very low	118 Å²	118	140.2 Å²	140.2	83%	0.825	77%	0.772	S	S	*	*	S	Bend	trans	-162.5	26.1	163.6	68.2	0	0	0	0	113.5
14	A	34.8	Very low	33.2	Very low	86 Å²	86	139 Å²	139	71%	0.711	76%	0.758	S	S	*	*	S	Bend	trans	-150.3	30.6	175.9	0	0	0	0	0	113.4
15	F	32.4	Very low	33.3	Very low	205 Å²	205	137.7 Å²	137.7	90%	0.899	75%	0.746	S	S	*	*	S	Bend	trans	-140.3	54.2	170.9	-103.1	-88.5	0	0	0	109.1
16	G	34.8	Very low	33.4	Very low	78 Å²	78	137.4 Å²	137.4	80%	0.804	74%	0.738	S	S	*	*			trans	-141	52.3	-179.8	0	0	0	0	0	110
17	A	34.8	Very low	33.3	Very low	103 Å²	103	139.8 Å²	139.8	85%	0.851	74%	0.738	S	S	*	*	S	Bend	trans	-160.1	20.9	174	0	0	0	0	0	114.7
18	S	34.2	Very low	33.2	Very low	87 Å²	87	134.5 Å²	134.5	61%	0.608	73%	0.727	S	S	*	*	S	Bend	trans	-137.1	10.9	174.4	75.2	0	0	0	0	115.8
19	C	32.1	Very low	33	Very low	121 Å²	121	131.2 Å²	131.2	82%	0.818	71%	0.713	S	S	*	*	S	Bend	trans	-104.9	17.7	-179.6	-85.7	0	0	0	0	115.3
20	S	33.3	Very low	32.9	Very low	100 Å²	100	131.4 Å²	131.4	70%	0.699	71%	0.714	S	S	*	*	S	Bend	trans	-111.2	-3.8	175	65.3	0	0	0	0	115.7
21	E	33.3	Very low	32.6	Very low	156 Å²	156	133.4 Å²	133.4	73%	0.729	71%	0.714	S	S	*	*	S	Bend	trans	-101.8	-15.7	179.8	-82.4	-175.3	152	0	0	115	S24 V25	E21-S24 PolarHBondContact O-OG 3.15Å; E21-V25 WeakPolarHBondContact O-CG2 3.46Å
22	R	34.5	Very low	32.5	Very low	207 Å²	207	125.5 Å²	125.5	78%	0.781	70%	0.7	S	S	*	*	H	α-helix	trans	-88.1	-25	179.5	-71.9	-174	-172.1	-173.8	2.4	114.3	F26	R22-F26 PolarHBondContact O-N 3.11Å
23	D	33.3	Very low	32.6	Very low	105 Å²	105	123.2 Å²	123.2	56%	0.561	70%	0.697	S	S	*	*	H	α-helix	trans	-83.1	-20.6	178.8	-87.3	-4.9	0	0	0	113.8	R27	D23-R27 WeakPolarHBondContact O-CG 3.28Å; D23-R27 PolarHBondContact O-N 3.34Å
24	S	31.4	Very low	32.5	Very low	60 Å²	60	128.1 Å²	128.1	42%	0.42	70%	0.697	S	S	.	*	H	α-helix	trans	-77	-35.9	173.3	58.2	0	0	0	0	111.8	E21 R27 L28	E21-S24 PolarHBondContact O-OG 3.15Å; S24-R27 PolarHBondContact O-N 3.04Å; S24-L28 WeakPolarHBondContact O-CD1 3.49Å; S24-L28 PolarHBondContact O-N 3.11Å
25	V	35.4	Very low	32.2	Very low	98 Å²	98	130.6 Å²	130.6	59%	0.594	70%	0.699	S	S	*	*	H	α-helix	trans	-70.1	-38.9	178.1	178.4	0	0	0	0	111.6	E21 L28 A29	E21-V25 WeakPolarHBondContact O-CG2 3.46Å; V25-L28 PolarHBondContact O-N 2.83Å; V25-A29 WeakPolarHBondContact O-CB 3.42Å; V25-A29 PolarHBondContact O-N 3.44Å
26	F	31.9	Very low	32.6	Very low	153 Å²	153	129.4 Å²	129.4	67%	0.671	70%	0.695	S	S	*	*	H	α-helix	trans	-70.3	-32.3	175.4	-106.9	-87	0	0	0	113.4	R22 N30	R22-F26 PolarHBondContact O-N 3.11Å; F26-N30 PolarHBondContact O-N 3.47Å
27	R	29.4	Very low	32.6	Very low	189 Å²	189	129.5 Å²	129.5	71%	0.713	68%	0.683	S	S	*	*	H	α-helix	trans	-77.6	-29.4	175.2	-71.4	-176	-159.2	-179.5	7.9	113.2	D23 S24 R31	D23-R27 WeakPolarHBondContact O-CG 3.28Å; D23-R27 PolarHBondContact O-N 3.34Å; S24-R27 PolarHBondContact O-N 3.04Å; R27-R31 PolarHBondContact O-N 2.99Å
28	L	31.3	Very low	32.5	Very low	130 Å²	130	131.2 Å²	131.2	68%	0.681	68%	0.684	S	S	*	*	H	α-helix	trans	-73.1	-38.6	170.4	-100.5	93.9	0	0	0	112.2	S24 V25 N30 R31 A32	S24-L28 WeakPolarHBondContact O-CD1 3.49Å; S24-L28 PolarHBondContact O-N 3.11Å; V25-L28 PolarHBondContact O-N 2.83Å; L28-N30 PolarHBondContact O-N 3.25Å; L28-R31 PolarHBondContact O-N 3.36Å; L28-A32 PolarHBondContact O-N 3.01Å; L28-A32 VanDerWaalsContact O-N 3.16Å
29	A	31.8	Very low	32.4	Very low	54 Å²	54	134.4 Å²	134.4	45%	0.446	69%	0.689	S	S	.	*	H	α-helix	trans	-62.6	-41.1	177	0	0	0	0	0	112.2	V25 R31 A32 V33	V25-A29 WeakPolarHBondContact O-CB 3.42Å; V25-A29 PolarHBondContact O-N 3.44Å; A29-R31 VanDerWaalsContact C-N 3.31Å; A29-R31 PolarHBondContact O-N 3.22Å; A29-A32 PolarHBondContact O-N 2.63Å; A29-V33 WeakPolarHBondContact O-CG2 3.07Å
30	N	29.5	Very low	32.5	Very low	128 Å²	128	132.9 Å²	132.9	68%	0.684	69%	0.685	S	S	*	*	H	α-helix	trans	-74.7	-15.8	176.5	-95.5	-18.7	0	0	0	114.7	F26 L28	F26-N30 PolarHBondContact O-N 3.47Å; L28-N30 PolarHBondContact O-N 3.25Å
31	R	26.7	Very low	32.8	Very low	219 Å²	219	130.3 Å²	130.3	83%	0.826	67%	0.67	S	S	*	*	H	α-helix	trans	-88.1	-21	174.3	-136.6	174.7	-174.8	-175.6	0.7	112.6	R27 L28 A29	R27-R31 PolarHBondContact O-N 2.99Å; L28-R31 PolarHBondContact O-N 3.36Å; A29-R31 VanDerWaalsContact C-N 3.31Å; A29-R31 PolarHBondContact O-N 3.22Å
32	A	28.9	Very low	33	Very low	70 Å²	70	127.1 Å²	127.1	58%	0.579	66%	0.663	S	S	*	*	H	α-helix	trans	-82	-15.4	177.2	0	0	0	0	0	114.2	L28 A29 R34	L28-A32 PolarHBondContact O-N 3.01Å; L28-A32 VanDerWaalsContact O-N 3.16Å; A29-A32 PolarHBondContact O-N 2.63Å; A32-R34 VanDerWaalsContact C-N 3.26Å; A32-R34 PolarHBondContact O-N 2.87Å
33	V	36.5	Very low	33.4	Very low	120 Å²	120	124.3 Å²	124.3	73%	0.727	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	5.6	-179.4	177.6	0	0	0	0	113.3	A29	A29-V33 WeakPolarHBondContact O-CG2 3.07Å
34	R	31.8	Very low	34.1	Very low	221 Å²	221	125 Å²	125	83%	0.834	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	10.7	176.6	-85.5	-171.8	177.9	-175.8	0.4	116.1	A32	A32-R34 VanDerWaalsContact C-N 3.26Å; A32-R34 PolarHBondContact O-N 2.87Å
35	N	28	Very low	35	Very low	139 Å²	139	128.5 Å²	128.5	74%	0.743	68%	0.678	S	S	*	*			trans	-107.3	105.4	172.5	-73.6	-12.5	0	0	0	110.3	S37	N35-S37 VanDerWaalsContact C-N 3.26Å; N35-S37 PolarHBondContact O-N 3.38Å
36	H	42.1	Very low	36.2	Very low	180 Å²	180	126 Å²	126	83%	0.833	67%	0.672	S	S	*	*			trans	-59.9	91.2	161.2	-70.3	-58.1	0	0	0	108.8	T38	H36-T38 PolarHBondContact O-N 2.55Å
37	S	33.9	Very low	38.4	Very low	79 Å²	79	121.4 Å²	121.4	55%	0.552	65%	0.653	S	S	*	*			trans	-81.5	115.5	174.7	-173.3	0	0	0	0	109.4	N35 Q39	N35-S37 VanDerWaalsContact C-N 3.26Å; N35-S37 PolarHBondContact O-N 3.38Å; S37-Q39 PolarHBondContact O-N 3.5Å; S37-Q39 WeakPolarHBondContact OG-CB 3.46Å; S37-Q39 WeakPolarHBondContact OG-CG 3.49Å; S37-Q39 PolarHBondContact OG-N 3.43Å
38	T	33.2	Very low	41.1	Very low	140 Å²	140	118.3 Å²	118.3	86%	0.859	65%	0.647	S	S	*	*			trans	-75.3	19.6	167.2	45.9	0	0	0	0	112.6	H36	H36-T38 PolarHBondContact O-N 2.55Å
39	Q	32.6	Very low	43.9	Very low	153 Å²	153	113.5 Å²	113.5	72%	0.715	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-68.9	137.3	179	-81.6	-179	-17.2	0	0	111.8	S37	S37-Q39 PolarHBondContact O-N 3.5Å; S37-Q39 WeakPolarHBondContact OG-CB 3.46Å; S37-Q39 WeakPolarHBondContact OG-CG 3.49Å; S37-Q39 PolarHBondContact OG-N 3.43Å
40	A	33.9	Very low	46.5	Very low	90 Å²	90	113.6 Å²	113.6	74%	0.744	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-57.2	136.3	170.4	0	0	0	0	0	109.4
41	A	38.4	Very low	49.4	Very low	46 Å²	46	110.1 Å²	110.1	38%	0.38	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-58.7	140.1	174.5	0	0	0	0	0	109.1	H43	A41-H43 PolarHBondContact O-N 3.16Å; A41-H43 VanDerWaalsContact O-N 3.15Å
42	P	39.1	Very low	52.5	Low	89 Å²	89	99.7 Å²	99.7	58%	0.578	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-57.3	122.3	174.8	22.5	-31.4	0	0	0	109.4	F44	P42-F44 HydrophobicContact CB-CD2 4.29Å; P42-F44 HydrophobicContact CB-CE2 3.65Å; P42-F44 HydrophobicContact CB-CZ 3.96Å; P42-F44 HydrophobicContact CG-CD2 4.44Å; P42-F44 HydrophobicContact CG-CE2 3.63Å; P42-F44 HydrophobicContact CG-CZ 4.21Å; P42-F44 WeakPolarHBondContact O-CD2 3.23Å; P42-F44 PolarHBondContact O-N 3.38Å
43	H	42.8	Very low	55.4	Low	148 Å²	148	96.4 Å²	96.4	69%	0.685	53%	0.526	S	S	*	.			trans	-83.2	103.1	179	-159.3	-39.4	0	0	0	108.3	A41	A41-H43 PolarHBondContact O-N 3.16Å; A41-H43 VanDerWaalsContact O-N 3.15Å
44	F	48.1	Very low	57.9	Low	119 Å²	119	93.6 Å²	93.6	52%	0.522	51%	0.511	S	S	.	.			trans	-92.4	153.1	170.6	-62.9	-78.6	0	0	0	109.9	P42 G46 M47	P42-F44 HydrophobicContact CB-CD2 4.29Å; P42-F44 HydrophobicContact CB-CE2 3.65Å; P42-F44 HydrophobicContact CB-CZ 3.96Å; P42-F44 HydrophobicContact CG-CD2 4.44Å; P42-F44 HydrophobicContact CG-CE2 3.63Å; P42-F44 HydrophobicContact CG-CZ 4.21Å; P42-F44 WeakPolarHBondContact O-CD2 3.23Å; P42-F44 PolarHBondContact O-N 3.38Å; F44-G46 PolarHBondContact O-N 3.26Å; F44-M47 HydrophobicContact CB-SD 4.33Å; F44-M47 HydrophobicContact CD2-SD 3.98Å; F44-M47 PolarHBondContact O-N 3.43Å
45	P	49.1	Very low	60.7	Low	134 Å²	134	84.5 Å²	84.5	87%	0.87	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	128.8	165	-17.3	29.6	0	0	0	109.4
46	G	61.6	Low	63.7	Low	46 Å²	46	77.9 Å²	77.9	47%	0.474	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.8	19.8	-176.4	0	0	0	0	0	115.8	F44 D51	F44-G46 PolarHBondContact O-N 3.26Å; G46-D51 VanDerWaalsContact CA-OD2 3.28Å; G46-D51 WeakPolarHBondContact CA-OD2 3.45Å
47	M	76.9	Confident	65.9	Low	56 Å²	56	70 Å²	70	28%	0.276	41%	0.408	S	S	.	.			trans	-123.4	34	174.5	-72.4	-169.5	145	0	0	112.4	F44 D51 T157 W161	F44-M47 HydrophobicContact CB-SD 4.33Å; F44-M47 HydrophobicContact CD2-SD 3.98Å; F44-M47 PolarHBondContact O-N 3.43Å; M47-D51 PolarHBondContact N-OD2 3.34Å; M47-T157 WeakPolarHBondContact O-CG2 3.17Å; M47-W161 HydrophobicContact CE-CB 3.91Å; M47-W161 HydrophobicContact CE-CD2 3.76Å; M47-W161 HydrophobicContact CE-CE3 3.94Å; M47-W161 HydrophobicContact CE-CG 3.75Å; M47-W161 HydrophobicContact CG-CD2 4.21Å; M47-W161 HydrophobicContact CG-CG 4.3Å; M47-W161 HydrophobicContact CG-CZ2 4.43Å; M47-W161 HydrophobicContact SD-CG 4.25Å
48	E	87.9	Confident	68.4	Low	124 Å²	124	70.9 Å²	70.9	58%	0.579	41%	0.411	S	S	*	.	S	Bend	trans	-78.7	171.4	173.6	-63	-165.8	154.2	0	0	111.6	Q50 D51 A52	E48-Q50 PolarHBondContact O-N 2.68Å; E48-D51 PolarHBondContact N-OD2 2.98Å; E48-D51 WeakPolarHBondContact O-CB 3.44Å; E48-D51 PolarHBondContact O-N 3.05Å; E48-A52 PolarHBondContact O-N 3.03Å; E48-A52 VanDerWaalsContact O-N 3.08Å
49	Y	88.4	Confident	71	Confident	28 Å²	28	65 Å²	65	11%	0.11	37%	0.374	C	S	.	.	H	α-helix	trans	-55.7	-42.3	176.6	174.3	-102.2	0	0	0	111.8	D51 A52 I53 R141 N153 F156 T157 D454	Y49-D51 VanDerWaalsContact C-N 3.32Å; Y49-D51 PolarHBondContact O-N 3.28Å; Y49-A52 WeakPolarHBondContact O-CB 3.3Å; Y49-A52 PolarHBondContact O-N 2.91Å; Y49-I53 HydrophobicContact CD1-CG1 4.21Å; Y49-I53 HydrophobicContact CD2-CG1 4.42Å; Y49-I53 HydrophobicContact CE1-CD1 4.29Å; Y49-I53 HydrophobicContact CE1-CG1 3.7Å; Y49-I53 HydrophobicContact CE2-CD1 3.77Å; Y49-I53 HydrophobicContact CE2-CG1 3.92Å; Y49-I53 WeakPolarHBondContact O-CG1 3.34Å; Y49-I53 PolarHBondContact O-N 2.96Å; Y49-I53 WeakPolarHBondContact OH-CD1 3.3Å; Y49-R141 HydrophobicContact CE2-CG 3.67Å; Y49-N153 HydrophobicContact CD2-CB 4.2Å; Y49-N153 HydrophobicContact CG-CB 4.16Å; Y49-F156 HydrophobicContact CD2-CB 4.47Å; Y49-F156 AromaticContact CD2-CD1 3.89Å; Y49-F156 HydrophobicContact CD2-CD1 3.89Å; Y49-F156 HydrophobicContact CD2-CG 4.45Å; Y49-F156 HydrophobicContact CE2-CB 4.37Å; Y49-F156 AromaticContact CE2-CD1 3.73Å; Y49-F156 HydrophobicContact CE2-CD1 3.73Å; Y49-F156 HydrophobicContact CE2-CE1 4.28Å; Y49-F156 HydrophobicContact CE2-CG 4.1Å; Y49-T157 WeakPolarHBondContact CA-OG1 3.33Å; Y49-T157 PolarHBondContact N-OG1 2.91Å; Y49-D454 WeakPolarHBondContact CE1-OD2 3.41Å; Y49-D454 PolarHBondContact OH-OD1 3.11Å; Y49-D454 VanDerWaalsContact OH-OD1 3.07Å; Y49-D454 PolarHBondContact OH-OD2 3.46Å; Y49-D454 VanDerWaalsContact OH-OD2 3.07Å
50	Q	87.6	Confident	73.2	Confident	57 Å²	57	59.8 Å²	59.8	27%	0.266	35%	0.35	S	S	.	.	H	α-helix	trans	-66	-36.2	-178.6	-164.3	55.3	29.1	0	0	112.3	E48 I53 C54 G451	E48-Q50 PolarHBondContact O-N 2.68Å; Q50-I53 PolarHBondContact O-N 3.19Å; Q50-C54 WeakPolarHBondContact O-CB 3.31Å; Q50-C54 PolarHBondContact O-N 2.61Å; Q50-C54 PolarHBondContact O-SG 2.88Å; Q50-G451 PolarHBondContact NE2-O 3.22Å
51	D	89.9	Confident	74.6	Confident	55 Å²	55	58 Å²	58	29%	0.294	33%	0.332	S	S	.	.	H	α-helix	trans	-63	-45.2	173.5	-59	-45.3	0	0	0	110.6	G46 M47 E48 Y49 I53 C54 T55 W161	G46-D51 VanDerWaalsContact CA-OD2 3.28Å; G46-D51 WeakPolarHBondContact CA-OD2 3.45Å; M47-D51 PolarHBondContact N-OD2 3.34Å; E48-D51 PolarHBondContact N-OD2 2.98Å; E48-D51 WeakPolarHBondContact O-CB 3.44Å; E48-D51 PolarHBondContact O-N 3.05Å; Y49-D51 VanDerWaalsContact C-N 3.32Å; Y49-D51 PolarHBondContact O-N 3.28Å; D51-I53 VanDerWaalsContact C-N 3.32Å; D51-I53 PolarHBondContact O-N 2.97Å; D51-C54 PolarHBondContact O-N 3.29Å; D51-T55 WeakPolarHBondContact O-CB 3.05Å; D51-T55 PolarHBondContact O-N 2.7Å; D51-T55 PolarHBondContact O-OG1 3Å; D51-T55 VanDerWaalsContact O-OG1 3.06Å; D51-W161 HydrophobicContact CB-CZ2 4.09Å
52	A	92.4	Very high	75	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-59.1	-41.8	176.9	0	0	0	0	0	112.2	E48 Y49 L56 F156 F160	E48-A52 PolarHBondContact O-N 3.03Å; E48-A52 VanDerWaalsContact O-N 3.08Å; Y49-A52 WeakPolarHBondContact O-CB 3.3Å; Y49-A52 PolarHBondContact O-N 2.91Å; A52-L56 WeakPolarHBondContact O-CB 3.44Å; A52-L56 PolarHBondContact O-N 2.86Å; A52-F156 HydrophobicContact CB-CE1 4.22Å; A52-F160 HydrophobicContact CB-CB 4.25Å; A52-F160 HydrophobicContact CB-CD1 3.48Å; A52-F160 VanDerWaalsContact CB-CD1 3.48Å; A52-F160 HydrophobicContact CB-CD2 4.39Å; A52-F160 HydrophobicContact CB-CE1 3.91Å; A52-F160 HydrophobicContact CB-CG 3.77Å; A52-F160 VanDerWaalsContact O-CZ 3.3Å; A52-F160 WeakPolarHBondContact O-CZ 3.37Å
53	I	90.3	Very high	75.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-67.3	-43.9	176.1	-60.6	-55.5	0	0	0	111.5	Y49 Q50 D51 L56 N57 V140 F156 A453	Y49-I53 HydrophobicContact CD1-CG1 4.21Å; Y49-I53 HydrophobicContact CD2-CG1 4.42Å; Y49-I53 HydrophobicContact CE1-CD1 4.29Å; Y49-I53 HydrophobicContact CE1-CG1 3.7Å; Y49-I53 HydrophobicContact CE2-CD1 3.77Å; Y49-I53 HydrophobicContact CE2-CG1 3.92Å; Y49-I53 WeakPolarHBondContact O-CG1 3.34Å; Y49-I53 PolarHBondContact O-N 2.96Å; Y49-I53 WeakPolarHBondContact OH-CD1 3.3Å; Q50-I53 PolarHBondContact O-N 3.19Å; D51-I53 VanDerWaalsContact C-N 3.32Å; D51-I53 PolarHBondContact O-N 2.97Å; I53-L56 PolarHBondContact O-N 3.44Å; I53-N57 WeakPolarHBondContact O-CB 3.35Å; I53-N57 VanDerWaalsContact O-CG 3.32Å; I53-N57 PolarHBondContact O-N 2.78Å; I53-N57 PolarHBondContact O-ND2 2.75Å; I53-V140 HydrophobicContact CD1-CB 3.89Å; I53-V140 HydrophobicContact CD1-CG1 4.36Å; I53-V140 HydrophobicContact CD1-CG2 4.07Å; I53-F156 HydrophobicContact CD1-CE1 3.79Å; I53-F156 HydrophobicContact CD1-CZ 4.07Å; I53-A453 HydrophobicContact CG2-CB 3.7Å
54	C	87.7	Confident	74.8	Confident	62 Å²	62	53.9 Å²	53.9	42%	0.419	31%	0.313	S	S	.	.	H	α-helix	trans	-59.1	-48.3	176.1	-74	0	0	0	0	111.3	Q50 D51 N57 T58	Q50-C54 WeakPolarHBondContact O-CB 3.31Å; Q50-C54 PolarHBondContact O-N 2.61Å; Q50-C54 PolarHBondContact O-SG 2.88Å; D51-C54 PolarHBondContact O-N 3.29Å; C54-N57 PolarHBondContact O-N 3.34Å; C54-T58 WeakPolarHBondContact O-CG2 3.39Å; C54-T58 PolarHBondContact O-N 3.36Å
55	T	91.1	Very high	74.4	Confident	30 Å²	30	50.7 Å²	50.7	18%	0.184	30%	0.304	C	S	.	.	H	α-helix	trans	-62.5	-44.7	176.1	-58.9	0	0	0	0	111.5	D51 N57 T58 F160 W161 Y164	D51-T55 WeakPolarHBondContact O-CB 3.05Å; D51-T55 PolarHBondContact O-N 2.7Å; D51-T55 PolarHBondContact O-OG1 3Å; D51-T55 VanDerWaalsContact O-OG1 3.06Å; T55-N57 VanDerWaalsContact C-N 3.25Å; T55-N57 PolarHBondContact O-N 3.12Å; T55-T58 WeakPolarHBondContact O-CB 3.36Å; T55-T58 PolarHBondContact O-N 3.07Å; T55-T58 PolarHBondContact O-OG1 3.13Å; T55-F160 HydrophobicContact CG2-CE1 4.12Å; T55-F160 HydrophobicContact CG2-CZ 3.87Å; T55-W161 HydrophobicContact CG2-CH2 4.19Å; T55-W161 HydrophobicContact CG2-CZ3 4.32Å; T55-W161 WeakPolarHBondContact OG1-CH2 3.29Å; T55-Y164 HydrophobicContact CG2-CD1 4.38Å; T55-Y164 HydrophobicContact CG2-CD2 3.93Å; T55-Y164 HydrophobicContact CG2-CE1 3.92Å; T55-Y164 HydrophobicContact CG2-CE2 3.39Å; T55-Y164 HydrophobicContact CG2-CG 4.4Å
56	L	90.9	Very high	74.2	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-56.2	-42.1	175.1	177.5	60.6	0	0	0	111.5	A52 I53 T58 L59 V140 F156 F160 Y181 F184 L185	A52-L56 WeakPolarHBondContact O-CB 3.44Å; A52-L56 PolarHBondContact O-N 2.86Å; I53-L56 PolarHBondContact O-N 3.44Å; L56-T58 PolarHBondContact O-N 2.82Å; L56-L59 HydrophobicContact CD1-CD1 4.28Å; L56-L59 VanDerWaalsContact O-CB 3.3Å; L56-L59 WeakPolarHBondContact O-CB 3.46Å; L56-L59 PolarHBondContact O-N 2.92Å; L56-V140 HydrophobicContact CD2-CG1 3.74Å; L56-V140 HydrophobicContact CD2-CG2 4.38Å; L56-F156 HydrophobicContact CD2-CZ 4.24Å; L56-F160 HydrophobicContact CB-CE2 3.68Å; L56-F160 HydrophobicContact CB-CZ 4.18Å; L56-F160 HydrophobicContact CD1-CE2 4.2Å; L56-F160 HydrophobicContact CG-CE2 4.41Å; L56-Y181 HydrophobicContact CD1-CD2 3.95Å; L56-Y181 HydrophobicContact CD1-CE2 4.02Å; L56-Y181 HydrophobicContact CD2-CE2 3.82Å; L56-Y181 HydrophobicContact CG-CD2 3.86Å; L56-Y181 HydrophobicContact CG-CE2 3.48Å; L56-Y181 VanDerWaalsContact CG-CE2 3.48Å; L56-Y181 WeakPolarHBondContact O-CD2 3.39Å; L56-F184 HydrophobicContact CD1-CD1 3.49Å; L56-F184 VanDerWaalsContact CD1-CD1 3.49Å; L56-F184 HydrophobicContact CD1-CE1 3.96Å; L56-F184 HydrophobicContact CD1-CG 4.38Å; L56-L185 HydrophobicContact CD1-CD2 4.28Å; L56-L185 HydrophobicContact CD1-CG 4.2Å; L56-L185 HydrophobicContact CD2-CD1 4.48Å; L56-L185 HydrophobicContact CD2-CD2 3.87Å; L56-L185 HydrophobicContact CD2-CG 4.32Å
57	N	87.7	Confident	72.9	Confident	13 Å²	13	53.2 Å²	53.2	7%	0.07	29%	0.294	C	S	.	.	H	α-helix	trans	-65.6	-24.2	179.7	-76.1	-21	0	0	0	113.1	I53 C54 T55 L59 Q60 A453 F458	I53-N57 WeakPolarHBondContact O-CB 3.35Å; I53-N57 VanDerWaalsContact O-CG 3.32Å; I53-N57 PolarHBondContact O-N 2.78Å; I53-N57 PolarHBondContact O-ND2 2.75Å; C54-N57 PolarHBondContact O-N 3.34Å; T55-N57 VanDerWaalsContact C-N 3.25Å; T55-N57 PolarHBondContact O-N 3.12Å; N57-L59 PolarHBondContact O-N 2.94Å; N57-Q60 VanDerWaalsContact O-CB 3.3Å; N57-Q60 WeakPolarHBondContact O-CB 3.43Å; N57-Q60 WeakPolarHBondContact O-CG 3.48Å; N57-Q60 PolarHBondContact O-N 3.46Å; N57-Q60 VanDerWaalsContact O-N 3.1Å; N57-Q60 PolarHBondContact OD1-NE2 3.42Å; N57-A453 PolarHBondContact ND2-O 3.17Å; N57-F458 HydrophobicContact CB-CE2 4Å
58	T	87.1	Confident	70.8	Confident	98 Å²	98	57.4 Å²	57.4	60%	0.601	31%	0.313	S	S	*	.	H	α-helix	trans	-65.3	-20.2	171.2	74.6	0	0	0	0	113.4	C54 T55 L56 Q60	C54-T58 WeakPolarHBondContact O-CG2 3.39Å; C54-T58 PolarHBondContact O-N 3.36Å; T55-T58 WeakPolarHBondContact O-CB 3.36Å; T55-T58 PolarHBondContact O-N 3.07Å; T55-T58 PolarHBondContact O-OG1 3.13Å; L56-T58 PolarHBondContact O-N 2.82Å; T58-Q60 PolarHBondContact O-N 3.43Å
59	L	87	Confident	68.6	Low	18 Å²	18	53.4 Å²	53.4	9%	0.094	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-1.2	175.6	-55	-179.8	0	0	0	112.8	L56 N57 Y164 M178 Y181 F184	L56-L59 HydrophobicContact CD1-CD1 4.28Å; L56-L59 VanDerWaalsContact O-CB 3.3Å; L56-L59 WeakPolarHBondContact O-CB 3.46Å; L56-L59 PolarHBondContact O-N 2.92Å; N57-L59 PolarHBondContact O-N 2.94Å; L59-Y164 HydrophobicContact CD1-CE2 4.39Å; L59-Y164 HydrophobicContact CD2-CE2 4.35Å; L59-M178 HydrophobicContact CD2-CB 4.01Å; L59-M178 HydrophobicContact CD2-CE 4.48Å; L59-Y181 PolarHBondContact O-N 3.43Å; L59-F184 HydrophobicContact CD1-CB 3.72Å; L59-F184 HydrophobicContact CD1-CD1 4.11Å; L59-F184 HydrophobicContact CD1-CD2 3.79Å; L59-F184 HydrophobicContact CD1-CE2 4.49Å; L59-F184 HydrophobicContact CD1-CG 3.57Å
60	Q	79.1	Confident	66.3	Low	42 Å²	42	56.5 Å²	56.5	20%	0.196	32%	0.323	C	S	.	.	S	Bend	trans	-73.3	133.4	171.3	-62.8	-175	11.5	0	0	109.7	N57 T58 N62 Y181	N57-Q60 VanDerWaalsContact O-CB 3.3Å; N57-Q60 WeakPolarHBondContact O-CB 3.43Å; N57-Q60 WeakPolarHBondContact O-CG 3.48Å; N57-Q60 PolarHBondContact O-N 3.46Å; N57-Q60 VanDerWaalsContact O-N 3.1Å; N57-Q60 PolarHBondContact OD1-NE2 3.42Å; T58-Q60 PolarHBondContact O-N 3.43Å; Q60-N62 PolarHBondContact O-N 3.12Å; Q60-Y181 HydrophobicContact CG-CD2 3.48Å; Q60-Y181 VanDerWaalsContact CG-CD2 3.48Å; Q60-Y181 HydrophobicContact CG-CE2 4.07Å; Q60-Y181 HydrophobicContact CG-CG 4.01Å
61	S	62.8	Low	64	Low	52 Å²	52	65.1 Å²	65.1	36%	0.364	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-68.7	118.4	169.9	-57.8	0	0	0	0	108.7
62	N	47.9	Very low	61.6	Low	100 Å²	100	64.8 Å²	64.8	54%	0.535	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-53.6	147.7	175.4	-68.6	-16.1	0	0	0	110.9	Q60 S64 V65 L66	Q60-N62 PolarHBondContact O-N 3.12Å; N62-S64 PolarHBondContact O-N 2.93Å; N62-V65 HydrophobicContact CB-CG2 4.48Å; N62-V65 WeakPolarHBondContact O-CA 3.31Å; N62-V65 WeakPolarHBondContact O-CB 3.27Å; N62-V65 PolarHBondContact O-N 3.27Å; N62-L66 PolarHBondContact O-N 3.23Å
63	A	43.5	Very low	59.6	Low	33 Å²	33	72.4 Å²	72.4	27%	0.273	40%	0.397	S	S	.	.	H	α-helix	trans	-48.8	-33.6	178.3	0	0	0	0	0	113.6	L66 Q67 N459	A63-L66 PolarHBondContact O-N 3.08Å; A63-Q67 WeakPolarHBondContact O-CB 3.42Å; A63-Q67 VanDerWaalsContact O-CG 3.32Å; A63-Q67 WeakPolarHBondContact O-CG 3.4Å; A63-Q67 PolarHBondContact O-N 3.06Å; A63-N459 HydrophobicContact CB-CB 4.11Å; A63-N459 PolarHBondContact N-OD1 3.45Å; A63-N459 VanDerWaalsContact N-OD1 3.17Å
64	S	33.8	Very low	58.1	Low	64 Å²	64	80.7 Å²	80.7	45%	0.448	43%	0.429	S	S	.	.	H	α-helix	trans	-67	-38.8	174.6	53.8	0	0	0	0	113.5	N62 Q67 Q68	N62-S64 PolarHBondContact O-N 2.93Å; S64-Q67 PolarHBondContact O-N 3.43Å; S64-Q68 WeakPolarHBondContact O-CB 3.44Å; S64-Q68 VanDerWaalsContact O-CG 3.27Å; S64-Q68 WeakPolarHBondContact O-CG 3.43Å; S64-Q68 PolarHBondContact O-N 2.8Å
65	V	40.4	Very low	57.5	Low	53 Å²	53	80.5 Å²	80.5	32%	0.321	42%	0.424	S	S	.	.	H	α-helix	trans	-68.9	-41.5	173.8	178.6	0	0	0	0	110	N62 Q67 Q68 T69	N62-V65 HydrophobicContact CB-CG2 4.48Å; N62-V65 WeakPolarHBondContact O-CA 3.31Å; N62-V65 WeakPolarHBondContact O-CB 3.27Å; N62-V65 PolarHBondContact O-N 3.27Å; V65-Q67 PolarHBondContact O-N 3.44Å; V65-Q68 PolarHBondContact O-N 3.45Å; V65-T69 WeakPolarHBondContact O-CB 3.27Å; V65-T69 PolarHBondContact O-N 2.97Å; V65-T69 PolarHBondContact O-OG1 3.01Å
66	L	43.7	Very low	56.9	Low	93 Å²	93	81.4 Å²	81.4	49%	0.487	43%	0.43	S	S	.	.	H	α-helix	trans	-62.5	-40.5	175	-70.7	168.1	0	0	0	112.1	N62 A63 T69 S70	N62-L66 PolarHBondContact O-N 3.23Å; A63-L66 PolarHBondContact O-N 3.08Å; L66-T69 PolarHBondContact O-N 2.97Å; L66-S70 PolarHBondContact O-N 3.39Å; L66-S70 VanDerWaalsContact O-N 3.08Å; L66-S70 PolarHBondContact O-OG 3.49Å
67	Q	35.6	Very low	56.6	Low	140 Å²	140	86 Å²	86	65%	0.654	45%	0.451	S	S	*	.	H	α-helix	trans	-68.1	-35.5	174.6	-76.8	-176.3	0	0	0	113.4	A63 S64 V65 S70	A63-Q67 WeakPolarHBondContact O-CB 3.42Å; A63-Q67 VanDerWaalsContact O-CG 3.32Å; A63-Q67 WeakPolarHBondContact O-CG 3.4Å; A63-Q67 PolarHBondContact O-N 3.06Å; S64-Q67 PolarHBondContact O-N 3.43Å; V65-Q67 PolarHBondContact O-N 3.44Å; Q67-S70 VanDerWaalsContact C-OG 3.26Å; Q67-S70 WeakPolarHBondContact CA-OG 3.36Å; Q67-S70 PolarHBondContact O-OG 2.93Å
68	Q	32.3	Very low	56.4	Low	144 Å²	144	91.4 Å²	91.4	67%	0.673	48%	0.476	S	S	*	.	H	α-helix	trans	-74.5	-34.1	174.6	-73.1	174.9	-3.1	0	0	112	S64 V65 S70 R71 G72	S64-Q68 WeakPolarHBondContact O-CB 3.44Å; S64-Q68 VanDerWaalsContact O-CG 3.27Å; S64-Q68 WeakPolarHBondContact O-CG 3.43Å; S64-Q68 PolarHBondContact O-N 2.8Å; V65-Q68 PolarHBondContact O-N 3.45Å; Q68-S70 VanDerWaalsContact C-N 3.31Å; Q68-S70 PolarHBondContact O-N 2.9Å; Q68-R71 PolarHBondContact O-N 2.77Å; Q68-G72 PolarHBondContact O-N 2.86Å
69	T	40.4	Very low	56.2	Low	40 Å²	40	89.8 Å²	89.8	25%	0.245	46%	0.462	C	S	.	.	H	α-helix	trans	-72.8	-23.6	176.4	-40.2	0	0	0	0	112.1	V65 L66 R71 G72 Q73 R74	V65-T69 WeakPolarHBondContact O-CB 3.27Å; V65-T69 PolarHBondContact O-N 2.97Å; V65-T69 PolarHBondContact O-OG1 3.01Å; L66-T69 PolarHBondContact O-N 2.97Å; T69-R71 PolarHBondContact O-N 3.15Å; T69-G72 CarbonylContact O-C 3.55Å; T69-G72 PolarHBondContact O-N 3.49Å; T69-G72 VanDerWaalsContact O-O 3.07Å; T69-Q73 PolarHBondContact O-N 2.97Å; T69-R74 HydrophobicContact CG2-CB 4.4Å; T69-R74 HydrophobicContact CG2-CG 4.3Å
70	S	41.9	Very low	56.2	Low	93 Å²	93	90.4 Å²	90.4	65%	0.65	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-13.8	167.8	40.6	0	0	0	0	114.1	L66 Q67 Q68	L66-S70 PolarHBondContact O-N 3.39Å; L66-S70 VanDerWaalsContact O-N 3.08Å; L66-S70 PolarHBondContact O-OG 3.49Å; Q67-S70 VanDerWaalsContact C-OG 3.26Å; Q67-S70 WeakPolarHBondContact CA-OG 3.36Å; Q67-S70 PolarHBondContact O-OG 2.93Å; Q68-S70 VanDerWaalsContact C-N 3.31Å; Q68-S70 PolarHBondContact O-N 2.9Å
71	R	38	Very low	56.7	Low	238 Å²	238	94.1 Å²	94.1	90%	0.898	49%	0.486	S	S	*	.	S	Bend	trans	-100.5	-9	173.4	-68.1	-175.8	176.2	177.7	-1.1	113.6	Q68 T69	Q68-R71 PolarHBondContact O-N 2.77Å; T69-R71 PolarHBondContact O-N 3.15Å
72	G	40.9	Very low	58	Low	47 Å²	47	93.4 Å²	93.4	49%	0.485	48%	0.483	S	S	.	.	S	Bend	trans	-153.7	93.4	173.2	0	0	0	0	0	109.2	Q68 T69 R74	Q68-G72 PolarHBondContact O-N 2.86Å; T69-G72 CarbonylContact O-C 3.55Å; T69-G72 PolarHBondContact O-N 3.49Å; T69-G72 VanDerWaalsContact O-O 3.07Å; G72-R74 PolarHBondContact O-N 3.14Å; G72-R74 VanDerWaalsContact O-N 3.1Å
73	Q	48.5	Very low	60.2	Low	160 Å²	160	88.6 Å²	88.6	75%	0.748	46%	0.457	S	S	*	.			trans	-59.3	114.7	-179.6	-81.7	179.2	-31.6	0	0	109.6	T69 D75	T69-Q73 PolarHBondContact O-N 2.97Å; Q73-D75 PolarHBondContact O-N 3.15Å
74	R	59.1	Low	62.7	Low	174 Å²	174	89.1 Å²	89.1	66%	0.657	46%	0.458	S	S	*	.			trans	-61.3	120.4	155.9	-75.2	-176.8	178.9	178.7	-0.7	106.8	T69 G72 P76	T69-R74 HydrophobicContact CG2-CB 4.4Å; T69-R74 HydrophobicContact CG2-CG 4.3Å; G72-R74 PolarHBondContact O-N 3.14Å; G72-R74 VanDerWaalsContact O-N 3.1Å; R74-P76 VanDerWaalsContact O-CD 3.27Å; R74-P76 WeakPolarHBondContact O-CD 3.39Å; R74-P76 VanDerWaalsContact O-N 3.13Å
75	D	76.2	Confident	65.6	Low	59 Å²	59	87.6 Å²	87.6	32%	0.316	45%	0.452	S	S	.	.			trans	-53	113.8	-176.1	176.9	8.6	0	0	0	111.5	Q73 Q77 Q78 Q79	Q73-D75 PolarHBondContact O-N 3.15Å; D75-Q77 PolarHBondContact O-N 3.13Å; D75-Q77 VanDerWaalsContact O-N 3.12Å; D75-Q77 WeakPolarHBondContact OD1-CB 3.43Å; D75-Q77 PolarHBondContact OD1-N 3.23Å; D75-Q78 HydrophobicContact CB-CB 4.1Å; D75-Q78 HydrophobicContact CB-CG 3.93Å; D75-Q78 WeakPolarHBondContact O-CB 3.5Å; D75-Q78 PolarHBondContact O-N 3.32Å; D75-Q78 VanDerWaalsContact O-N 3.1Å; D75-Q78 WeakPolarHBondContact OD2-CG 3.37Å; D75-Q79 WeakPolarHBondContact O-CG 3.39Å; D75-Q79 PolarHBondContact O-N 2.84Å; D75-Q79 VanDerWaalsContact O-N 3.09Å
76	P	78.6	Confident	68.2	Low	49 Å²	49	85.8 Å²	85.8	32%	0.318	44%	0.44	S	S	.	.	H	α-helix	trans	-55.3	-27.1	177.9	-26.4	35.7	0	0	0	113.7	R74 Q79 L80 Y211	R74-P76 VanDerWaalsContact O-CD 3.27Å; R74-P76 WeakPolarHBondContact O-CD 3.39Å; R74-P76 VanDerWaalsContact O-N 3.13Å; P76-Q79 WeakPolarHBondContact O-CB 3.46Å; P76-Q79 PolarHBondContact O-N 3.46Å; P76-L80 PolarHBondContact O-N 3.43Å; P76-Y211 HydrophobicContact CB-CD2 3.89Å; P76-Y211 HydrophobicContact CB-CG 3.98Å
77	Q	84.9	Confident	70.8	Confident	95 Å²	95	81.3 Å²	81.3	44%	0.444	42%	0.417	S	S	.	.	H	α-helix	trans	-70	-48.8	175.5	-174.6	176.2	-8.6	0	0	111.2	D75 Q79 L80 L81 Y211	D75-Q77 PolarHBondContact O-N 3.13Å; D75-Q77 VanDerWaalsContact O-N 3.12Å; D75-Q77 WeakPolarHBondContact OD1-CB 3.43Å; D75-Q77 PolarHBondContact OD1-N 3.23Å; Q77-Q79 PolarHBondContact O-N 2.95Å; Q77-L80 PolarHBondContact O-N 3.47Å; Q77-L80 VanDerWaalsContact O-N 3.09Å; Q77-L81 HydrophobicContact CG-CD1 4.25Å; Q77-L81 WeakPolarHBondContact O-CG 3.31Å; Q77-L81 PolarHBondContact O-N 3.49Å; Q77-Y211 HydrophobicContact CB-CD1 4.22Å; Q77-Y211 HydrophobicContact CB-CE1 3.98Å; Q77-Y211 HydrophobicContact CG-CE1 4.22Å
78	Q	82.9	Confident	73.6	Confident	128 Å²	128	81 Å²	81	60%	0.598	42%	0.415	S	S	*	.	H	α-helix	trans	-56.4	-34.9	173.7	-72.5	174.8	13.4	0	0	112	D75 L81 A82	D75-Q78 HydrophobicContact CB-CB 4.1Å; D75-Q78 HydrophobicContact CB-CG 3.93Å; D75-Q78 WeakPolarHBondContact O-CB 3.5Å; D75-Q78 PolarHBondContact O-N 3.32Å; D75-Q78 VanDerWaalsContact O-N 3.1Å; D75-Q78 WeakPolarHBondContact OD2-CG 3.37Å; Q78-L81 PolarHBondContact O-N 3.4Å; Q78-A82 PolarHBondContact O-N 3.05Å; Q78-A82 VanDerWaalsContact O-N 3.07Å
79	Q	81.9	Confident	76.6	Confident	64 Å²	64	75.2 Å²	75.2	30%	0.299	39%	0.387	S	S	.	.	H	α-helix	trans	-62.8	-42	176.3	-74.4	-164.6	11.8	0	0	113.5	D75 P76 Q77 R183	D75-Q79 WeakPolarHBondContact O-CG 3.39Å; D75-Q79 PolarHBondContact O-N 2.84Å; D75-Q79 VanDerWaalsContact O-N 3.09Å; P76-Q79 WeakPolarHBondContact O-CB 3.46Å; P76-Q79 PolarHBondContact O-N 3.46Å; Q77-Q79 PolarHBondContact O-N 2.95Å; Q79-R183 PolarHBondContact O-NH1 2.97Å
80	L	87.9	Confident	79.3	Confident	30 Å²	30	73.3 Å²	73.3	16%	0.157	38%	0.375	C	S	.	.	H	α-helix	trans	-69.8	-40.5	173	176.7	59.9	0	0	0	111.3	P76 Q77 A82 M83 A210 N215 V216	P76-L80 PolarHBondContact O-N 3.43Å; Q77-L80 PolarHBondContact O-N 3.47Å; Q77-L80 VanDerWaalsContact O-N 3.09Å; L80-A82 PolarHBondContact O-N 2.96Å; L80-A82 VanDerWaalsContact O-N 3.16Å; L80-M83 HydrophobicContact CD1-CG 4.24Å; L80-M83 VanDerWaalsContact O-CB 3.27Å; L80-M83 WeakPolarHBondContact O-CB 3.42Å; L80-M83 PolarHBondContact O-N 2.78Å; L80-A210 WeakPolarHBondContact CD2-O 3.3Å; L80-N215 HydrophobicContact CD2-CB 4.34Å; L80-V216 HydrophobicContact CD1-CB 4.47Å
81	L	89.9	Confident	81.9	Confident	121 Å²	121	71 Å²	71	63%	0.634	37%	0.366	S	S	*	.	H	α-helix	trans	-62	-21.7	178	-68.3	173.3	0	0	0	113.2	Q77 Q78 P84	Q77-L81 HydrophobicContact CG-CD1 4.25Å; Q77-L81 WeakPolarHBondContact O-CG 3.31Å; Q77-L81 PolarHBondContact O-N 3.49Å; Q78-L81 PolarHBondContact O-N 3.4Å; L81-P84 WeakPolarHBondContact O-CD 3.38Å
82	A	90.7	Very high	84.7	Confident	36 Å²	36	59.9 Å²	59.9	30%	0.298	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-16.7	173.1	0	0	0	0	0	114	Q78 L80 G85 F86	Q78-A82 PolarHBondContact O-N 3.05Å; Q78-A82 VanDerWaalsContact O-N 3.07Å; L80-A82 PolarHBondContact O-N 2.96Å; L80-A82 VanDerWaalsContact O-N 3.16Å; A82-G85 PolarHBondContact O-N 2.98Å; A82-F86 HydrophobicContact CB-CD2 4.25Å; A82-F86 HydrophobicContact CB-CE2 3.89Å; A82-F86 WeakPolarHBondContact O-CD2 3.4Å; A82-F86 PolarHBondContact O-N 3.34Å; A82-F86 VanDerWaalsContact O-N 3.16Å
83	M	94.1	Very high	87.3	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-60.2	-45	-176.4	-75.6	-64.3	-63	0	0	113.9	L80 G85 F86 L87 R183 T186 I187 C213 V216	L80-M83 HydrophobicContact CD1-CG 4.24Å; L80-M83 VanDerWaalsContact O-CB 3.27Å; L80-M83 WeakPolarHBondContact O-CB 3.42Å; L80-M83 PolarHBondContact O-N 2.78Å; M83-G85 VanDerWaalsContact C-N 3.32Å; M83-G85 PolarHBondContact O-N 2.86Å; M83-F86 PolarHBondContact O-N 2.79Å; M83-L87 WeakPolarHBondContact O-CG 3.32Å; M83-L87 PolarHBondContact O-N 3.01Å; M83-R183 HydrophobicContact SD-CB 3.84Å; M83-R183 HydrophobicContact SD-CG 3.8Å; M83-T186 HydrophobicContact CE-CG2 4.34Å; M83-I187 HydrophobicContact CE-CD1 4.29Å; M83-I187 HydrophobicContact CE-CG1 3.88Å; M83-C213 HydrophobicContact CE-CB 3.92Å; M83-C213 HydrophobicContact CG-CB 3.94Å; M83-C213 HydrophobicContact SD-CB 3.6Å; M83-C213 VanDerWaalsContact SD-CB 3.6Å; M83-V216 HydrophobicContact CB-CB 4.06Å; M83-V216 HydrophobicContact CB-CG2 3.86Å; M83-V216 HydrophobicContact CE-CG1 4.43Å
84	P	95.6	Very high	89.5	Confident	43 Å²	43	53.7 Å²	53.7	28%	0.279	29%	0.288	S	S	.	.	H	α-helix	trans	-55.1	-44.5	175	-27.6	36.6	0	0	0	113	L81 F86 L87 E88 V94 V216	L81-P84 WeakPolarHBondContact O-CD 3.38Å; P84-F86 VanDerWaalsContact C-N 3.34Å; P84-F86 PolarHBondContact O-N 2.9Å; P84-L87 WeakPolarHBondContact O-CB 3.26Å; P84-L87 PolarHBondContact O-N 3.08Å; P84-L87 VanDerWaalsContact O-N 3.15Å; P84-E88 WeakPolarHBondContact O-CG 3.26Å; P84-E88 PolarHBondContact O-N 3.32Å; P84-V94 HydrophobicContact CB-CG2 3.91Å; P84-V94 HydrophobicContact CG-CG2 4.14Å; P84-V216 HydrophobicContact CG-CG2 4.3Å
85	G	94.3	Very high	91.3	Very high	32 Å²	32	50 Å²	50	33%	0.33	28%	0.278	S	S	.	.	H	α-helix	trans	-64	-36.2	177.8	0	0	0	0	0	113.2	A82 M83 R89	A82-G85 PolarHBondContact O-N 2.98Å; M83-G85 VanDerWaalsContact C-N 3.32Å; M83-G85 PolarHBondContact O-N 2.86Å; G85-R89 WeakPolarHBondContact O-CB 3.24Å; G85-R89 VanDerWaalsContact O-CG 3.29Å; G85-R89 WeakPolarHBondContact O-CG 3.47Å; G85-R89 PolarHBondContact O-N 3.25Å; G85-R89 VanDerWaalsContact O-N 3.1Å
86	F	95.8	Very high	92.3	Very high	15 Å²	15	50.7 Å²	50.7	7%	0.066	28%	0.28	C	S	.	.	H	α-helix	trans	-70.6	-35.7	172.7	-69.4	-58.7	0	0	0	113	A82 M83 P84 R89 A90 L167 P179 I187	A82-F86 HydrophobicContact CB-CD2 4.25Å; A82-F86 HydrophobicContact CB-CE2 3.89Å; A82-F86 WeakPolarHBondContact O-CD2 3.4Å; A82-F86 PolarHBondContact O-N 3.34Å; A82-F86 VanDerWaalsContact O-N 3.16Å; M83-F86 PolarHBondContact O-N 2.79Å; P84-F86 VanDerWaalsContact C-N 3.34Å; P84-F86 PolarHBondContact O-N 2.9Å; F86-R89 VanDerWaalsContact CE1-NH1 3.34Å; F86-A90 WeakPolarHBondContact O-CB 3.35Å; F86-A90 PolarHBondContact O-N 3.45Å; F86-L167 HydrophobicContact CB-CD2 4.5Å; F86-L167 HydrophobicContact CD1-CD2 4.16Å; F86-P179 HydrophobicContact CD1-CB 4.02Å; F86-P179 HydrophobicContact CD1-CG 4.1Å; F86-P179 HydrophobicContact CD2-CB 4.11Å; F86-P179 HydrophobicContact CE1-CB 4.1Å; F86-P179 HydrophobicContact CE1-CG 4.35Å; F86-P179 HydrophobicContact CE2-CB 4.2Å; F86-P179 HydrophobicContact CG-CB 4.03Å; F86-P179 HydrophobicContact CG-CG 4.43Å; F86-P179 HydrophobicContact CZ-CB 4.19Å; F86-I187 HydrophobicContact CB-CD1 3.54Å; F86-I187 HydrophobicContact CG-CD1 4.44Å
87	L	96.6	Very high	93.2	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62	-48.3	173.6	-73.5	168.1	0	0	0	110.6	M83 P84 R89 A90 G91 L92 V94 L97 I187 F190 V216	M83-L87 WeakPolarHBondContact O-CG 3.32Å; M83-L87 PolarHBondContact O-N 3.01Å; P84-L87 WeakPolarHBondContact O-CB 3.26Å; P84-L87 PolarHBondContact O-N 3.08Å; P84-L87 VanDerWaalsContact O-N 3.15Å; L87-R89 VanDerWaalsContact C-N 3.35Å; L87-R89 PolarHBondContact O-N 3.02Å; L87-A90 CarbonylContact O-C 3.18Å; L87-A90 WeakPolarHBondContact O-CA 3.48Å; L87-A90 WeakPolarHBondContact O-CB 3.44Å; L87-A90 PolarHBondContact O-N 3.18Å; L87-G91 PolarHBondContact O-N 2.82Å; L87-G91 VanDerWaalsContact O-N 3.17Å; L87-L92 CarbonylContact C-O 3.6Å; L87-L92 HydrophobicContact CB-CB 4.26Å; L87-L92 HydrophobicContact CD2-CB 4.17Å; L87-L92 HydrophobicContact CD2-CD1 3.95Å; L87-L92 CarbonylContact O-C 3.52Å; L87-L92 WeakPolarHBondContact O-CA 3.06Å; L87-L92 PolarHBondContact O-N 3.08Å; L87-V94 HydrophobicContact CD1-CG2 4.07Å; L87-L97 HydrophobicContact CD1-CD1 3.98Å; L87-I187 HydrophobicContact CD2-CG1 4.07Å; L87-I187 HydrophobicContact CD2-CG2 4.28Å; L87-F190 HydrophobicContact CD2-CD2 4.33Å; L87-V216 HydrophobicContact CD1-CG1 4.26Å; L87-V216 HydrophobicContact CD1-CG2 3.73Å
88	E	95.7	Very high	93.7	Very high	134 Å²	134	45.8 Å²	45.8	63%	0.626	25%	0.254	S	S	*	.	H	α-helix	trans	-57	-47.6	178	-74.8	174.6	-172.5	0	0	111.5	P84 A90 G91 L92	P84-E88 WeakPolarHBondContact O-CG 3.26Å; P84-E88 PolarHBondContact O-N 3.32Å; E88-A90 VanDerWaalsContact C-N 3.28Å; E88-A90 PolarHBondContact O-N 3.48Å; E88-G91 WeakPolarHBondContact O-CA 3.28Å; E88-G91 PolarHBondContact O-N 3.3Å; E88-L92 WeakPolarHBondContact CA-O 3.42Å; E88-L92 PolarHBondContact N-O 3.05Å; E88-L92 VanDerWaalsContact N-O 3.14Å
89	R	95.9	Very high	94.3	Very high	22 Å²	22	46.1 Å²	46.1	8%	0.083	26%	0.255	C	S	.	.	H	α-helix	trans	-62.2	-33.1	175.5	-73.3	170.2	58.3	-165.6	-4.6	113.2	G85 F86 L87 G91 R166 L167 T170 T177	G85-R89 WeakPolarHBondContact O-CB 3.24Å; G85-R89 VanDerWaalsContact O-CG 3.29Å; G85-R89 WeakPolarHBondContact O-CG 3.47Å; G85-R89 PolarHBondContact O-N 3.25Å; G85-R89 VanDerWaalsContact O-N 3.1Å; F86-R89 VanDerWaalsContact CE1-NH1 3.34Å; L87-R89 VanDerWaalsContact C-N 3.35Å; L87-R89 PolarHBondContact O-N 3.02Å; R89-G91 PolarHBondContact O-N 3.38Å; R89-R166 WeakPolarHBondContact O-CB 3.46Å; R89-L167 HydrophobicContact CB-CD2 3.82Å; R89-L167 PolarHBondContact NH2-O 3.46Å; R89-T170 PolarHBondContact NE-OG1 2.99Å; R89-T177 PolarHBondContact NH1-O 3.35Å; R89-T177 PolarHBondContact NH1-OG1 2.86Å; R89-T177 PolarHBondContact NH2-O 3.02Å
90	A	96.2	Very high	95	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-3.8	173.4	0	0	0	0	0	113.1	F86 L87 E88 V163 R166 L167 I187	F86-A90 WeakPolarHBondContact O-CB 3.35Å; F86-A90 PolarHBondContact O-N 3.45Å; L87-A90 CarbonylContact O-C 3.18Å; L87-A90 WeakPolarHBondContact O-CA 3.48Å; L87-A90 WeakPolarHBondContact O-CB 3.44Å; L87-A90 PolarHBondContact O-N 3.18Å; E88-A90 VanDerWaalsContact C-N 3.28Å; E88-A90 PolarHBondContact O-N 3.48Å; A90-V163 HydrophobicContact CB-CG1 4.19Å; A90-R166 WeakPolarHBondContact O-CD 3.43Å; A90-R166 PolarHBondContact O-NH1 3.04Å; A90-L167 HydrophobicContact CB-CD2 4.47Å; A90-L167 HydrophobicContact CB-CG 4.41Å; A90-I187 HydrophobicContact CB-CG2 3.63Å
91	G	95.6	Very high	95.5	Very high	44 Å²	44	43.1 Å²	43.1	45%	0.454	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.9	27.6	-177	0	0	0	0	0	113.6	L87 E88 R89	L87-G91 PolarHBondContact O-N 2.82Å; L87-G91 VanDerWaalsContact O-N 3.17Å; E88-G91 WeakPolarHBondContact O-CA 3.28Å; E88-G91 PolarHBondContact O-N 3.3Å; R89-G91 PolarHBondContact O-N 3.38Å
92	L	96.8	Very high	95.9	Very high	5 Å²	5	37.5 Å²	37.5	3%	0.026	21%	0.212	C	C	.	.			trans	-119	156	175.2	-59.4	178.9	0	0	0	110.4	L87 E88 I187 F190 H191 L194	L87-L92 CarbonylContact C-O 3.6Å; L87-L92 HydrophobicContact CB-CB 4.26Å; L87-L92 HydrophobicContact CD2-CB 4.17Å; L87-L92 HydrophobicContact CD2-CD1 3.95Å; L87-L92 CarbonylContact O-C 3.52Å; L87-L92 WeakPolarHBondContact O-CA 3.06Å; L87-L92 PolarHBondContact O-N 3.08Å; E88-L92 WeakPolarHBondContact CA-O 3.42Å; E88-L92 PolarHBondContact N-O 3.05Å; E88-L92 VanDerWaalsContact N-O 3.14Å; L92-I187 HydrophobicContact CD1-CG2 4.45Å; L92-F190 HydrophobicContact CD1-CB 4.38Å; L92-H191 HydrophobicContact CD1-CB 4.06Å; L92-L194 HydrophobicContact CD2-CD1 3.82Å
93	T	95.9	Very high	96.3	Very high	58 Å²	58	35.8 Å²	35.8	36%	0.356	20%	0.198	S	C	.	.			trans	-117.3	156.8	171	56.7	0	0	0	0	109.7	E95 Q96	T93-E95 PolarHBondContact O-N 2.98Å; T93-Q96 PolarHBondContact O-N 3.26Å; T93-Q96 WeakPolarHBondContact OG1-CG 3.47Å; T93-Q96 PolarHBondContact OG1-N 3.17Å; T93-Q96 PolarHBondContact OG1-OE1 3.47Å
94	V	95.9	Very high	96.5	Very high	19 Å²	19	35.8 Å²	35.8	12%	0.115	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-33.6	178.6	-171.8	0	0	0	0	110.5	P84 L87 Q96 L97 V216 R218	P84-V94 HydrophobicContact CB-CG2 3.91Å; P84-V94 HydrophobicContact CG-CG2 4.14Å; L87-V94 HydrophobicContact CD1-CG2 4.07Å; V94-Q96 VanDerWaalsContact C-N 3.33Å; V94-Q96 PolarHBondContact O-N 3.42Å; V94-L97 WeakPolarHBondContact O-CB 3.47Å; V94-L97 PolarHBondContact O-N 2.76Å; V94-V216 HydrophobicContact CG1-CG2 4.33Å; V94-V216 WeakPolarHBondContact CG1-O 3.29Å; V94-V216 HydrophobicContact CG2-CG2 4.32Å; V94-R218 VanDerWaalsContact CG1-CD 3.48Å; V94-R218 HydrophobicContact CG1-CG 3.67Å
95	E	96.4	Very high	96.7	Very high	96 Å²	96	33.7 Å²	33.7	45%	0.449	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-61.8	-37.7	175.3	-67.1	61.2	-140.6	0	0	112.3	T93 L97 D98 R218	T93-E95 PolarHBondContact O-N 2.98Å; E95-L97 PolarHBondContact O-N 3.33Å; E95-D98 WeakPolarHBondContact O-CB 3.4Å; E95-D98 PolarHBondContact O-N 3.37Å; E95-D98 VanDerWaalsContact O-N 3.08Å; E95-R218 IonicContact OE1-CZ 3.75Å; E95-R218 VanDerWaalsContact OE1-CZ 3.25Å; E95-R218 IonicContact OE1-NH1 3.16Å; E95-R218 PolarHBondContact OE1-NH1 3.19Å; E95-R218 IonicContact OE1-NH2 3.76Å; E95-R218 PolarHBondContact OE1-NH2 2.9Å
96	Q	96.7	Very high	96.9	Very high	73 Å²	73	32.2 Å²	32.2	34%	0.341	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-61.3	-30.1	178	-82.6	168.2	-46.3	0	0	112.2	T93 V94 D98 H99 L194	T93-Q96 PolarHBondContact O-N 3.26Å; T93-Q96 WeakPolarHBondContact OG1-CG 3.47Å; T93-Q96 PolarHBondContact OG1-N 3.17Å; T93-Q96 PolarHBondContact OG1-OE1 3.47Å; V94-Q96 VanDerWaalsContact C-N 3.33Å; V94-Q96 PolarHBondContact O-N 3.42Å; Q96-D98 PolarHBondContact O-N 2.94Å; Q96-H99 WeakPolarHBondContact O-CB 3.27Å; Q96-H99 PolarHBondContact O-N 2.7Å; Q96-H99 PolarHBondContact O-ND1 3.42Å; Q96-H99 VanDerWaalsContact O-ND1 3.16Å; Q96-L194 HydrophobicContact CB-CD1 4.16Å; Q96-L194 WeakPolarHBondContact O-CD2 3.3Å
97	L	97.3	Very high	96.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-65.2	-24.1	178.5	-51.9	-171.3	0	0	0	112.5	L87 V94 E95 H99 L100 F190 L194 V216	L87-L97 HydrophobicContact CD1-CD1 3.98Å; V94-L97 WeakPolarHBondContact O-CB 3.47Å; V94-L97 PolarHBondContact O-N 2.76Å; E95-L97 PolarHBondContact O-N 3.33Å; L97-H99 PolarHBondContact O-N 3.17Å; L97-L100 HydrophobicContact CD2-CD1 4.41Å; L97-L100 WeakPolarHBondContact O-CB 3.12Å; L97-L100 PolarHBondContact O-N 2.69Å; L97-F190 HydrophobicContact CD1-CD2 3.9Å; L97-F190 HydrophobicContact CD1-CE2 3.85Å; L97-F190 HydrophobicContact CD1-CG 4.29Å; L97-F190 HydrophobicContact CD1-CZ 4.22Å; L97-F190 HydrophobicContact CD2-CB 3.68Å; L97-F190 HydrophobicContact CD2-CD1 4.1Å; L97-F190 HydrophobicContact CD2-CD2 4.02Å; L97-F190 HydrophobicContact CD2-CG 3.69Å; L97-L194 HydrophobicContact CD2-CD1 4.18Å; L97-V216 HydrophobicContact CD1-CG1 4.01Å
98	D	95.3	Very high	96.7	Very high	41 Å²	41	32 Å²	32	22%	0.219	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-67	-22	178.8	-61.4	-33.8	0	0	0	111.7	E95 Q96 L100 R218	E95-D98 WeakPolarHBondContact O-CB 3.4Å; E95-D98 PolarHBondContact O-N 3.37Å; E95-D98 VanDerWaalsContact O-N 3.08Å; Q96-D98 PolarHBondContact O-N 2.94Å; D98-L100 PolarHBondContact O-N 2.77Å; D98-R218 IonicContact OD2-CZ 3.25Å; D98-R218 IonicContact OD2-NE 2.68Å; D98-R218 IonicContact OD2-NH2 3.33Å; D98-R218 PolarHBondContact OD2-NH2 3.12Å
99	H	95.6	Very high	96.6	Very high	136 Å²	136	27.9 Å²	27.9	63%	0.63	15%	0.149	S	C	*	.	G	3₁₀ helix	trans	-71.6	-12.5	173.5	-58.4	109.8	0	0	0	113.7	Q96 L97 N101	Q96-H99 WeakPolarHBondContact O-CB 3.27Å; Q96-H99 PolarHBondContact O-N 2.7Å; Q96-H99 PolarHBondContact O-ND1 3.42Å; Q96-H99 VanDerWaalsContact O-ND1 3.16Å; L97-H99 PolarHBondContact O-N 3.17Å; H99-N101 VanDerWaalsContact C-N 3.25Å; H99-N101 PolarHBondContact O-N 2.91Å
100	L	97.8	Very high	96.6	Very high	3 Å²	3	27.6 Å²	27.6	2%	0.016	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-83.3	3.4	179.3	-63.5	177.4	0	0	0	113.2	L97 D98 I102 F190 F193 L194 V198 L200 A201	L97-L100 HydrophobicContact CD2-CD1 4.41Å; L97-L100 WeakPolarHBondContact O-CB 3.12Å; L97-L100 PolarHBondContact O-N 2.69Å; D98-L100 PolarHBondContact O-N 2.77Å; L100-I102 VanDerWaalsContact C-N 3.27Å; L100-I102 HydrophobicContact CB-CD1 4.04Å; L100-I102 HydrophobicContact CB-CG1 3.66Å; L100-I102 HydrophobicContact CD1-CD1 4.42Å; L100-I102 PolarHBondContact O-N 2.89Å; L100-I102 VanDerWaalsContact O-N 3.1Å; L100-F190 HydrophobicContact CD1-CD1 3.81Å; L100-F193 HydrophobicContact CD1-CB 4.24Å; L100-F193 HydrophobicContact CD2-CB 3.72Å; L100-L194 HydrophobicContact CD1-CD2 4.39Å; L100-L194 HydrophobicContact CD1-CG 4.21Å; L100-L194 HydrophobicContact CD2-CD2 3.69Å; L100-L194 HydrophobicContact CD2-CG 3.94Å; L100-L194 HydrophobicContact CG-CD2 3.84Å; L100-L194 HydrophobicContact CG-CG 4.17Å; L100-V198 HydrophobicContact CD2-CG2 3.93Å; L100-L200 CarbonylContact O-C 3.55Å; L100-L200 VanDerWaalsContact O-CA 3.24Å; L100-L200 WeakPolarHBondContact O-CA 3.46Å; L100-A201 HydrophobicContact CB-CB 4.13Å; L100-A201 PolarHBondContact O-N 3.28Å
101	N	97.3	Very high	96.6	Very high	27 Å²	27	29 Å²	29	14%	0.144	16%	0.159	C	C	.	.			trans	44.8	49.2	174.5	-55.5	-45	0	0	0	113.7	H99 D199 L200 W221 W320	H99-N101 VanDerWaalsContact C-N 3.25Å; H99-N101 PolarHBondContact O-N 2.91Å; N101-D199 PolarHBondContact ND2-O 3.32Å; N101-L200 HydrophobicContact CB-CB 4.24Å; N101-W221 HydrophobicContact CB-CD2 4.12Å; N101-W221 HydrophobicContact CB-CG 4.38Å; N101-W221 HydrophobicContact CB-CZ2 4.18Å; N101-W221 VanDerWaalsContact OD1-CE2 3.28Å; N101-W221 WeakPolarHBondContact OD1-CZ2 3.39Å; N101-W221 PolarHBondContact OD1-NE1 3.44Å; N101-W320 HydrophobicContact CB-CZ2 4.16Å; N101-W320 PolarHBondContact O-NE1 2.86Å
102	I	98.6	Very high	96.6	Very high	3 Å²	3	27.3 Å²	27.3	2%	0.015	14%	0.142	C	C	.	.			trans	-68.1	137.8	-157.6	-67.7	172.9	0	0	0	113.3	L100 H104 F190 A201 I203 V217 P220 W221	L100-I102 VanDerWaalsContact C-N 3.27Å; L100-I102 HydrophobicContact CB-CD1 4.04Å; L100-I102 HydrophobicContact CB-CG1 3.66Å; L100-I102 HydrophobicContact CD1-CD1 4.42Å; L100-I102 PolarHBondContact O-N 2.89Å; L100-I102 VanDerWaalsContact O-N 3.1Å; I102-H104 HydrophobicContact CG2-CB 4.2Å; I102-F190 HydrophobicContact CD1-CE1 4.17Å; I102-A201 VanDerWaalsContact CA-O 3.31Å; I102-A201 WeakPolarHBondContact CA-O 3.3Å; I102-A201 HydrophobicContact CG1-CB 4.34Å; I102-I203 HydrophobicContact CD1-CG1 4.44Å; I102-I203 HydrophobicContact CG1-CG1 4.43Å; I102-I203 HydrophobicContact CG2-CB 4.16Å; I102-I203 HydrophobicContact CG2-CG1 3.66Å; I102-V217 HydrophobicContact CB-CG1 4.27Å; I102-V217 HydrophobicContact CD1-CB 4.34Å; I102-V217 HydrophobicContact CD1-CG1 3.8Å; I102-V217 HydrophobicContact CD1-CG2 3.51Å; I102-V217 HydrophobicContact CG2-CG1 4.2Å; I102-P220 HydrophobicContact CB-CB 4.49Å; I102-P220 HydrophobicContact CG2-CB 4.36Å; I102-P220 CarbonylContact O-C 3.58Å; I102-P220 WeakPolarHBondContact O-CA 3.05Å; I102-W221 PolarHBondContact O-N 3.46Å
103	I	98.9	Very high	96.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	118.1	160.9	-59.3	179.1	0	0	0	107.9	V105 T118 L122 L200 A201 I203 V222 L316 W320	I103-V105 HydrophobicContact CG2-CG2 4.05Å; I103-T118 HydrophobicContact CD1-CG2 3.59Å; I103-T118 HydrophobicContact CG2-CG2 4.29Å; I103-L122 HydrophobicContact CD1-CD1 3.51Å; I103-L200 HydrophobicContact CD1-CD1 3.85Å; I103-L200 HydrophobicContact CG1-CD1 4.27Å; I103-A201 PolarHBondContact N-O 3.49Å; I103-I203 PolarHBondContact O-N 3.47Å; I103-V222 HydrophobicContact CB-CG1 4.34Å; I103-V222 HydrophobicContact CD1-CG1 4.36Å; I103-V222 HydrophobicContact CG1-CG1 3.84Å; I103-V222 HydrophobicContact CG2-CG1 4.03Å; I103-L316 HydrophobicContact CG2-CB 4.34Å; I103-L316 HydrophobicContact CG2-CD1 4.09Å; I103-L316 HydrophobicContact CG2-CD2 4.44Å; I103-W320 HydrophobicContact CD1-CB 4.03Å; I103-W320 HydrophobicContact CD1-CG 3.91Å; I103-W320 HydrophobicContact CG1-CG 4.2Å
104	H	98.8	Very high	96.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	120.2	-172.8	-163.7	-166.1	0	0	0	111.4	I102 I203 V205 T214 P220 V222 C223 G224	I102-H104 HydrophobicContact CG2-CB 4.2Å; H104-I203 PolarHBondContact CD2-O 3.29Å; H104-V205 WeakPolarHBondContact NE2-CG2 3.4Å; H104-T214 PolarHBondContact NE2-OG1 3.24Å; H104-P220 HydrophobicContact CB-CB 4.11Å; H104-V222 PolarHBondContact N-O 3.31Å; H104-V222 VanDerWaalsContact N-O 3.1Å; H104-C223 CarbonylContact O-C 3.56Å; H104-C223 VanDerWaalsContact O-CA 3.28Å; H104-C223 WeakPolarHBondContact O-CA 3.42Å; H104-G224 PolarHBondContact O-N 3.21Å
105	V	98.9	Very high	96.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	127.7	-170.4	-175	0	0	0	0	111.7	I103 T114 C115 I203 V205 G224 L316	I103-V105 HydrophobicContact CG2-CG2 4.05Å; V105-T114 HydrophobicContact CG1-CG2 4.24Å; V105-C115 VanDerWaalsContact CB-SG 3.59Å; V105-I203 PolarHBondContact N-O 2.87Å; V105-V205 WeakPolarHBondContact O-CG2 3.44Å; V105-V205 PolarHBondContact O-N 2.8Å; V105-G224 CarbonylContact C-O 3.54Å; V105-G224 WeakPolarHBondContact CA-O 3.49Å; V105-L316 HydrophobicContact CG2-CD1 3.86Å
106	T	98.4	Very high	97	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	-179.2	169.4	-166.7	0	0	0	0	111.7	K111 G208 G224 I225 A226 K247 I250	T106-K111 VanDerWaalsContact C-CG 3.44Å; T106-G208 PolarHBondContact OG1-O 2.95Å; T106-G224 PolarHBondContact N-O 3.27Å; T106-I225 HydrophobicContact CG2-CD1 4.37Å; T106-I225 HydrophobicContact CG2-CG1 3.86Å; T106-I225 CarbonylContact O-C 3.46Å; T106-I225 WeakPolarHBondContact O-CA 3.42Å; T106-A226 PolarHBondContact O-N 2.92Å; T106-K247 HydrophobicContact CG2-CB 3.81Å; T106-K247 HydrophobicContact CG2-CG 4.2Å; T106-K247 WeakPolarHBondContact CG2-O 3.19Å; T106-I250 HydrophobicContact CG2-CD1 3.61Å; T106-I250 HydrophobicContact CG2-CG1 4.04Å; T106-I250 HydrophobicContact CG2-CG2 4.46Å
107	G	96.5	Very high	97.1	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.085	C	C	.	.			trans	148.6	169.6	-174.9	0	0	0	0	0	112.1	K111 K247	G107-K111 WeakPolarHBondContact O-CD 3.3Å; G107-K111 WeakPolarHBondContact O-CE 3.42Å; G107-K111 PolarHBondContact O-NZ 2.85Å; G107-K247 VanDerWaalsContact C-NZ 3.34Å; G107-K247 PolarHBondContact O-NZ 3.16Å
108	T	92.6	Very high	97.2	Very high	11 Å²	11	15.9 Å²	15.9	7%	0.067	9%	0.085	C	C	.	.	S	Bend	trans	-86.7	-50.8	170.7	-60.7	0	0	0	0	109.7	K111 S227 G229 D231 K247	T108-K111 PolarHBondContact O-NZ 2.9Å; T108-S227 WeakPolarHBondContact CA-O 3.42Å; T108-S227 WeakPolarHBondContact CB-O 3.4Å; T108-S227 PolarHBondContact N-O 3.2Å; T108-G229 WeakPolarHBondContact CG2-O 3.46Å; T108-G229 PolarHBondContact OG1-N 3.41Å; T108-G229 PolarHBondContact OG1-O 3.23Å; T108-D231 HydrophobicContact CG2-CB 3.49Å; T108-D231 VanDerWaalsContact CG2-CB 3.49Å; T108-K247 WeakPolarHBondContact OG1-CE 3.45Å
109	K	93.6	Very high	97.4	Very high	47 Å²	47	14.3 Å²	14.3	20%	0.204	8%	0.076	C	C	.	.	B	Isolated β-bridge	trans	-126.1	150.8	176.2	-56.6	-59.7	169	-154.2	0	110.4	A226 S227 D231 H382 T383	K109-A226 WeakPolarHBondContact O-CB 3.43Å; K109-S227 PolarHBondContact N-O 3.31Å; K109-S227 PolarHBondContact O-N 3.47Å; K109-D231 IonicContact NZ-OD2 2.8Å; K109-D231 PolarHBondContact NZ-OD2 3.43Å; K109-H382 PolarHBondContact NZ-NE2 3.43Å; K109-T383 VanDerWaalsContact CE-CG2 3.42Å; K109-T383 VanDerWaalsContact CE-OG1 3.3Å; K109-T383 WeakPolarHBondContact CE-OG1 3.23Å; K109-T383 VanDerWaalsContact NZ-CG2 3.25Å
110	G	95	Very high	97.5	Very high	17 Å²	17	10.2 Å²	10.2	18%	0.175	6%	0.055	C	C	.	.	S	Bend	trans	86.1	-0.3	177.3	0	0	0	0	0	116.4	T114 N309	G110-T114 VanDerWaalsContact O-CB 3.29Å; G110-T114 WeakPolarHBondContact O-CB 3.41Å; G110-T114 PolarHBondContact O-N 3.32Å; G110-T114 PolarHBondContact O-OG1 2.68Å; G110-N309 WeakPolarHBondContact CA-ND2 3.35Å; G110-N309 WeakPolarHBondContact CA-OD1 3.29Å
111	K	96.1	Very high	97.6	Very high	28 Å²	28	10 Å²	10	12%	0.122	5%	0.054	C	C	.	.	H	α-helix	trans	-54.5	-66.9	176	-66	-171.5	-65.5	-65.3	0	112.5	T106 G107 T108 S113 T114 C115 E204 V205	T106-K111 VanDerWaalsContact C-CG 3.44Å; G107-K111 WeakPolarHBondContact O-CD 3.3Å; G107-K111 WeakPolarHBondContact O-CE 3.42Å; G107-K111 PolarHBondContact O-NZ 2.85Å; T108-K111 PolarHBondContact O-NZ 2.9Å; K111-S113 VanDerWaalsContact C-N 3.31Å; K111-S113 PolarHBondContact O-N 3.47Å; K111-T114 WeakPolarHBondContact O-CB 3.41Å; K111-T114 PolarHBondContact O-N 3.44Å; K111-C115 PolarHBondContact O-N 3.29Å; K111-C115 PolarHBondContact O-SG 3.47Å; K111-C115 VanDerWaalsContact O-SG 3.36Å; K111-E204 HydrophobicContact CB-CG 4.03Å; K111-E204 WeakPolarHBondContact CB-OE1 3.5Å; K111-E204 HydrophobicContact CD-CG 4.34Å; K111-V205 WeakPolarHBondContact CE-O 3.36Å
112	G	96.3	Very high	97.6	Very high	9 Å²	9	8.8 Å²	8.8	9%	0.093	5%	0.047	C	C	.	.	H	α-helix	trans	-53.3	-42.3	177.3	0	0	0	0	0	113.8	C115 A116 E204	G112-C115 PolarHBondContact O-N 2.97Å; G112-A116 WeakPolarHBondContact O-CB 3.48Å; G112-A116 PolarHBondContact O-N 2.86Å; G112-E204 PolarHBondContact N-OE1 3.02Å; G112-E204 VanDerWaalsContact N-OE1 3.16Å
113	S	98	Very high	97.6	Very high	7 Å²	7	11.9 Å²	11.9	5%	0.049	6%	0.059	C	C	.	.	H	α-helix	trans	-64.5	-41.7	175.9	-57.2	0	0	0	0	112.7	K111 A116 F117 Q306	K111-S113 VanDerWaalsContact C-N 3.31Å; K111-S113 PolarHBondContact O-N 3.47Å; S113-A116 PolarHBondContact O-N 3.37Å; S113-F117 WeakPolarHBondContact O-CD2 3.2Å; S113-F117 PolarHBondContact O-N 3.38Å; S113-Q306 PolarHBondContact OG-OE1 3.48Å
114	T	98.8	Very high	97.6	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-62.1	-45.2	175.4	-58.8	0	0	0	0	110.3	V105 G110 K111 F117 T118 L312 A313 L316	V105-T114 HydrophobicContact CG1-CG2 4.24Å; G110-T114 VanDerWaalsContact O-CB 3.29Å; G110-T114 WeakPolarHBondContact O-CB 3.41Å; G110-T114 PolarHBondContact O-N 3.32Å; G110-T114 PolarHBondContact O-OG1 2.68Å; K111-T114 WeakPolarHBondContact O-CB 3.41Å; K111-T114 PolarHBondContact O-N 3.44Å; T114-F117 PolarHBondContact O-N 2.89Å; T114-T118 WeakPolarHBondContact O-CB 3.31Å; T114-T118 PolarHBondContact O-N 2.85Å; T114-T118 PolarHBondContact O-OG1 2.82Å; T114-L312 HydrophobicContact CG2-CB 4.05Å; T114-L312 HydrophobicContact CG2-CD2 3.7Å; T114-L312 HydrophobicContact CG2-CG 3.68Å; T114-A313 HydrophobicContact CG2-CB 4.32Å; T114-L316 HydrophobicContact CG2-CD1 3.85Å
115	C	98.8	Very high	97.5	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-62.7	-41.6	175.9	-64.1	0	0	0	0	112	V105 K111 G112 T118 E119 F131 I202	V105-C115 VanDerWaalsContact CB-SG 3.59Å; K111-C115 PolarHBondContact O-N 3.29Å; K111-C115 PolarHBondContact O-SG 3.47Å; K111-C115 VanDerWaalsContact O-SG 3.36Å; G112-C115 PolarHBondContact O-N 2.97Å; C115-T118 PolarHBondContact O-N 2.84Å; C115-E119 VanDerWaalsContact O-CB 3.29Å; C115-E119 WeakPolarHBondContact O-CB 3.5Å; C115-E119 PolarHBondContact O-N 2.9Å; C115-F131 HydrophobicContact CB-CD2 4.07Å; C115-F131 HydrophobicContact CB-CE1 4.34Å; C115-F131 HydrophobicContact CB-CE2 3.24Å; C115-F131 HydrophobicContact CB-CZ 3.4Å; C115-I202 HydrophobicContact CB-CG2 3.64Å
116	A	98.6	Very high	97.5	Very high	5 Å²	5	20.9 Å²	20.9	4%	0.041	12%	0.118	C	C	.	.	H	α-helix	trans	-63.5	-44.6	177.7	0	0	0	0	0	112.1	G112 S113 R120 F131 T360 W362	G112-A116 WeakPolarHBondContact O-CB 3.48Å; G112-A116 PolarHBondContact O-N 2.86Å; S113-A116 PolarHBondContact O-N 3.37Å; A116-R120 VanDerWaalsContact O-CB 3.32Å; A116-R120 WeakPolarHBondContact O-CB 3.42Å; A116-R120 PolarHBondContact O-N 3.2Å; A116-F131 HydrophobicContact CB-CE1 4.48Å; A116-T360 HydrophobicContact CB-CG2 4.06Å; A116-W362 HydrophobicContact CB-CB 4.12Å; A116-W362 HydrophobicContact CB-CD2 3.86Å; A116-W362 HydrophobicContact CB-CE3 3.86Å; A116-W362 HydrophobicContact CB-CG 3.97Å
117	F	98.8	Very high	97.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-60.3	-45.9	171.8	-77.5	-57.6	0	0	0	111.3	S113 T114 R120 I121 L299 L301 Q306 N309 A310 A313 L357 T360	S113-F117 WeakPolarHBondContact O-CD2 3.2Å; S113-F117 PolarHBondContact O-N 3.38Å; T114-F117 PolarHBondContact O-N 2.89Å; F117-R120 PolarHBondContact O-N 3.21Å; F117-I121 WeakPolarHBondContact O-CB 3.12Å; F117-I121 WeakPolarHBondContact O-CD1 3.14Å; F117-I121 WeakPolarHBondContact O-CG1 3.3Å; F117-I121 PolarHBondContact O-N 3.41Å; F117-L299 HydrophobicContact CE1-CB 4.48Å; F117-L299 HydrophobicContact CE1-CD2 4.36Å; F117-L299 HydrophobicContact CZ-CB 4.3Å; F117-L299 HydrophobicContact CZ-CD1 4.48Å; F117-L299 HydrophobicContact CZ-CD2 4.4Å; F117-L301 HydrophobicContact CD2-CD1 4.35Å; F117-L301 HydrophobicContact CE1-CD1 4.34Å; F117-L301 HydrophobicContact CE1-CG 4.15Å; F117-L301 HydrophobicContact CE2-CB 4.44Å; F117-L301 HydrophobicContact CE2-CD1 3.74Å; F117-L301 HydrophobicContact CE2-CG 4.27Å; F117-L301 HydrophobicContact CZ-CB 3.82Å; F117-L301 HydrophobicContact CZ-CD1 3.73Å; F117-L301 HydrophobicContact CZ-CG 3.73Å; F117-Q306 HydrophobicContact CE2-CB 4.32Å; F117-Q306 HydrophobicContact CZ-CB 4.45Å; F117-N309 HydrophobicContact CD2-CB 4.36Å; F117-N309 HydrophobicContact CE2-CB 4.34Å; F117-A310 HydrophobicContact CD2-CB 4.22Å; F117-A310 HydrophobicContact CE2-CB 4.01Å; F117-A310 HydrophobicContact CZ-CB 4.22Å; F117-A313 HydrophobicContact CB-CB 3.43Å; F117-A313 VanDerWaalsContact CB-CB 3.43Å; F117-A313 HydrophobicContact CG-CB 4.45Å; F117-L357 HydrophobicContact CB-CD2 4.24Å; F117-L357 HydrophobicContact CD1-CD2 3.52Å; F117-L357 HydrophobicContact CE1-CD2 4.02Å; F117-L357 HydrophobicContact CG-CD2 3.99Å; F117-T360 VanDerWaalsContact CD1-CB 3.48Å; F117-T360 HydrophobicContact CD1-CG2 3.61Å; F117-T360 VanDerWaalsContact CD1-OG1 3.23Å; F117-T360 WeakPolarHBondContact CD1-OG1 3.24Å; F117-T360 HydrophobicContact CE1-CG2 3.89Å; F117-T360 HydrophobicContact CG-CG2 4.13Å
118	T	98.9	Very high	97.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.5	-47.9	-178.5	-57.9	0	0	0	0	111.4	I103 T114 C115 L122 I202 A313	I103-T118 HydrophobicContact CD1-CG2 3.59Å; I103-T118 HydrophobicContact CG2-CG2 4.29Å; T114-T118 WeakPolarHBondContact O-CB 3.31Å; T114-T118 PolarHBondContact O-N 2.85Å; T114-T118 PolarHBondContact O-OG1 2.82Å; C115-T118 PolarHBondContact O-N 2.84Å; T118-L122 HydrophobicContact CG2-CD1 3.94Å; T118-L122 WeakPolarHBondContact O-CG 3.36Å; T118-L122 PolarHBondContact O-N 2.87Å; T118-I202 HydrophobicContact CG2-CG1 4.03Å; T118-A313 WeakPolarHBondContact OG1-CB 3.48Å
119	E	98.8	Very high	97.8	Very high	8 Å²	8	26 Å²	26	4%	0.037	14%	0.136	C	C	.	.	H	α-helix	trans	-57.9	-52.6	175.7	-174.8	-70.7	140.4	0	0	110.6	C115 I121 L122 R123 T129 F131 G148 I202	C115-E119 VanDerWaalsContact O-CB 3.29Å; C115-E119 WeakPolarHBondContact O-CB 3.5Å; C115-E119 PolarHBondContact O-N 2.9Å; E119-I121 VanDerWaalsContact C-N 3.33Å; E119-I121 PolarHBondContact O-N 2.98Å; E119-L122 PolarHBondContact O-N 2.61Å; E119-R123 VanDerWaalsContact O-CB 3.3Å; E119-R123 WeakPolarHBondContact O-CB 3.48Å; E119-R123 PolarHBondContact O-N 3.22Å; E119-R123 WeakPolarHBondContact OE1-CD 3.43Å; E119-R123 IonicContact OE1-CZ 2.7Å; E119-R123 IonicContact OE1-NE 3.98Å; E119-R123 PolarHBondContact OE1-NE 3.46Å; E119-R123 IonicContact OE1-NH2 3.76Å; E119-R123 IonicContact OE2-CZ 3.84Å; E119-R123 IonicContact OE2-NE 2.77Å; E119-R123 PolarHBondContact OE2-NE 3.27Å; E119-R123 IonicContact OE2-NH2 2.69Å; E119-R123 PolarHBondContact OE2-NH2 2.81Å; E119-R123 VanDerWaalsContact OE2-NH2 3.16Å; E119-T129 PolarHBondContact OE1-OG1 3.34Å; E119-F131 HydrophobicContact CB-CD1 4.38Å; E119-F131 HydrophobicContact CG-CB 4.04Å; E119-F131 HydrophobicContact CG-CD1 4.27Å; E119-F131 HydrophobicContact CG-CG 4.47Å; E119-G148 PolarHBondContact OE1-N 3.1Å; E119-I202 HydrophobicContact CB-CD1 4.19Å; E119-I202 HydrophobicContact CG-CD1 4.43Å
120	R	98.8	Very high	98.1	Very high	49 Å²	49	23.7 Å²	23.7	19%	0.185	13%	0.127	C	C	.	.	H	α-helix	trans	-63.8	-40.3	-175.3	178.8	59.9	-178.7	177.7	-3.5	111.7	A116 F117 R123 T124 G356 D359 T360	A116-R120 VanDerWaalsContact O-CB 3.32Å; A116-R120 WeakPolarHBondContact O-CB 3.42Å; A116-R120 PolarHBondContact O-N 3.2Å; F117-R120 PolarHBondContact O-N 3.21Å; R120-R123 VanDerWaalsContact CD-NH2 3.26Å; R120-R123 VanDerWaalsContact NH1-CZ 3.32Å; R120-T124 WeakPolarHBondContact O-CB 3.43Å; R120-T124 PolarHBondContact O-N 3.19Å; R120-T124 PolarHBondContact O-OG1 3.09Å; R120-G356 WeakPolarHBondContact CG-O 3.5Å; R120-D359 IonicContact CZ-OD2 2.84Å; R120-D359 VanDerWaalsContact NE-CB 3.27Å; R120-D359 IonicContact NE-OD2 2.77Å; R120-D359 VanDerWaalsContact NH2-CB 3.26Å; R120-D359 IonicContact NH2-OD2 3.75Å; R120-D359 PolarHBondContact NH2-OD2 2.98Å; R120-T360 WeakPolarHBondContact CB-OG1 3.46Å; R120-T360 WeakPolarHBondContact CG-OG1 3.39Å
121	I	98.8	Very high	98.3	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.4	-55.7	175.1	-71.3	165.7	0	0	0	109.9	F117 E119 R123 T124 Y125 A313 L314 C317 M353 L357	F117-I121 WeakPolarHBondContact O-CB 3.12Å; F117-I121 WeakPolarHBondContact O-CD1 3.14Å; F117-I121 WeakPolarHBondContact O-CG1 3.3Å; F117-I121 PolarHBondContact O-N 3.41Å; E119-I121 VanDerWaalsContact C-N 3.33Å; E119-I121 PolarHBondContact O-N 2.98Å; I121-R123 VanDerWaalsContact C-N 3.32Å; I121-R123 PolarHBondContact O-N 3.48Å; I121-T124 WeakPolarHBondContact O-CA 3.43Å; I121-T124 VanDerWaalsContact O-CB 3.3Å; I121-T124 WeakPolarHBondContact O-CB 3.27Å; I121-T124 PolarHBondContact O-N 2.87Å; I121-Y125 HydrophobicContact CG2-CD2 4.04Å; I121-Y125 HydrophobicContact CG2-CE2 3.83Å; I121-Y125 VanDerWaalsContact O-CD2 3.31Å; I121-Y125 WeakPolarHBondContact O-CD2 3.49Å; I121-Y125 PolarHBondContact O-N 2.98Å; I121-Y125 VanDerWaalsContact O-N 3.12Å; I121-A313 HydrophobicContact CD1-CB 4.49Å; I121-L314 HydrophobicContact CD1-CD2 4.28Å; I121-C317 HydrophobicContact CG2-CB 3.87Å; I121-C317 VanDerWaalsContact CG2-SG 3.59Å; I121-M353 HydrophobicContact CG2-CB 4.38Å; I121-M353 HydrophobicContact CG2-CG 3.78Å; I121-L357 HydrophobicContact CD1-CD2 3.81Å; I121-L357 HydrophobicContact CD1-CG 4.07Å
122	L	98.6	Very high	98.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-66.8	-34.4	-174.1	-67.1	170.6	0	0	0	112.1	I103 T118 E119 T124 Y125 G126 F127 T129 L200 C317 W320 L321	I103-L122 HydrophobicContact CD1-CD1 3.51Å; T118-L122 HydrophobicContact CG2-CD1 3.94Å; T118-L122 WeakPolarHBondContact O-CG 3.36Å; T118-L122 PolarHBondContact O-N 2.87Å; E119-L122 PolarHBondContact O-N 2.61Å; L122-T124 VanDerWaalsContact C-N 3.31Å; L122-T124 PolarHBondContact O-N 3.1Å; L122-Y125 WeakPolarHBondContact O-CB 3.38Å; L122-Y125 PolarHBondContact O-N 2.79Å; L122-Y125 VanDerWaalsContact O-N 3.14Å; L122-G126 PolarHBondContact O-N 2.85Å; L122-F127 WeakPolarHBondContact O-CD2 3.39Å; L122-F127 PolarHBondContact O-N 3.13Å; L122-T129 HydrophobicContact CB-CG2 4.24Å; L122-L200 HydrophobicContact CB-CD2 4.3Å; L122-L200 HydrophobicContact CD1-CD1 3.38Å; L122-L200 HydrophobicContact CD1-CD2 4.37Å; L122-C317 HydrophobicContact CD2-CB 4.17Å; L122-C317 HydrophobicContact CG-CB 4.4Å; L122-W320 HydrophobicContact CD1-CE3 4.45Å; L122-W320 HydrophobicContact CD2-CE3 3.78Å; L122-W320 HydrophobicContact CD2-CZ3 4.17Å; L122-L321 HydrophobicContact CD2-CD1 4.22Å; L122-L321 HydrophobicContact CD2-CD2 3.96Å; L122-L321 HydrophobicContact CD2-CG 3.9Å
123	R	98.5	Very high	98.4	Very high	68 Å²	68	21.4 Å²	21.4	26%	0.257	11%	0.11	S	C	.	.	H	α-helix	trans	-65.1	-34	169.3	-179.1	163.1	54	99.2	0.4	113.2	E119 R120 I121 Y125 G126 T129 D147	E119-R123 VanDerWaalsContact O-CB 3.3Å; E119-R123 WeakPolarHBondContact O-CB 3.48Å; E119-R123 PolarHBondContact O-N 3.22Å; E119-R123 WeakPolarHBondContact OE1-CD 3.43Å; E119-R123 IonicContact OE1-CZ 2.7Å; E119-R123 IonicContact OE1-NE 3.98Å; E119-R123 PolarHBondContact OE1-NE 3.46Å; E119-R123 IonicContact OE1-NH2 3.76Å; E119-R123 IonicContact OE2-CZ 3.84Å; E119-R123 IonicContact OE2-NE 2.77Å; E119-R123 PolarHBondContact OE2-NE 3.27Å; E119-R123 IonicContact OE2-NH2 2.69Å; E119-R123 PolarHBondContact OE2-NH2 2.81Å; E119-R123 VanDerWaalsContact OE2-NH2 3.16Å; R120-R123 VanDerWaalsContact CD-NH2 3.26Å; R120-R123 VanDerWaalsContact NH1-CZ 3.32Å; I121-R123 VanDerWaalsContact C-N 3.32Å; I121-R123 PolarHBondContact O-N 3.48Å; R123-Y125 PolarHBondContact O-N 2.76Å; R123-G126 WeakPolarHBondContact O-CA 3.32Å; R123-G126 PolarHBondContact O-N 3.1Å; R123-T129 HydrophobicContact CB-CG2 4.08Å; R123-D147 VanDerWaalsContact CD-CA 3.47Å; R123-D147 VanDerWaalsContact CD-O 3.3Å; R123-D147 WeakPolarHBondContact CD-O 3.13Å; R123-D147 PolarHBondContact NE-O 3.33Å; R123-D147 PolarHBondContact NH1-O 3.43Å
124	T	98.5	Very high	98	Very high	38 Å²	38	22 Å²	22	23%	0.233	11%	0.114	C	C	.	.	H	α-helix	trans	-66.6	-25.9	174.1	-56.8	0	0	0	0	111.7	R120 I121 L122 G126 A352 K355	R120-T124 WeakPolarHBondContact O-CB 3.43Å; R120-T124 PolarHBondContact O-N 3.19Å; R120-T124 PolarHBondContact O-OG1 3.09Å; I121-T124 WeakPolarHBondContact O-CA 3.43Å; I121-T124 VanDerWaalsContact O-CB 3.3Å; I121-T124 WeakPolarHBondContact O-CB 3.27Å; I121-T124 PolarHBondContact O-N 2.87Å; L122-T124 VanDerWaalsContact C-N 3.31Å; L122-T124 PolarHBondContact O-N 3.1Å; T124-G126 PolarHBondContact O-N 3.41Å; T124-A352 HydrophobicContact CG2-CB 3.93Å; T124-A352 WeakPolarHBondContact CG2-O 3.35Å; T124-K355 HydrophobicContact CG2-CB 4.29Å; T124-K355 HydrophobicContact CG2-CD 4.09Å; T124-K355 HydrophobicContact CG2-CG 4.3Å
125	Y	97.2	Very high	97.5	Very high	88 Å²	88	24.7 Å²	24.7	35%	0.345	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-4.1	168.1	-80.2	-85.2	0	0	0	113.9	I121 L122 R123 L321 A352 M353	I121-Y125 HydrophobicContact CG2-CD2 4.04Å; I121-Y125 HydrophobicContact CG2-CE2 3.83Å; I121-Y125 VanDerWaalsContact O-CD2 3.31Å; I121-Y125 WeakPolarHBondContact O-CD2 3.49Å; I121-Y125 PolarHBondContact O-N 2.98Å; I121-Y125 VanDerWaalsContact O-N 3.12Å; L122-Y125 WeakPolarHBondContact O-CB 3.38Å; L122-Y125 PolarHBondContact O-N 2.79Å; L122-Y125 VanDerWaalsContact O-N 3.14Å; R123-Y125 PolarHBondContact O-N 2.76Å; Y125-L321 HydrophobicContact CD1-CD2 4.46Å; Y125-L321 HydrophobicContact CD2-CD1 4.04Å; Y125-L321 HydrophobicContact CE1-CD1 4.16Å; Y125-L321 HydrophobicContact CE2-CD1 3.64Å; Y125-L321 HydrophobicContact CG-CD1 4.47Å; Y125-L321 HydrophobicContact CG-CD2 4.36Å; Y125-A352 HydrophobicContact CD1-CB 4.02Å; Y125-A352 HydrophobicContact CD2-CB 3.83Å; Y125-A352 HydrophobicContact CE1-CB 3.88Å; Y125-A352 HydrophobicContact CE2-CB 3.66Å; Y125-A352 HydrophobicContact CG-CB 3.99Å; Y125-M353 HydrophobicContact CE2-CE 4.34Å; Y125-M353 HydrophobicContact CE2-CG 3.73Å; Y125-M353 WeakPolarHBondContact OH-CG 3.46Å
126	G	97.3	Very high	97.1	Very high	64 Å²	64	25.5 Å²	25.5	66%	0.66	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	91	6.7	178	0	0	0	0	0	115.1	L122 R123 T124	L122-G126 PolarHBondContact O-N 2.85Å; R123-G126 WeakPolarHBondContact O-CA 3.32Å; R123-G126 PolarHBondContact O-N 3.1Å; T124-G126 PolarHBondContact O-N 3.41Å
127	F	98.2	Very high	96.5	Very high	37 Å²	37	26 Å²	26	16%	0.162	14%	0.137	C	C	.	.			trans	-74.4	142.6	174.3	-64.3	-71.9	0	0	0	111.2	L122 T129 D199 L200 W320 L321 R324	L122-F127 WeakPolarHBondContact O-CD2 3.39Å; L122-F127 PolarHBondContact O-N 3.13Å; F127-T129 PolarHBondContact O-N 3.48Å; F127-D199 HydrophobicContact CB-CB 4.23Å; F127-D199 HydrophobicContact CD1-CB 4.07Å; F127-L200 HydrophobicContact CB-CD2 3.76Å; F127-L200 HydrophobicContact CG-CD2 4.22Å; F127-W320 HydrophobicContact CD1-CH2 4.01Å; F127-W320 HydrophobicContact CD1-CZ3 4.33Å; F127-W320 HydrophobicContact CD2-CH2 4.37Å; F127-W320 AromaticContact CD2-CZ3 3.97Å; F127-W320 HydrophobicContact CD2-CZ3 3.97Å; F127-W320 AromaticContact CE1-CH2 3.94Å; F127-W320 HydrophobicContact CE1-CH2 3.94Å; F127-W320 HydrophobicContact CE1-CZ3 4.07Å; F127-W320 HydrophobicContact CE2-CH2 4.34Å; F127-W320 AromaticContact CE2-CZ3 3.72Å; F127-W320 HydrophobicContact CE2-CZ3 3.72Å; F127-W320 HydrophobicContact CG-CH2 4.23Å; F127-W320 HydrophobicContact CG-CZ3 4.29Å; F127-W320 HydrophobicContact CZ-CH2 4.12Å; F127-W320 AromaticContact CZ-CZ3 3.76Å; F127-W320 HydrophobicContact CZ-CZ3 3.76Å; F127-L321 HydrophobicContact CD2-CD2 4.47Å; F127-L321 HydrophobicContact CE2-CD2 3.52Å; F127-L321 HydrophobicContact CZ-CD2 4.11Å; F127-R324 HydrophobicContact CE1-CG 4.46Å; F127-R324 HydrophobicContact CZ-CG 4.5Å
128	R	98.5	Very high	95.9	Very high	80 Å²	80	27 Å²	27	30%	0.302	14%	0.143	S	C	.	.			trans	-76.9	111.8	169.3	-168.2	174.7	-176.1	-158.1	-10.5	109.6	I146 D147 E196 D199	R128-I146 HydrophobicContact CG-CG2 4.45Å; R128-D147 VanDerWaalsContact CA-OD1 3.28Å; R128-D147 WeakPolarHBondContact CA-OD1 3.38Å; R128-E196 IonicContact CZ-OE2 2.66Å; R128-E196 PolarHBondContact NH1-O 2.96Å; R128-E196 PolarHBondContact NH2-O 2.96Å; R128-E196 IonicContact NH2-OE2 3.66Å; R128-E196 PolarHBondContact NH2-OE2 2.8Å; R128-D199 WeakPolarHBondContact CB-OD2 3.32Å; R128-D199 PolarHBondContact N-OD2 3.24Å; R128-D199 PolarHBondContact O-N 2.83Å
129	T	98.8	Very high	95.4	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	134	-170.7	51.7	0	0	0	0	111.4	E119 L122 R123 F127 I146 D147 L200 I202	E119-T129 PolarHBondContact OE1-OG1 3.34Å; L122-T129 HydrophobicContact CB-CG2 4.24Å; R123-T129 HydrophobicContact CB-CG2 4.08Å; F127-T129 PolarHBondContact O-N 3.48Å; T129-I146 VanDerWaalsContact O-CA 3.28Å; T129-I146 WeakPolarHBondContact O-CA 3.46Å; T129-D147 PolarHBondContact N-OD1 2.91Å; T129-D147 PolarHBondContact O-N 3.15Å; T129-D147 WeakPolarHBondContact OG1-CA 3.38Å; T129-L200 HydrophobicContact CG2-CD2 4.08Å; T129-L200 HydrophobicContact CG2-CG 4.49Å; T129-I202 HydrophobicContact CG2-CD1 4.3Å
130	G	98.8	Very high	95.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	138.4	158.5	0	0	0	0	0	110	R145 L200 A201 I202	G130-R145 CarbonylContact C-O 3.51Å; G130-R145 WeakPolarHBondContact CA-O 3.3Å; G130-L200 PolarHBondContact N-O 2.96Å; G130-A201 CarbonylContact O-C 3.47Å; G130-A201 WeakPolarHBondContact O-CA 3.45Å; G130-I202 WeakPolarHBondContact O-CD1 3.27Å; G130-I202 PolarHBondContact O-N 2.94Å
131	F	98.7	Very high	94.9	Very high	3 Å²	3	26 Å²	26	1%	0.013	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	116.9	174.3	174.7	-156.8	0	0	0	110.6	C115 A116 E119 R145 I202 W362	C115-F131 HydrophobicContact CB-CD2 4.07Å; C115-F131 HydrophobicContact CB-CE1 4.34Å; C115-F131 HydrophobicContact CB-CE2 3.24Å; C115-F131 HydrophobicContact CB-CZ 3.4Å; A116-F131 HydrophobicContact CB-CE1 4.48Å; E119-F131 HydrophobicContact CB-CD1 4.38Å; E119-F131 HydrophobicContact CG-CB 4.04Å; E119-F131 HydrophobicContact CG-CD1 4.27Å; E119-F131 HydrophobicContact CG-CG 4.47Å; F131-R145 HydrophobicContact CB-CB 4.23Å; F131-R145 PolarHBondContact N-O 2.78Å; F131-R145 PolarHBondContact O-N 2.83Å; F131-I202 WeakPolarHBondContact CA-O 3.35Å; F131-I202 HydrophobicContact CD2-CB 4.21Å; F131-I202 HydrophobicContact CD2-CG2 4.22Å; F131-W362 HydrophobicContact CD1-CH2 4.38Å; F131-W362 HydrophobicContact CD1-CZ3 4.33Å; F131-W362 HydrophobicContact CE1-CE3 4.32Å; F131-W362 AromaticContact CE1-CH2 3.37Å; F131-W362 HydrophobicContact CE1-CH2 3.37Å; F131-W362 HydrophobicContact CE1-CZ2 4.14Å; F131-W362 AromaticContact CE1-CZ3 3.48Å; F131-W362 HydrophobicContact CE1-CZ3 3.48Å; F131-W362 VanDerWaalsContact CE1-CZ3 3.48Å; F131-W362 AromaticContact CZ-CH2 3.68Å; F131-W362 HydrophobicContact CZ-CH2 3.68Å; F131-W362 HydrophobicContact CZ-CZ2 4.05Å; F131-W362 HydrophobicContact CZ-CZ3 4.22Å
132	Y	98.6	Very high	94.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	121.9	172.8	-177.9	-114	0	0	0	110.8	R143 I144 F182 L185 T186 A189 I202 I203 E204 T214	Y132-R143 VanDerWaalsContact CA-O 3.25Å; Y132-R143 WeakPolarHBondContact CA-O 3.36Å; Y132-R143 WeakPolarHBondContact CD2-O 3.46Å; Y132-R143 HydrophobicContact CE2-CB 4.49Å; Y132-I144 HydrophobicContact CD2-CG1 4.28Å; Y132-F182 HydrophobicContact CE1-CE2 4.4Å; Y132-F182 HydrophobicContact CE1-CZ 4.21Å; Y132-F182 WeakPolarHBondContact OH-CE2 3.42Å; Y132-L185 HydrophobicContact CE2-CB 4.44Å; Y132-T186 PolarHBondContact OH-N 3.48Å; Y132-T186 PolarHBondContact OH-OG1 3.07Å; Y132-A189 HydrophobicContact CD2-CB 3.37Å; Y132-A189 HydrophobicContact CE2-CB 3.83Å; Y132-A189 HydrophobicContact CG-CB 3.94Å; Y132-I202 PolarHBondContact N-O 3.04Å; Y132-I203 HydrophobicContact CD1-CG2 4.26Å; Y132-E204 VanDerWaalsContact O-CB 3.27Å; Y132-E204 WeakPolarHBondContact O-CB 3.49Å; Y132-E204 PolarHBondContact O-N 2.82Å; Y132-T214 HydrophobicContact CD1-CG2 4.22Å; Y132-T214 HydrophobicContact CE1-CG2 3.95Å
133	S	95.8	Very high	94.6	Very high	3 Å²	3	28.2 Å²	28.2	2%	0.021	15%	0.149	C	C	.	.			trans	-133.5	160.9	-176.2	68	0	0	0	0	113.6	E142 R143 E204	S133-E142 PolarHBondContact OG-O 2.68Å; S133-R143 PolarHBondContact N-O 3.36Å; S133-R143 WeakPolarHBondContact O-CA 3.18Å; S133-R143 WeakPolarHBondContact O-CB 3.48Å; S133-R143 WeakPolarHBondContact O-CG 3.49Å; S133-E204 WeakPolarHBondContact CA-OE2 3.31Å; S133-E204 VanDerWaalsContact CB-OE2 3.32Å; S133-E204 WeakPolarHBondContact CB-OE2 3.45Å
134	S	89.8	Confident	94.6	Very high	20 Å²	20	25 Å²	25	14%	0.14	14%	0.137	C	C	.	.	S	Bend	trans	-152.8	150.8	172.8	67.1	0	0	0	0	114.5	E204	S134-E204 PolarHBondContact N-OE2 3.24Å; S134-E204 VanDerWaalsContact N-OE2 3.09Å
135	P	89.4	Confident	94.6	Very high	55 Å²	55	24.7 Å²	24.7	36%	0.357	13%	0.132	S	C	.	.	S	Bend	cis	-76	176.3	-15.3	37	-38.1	0	0	0	112.1	L562	P135-L562 HydrophobicContact CG-CD2 3.53Å
136	H	89.4	Confident	94.7	Very high	17 Å²	17	21.5 Å²	21.5	8%	0.079	12%	0.12	C	C	.	.			trans	-76.8	161.4	166	53.5	-112.7	0	0	0	111.2	Q139 V140 E142 R143 D454	H136-Q139 WeakPolarHBondContact CB-O 3.41Å; H136-V140 WeakPolarHBondContact ND1-CA 3.34Å; H136-E142 HydrophobicContact CB-CB 4Å; H136-R143 HydrophobicContact CB-CG 4.03Å; H136-R143 PolarHBondContact ND1-NE 2.89Å; H136-D454 PolarHBondContact NE2-O 3.46Å
137	L	86.4	Confident	94.7	Very high	17 Å²	17	21.1 Å²	21.1	9%	0.089	10%	0.103	C	C	.	.	S	Bend	trans	-90.8	-53.3	172.1	-64.5	178.7	0	0	0	111.7	E142 A363 Q455 L562 G566 L569	L137-E142 WeakPolarHBondContact CB-OE2 3.24Å; L137-E142 PolarHBondContact N-OE2 3.38Å; L137-A363 HydrophobicContact CD1-CB 3.47Å; L137-A363 VanDerWaalsContact CD1-CB 3.47Å; L137-A363 WeakPolarHBondContact CD1-O 3.3Å; L137-Q455 PolarHBondContact O-NE2 2.95Å; L137-L562 HydrophobicContact CD2-CD1 3.38Å; L137-L562 HydrophobicContact CD2-CD2 4.14Å; L137-L562 HydrophobicContact CD2-CG 3.48Å; L137-L562 VanDerWaalsContact CD2-CG 3.48Å; L137-G566 WeakPolarHBondContact O-CA 3.38Å; L137-L569 HydrophobicContact CD1-CD1 3.8Å
138	V	86.1	Confident	94.6	Very high	20 Å²	20	20.2 Å²	20.2	12%	0.121	10%	0.104	C	C	.	.	S	Bend	trans	-116.1	-50.7	-172.7	-167.6	0	0	0	0	111.1	E142 Q455 G566 L569 K570	V138-E142 VanDerWaalsContact CA-OE1 3.27Å; V138-E142 WeakPolarHBondContact CA-OE1 3.4Å; V138-E142 VanDerWaalsContact CB-OE1 3.23Å; V138-E142 WeakPolarHBondContact CB-OE1 3.42Å; V138-E142 PolarHBondContact N-OE1 3.03Å; V138-Q455 WeakPolarHBondContact O-CG 3.4Å; V138-G566 WeakPolarHBondContact CG2-O 3.31Å; V138-L569 HydrophobicContact CG2-CB 4.4Å; V138-K570 HydrophobicContact CG1-CB 3.93Å; V138-K570 HydrophobicContact CG1-CG 3.96Å
139	Q	89.3	Confident	94.5	Very high	19 Å²	19	25.8 Å²	25.8	9%	0.089	13%	0.125	C	C	.	.			trans	-129.2	142.8	-170.4	-61.6	177.7	-17.5	0	0	112.3	H136 R141 E142 G577	H136-Q139 WeakPolarHBondContact CB-O 3.41Å; Q139-R141 PolarHBondContact O-N 3.06Å; Q139-R141 VanDerWaalsContact O-N 3.15Å; Q139-E142 PolarHBondContact N-OE1 3.5Å; Q139-E142 VanDerWaalsContact O-CB 3.29Å; Q139-E142 WeakPolarHBondContact O-CB 3.41Å; Q139-E142 WeakPolarHBondContact O-CG 3.44Å; Q139-E142 PolarHBondContact O-N 2.79Å; Q139-G577 VanDerWaalsContact NE2-CA 3.33Å; Q139-G577 PolarHBondContact NE2-O 3.33Å
140	V	91.6	Very high	94.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-55.4	-35.6	179.5	171.9	0	0	0	0	112.7	I53 L56 H136 E142 R143 F156 Y181 L185 D454	I53-V140 HydrophobicContact CD1-CB 3.89Å; I53-V140 HydrophobicContact CD1-CG1 4.36Å; I53-V140 HydrophobicContact CD1-CG2 4.07Å; L56-V140 HydrophobicContact CD2-CG1 3.74Å; L56-V140 HydrophobicContact CD2-CG2 4.38Å; H136-V140 WeakPolarHBondContact ND1-CA 3.34Å; V140-E142 PolarHBondContact O-N 2.87Å; V140-E142 VanDerWaalsContact O-N 3.14Å; V140-R143 VanDerWaalsContact O-CB 3.3Å; V140-R143 WeakPolarHBondContact O-CB 3.45Å; V140-R143 WeakPolarHBondContact O-CG 3.16Å; V140-R143 PolarHBondContact O-N 3.15Å; V140-F156 HydrophobicContact CG1-CE2 3.82Å; V140-F156 HydrophobicContact CG1-CZ 3.84Å; V140-Y181 WeakPolarHBondContact CG2-OH 3.45Å; V140-L185 HydrophobicContact CG1-CD1 4.44Å; V140-L185 HydrophobicContact CG1-CD2 3.97Å; V140-D454 WeakPolarHBondContact CB-OD1 3.4Å; V140-D454 WeakPolarHBondContact CG2-OD1 3.47Å; V140-D454 PolarHBondContact N-OD1 3.34Å
141	R	94.9	Very high	94.3	Very high	17 Å²	17	27.4 Å²	27.4	6%	0.064	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-58.1	-25.8	178.2	-62.6	-171.1	-68.2	91.6	-0.6	113.6	Y49 Q139 R143 I144 P150 I151 S152 N153 F156	Y49-R141 HydrophobicContact CE2-CG 3.67Å; Q139-R141 PolarHBondContact O-N 3.06Å; Q139-R141 VanDerWaalsContact O-N 3.15Å; R141-R143 PolarHBondContact O-N 3.48Å; R141-I144 CarbonylContact O-C 3.15Å; R141-I144 PolarHBondContact O-N 3.25Å; R141-P150 HydrophobicContact CB-CB 4.21Å; R141-I151 HydrophobicContact CB-CG1 4.47Å; R141-I151 VanDerWaalsContact CD-O 3.25Å; R141-I151 WeakPolarHBondContact CD-O 3.48Å; R141-I151 PolarHBondContact NH1-O 2.74Å; R141-S152 WeakPolarHBondContact CD-O 3.39Å; R141-N153 PolarHBondContact NE-OD1 2.81Å; R141-N153 PolarHBondContact NH2-OD1 3.36Å; R141-N153 VanDerWaalsContact NH2-OD1 3.09Å; R141-F156 HydrophobicContact CG-CB 3.85Å; R141-F156 HydrophobicContact CG-CD2 3.76Å; R141-F156 HydrophobicContact CG-CG 3.83Å
142	E	94.6	Very high	94.2	Very high	24 Å²	24	29.3 Å²	29.3	11%	0.112	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-59.1	-22.3	176.2	-67	170.3	-145	0	0	113.5	S133 H136 L137 V138 Q139 V140 I144 R145 P150	S133-E142 PolarHBondContact OG-O 2.68Å; H136-E142 HydrophobicContact CB-CB 4Å; L137-E142 WeakPolarHBondContact CB-OE2 3.24Å; L137-E142 PolarHBondContact N-OE2 3.38Å; V138-E142 VanDerWaalsContact CA-OE1 3.27Å; V138-E142 WeakPolarHBondContact CA-OE1 3.4Å; V138-E142 VanDerWaalsContact CB-OE1 3.23Å; V138-E142 WeakPolarHBondContact CB-OE1 3.42Å; V138-E142 PolarHBondContact N-OE1 3.03Å; Q139-E142 PolarHBondContact N-OE1 3.5Å; Q139-E142 VanDerWaalsContact O-CB 3.29Å; Q139-E142 WeakPolarHBondContact O-CB 3.41Å; Q139-E142 WeakPolarHBondContact O-CG 3.44Å; Q139-E142 PolarHBondContact O-N 2.79Å; V140-E142 PolarHBondContact O-N 2.87Å; V140-E142 VanDerWaalsContact O-N 3.14Å; E142-I144 VanDerWaalsContact C-N 3.27Å; E142-R145 WeakPolarHBondContact O-CG 3.26Å; E142-R145 PolarHBondContact O-NE 2.86Å; E142-P150 HydrophobicContact CG-CG 4.22Å
143	R	96.8	Very high	94	Very high	22 Å²	22	32 Å²	32	8%	0.083	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-72.7	-19.8	177.2	-61.3	177.5	173.1	-100.7	3.1	113	Y132 S133 H136 V140 R141	Y132-R143 VanDerWaalsContact CA-O 3.25Å; Y132-R143 WeakPolarHBondContact CA-O 3.36Å; Y132-R143 WeakPolarHBondContact CD2-O 3.46Å; Y132-R143 HydrophobicContact CE2-CB 4.49Å; S133-R143 PolarHBondContact N-O 3.36Å; S133-R143 WeakPolarHBondContact O-CA 3.18Å; S133-R143 WeakPolarHBondContact O-CB 3.48Å; S133-R143 WeakPolarHBondContact O-CG 3.49Å; H136-R143 HydrophobicContact CB-CG 4.03Å; H136-R143 PolarHBondContact ND1-NE 2.89Å; V140-R143 VanDerWaalsContact O-CB 3.3Å; V140-R143 WeakPolarHBondContact O-CB 3.45Å; V140-R143 WeakPolarHBondContact O-CG 3.16Å; V140-R143 PolarHBondContact O-N 3.15Å; R141-R143 PolarHBondContact O-N 3.48Å
144	I	98.4	Very high	93.9	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	101.5	-178.5	-51.6	175.5	0	0	0	107.3	Y132 R141 E142 I151 L188 A189 V192 F193	Y132-I144 HydrophobicContact CD2-CG1 4.28Å; R141-I144 CarbonylContact O-C 3.15Å; R141-I144 PolarHBondContact O-N 3.25Å; E142-I144 VanDerWaalsContact C-N 3.27Å; I144-I151 HydrophobicContact CB-CD1 4.16Å; I144-I151 HydrophobicContact CB-CG1 4.38Å; I144-I151 HydrophobicContact CG2-CD1 4.07Å; I144-I151 HydrophobicContact CG2-CG2 4.25Å; I144-I151 PolarHBondContact O-N 3.25Å; I144-L188 HydrophobicContact CD1-CB 4.43Å; I144-L188 HydrophobicContact CD1-CD2 3.99Å; I144-L188 HydrophobicContact CD1-CG 3.88Å; I144-A189 HydrophobicContact CD1-CB 4.11Å; I144-A189 HydrophobicContact CG1-CB 4.01Å; I144-A189 HydrophobicContact CG2-CB 4.5Å; I144-V192 HydrophobicContact CG2-CB 4.13Å; I144-V192 HydrophobicContact CG2-CG1 3.85Å; I144-V192 HydrophobicContact CG2-CG2 4.36Å; I144-F193 HydrophobicContact CG2-CE1 3.75Å; I144-F193 HydrophobicContact CG2-CZ 4.07Å
145	R	98.5	Very high	94.2	Very high	32 Å²	32	39.6 Å²	39.6	12%	0.121	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	143.8	-178	-62.7	-179.7	172.5	-115.3	-1.5	111.3	G130 F131 E142 G148 R149 F193	G130-R145 CarbonylContact C-O 3.51Å; G130-R145 WeakPolarHBondContact CA-O 3.3Å; F131-R145 HydrophobicContact CB-CB 4.23Å; F131-R145 PolarHBondContact N-O 2.78Å; F131-R145 PolarHBondContact O-N 2.83Å; E142-R145 WeakPolarHBondContact O-CG 3.26Å; E142-R145 PolarHBondContact O-NE 2.86Å; R145-G148 PolarHBondContact NH1-O 3.39Å; R145-R149 CarbonylContact C-O 3.39Å; R145-R149 WeakPolarHBondContact CA-O 3.31Å; R145-R149 WeakPolarHBondContact CB-O 3.36Å; R145-F193 WeakPolarHBondContact O-CE1 3.49Å
146	I	98.6	Very high	94.6	Very high	20 Å²	20	37 Å²	37	10%	0.103	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.9	167.3	-61.9	176.8	0	0	0	107.6	R128 T129 G148 R149 I151 V192 F193 E196	R128-I146 HydrophobicContact CG-CG2 4.45Å; T129-I146 VanDerWaalsContact O-CA 3.28Å; T129-I146 WeakPolarHBondContact O-CA 3.46Å; I146-G148 PolarHBondContact O-N 3.1Å; I146-R149 PolarHBondContact N-O 2.72Å; I146-R149 PolarHBondContact O-N 3.18Å; I146-I151 HydrophobicContact CD1-CG2 3.93Å; I146-I151 HydrophobicContact CG1-CG2 3.99Å; I146-V192 HydrophobicContact CD1-CG1 4.04Å; I146-F193 HydrophobicContact CG1-CE1 4.48Å; I146-E196 HydrophobicContact CD1-CB 3.52Å; I146-E196 HydrophobicContact CD1-CG 3.52Å
147	D	98	Very high	95	Very high	56 Å²	56	37 Å²	37	30%	0.299	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	38.6	179.9	-57.3	-37.2	0	0	0	114.1	R123 R128 T129 R149	R123-D147 VanDerWaalsContact CD-CA 3.47Å; R123-D147 VanDerWaalsContact CD-O 3.3Å; R123-D147 WeakPolarHBondContact CD-O 3.13Å; R123-D147 PolarHBondContact NE-O 3.33Å; R123-D147 PolarHBondContact NH1-O 3.43Å; R128-D147 VanDerWaalsContact CA-OD1 3.28Å; R128-D147 WeakPolarHBondContact CA-OD1 3.38Å; T129-D147 PolarHBondContact N-OD1 2.91Å; T129-D147 PolarHBondContact O-N 3.15Å; T129-D147 WeakPolarHBondContact OG1-CA 3.38Å; D147-R149 VanDerWaalsContact C-N 3.27Å; D147-R149 PolarHBondContact O-N 3.42Å
148	G	95.8	Very high	95.4	Very high	18 Å²	18	39.3 Å²	39.3	19%	0.186	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	81	-5.2	-179.7	0	0	0	0	0	115	E119 R145 I146	E119-G148 PolarHBondContact OE1-N 3.1Å; R145-G148 PolarHBondContact NH1-O 3.39Å; I146-G148 PolarHBondContact O-N 3.1Å
149	R	96.6	Very high	96	Very high	197 Å²	197	38.7 Å²	38.7	74%	0.743	19%	0.187	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-107.4	139.5	-177.7	-64.3	-178.2	176.8	-178.7	-2.3	111.4	R145 I146 D147	R145-R149 CarbonylContact C-O 3.39Å; R145-R149 WeakPolarHBondContact CA-O 3.31Å; R145-R149 WeakPolarHBondContact CB-O 3.36Å; I146-R149 PolarHBondContact N-O 2.72Å; I146-R149 PolarHBondContact O-N 3.18Å; D147-R149 VanDerWaalsContact C-N 3.27Å; D147-R149 PolarHBondContact O-N 3.42Å
150	P	96.8	Very high	96.4	Very high	29 Å²	29	37.8 Å²	37.8	19%	0.188	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.3	141	166.8	-23.4	34.9	0	0	0	110.3	R141 E142	R141-P150 HydrophobicContact CB-CB 4.21Å; E142-P150 HydrophobicContact CG-CG 4.22Å
151	I	97	Very high	96.7	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.026	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-59.6	153.6	171.7	60.5	174.9	0	0	0	110.3	R141 I144 I146 L155 F156 V192	R141-I151 HydrophobicContact CB-CG1 4.47Å; R141-I151 VanDerWaalsContact CD-O 3.25Å; R141-I151 WeakPolarHBondContact CD-O 3.48Å; R141-I151 PolarHBondContact NH1-O 2.74Å; I144-I151 HydrophobicContact CB-CD1 4.16Å; I144-I151 HydrophobicContact CB-CG1 4.38Å; I144-I151 HydrophobicContact CG2-CD1 4.07Å; I144-I151 HydrophobicContact CG2-CG2 4.25Å; I144-I151 PolarHBondContact O-N 3.25Å; I146-I151 HydrophobicContact CD1-CG2 3.93Å; I146-I151 HydrophobicContact CG1-CG2 3.99Å; I151-L155 HydrophobicContact CB-CB 4.28Å; I151-F156 HydrophobicContact CD1-CB 3.9Å; I151-F156 HydrophobicContact CD1-CD2 4Å; I151-F156 HydrophobicContact CD1-CG 4.44Å; I151-F156 HydrophobicContact CG1-CB 4.17Å; I151-F156 HydrophobicContact CG1-CD2 4.46Å; I151-V192 HydrophobicContact CD1-CG1 4.44Å; I151-V192 HydrophobicContact CD1-CG2 4.24Å; I151-V192 HydrophobicContact CG2-CG1 4.18Å
152	S	96.1	Very high	96.8	Very high	44 Å²	44	41.6 Å²	41.6	31%	0.308	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-69.6	165.5	-178.7	81.9	0	0	0	0	112.2	R141 E154 L155 F156	R141-S152 WeakPolarHBondContact CD-O 3.39Å; S152-E154 WeakPolarHBondContact CB-OE2 3.3Å; S152-E154 PolarHBondContact O-N 2.89Å; S152-E154 PolarHBondContact OG-N 3.32Å; S152-E154 PolarHBondContact OG-OE2 3.26Å; S152-L155 PolarHBondContact O-N 3.12Å; S152-L155 PolarHBondContact OG-N 3.48Å; S152-L155 VanDerWaalsContact OG-N 3.17Å; S152-F156 WeakPolarHBondContact O-CB 3.35Å; S152-F156 PolarHBondContact O-N 3.03Å
153	N	93.7	Very high	96.9	Very high	56 Å²	56	40.4 Å²	40.4	30%	0.299	19%	0.194	S	C	.	.	H	α-helix	trans	-54	-45.9	172.5	-75.6	-9.6	0	0	0	110.4	Y49 R141 F156 T157	Y49-N153 HydrophobicContact CD2-CB 4.2Å; Y49-N153 HydrophobicContact CG-CB 4.16Å; R141-N153 PolarHBondContact NE-OD1 2.81Å; R141-N153 PolarHBondContact NH2-OD1 3.36Å; R141-N153 VanDerWaalsContact NH2-OD1 3.09Å; N153-F156 PolarHBondContact O-N 3.24Å; N153-T157 WeakPolarHBondContact O-CB 3.4Å; N153-T157 PolarHBondContact O-N 3.12Å; N153-T157 PolarHBondContact O-OG1 3.3Å
154	E	94.9	Very high	96.9	Very high	131 Å²	131	41 Å²	41	61%	0.612	20%	0.197	S	C	*	.	H	α-helix	trans	-65	-45.2	-176.5	-54.6	69.9	-146.9	0	0	111.5	S152 K158	S152-E154 WeakPolarHBondContact CB-OE2 3.3Å; S152-E154 PolarHBondContact O-N 2.89Å; S152-E154 PolarHBondContact OG-N 3.32Å; S152-E154 PolarHBondContact OG-OE2 3.26Å; E154-K158 VanDerWaalsContact O-CB 3.22Å; E154-K158 WeakPolarHBondContact O-CB 3.44Å; E154-K158 PolarHBondContact O-N 3.46Å
155	L	96.1	Very high	96.8	Very high	52 Å²	52	41.9 Å²	41.9	27%	0.272	21%	0.206	S	C	.	.	H	α-helix	trans	-65.7	-43.8	176.9	-73.9	-179.5	0	0	0	111.5	I151 S152 Y159	I151-L155 HydrophobicContact CB-CB 4.28Å; S152-L155 PolarHBondContact O-N 3.12Å; S152-L155 PolarHBondContact OG-N 3.48Å; S152-L155 VanDerWaalsContact OG-N 3.17Å; L155-Y159 HydrophobicContact CB-CD2 4.44Å; L155-Y159 HydrophobicContact CB-CE2 4.42Å; L155-Y159 HydrophobicContact CD2-CE2 3.94Å; L155-Y159 WeakPolarHBondContact O-CD2 3.4Å; L155-Y159 PolarHBondContact O-N 3.26Å
156	F	97.4	Very high	96.6	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.8	-53	176.8	-176.4	-85.6	0	0	0	110.6	Y49 A52 I53 L56 V140 R141 I151 S152 N153 K158 Y159 F160 L185 L188	Y49-F156 HydrophobicContact CD2-CB 4.47Å; Y49-F156 AromaticContact CD2-CD1 3.89Å; Y49-F156 HydrophobicContact CD2-CD1 3.89Å; Y49-F156 HydrophobicContact CD2-CG 4.45Å; Y49-F156 HydrophobicContact CE2-CB 4.37Å; Y49-F156 AromaticContact CE2-CD1 3.73Å; Y49-F156 HydrophobicContact CE2-CD1 3.73Å; Y49-F156 HydrophobicContact CE2-CE1 4.28Å; Y49-F156 HydrophobicContact CE2-CG 4.1Å; A52-F156 HydrophobicContact CB-CE1 4.22Å; I53-F156 HydrophobicContact CD1-CE1 3.79Å; I53-F156 HydrophobicContact CD1-CZ 4.07Å; L56-F156 HydrophobicContact CD2-CZ 4.24Å; V140-F156 HydrophobicContact CG1-CE2 3.82Å; V140-F156 HydrophobicContact CG1-CZ 3.84Å; R141-F156 HydrophobicContact CG-CB 3.85Å; R141-F156 HydrophobicContact CG-CD2 3.76Å; R141-F156 HydrophobicContact CG-CG 3.83Å; I151-F156 HydrophobicContact CD1-CB 3.9Å; I151-F156 HydrophobicContact CD1-CD2 4Å; I151-F156 HydrophobicContact CD1-CG 4.44Å; I151-F156 HydrophobicContact CG1-CB 4.17Å; I151-F156 HydrophobicContact CG1-CD2 4.46Å; S152-F156 WeakPolarHBondContact O-CB 3.35Å; S152-F156 PolarHBondContact O-N 3.03Å; N153-F156 PolarHBondContact O-N 3.24Å; F156-K158 PolarHBondContact O-N 2.85Å; F156-Y159 PolarHBondContact O-N 3.27Å; F156-F160 HydrophobicContact CD1-CB 4.32Å; F156-F160 HydrophobicContact CE1-CB 4.13Å; F156-F160 HydrophobicContact CE1-CD2 4.1Å; F156-F160 HydrophobicContact CE1-CG 4.31Å; F156-F160 HydrophobicContact CZ-CD2 4.29Å; F156-F160 WeakPolarHBondContact O-CB 3.47Å; F156-F160 PolarHBondContact O-N 2.83Å; F156-L185 HydrophobicContact CE2-CD2 4.49Å; F156-L188 HydrophobicContact CD2-CD2 4.39Å; F156-L188 HydrophobicContact CE2-CD2 3.81Å; F156-L188 HydrophobicContact CZ-CD2 4.08Å
157	T	96.4	Very high	96.5	Very high	18 Å²	18	44 Å²	44	11%	0.11	21%	0.212	C	C	.	.	H	α-helix	trans	-58.4	-47.6	-179.6	-61.4	0	0	0	0	111.9	M47 Y49 N153 Y159 F160 W161	M47-T157 WeakPolarHBondContact O-CG2 3.17Å; Y49-T157 WeakPolarHBondContact CA-OG1 3.33Å; Y49-T157 PolarHBondContact N-OG1 2.91Å; N153-T157 WeakPolarHBondContact O-CB 3.4Å; N153-T157 PolarHBondContact O-N 3.12Å; N153-T157 PolarHBondContact O-OG1 3.3Å; T157-Y159 PolarHBondContact O-N 2.76Å; T157-F160 PolarHBondContact O-N 3.2Å; T157-W161 PolarHBondContact O-N 3.46Å; T157-W161 VanDerWaalsContact O-N 3.07Å
158	K	96.4	Very high	96.3	Very high	64 Å²	64	43.8 Å²	43.8	28%	0.278	21%	0.211	S	C	.	.	H	α-helix	trans	-55.4	-53.6	177.4	176	-171.5	173.9	-169	0	111.3	E154 F156 Q162	E154-K158 VanDerWaalsContact O-CB 3.22Å; E154-K158 WeakPolarHBondContact O-CB 3.44Å; E154-K158 PolarHBondContact O-N 3.46Å; F156-K158 PolarHBondContact O-N 2.85Å; K158-Q162 VanDerWaalsContact O-CG 3.29Å; K158-Q162 WeakPolarHBondContact O-CG 3.18Å; K158-Q162 PolarHBondContact O-N 2.8Å
159	Y	98.2	Very high	96.2	Very high	8 Å²	8	50.6 Å²	50.6	3%	0.031	24%	0.238	C	C	.	.	H	α-helix	trans	-74.5	-32.5	-175.6	-68	-49.6	0	0	0	112.6	L155 F156 T157 Q162 V163 L188 H191 V192 Q195 E196	L155-Y159 HydrophobicContact CB-CD2 4.44Å; L155-Y159 HydrophobicContact CB-CE2 4.42Å; L155-Y159 HydrophobicContact CD2-CE2 3.94Å; L155-Y159 WeakPolarHBondContact O-CD2 3.4Å; L155-Y159 PolarHBondContact O-N 3.26Å; F156-Y159 PolarHBondContact O-N 3.27Å; T157-Y159 PolarHBondContact O-N 2.76Å; Y159-Q162 PolarHBondContact O-N 3.26Å; Y159-V163 WeakPolarHBondContact O-CG2 3.33Å; Y159-V163 PolarHBondContact O-N 2.94Å; Y159-L188 VanDerWaalsContact C-CD1 3.42Å; Y159-L188 WeakPolarHBondContact O-CD1 3.15Å; Y159-H191 AromaticContact CD1-CD2 3.63Å; Y159-H191 AromaticContact CD1-NE2 3.65Å; Y159-V192 HydrophobicContact CD2-CB 4.38Å; Y159-V192 HydrophobicContact CD2-CG1 4.4Å; Y159-V192 HydrophobicContact CD2-CG2 3.63Å; Y159-V192 HydrophobicContact CE2-CG2 4.46Å; Y159-V192 HydrophobicContact CG-CG2 3.89Å; Y159-Q195 HydrophobicContact CD1-CG 4.33Å; Y159-Q195 HydrophobicContact CE1-CB 3.66Å; Y159-Q195 HydrophobicContact CE1-CG 3.76Å; Y159-E196 HydrophobicContact CE2-CG 4.03Å; Y159-E196 WeakPolarHBondContact CE2-OE1 3.47Å; Y159-E196 PolarHBondContact OH-OE1 3.03Å
160	F	98	Very high	95.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-56	-55.6	173.2	176.6	-89.3	0	0	0	110.4	A52 T55 L56 F156 T157 Q162 V163 Y164 F184 L188	A52-F160 HydrophobicContact CB-CB 4.25Å; A52-F160 HydrophobicContact CB-CD1 3.48Å; A52-F160 VanDerWaalsContact CB-CD1 3.48Å; A52-F160 HydrophobicContact CB-CD2 4.39Å; A52-F160 HydrophobicContact CB-CE1 3.91Å; A52-F160 HydrophobicContact CB-CG 3.77Å; A52-F160 VanDerWaalsContact O-CZ 3.3Å; A52-F160 WeakPolarHBondContact O-CZ 3.37Å; T55-F160 HydrophobicContact CG2-CE1 4.12Å; T55-F160 HydrophobicContact CG2-CZ 3.87Å; L56-F160 HydrophobicContact CB-CE2 3.68Å; L56-F160 HydrophobicContact CB-CZ 4.18Å; L56-F160 HydrophobicContact CD1-CE2 4.2Å; L56-F160 HydrophobicContact CG-CE2 4.41Å; F156-F160 HydrophobicContact CD1-CB 4.32Å; F156-F160 HydrophobicContact CE1-CB 4.13Å; F156-F160 HydrophobicContact CE1-CD2 4.1Å; F156-F160 HydrophobicContact CE1-CG 4.31Å; F156-F160 HydrophobicContact CZ-CD2 4.29Å; F156-F160 WeakPolarHBondContact O-CB 3.47Å; F156-F160 PolarHBondContact O-N 2.83Å; T157-F160 PolarHBondContact O-N 3.2Å; F160-Q162 VanDerWaalsContact C-N 3.34Å; F160-Q162 PolarHBondContact O-N 2.95Å; F160-V163 PolarHBondContact O-N 3.28Å; F160-Y164 HydrophobicContact CE1-CD2 4.27Å; F160-Y164 HydrophobicContact CE1-CG 4.13Å; F160-Y164 AromaticContact CZ-CD2 3.82Å; F160-Y164 HydrophobicContact CZ-CD2 3.82Å; F160-Y164 HydrophobicContact CZ-CG 4.14Å; F160-Y164 WeakPolarHBondContact O-CB 3.45Å; F160-Y164 PolarHBondContact O-N 3.39Å; F160-F184 AromaticContact CD2-CE1 3.43Å; F160-F184 HydrophobicContact CD2-CE1 3.43Å; F160-F184 VanDerWaalsContact CD2-CE1 3.43Å; F160-F184 AromaticContact CD2-CZ 3.62Å; F160-F184 HydrophobicContact CD2-CZ 3.62Å; F160-F184 HydrophobicContact CE2-CD1 4.32Å; F160-F184 AromaticContact CE2-CE1 3.32Å; F160-F184 HydrophobicContact CE2-CE1 3.32Å; F160-F184 AromaticContact CE2-CZ 3.5Å; F160-F184 HydrophobicContact CE2-CZ 3.5Å; F160-F184 HydrophobicContact CG-CZ 4.39Å; F160-F184 HydrophobicContact CZ-CE1 4.39Å; F160-F184 HydrophobicContact CZ-CZ 4.23Å; F160-L188 HydrophobicContact CD2-CD2 4.42Å
161	W	97.1	Very high	95.6	Very high	44 Å²	44	44.5 Å²	44.5	17%	0.167	22%	0.218	C	C	.	.	H	α-helix	trans	-69.1	-30.6	-177.1	-71	120.5	0	0	0	113.2	M47 D51 T55 T157 Y164 G165	M47-W161 HydrophobicContact CE-CB 3.91Å; M47-W161 HydrophobicContact CE-CD2 3.76Å; M47-W161 HydrophobicContact CE-CE3 3.94Å; M47-W161 HydrophobicContact CE-CG 3.75Å; M47-W161 HydrophobicContact CG-CD2 4.21Å; M47-W161 HydrophobicContact CG-CG 4.3Å; M47-W161 HydrophobicContact CG-CZ2 4.43Å; M47-W161 HydrophobicContact SD-CG 4.25Å; D51-W161 HydrophobicContact CB-CZ2 4.09Å; T55-W161 HydrophobicContact CG2-CH2 4.19Å; T55-W161 HydrophobicContact CG2-CZ3 4.32Å; T55-W161 WeakPolarHBondContact OG1-CH2 3.29Å; T157-W161 PolarHBondContact O-N 3.46Å; T157-W161 VanDerWaalsContact O-N 3.07Å; W161-Y164 HydrophobicContact CE3-CD1 4.2Å; W161-Y164 AromaticContact CZ3-CD1 3.96Å; W161-Y164 HydrophobicContact CZ3-CD1 3.96Å; W161-Y164 HydrophobicContact CZ3-CE1 4.39Å; W161-G165 WeakPolarHBondContact O-CA 3.32Å; W161-G165 PolarHBondContact O-N 2.99Å
162	Q	96.6	Very high	95.2	Very high	52 Å²	52	50.9 Å²	50.9	24%	0.243	25%	0.248	C	C	.	.	H	α-helix	trans	-61.7	-46.4	171.4	-75.7	179.7	2.6	0	0	112.3	K158 Y159 F160 R166 H191	K158-Q162 VanDerWaalsContact O-CG 3.29Å; K158-Q162 WeakPolarHBondContact O-CG 3.18Å; K158-Q162 PolarHBondContact O-N 2.8Å; Y159-Q162 PolarHBondContact O-N 3.26Å; F160-Q162 VanDerWaalsContact C-N 3.34Å; F160-Q162 PolarHBondContact O-N 2.95Å; Q162-R166 WeakPolarHBondContact O-CD 3.44Å; Q162-R166 VanDerWaalsContact O-CG 3.26Å; Q162-R166 WeakPolarHBondContact O-CG 3.15Å; Q162-H191 PolarHBondContact OE1-NE2 3.2Å
163	V	97.8	Very high	94.5	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-75.2	-47.3	-178.5	173	0	0	0	0	110.6	A90 Y159 F160 L167 F184 I187 L188 H191	A90-V163 HydrophobicContact CB-CG1 4.19Å; Y159-V163 WeakPolarHBondContact O-CG2 3.33Å; Y159-V163 PolarHBondContact O-N 2.94Å; F160-V163 PolarHBondContact O-N 3.28Å; V163-L167 HydrophobicContact CG1-CD1 3.79Å; V163-L167 WeakPolarHBondContact O-CG 3.11Å; V163-L167 PolarHBondContact O-N 2.85Å; V163-L167 VanDerWaalsContact O-N 3.13Å; V163-F184 HydrophobicContact CB-CE2 4.44Å; V163-F184 HydrophobicContact CB-CZ 4.45Å; V163-F184 HydrophobicContact CG1-CD2 4.43Å; V163-F184 HydrophobicContact CG1-CE2 3.81Å; V163-F184 HydrophobicContact CG1-CZ 4.19Å; V163-I187 HydrophobicContact CG1-CG2 3.85Å; V163-L188 HydrophobicContact CB-CD1 4.42Å; V163-L188 HydrophobicContact CG2-CD1 4.05Å; V163-H191 HydrophobicContact CG2-CB 3.75Å
164	Y	96.8	Very high	94	Very high	35 Å²	35	54.9 Å²	54.9	14%	0.137	27%	0.274	C	S	.	.	H	α-helix	trans	-60.8	-47.8	179.2	-171.6	-83.2	0	0	0	111.6	T55 L59 F160 W161 R166 L167 D168 M178 F184	T55-Y164 HydrophobicContact CG2-CD1 4.38Å; T55-Y164 HydrophobicContact CG2-CD2 3.93Å; T55-Y164 HydrophobicContact CG2-CE1 3.92Å; T55-Y164 HydrophobicContact CG2-CE2 3.39Å; T55-Y164 HydrophobicContact CG2-CG 4.4Å; L59-Y164 HydrophobicContact CD1-CE2 4.39Å; L59-Y164 HydrophobicContact CD2-CE2 4.35Å; F160-Y164 HydrophobicContact CE1-CD2 4.27Å; F160-Y164 HydrophobicContact CE1-CG 4.13Å; F160-Y164 AromaticContact CZ-CD2 3.82Å; F160-Y164 HydrophobicContact CZ-CD2 3.82Å; F160-Y164 HydrophobicContact CZ-CG 4.14Å; F160-Y164 WeakPolarHBondContact O-CB 3.45Å; F160-Y164 PolarHBondContact O-N 3.39Å; W161-Y164 HydrophobicContact CE3-CD1 4.2Å; W161-Y164 AromaticContact CZ3-CD1 3.96Å; W161-Y164 HydrophobicContact CZ3-CD1 3.96Å; W161-Y164 HydrophobicContact CZ3-CE1 4.39Å; Y164-R166 PolarHBondContact O-N 2.88Å; Y164-L167 PolarHBondContact O-N 3.37Å; Y164-D168 HydrophobicContact CD1-CB 4.25Å; Y164-D168 HydrophobicContact CE1-CB 3.95Å; Y164-D168 WeakPolarHBondContact O-CB 3.34Å; Y164-D168 PolarHBondContact O-N 3.14Å; Y164-M178 HydrophobicContact CD2-CE 3.97Å; Y164-M178 HydrophobicContact CE2-CE 3.66Å; Y164-F184 AromaticContact CD2-CE2 3.97Å; Y164-F184 HydrophobicContact CD2-CE2 3.97Å; Y164-F184 HydrophobicContact CD2-CZ 4.27Å; Y164-F184 HydrophobicContact CG-CE2 4.43Å
165	G	95.4	Very high	93.2	Very high	19 Å²	19	52 Å²	52	20%	0.196	28%	0.279	C	S	.	.	H	α-helix	trans	-56.7	-48.8	-179.8	0	0	0	0	0	112.3	W161 L167 D168 E169	W161-G165 WeakPolarHBondContact O-CA 3.32Å; W161-G165 PolarHBondContact O-N 2.99Å; G165-L167 VanDerWaalsContact C-N 3.35Å; G165-L167 PolarHBondContact O-N 3.32Å; G165-D168 PolarHBondContact O-N 2.92Å; G165-E169 WeakPolarHBondContact O-CB 3.28Å; G165-E169 WeakPolarHBondContact O-CG 3.42Å; G165-E169 PolarHBondContact O-N 3.33Å
166	R	95.9	Very high	92.3	Very high	96 Å²	96	51.3 Å²	51.3	36%	0.362	29%	0.285	S	S	.	.	H	α-helix	trans	-62.6	-40.1	178	-67.5	173	-177.7	-178.1	-0.9	113.1	R89 A90 Q162 Y164 T170	R89-R166 WeakPolarHBondContact O-CB 3.46Å; A90-R166 WeakPolarHBondContact O-CD 3.43Å; A90-R166 PolarHBondContact O-NH1 3.04Å; Q162-R166 WeakPolarHBondContact O-CD 3.44Å; Q162-R166 VanDerWaalsContact O-CG 3.26Å; Q162-R166 WeakPolarHBondContact O-CG 3.15Å; Y164-R166 PolarHBondContact O-N 2.88Å; R166-T170 WeakPolarHBondContact O-CG2 3.15Å; R166-T170 PolarHBondContact O-N 2.72Å; R166-T170 PolarHBondContact O-OG1 3.47Å
167	L	95.6	Very high	91.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-66.7	-43.1	176.6	-73.3	166.7	0	0	0	111.2	F86 R89 A90 V163 Y164 G165 T170 K171 M178 P179 F184	F86-L167 HydrophobicContact CB-CD2 4.5Å; F86-L167 HydrophobicContact CD1-CD2 4.16Å; R89-L167 HydrophobicContact CB-CD2 3.82Å; R89-L167 PolarHBondContact NH2-O 3.46Å; A90-L167 HydrophobicContact CB-CD2 4.47Å; A90-L167 HydrophobicContact CB-CG 4.41Å; V163-L167 HydrophobicContact CG1-CD1 3.79Å; V163-L167 WeakPolarHBondContact O-CG 3.11Å; V163-L167 PolarHBondContact O-N 2.85Å; V163-L167 VanDerWaalsContact O-N 3.13Å; Y164-L167 PolarHBondContact O-N 3.37Å; G165-L167 VanDerWaalsContact C-N 3.35Å; G165-L167 PolarHBondContact O-N 3.32Å; L167-T170 PolarHBondContact O-N 3.04Å; L167-T170 PolarHBondContact O-OG1 2.92Å; L167-K171 PolarHBondContact O-N 3.38Å; L167-M178 HydrophobicContact CB-CE 3.88Å; L167-M178 HydrophobicContact CB-SD 3.99Å; L167-P179 HydrophobicContact CD1-CG 3.71Å; L167-P179 HydrophobicContact CD2-CG 4.39Å; L167-F184 HydrophobicContact CD1-CD2 3.78Å; L167-F184 HydrophobicContact CD1-CE2 3.9Å
168	D	94.4	Very high	91.4	Very high	51 Å²	51	55.7 Å²	55.7	27%	0.273	31%	0.309	S	S	.	.	H	α-helix	trans	-69.2	-43.7	-179	-164	71.2	0	0	0	111.9	Y164 G165 T170 K171 M178	Y164-D168 HydrophobicContact CD1-CB 4.25Å; Y164-D168 HydrophobicContact CE1-CB 3.95Å; Y164-D168 WeakPolarHBondContact O-CB 3.34Å; Y164-D168 PolarHBondContact O-N 3.14Å; G165-D168 PolarHBondContact O-N 2.92Å; D168-T170 PolarHBondContact O-N 3.46Å; D168-K171 VanDerWaalsContact CG-NZ 3.32Å; D168-K171 WeakPolarHBondContact O-CB 3.49Å; D168-K171 WeakPolarHBondContact O-CD 3.46Å; D168-K171 WeakPolarHBondContact O-CG 3.28Å; D168-K171 PolarHBondContact O-N 3.12Å; D168-K171 VanDerWaalsContact O-N 3.08Å; D168-K171 VanDerWaalsContact OD1-CD 3.28Å; D168-K171 WeakPolarHBondContact OD1-CD 3.42Å; D168-K171 WeakPolarHBondContact OD1-CE 3.29Å; D168-K171 IonicContact OD1-NZ 2.73Å; D168-K171 PolarHBondContact OD1-NZ 2.67Å; D168-K171 IonicContact OD2-NZ 3.23Å; D168-K171 PolarHBondContact OD2-NZ 3.42Å; D168-M178 HydrophobicContact CB-CE 4.44Å
169	E	93.4	Very high	91.1	Very high	161 Å²	161	52.7 Å²	52.7	75%	0.752	30%	0.296	S	S	*	.	H	α-helix	trans	-56	-35.4	175.7	-77	166.9	-167.4	0	0	112.4	G165	G165-E169 WeakPolarHBondContact O-CB 3.28Å; G165-E169 WeakPolarHBondContact O-CG 3.42Å; G165-E169 PolarHBondContact O-N 3.33Å
170	T	90.9	Very high	90.8	Very high	43 Å²	43	54.1 Å²	54.1	26%	0.264	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-1.3	-178.1	57.9	0	0	0	0	113.5	R89 R166 L167 D168 E172 A173 H174	R89-T170 PolarHBondContact NE-OG1 2.99Å; R166-T170 WeakPolarHBondContact O-CG2 3.15Å; R166-T170 PolarHBondContact O-N 2.72Å; R166-T170 PolarHBondContact O-OG1 3.47Å; L167-T170 PolarHBondContact O-N 3.04Å; L167-T170 PolarHBondContact O-OG1 2.92Å; D168-T170 PolarHBondContact O-N 3.46Å; T170-E172 PolarHBondContact O-N 2.96Å; T170-A173 PolarHBondContact O-N 3.28Å; T170-H174 PolarHBondContact O-N 3.38Å; T170-H174 PolarHBondContact O-ND1 3.32Å
171	K	89.3	Confident	90.4	Very high	55 Å²	55	55.5 Å²	55.5	24%	0.239	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-43.1	-169.3	80.6	-169.2	167.4	-165.3	0	113.3	L167 D168 A173 H174 G175 G176 M178	L167-K171 PolarHBondContact O-N 3.38Å; D168-K171 VanDerWaalsContact CG-NZ 3.32Å; D168-K171 WeakPolarHBondContact O-CB 3.49Å; D168-K171 WeakPolarHBondContact O-CD 3.46Å; D168-K171 WeakPolarHBondContact O-CG 3.28Å; D168-K171 PolarHBondContact O-N 3.12Å; D168-K171 VanDerWaalsContact O-N 3.08Å; D168-K171 VanDerWaalsContact OD1-CD 3.28Å; D168-K171 WeakPolarHBondContact OD1-CD 3.42Å; D168-K171 WeakPolarHBondContact OD1-CE 3.29Å; D168-K171 IonicContact OD1-NZ 2.73Å; D168-K171 PolarHBondContact OD1-NZ 2.67Å; D168-K171 IonicContact OD2-NZ 3.23Å; D168-K171 PolarHBondContact OD2-NZ 3.42Å; K171-A173 VanDerWaalsContact C-N 3.35Å; K171-A173 PolarHBondContact O-N 3.06Å; K171-H174 CarbonylContact O-C 3.18Å; K171-H174 WeakPolarHBondContact O-CA 3.25Å; K171-H174 PolarHBondContact O-N 3.38Å; K171-G175 PolarHBondContact O-N 2.87Å; K171-G176 VanDerWaalsContact O-CA 3.31Å; K171-G176 WeakPolarHBondContact O-CA 3.47Å; K171-G176 PolarHBondContact O-N 3.35Å; K171-M178 HydrophobicContact CB-SD 4.27Å
172	E	88.1	Confident	90.1	Very high	140 Å²	140	55.9 Å²	55.9	65%	0.654	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-65.7	-40.6	-175.3	-63.1	-53.5	133.3	0	0	111	T170 H174 G175	T170-E172 PolarHBondContact O-N 2.96Å; E172-H174 PolarHBondContact O-N 2.94Å; E172-H174 VanDerWaalsContact O-N 3.09Å; E172-G175 PolarHBondContact O-N 3.47Å
173	A	82.9	Confident	90	Very high	88 Å²	88	55.3 Å²	55.3	73%	0.727	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-62.5	-15.9	173.2	0	0	0	0	0	113.4	T170 K171	T170-A173 PolarHBondContact O-N 3.28Å; K171-A173 VanDerWaalsContact C-N 3.35Å; K171-A173 PolarHBondContact O-N 3.06Å
174	H	82.8	Confident	89.9	Confident	95 Å²	95	55.3 Å²	55.3	44%	0.44	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-119	36.2	179	-61.1	83.2	0	0	0	111.7	T170 K171 E172 G176 T177	T170-H174 PolarHBondContact O-N 3.38Å; T170-H174 PolarHBondContact O-ND1 3.32Å; K171-H174 CarbonylContact O-C 3.18Å; K171-H174 WeakPolarHBondContact O-CA 3.25Å; K171-H174 PolarHBondContact O-N 3.38Å; E172-H174 PolarHBondContact O-N 2.94Å; E172-H174 VanDerWaalsContact O-N 3.09Å; H174-G176 VanDerWaalsContact C-N 3.35Å; H174-G176 PolarHBondContact O-N 2.96Å; H174-T177 WeakPolarHBondContact O-CB 3.43Å; H174-T177 WeakPolarHBondContact O-CG2 3.39Å; H174-T177 PolarHBondContact O-N 3.37Å; H174-T177 PolarHBondContact O-OG1 3.26Å
175	G	78.4	Confident	89.9	Confident	70 Å²	70	53.6 Å²	53.6	72%	0.722	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	30.4	173.2	0	0	0	0	0	114.2	K171 E172 T177	K171-G175 PolarHBondContact O-N 2.87Å; E172-G175 PolarHBondContact O-N 3.47Å; G175-T177 VanDerWaalsContact C-N 3.27Å; G175-T177 PolarHBondContact O-N 2.75Å
176	G	77.1	Confident	90	Very high	38 Å²	38	52.8 Å²	52.8	39%	0.392	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	18	-179.8	0	0	0	0	0	114.1	K171 H174	K171-G176 VanDerWaalsContact O-CA 3.31Å; K171-G176 WeakPolarHBondContact O-CA 3.47Å; K171-G176 PolarHBondContact O-N 3.35Å; H174-G176 VanDerWaalsContact C-N 3.35Å; H174-G176 PolarHBondContact O-N 2.96Å
177	T	83.8	Confident	90.1	Very high	65 Å²	65	48.2 Å²	48.2	40%	0.399	28%	0.281	S	S	.	.			trans	-86.8	128.3	-169.9	60.1	0	0	0	0	113.3	R89 H174 G175	R89-T177 PolarHBondContact NH1-O 3.35Å; R89-T177 PolarHBondContact NH1-OG1 2.86Å; R89-T177 PolarHBondContact NH2-O 3.02Å; H174-T177 WeakPolarHBondContact O-CB 3.43Å; H174-T177 WeakPolarHBondContact O-CG2 3.39Å; H174-T177 PolarHBondContact O-N 3.37Å; H174-T177 PolarHBondContact O-OG1 3.26Å; G175-T177 VanDerWaalsContact C-N 3.27Å; G175-T177 PolarHBondContact O-N 2.75Å
178	M	90.5	Very high	90.3	Very high	45 Å²	45	48.2 Å²	48.2	22%	0.222	28%	0.281	C	S	.	.			trans	-112.7	146.6	168.8	-70.6	-63.5	-78.8	0	0	110.7	L59 Y164 L167 D168 K171 A180	L59-M178 HydrophobicContact CD2-CB 4.01Å; L59-M178 HydrophobicContact CD2-CE 4.48Å; Y164-M178 HydrophobicContact CD2-CE 3.97Å; Y164-M178 HydrophobicContact CE2-CE 3.66Å; L167-M178 HydrophobicContact CB-CE 3.88Å; L167-M178 HydrophobicContact CB-SD 3.99Å; D168-M178 HydrophobicContact CB-CE 4.44Å; K171-M178 HydrophobicContact CB-SD 4.27Å; M178-A180 PolarHBondContact O-N 2.9Å
179	P	91.2	Very high	90.5	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	27%	0.268	C	S	.	.			trans	-66.8	135.1	173.4	26.9	-31	0	0	0	109.9	F86 L167 R183 F184 I187	F86-P179 HydrophobicContact CD1-CB 4.02Å; F86-P179 HydrophobicContact CD1-CG 4.1Å; F86-P179 HydrophobicContact CD2-CB 4.11Å; F86-P179 HydrophobicContact CE1-CB 4.1Å; F86-P179 HydrophobicContact CE1-CG 4.35Å; F86-P179 HydrophobicContact CE2-CB 4.2Å; F86-P179 HydrophobicContact CG-CB 4.03Å; F86-P179 HydrophobicContact CG-CG 4.43Å; F86-P179 HydrophobicContact CZ-CB 4.19Å; L167-P179 HydrophobicContact CD1-CG 3.71Å; L167-P179 HydrophobicContact CD2-CG 4.39Å; P179-R183 HydrophobicContact CB-CB 3.93Å; P179-F184 HydrophobicContact CB-CB 4.42Å; P179-F184 HydrophobicContact CG-CB 4.08Å; P179-F184 HydrophobicContact CG-CD2 4.15Å; P179-I187 HydrophobicContact CB-CD1 4.27Å; P179-I187 HydrophobicContact CG-CD1 4.29Å
180	A	90.4	Very high	90.8	Very high	38 Å²	38	38.2 Å²	38.2	31%	0.314	23%	0.233	S	C	.	.			trans	-60.7	156.5	174.7	0	0	0	0	0	111.4	M178 F182 R183 F184	M178-A180 PolarHBondContact O-N 2.9Å; A180-F182 VanDerWaalsContact C-N 3.31Å; A180-F182 PolarHBondContact O-N 2.84Å; A180-R183 WeakPolarHBondContact O-CA 3.34Å; A180-R183 WeakPolarHBondContact O-CB 3.4Å; A180-R183 PolarHBondContact O-N 3.02Å; A180-F184 PolarHBondContact O-N 3.23Å
181	Y	90.3	Very high	91.1	Very high	29 Å²	29	36.2 Å²	36.2	11%	0.114	22%	0.221	C	C	.	.	H	α-helix	trans	-34.6	-54.9	-174	-174.6	-83.7	0	0	0	115	L56 L59 Q60 V140 F184 L185	L56-Y181 HydrophobicContact CD1-CD2 3.95Å; L56-Y181 HydrophobicContact CD1-CE2 4.02Å; L56-Y181 HydrophobicContact CD2-CE2 3.82Å; L56-Y181 HydrophobicContact CG-CD2 3.86Å; L56-Y181 HydrophobicContact CG-CE2 3.48Å; L56-Y181 VanDerWaalsContact CG-CE2 3.48Å; L56-Y181 WeakPolarHBondContact O-CD2 3.39Å; L59-Y181 PolarHBondContact O-N 3.43Å; Q60-Y181 HydrophobicContact CG-CD2 3.48Å; Q60-Y181 VanDerWaalsContact CG-CD2 3.48Å; Q60-Y181 HydrophobicContact CG-CE2 4.07Å; Q60-Y181 HydrophobicContact CG-CG 4.01Å; V140-Y181 WeakPolarHBondContact CG2-OH 3.45Å; Y181-F184 PolarHBondContact O-N 3.45Å; Y181-L185 HydrophobicContact CD1-CD1 3.84Å; Y181-L185 HydrophobicContact CE1-CD1 3.26Å; Y181-L185 HydrophobicContact CE1-CG 4.35Å; Y181-L185 PolarHBondContact O-N 2.87Å
182	F	90.8	Very high	91.6	Very high	52 Å²	52	33.6 Å²	33.6	23%	0.228	21%	0.209	C	C	.	.	H	α-helix	trans	-69.7	-36.8	-175.7	-170.2	-110.7	0	0	0	113.1	Y132 A180 L185 T186 G206 C213	Y132-F182 HydrophobicContact CE1-CE2 4.4Å; Y132-F182 HydrophobicContact CE1-CZ 4.21Å; Y132-F182 WeakPolarHBondContact OH-CE2 3.42Å; A180-F182 VanDerWaalsContact C-N 3.31Å; A180-F182 PolarHBondContact O-N 2.84Å; F182-L185 PolarHBondContact O-N 3.29Å; F182-T186 PolarHBondContact O-N 3.24Å; F182-T186 PolarHBondContact O-OG1 3.46Å; F182-G206 VanDerWaalsContact CZ-CA 3.48Å; F182-C213 WeakPolarHBondContact CD1-SG 3.34Å; F182-C213 WeakPolarHBondContact CE1-SG 3.36Å
183	R	93.5	Very high	92.1	Very high	40 Å²	40	26.9 Å²	26.9	15%	0.151	18%	0.178	C	C	.	.	H	α-helix	trans	-68.3	-43.4	176	-64.1	-169	-166	151.9	28.2	111.3	Q79 M83 P179 A180 L185 T186 I187 C213	Q79-R183 PolarHBondContact O-NH1 2.97Å; M83-R183 HydrophobicContact SD-CB 3.84Å; M83-R183 HydrophobicContact SD-CG 3.8Å; P179-R183 HydrophobicContact CB-CB 3.93Å; A180-R183 WeakPolarHBondContact O-CA 3.34Å; A180-R183 WeakPolarHBondContact O-CB 3.4Å; A180-R183 PolarHBondContact O-N 3.02Å; R183-L185 VanDerWaalsContact C-N 3.33Å; R183-L185 PolarHBondContact O-N 3.44Å; R183-T186 WeakPolarHBondContact O-CB 3.45Å; R183-T186 PolarHBondContact O-N 2.91Å; R183-I187 WeakPolarHBondContact O-CG1 3.33Å; R183-I187 PolarHBondContact O-N 3.39Å; R183-C213 HydrophobicContact CG-CB 3.79Å
184	F	96.6	Very high	92.8	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-57	-48.6	175.1	178.2	-87.7	0	0	0	110.7	L56 L59 F160 V163 Y164 L167 P179 A180 Y181 T186 I187 L188	L56-F184 HydrophobicContact CD1-CD1 3.49Å; L56-F184 VanDerWaalsContact CD1-CD1 3.49Å; L56-F184 HydrophobicContact CD1-CE1 3.96Å; L56-F184 HydrophobicContact CD1-CG 4.38Å; L59-F184 HydrophobicContact CD1-CB 3.72Å; L59-F184 HydrophobicContact CD1-CD1 4.11Å; L59-F184 HydrophobicContact CD1-CD2 3.79Å; L59-F184 HydrophobicContact CD1-CE2 4.49Å; L59-F184 HydrophobicContact CD1-CG 3.57Å; F160-F184 AromaticContact CD2-CE1 3.43Å; F160-F184 HydrophobicContact CD2-CE1 3.43Å; F160-F184 VanDerWaalsContact CD2-CE1 3.43Å; F160-F184 AromaticContact CD2-CZ 3.62Å; F160-F184 HydrophobicContact CD2-CZ 3.62Å; F160-F184 HydrophobicContact CE2-CD1 4.32Å; F160-F184 AromaticContact CE2-CE1 3.32Å; F160-F184 HydrophobicContact CE2-CE1 3.32Å; F160-F184 AromaticContact CE2-CZ 3.5Å; F160-F184 HydrophobicContact CE2-CZ 3.5Å; F160-F184 HydrophobicContact CG-CZ 4.39Å; F160-F184 HydrophobicContact CZ-CE1 4.39Å; F160-F184 HydrophobicContact CZ-CZ 4.23Å; V163-F184 HydrophobicContact CB-CE2 4.44Å; V163-F184 HydrophobicContact CB-CZ 4.45Å; V163-F184 HydrophobicContact CG1-CD2 4.43Å; V163-F184 HydrophobicContact CG1-CE2 3.81Å; V163-F184 HydrophobicContact CG1-CZ 4.19Å; Y164-F184 AromaticContact CD2-CE2 3.97Å; Y164-F184 HydrophobicContact CD2-CE2 3.97Å; Y164-F184 HydrophobicContact CD2-CZ 4.27Å; Y164-F184 HydrophobicContact CG-CE2 4.43Å; L167-F184 HydrophobicContact CD1-CD2 3.78Å; L167-F184 HydrophobicContact CD1-CE2 3.9Å; P179-F184 HydrophobicContact CB-CB 4.42Å; P179-F184 HydrophobicContact CG-CB 4.08Å; P179-F184 HydrophobicContact CG-CD2 4.15Å; A180-F184 PolarHBondContact O-N 3.23Å; Y181-F184 PolarHBondContact O-N 3.45Å; F184-T186 VanDerWaalsContact C-N 3.3Å; F184-T186 PolarHBondContact O-N 2.95Å; F184-I187 PolarHBondContact O-N 3.2Å; F184-L188 HydrophobicContact CE1-CB 4.38Å; F184-L188 HydrophobicContact CE1-CD2 4.12Å; F184-L188 WeakPolarHBondContact O-CB 3.47Å; F184-L188 PolarHBondContact O-N 3.47Å
185	L	97.3	Very high	93.6	Very high	0 Å²	0	24 Å²	24	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.7	-34.6	177.3	-77.4	176.7	0	0	0	113.3	L56 Y132 V140 F156 Y181 F182 R183 L188 A189	L56-L185 HydrophobicContact CD1-CD2 4.28Å; L56-L185 HydrophobicContact CD1-CG 4.2Å; L56-L185 HydrophobicContact CD2-CD1 4.48Å; L56-L185 HydrophobicContact CD2-CD2 3.87Å; L56-L185 HydrophobicContact CD2-CG 4.32Å; Y132-L185 HydrophobicContact CE2-CB 4.44Å; V140-L185 HydrophobicContact CG1-CD1 4.44Å; V140-L185 HydrophobicContact CG1-CD2 3.97Å; F156-L185 HydrophobicContact CE2-CD2 4.49Å; Y181-L185 HydrophobicContact CD1-CD1 3.84Å; Y181-L185 HydrophobicContact CE1-CD1 3.26Å; Y181-L185 HydrophobicContact CE1-CG 4.35Å; Y181-L185 PolarHBondContact O-N 2.87Å; F182-L185 PolarHBondContact O-N 3.29Å; R183-L185 VanDerWaalsContact C-N 3.33Å; R183-L185 PolarHBondContact O-N 3.44Å; L185-L188 HydrophobicContact CD2-CD2 4.25Å; L185-L188 PolarHBondContact O-N 2.7Å; L185-A189 WeakPolarHBondContact O-CB 3.43Å; L185-A189 PolarHBondContact O-N 3.01Å
186	T	97.7	Very high	94.5	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.006	12%	0.123	C	C	.	.	H	α-helix	trans	-64.7	-46.2	174.8	-60.4	0	0	0	0	110.9	M83 Y132 F182 R183 F184 L188 A189 F190 C213 T214	M83-T186 HydrophobicContact CE-CG2 4.34Å; Y132-T186 PolarHBondContact OH-N 3.48Å; Y132-T186 PolarHBondContact OH-OG1 3.07Å; F182-T186 PolarHBondContact O-N 3.24Å; F182-T186 PolarHBondContact O-OG1 3.46Å; R183-T186 WeakPolarHBondContact O-CB 3.45Å; R183-T186 PolarHBondContact O-N 2.91Å; F184-T186 VanDerWaalsContact C-N 3.3Å; F184-T186 PolarHBondContact O-N 2.95Å; T186-L188 VanDerWaalsContact C-N 3.35Å; T186-A189 PolarHBondContact O-N 2.93Å; T186-F190 HydrophobicContact CG2-CD2 4.06Å; T186-F190 HydrophobicContact CG2-CE2 3.49Å; T186-F190 VanDerWaalsContact CG2-CE2 3.49Å; T186-F190 HydrophobicContact CG2-CZ 4.04Å; T186-F190 VanDerWaalsContact O-CD2 3.31Å; T186-F190 WeakPolarHBondContact O-CD2 3.47Å; T186-F190 PolarHBondContact O-N 2.85Å; T186-F190 VanDerWaalsContact O-N 3.08Å; T186-C213 PolarHBondContact OG1-SG 3.05Å; T186-T214 HydrophobicContact CG2-CG2 4.07Å
187	I	98.4	Very high	95.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62	-44.7	176.1	-65.2	161.3	0	0	0	110.3	M83 F86 L87 A90 L92 V163 P179 R183 F184 A189 F190 H191	M83-I187 HydrophobicContact CE-CD1 4.29Å; M83-I187 HydrophobicContact CE-CG1 3.88Å; F86-I187 HydrophobicContact CB-CD1 3.54Å; F86-I187 HydrophobicContact CG-CD1 4.44Å; L87-I187 HydrophobicContact CD2-CG1 4.07Å; L87-I187 HydrophobicContact CD2-CG2 4.28Å; A90-I187 HydrophobicContact CB-CG2 3.63Å; L92-I187 HydrophobicContact CD1-CG2 4.45Å; V163-I187 HydrophobicContact CG1-CG2 3.85Å; P179-I187 HydrophobicContact CB-CD1 4.27Å; P179-I187 HydrophobicContact CG-CD1 4.29Å; R183-I187 WeakPolarHBondContact O-CG1 3.33Å; R183-I187 PolarHBondContact O-N 3.39Å; F184-I187 PolarHBondContact O-N 3.2Å; I187-A189 VanDerWaalsContact C-N 3.35Å; I187-A189 PolarHBondContact O-N 3.05Å; I187-F190 PolarHBondContact O-N 3.28Å; I187-H191 PolarHBondContact O-N 3.26Å
188	L	98.6	Very high	96.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59.2	-45.1	176.5	179.3	60.6	0	0	0	111.4	I144 F156 Y159 F160 V163 F184 L185 T186 F190 H191 V192	I144-L188 HydrophobicContact CD1-CB 4.43Å; I144-L188 HydrophobicContact CD1-CD2 3.99Å; I144-L188 HydrophobicContact CD1-CG 3.88Å; F156-L188 HydrophobicContact CD2-CD2 4.39Å; F156-L188 HydrophobicContact CE2-CD2 3.81Å; F156-L188 HydrophobicContact CZ-CD2 4.08Å; Y159-L188 VanDerWaalsContact C-CD1 3.42Å; Y159-L188 WeakPolarHBondContact O-CD1 3.15Å; F160-L188 HydrophobicContact CD2-CD2 4.42Å; V163-L188 HydrophobicContact CB-CD1 4.42Å; V163-L188 HydrophobicContact CG2-CD1 4.05Å; F184-L188 HydrophobicContact CE1-CB 4.38Å; F184-L188 HydrophobicContact CE1-CD2 4.12Å; F184-L188 WeakPolarHBondContact O-CB 3.47Å; F184-L188 PolarHBondContact O-N 3.47Å; L185-L188 HydrophobicContact CD2-CD2 4.25Å; L185-L188 PolarHBondContact O-N 2.7Å; T186-L188 VanDerWaalsContact C-N 3.35Å; L188-F190 PolarHBondContact O-N 3.37Å; L188-H191 PolarHBondContact O-N 2.9Å; L188-V192 HydrophobicContact CD1-CG2 4.15Å; L188-V192 HydrophobicContact CG-CG2 4.35Å; L188-V192 WeakPolarHBondContact O-CB 3.37Å; L188-V192 WeakPolarHBondContact O-CG2 3.22Å; L188-V192 PolarHBondContact O-N 3.41Å
189	A	98.7	Very high	96.6	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.008	13%	0.127	C	C	.	.	H	α-helix	trans	-60.7	-45.2	177.8	0	0	0	0	0	112	Y132 I144 L185 T186 I187 V192 F193	Y132-A189 HydrophobicContact CD2-CB 3.37Å; Y132-A189 HydrophobicContact CE2-CB 3.83Å; Y132-A189 HydrophobicContact CG-CB 3.94Å; I144-A189 HydrophobicContact CD1-CB 4.11Å; I144-A189 HydrophobicContact CG1-CB 4.01Å; I144-A189 HydrophobicContact CG2-CB 4.5Å; L185-A189 WeakPolarHBondContact O-CB 3.43Å; L185-A189 PolarHBondContact O-N 3.01Å; T186-A189 PolarHBondContact O-N 2.93Å; I187-A189 VanDerWaalsContact C-N 3.35Å; I187-A189 PolarHBondContact O-N 3.05Å; A189-V192 PolarHBondContact O-N 3.26Å; A189-F193 HydrophobicContact CB-CE2 4.17Å; A189-F193 HydrophobicContact CB-CZ 4.42Å; A189-F193 VanDerWaalsContact O-CD2 3.25Å; A189-F193 WeakPolarHBondContact O-CD2 3.42Å; A189-F193 WeakPolarHBondContact O-CG 3.47Å; A189-F193 PolarHBondContact O-N 2.95Å
190	F	98.8	Very high	97	Very high	1 Å²	1	26.1 Å²	26.1	0%	0.004	13%	0.126	C	C	.	.	H	α-helix	trans	-61.9	-43.9	175	-68	-41.5	0	0	0	112.4	L87 L92 L97 L100 I102 T186 I187 L188 F193 L194 I203 V216 V217	L87-F190 HydrophobicContact CD2-CD2 4.33Å; L92-F190 HydrophobicContact CD1-CB 4.38Å; L97-F190 HydrophobicContact CD1-CD2 3.9Å; L97-F190 HydrophobicContact CD1-CE2 3.85Å; L97-F190 HydrophobicContact CD1-CG 4.29Å; L97-F190 HydrophobicContact CD1-CZ 4.22Å; L97-F190 HydrophobicContact CD2-CB 3.68Å; L97-F190 HydrophobicContact CD2-CD1 4.1Å; L97-F190 HydrophobicContact CD2-CD2 4.02Å; L97-F190 HydrophobicContact CD2-CG 3.69Å; L100-F190 HydrophobicContact CD1-CD1 3.81Å; I102-F190 HydrophobicContact CD1-CE1 4.17Å; T186-F190 HydrophobicContact CG2-CD2 4.06Å; T186-F190 HydrophobicContact CG2-CE2 3.49Å; T186-F190 VanDerWaalsContact CG2-CE2 3.49Å; T186-F190 HydrophobicContact CG2-CZ 4.04Å; T186-F190 VanDerWaalsContact O-CD2 3.31Å; T186-F190 WeakPolarHBondContact O-CD2 3.47Å; T186-F190 PolarHBondContact O-N 2.85Å; T186-F190 VanDerWaalsContact O-N 3.08Å; I187-F190 PolarHBondContact O-N 3.28Å; L188-F190 PolarHBondContact O-N 3.37Å; F190-F193 PolarHBondContact O-N 2.91Å; F190-L194 WeakPolarHBondContact O-CB 3.41Å; F190-L194 VanDerWaalsContact O-CG 3.31Å; F190-L194 WeakPolarHBondContact O-CG 3.36Å; F190-L194 PolarHBondContact O-N 2.93Å; F190-I203 HydrophobicContact CE1-CD1 3.95Å; F190-I203 HydrophobicContact CE1-CG1 4.27Å; F190-V216 HydrophobicContact CE2-CG1 3.78Å; F190-V216 HydrophobicContact CZ-CG1 4.35Å; F190-V217 HydrophobicContact CE1-CG2 4.17Å; F190-V217 HydrophobicContact CZ-CG2 3.77Å
191	H	98.6	Very high	97.4	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-57.7	-50.4	175.1	-175	69.9	0	0	0	110.9	L92 Y159 Q162 V163 I187 L188 F193 L194 Q195	L92-H191 HydrophobicContact CD1-CB 4.06Å; Y159-H191 AromaticContact CD1-CD2 3.63Å; Y159-H191 AromaticContact CD1-NE2 3.65Å; Q162-H191 PolarHBondContact OE1-NE2 3.2Å; V163-H191 HydrophobicContact CG2-CB 3.75Å; I187-H191 PolarHBondContact O-N 3.26Å; L188-H191 PolarHBondContact O-N 2.9Å; H191-F193 PolarHBondContact O-N 3Å; H191-L194 PolarHBondContact O-N 3.31Å; H191-Q195 WeakPolarHBondContact O-CB 3.07Å; H191-Q195 VanDerWaalsContact O-CG 3.28Å; H191-Q195 WeakPolarHBondContact O-CG 3.29Å; H191-Q195 PolarHBondContact O-N 3.35Å
192	V	98.8	Very high	97.8	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-55.8	-52.4	178.1	170.8	0	0	0	0	110.5	I144 I146 I151 Y159 L188 A189 L194 Q195 E196	I144-V192 HydrophobicContact CG2-CB 4.13Å; I144-V192 HydrophobicContact CG2-CG1 3.85Å; I144-V192 HydrophobicContact CG2-CG2 4.36Å; I146-V192 HydrophobicContact CD1-CG1 4.04Å; I151-V192 HydrophobicContact CD1-CG1 4.44Å; I151-V192 HydrophobicContact CD1-CG2 4.24Å; I151-V192 HydrophobicContact CG2-CG1 4.18Å; Y159-V192 HydrophobicContact CD2-CB 4.38Å; Y159-V192 HydrophobicContact CD2-CG1 4.4Å; Y159-V192 HydrophobicContact CD2-CG2 3.63Å; Y159-V192 HydrophobicContact CE2-CG2 4.46Å; Y159-V192 HydrophobicContact CG-CG2 3.89Å; L188-V192 HydrophobicContact CD1-CG2 4.15Å; L188-V192 HydrophobicContact CG-CG2 4.35Å; L188-V192 WeakPolarHBondContact O-CB 3.37Å; L188-V192 WeakPolarHBondContact O-CG2 3.22Å; L188-V192 PolarHBondContact O-N 3.41Å; A189-V192 PolarHBondContact O-N 3.26Å; V192-L194 VanDerWaalsContact C-N 3.31Å; V192-L194 PolarHBondContact O-N 2.81Å; V192-Q195 PolarHBondContact O-N 2.8Å; V192-E196 HydrophobicContact CG1-CG 4.18Å; V192-E196 WeakPolarHBondContact O-CB 3.29Å; V192-E196 WeakPolarHBondContact O-CG 3.36Å; V192-E196 PolarHBondContact O-N 2.72Å
193	F	98.8	Very high	98.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63.5	-35.3	-176.7	-63	-24.4	0	0	0	113.2	L100 I144 R145 I146 A189 F190 H191 E196 K197 V198 A201 I203	L100-F193 HydrophobicContact CD1-CB 4.24Å; L100-F193 HydrophobicContact CD2-CB 3.72Å; I144-F193 HydrophobicContact CG2-CE1 3.75Å; I144-F193 HydrophobicContact CG2-CZ 4.07Å; R145-F193 WeakPolarHBondContact O-CE1 3.49Å; I146-F193 HydrophobicContact CG1-CE1 4.48Å; A189-F193 HydrophobicContact CB-CE2 4.17Å; A189-F193 HydrophobicContact CB-CZ 4.42Å; A189-F193 VanDerWaalsContact O-CD2 3.25Å; A189-F193 WeakPolarHBondContact O-CD2 3.42Å; A189-F193 WeakPolarHBondContact O-CG 3.47Å; A189-F193 PolarHBondContact O-N 2.95Å; F190-F193 PolarHBondContact O-N 2.91Å; H191-F193 PolarHBondContact O-N 3Å; F193-E196 CarbonylContact O-C 3.6Å; F193-K197 PolarHBondContact O-N 3.14Å; F193-V198 HydrophobicContact CB-CG1 4.42Å; F193-V198 HydrophobicContact CB-CG2 3.72Å; F193-V198 HydrophobicContact CD1-CG1 4.28Å; F193-V198 HydrophobicContact CG-CG2 4.29Å; F193-V198 PolarHBondContact O-N 3.17Å; F193-V198 VanDerWaalsContact O-N 3.15Å; F193-A201 HydrophobicContact CD2-CB 3.66Å; F193-A201 HydrophobicContact CE2-CB 4.07Å; F193-A201 HydrophobicContact CG-CB 4.36Å; F193-I203 HydrophobicContact CD2-CD1 4.35Å; F193-I203 HydrophobicContact CE2-CD1 3.9Å
194	L	98.6	Very high	98.4	Very high	35 Å²	35	19.1 Å²	19.1	18%	0.183	9%	0.091	C	C	.	.	H	α-helix	trans	-70.4	-46.8	174.8	-72.3	168.9	0	0	0	112	L92 Q96 L97 L100 F190 H191 V192 E196 K197	L92-L194 HydrophobicContact CD2-CD1 3.82Å; Q96-L194 HydrophobicContact CB-CD1 4.16Å; Q96-L194 WeakPolarHBondContact O-CD2 3.3Å; L97-L194 HydrophobicContact CD2-CD1 4.18Å; L100-L194 HydrophobicContact CD1-CD2 4.39Å; L100-L194 HydrophobicContact CD1-CG 4.21Å; L100-L194 HydrophobicContact CD2-CD2 3.69Å; L100-L194 HydrophobicContact CD2-CG 3.94Å; L100-L194 HydrophobicContact CG-CD2 3.84Å; L100-L194 HydrophobicContact CG-CG 4.17Å; F190-L194 WeakPolarHBondContact O-CB 3.41Å; F190-L194 VanDerWaalsContact O-CG 3.31Å; F190-L194 WeakPolarHBondContact O-CG 3.36Å; F190-L194 PolarHBondContact O-N 2.93Å; H191-L194 PolarHBondContact O-N 3.31Å; V192-L194 VanDerWaalsContact C-N 3.31Å; V192-L194 PolarHBondContact O-N 2.81Å; L194-E196 VanDerWaalsContact C-N 3.33Å; L194-K197 PolarHBondContact O-N 3Å; L194-K197 VanDerWaalsContact O-N 3.11Å
195	Q	98.3	Very high	98.4	Very high	86 Å²	86	19.1 Å²	19.1	40%	0.402	9%	0.091	S	C	.	.	H	α-helix	trans	-65.5	-40.6	179.2	-66.9	-50.6	-51.3	0	0	111.6	Y159 H191 V192 K197	Y159-Q195 HydrophobicContact CD1-CG 4.33Å; Y159-Q195 HydrophobicContact CE1-CB 3.66Å; Y159-Q195 HydrophobicContact CE1-CG 3.76Å; H191-Q195 WeakPolarHBondContact O-CB 3.07Å; H191-Q195 VanDerWaalsContact O-CG 3.28Å; H191-Q195 WeakPolarHBondContact O-CG 3.29Å; H191-Q195 PolarHBondContact O-N 3.35Å; V192-Q195 PolarHBondContact O-N 2.8Å; Q195-K197 PolarHBondContact O-N 2.89Å
196	E	98.4	Very high	98.1	Very high	33 Å²	33	19.8 Å²	19.8	15%	0.154	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	8.9	175.2	-64.1	-61.5	146.3	0	0	112.3	R128 I146 Y159 V192 F193 L194 V198	R128-E196 IonicContact CZ-OE2 2.66Å; R128-E196 PolarHBondContact NH1-O 2.96Å; R128-E196 PolarHBondContact NH2-O 2.96Å; R128-E196 IonicContact NH2-OE2 3.66Å; R128-E196 PolarHBondContact NH2-OE2 2.8Å; I146-E196 HydrophobicContact CD1-CB 3.52Å; I146-E196 HydrophobicContact CD1-CG 3.52Å; Y159-E196 HydrophobicContact CE2-CG 4.03Å; Y159-E196 WeakPolarHBondContact CE2-OE1 3.47Å; Y159-E196 PolarHBondContact OH-OE1 3.03Å; V192-E196 HydrophobicContact CG1-CG 4.18Å; V192-E196 WeakPolarHBondContact O-CB 3.29Å; V192-E196 WeakPolarHBondContact O-CG 3.36Å; V192-E196 PolarHBondContact O-N 2.72Å; F193-E196 CarbonylContact O-C 3.6Å; L194-E196 VanDerWaalsContact C-N 3.33Å; E196-V198 VanDerWaalsContact C-N 3.27Å; E196-V198 PolarHBondContact O-N 2.86Å
197	K	98.1	Very high	97.6	Very high	162 Å²	162	23.1 Å²	23.1	70%	0.704	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	43.7	50	169.4	-55.9	-179.1	-176.6	179.2	0	113.7	F193 L194 Q195	F193-K197 PolarHBondContact O-N 3.14Å; L194-K197 PolarHBondContact O-N 3Å; L194-K197 VanDerWaalsContact O-N 3.11Å; Q195-K197 PolarHBondContact O-N 2.89Å
198	V	98.6	Very high	97.3	Very high	10 Å²	10	23.1 Å²	23.1	6%	0.061	12%	0.115	C	C	.	.			trans	-67.4	149.5	175.2	-56.3	0	0	0	0	109.8	L100 F193 E196 L200	L100-V198 HydrophobicContact CD2-CG2 3.93Å; F193-V198 HydrophobicContact CB-CG1 4.42Å; F193-V198 HydrophobicContact CB-CG2 3.72Å; F193-V198 HydrophobicContact CD1-CG1 4.28Å; F193-V198 HydrophobicContact CG-CG2 4.29Å; F193-V198 PolarHBondContact O-N 3.17Å; F193-V198 VanDerWaalsContact O-N 3.15Å; E196-V198 VanDerWaalsContact C-N 3.27Å; E196-V198 PolarHBondContact O-N 2.86Å; V198-L200 VanDerWaalsContact C-N 3.35Å; V198-L200 WeakPolarHBondContact CG2-O 3.5Å
199	D	98.4	Very high	97.1	Very high	60 Å²	60	23.1 Å²	23.1	32%	0.321	12%	0.115	S	C	.	.	S	Bend	trans	-73.6	-32.2	176.9	-68.2	-50.6	0	0	0	111.7	N101 F127 R128	N101-D199 PolarHBondContact ND2-O 3.32Å; F127-D199 HydrophobicContact CB-CB 4.23Å; F127-D199 HydrophobicContact CD1-CB 4.07Å; R128-D199 WeakPolarHBondContact CB-OD2 3.32Å; R128-D199 PolarHBondContact N-OD2 3.24Å; R128-D199 PolarHBondContact O-N 2.83Å
200	L	98.6	Very high	96.9	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	158.7	171.6	71.9	140.4	0	0	0	112.4	L100 N101 I103 L122 F127 T129 G130 V198 I202 W320	L100-L200 CarbonylContact O-C 3.55Å; L100-L200 VanDerWaalsContact O-CA 3.24Å; L100-L200 WeakPolarHBondContact O-CA 3.46Å; N101-L200 HydrophobicContact CB-CB 4.24Å; I103-L200 HydrophobicContact CD1-CD1 3.85Å; I103-L200 HydrophobicContact CG1-CD1 4.27Å; L122-L200 HydrophobicContact CB-CD2 4.3Å; L122-L200 HydrophobicContact CD1-CD1 3.38Å; L122-L200 HydrophobicContact CD1-CD2 4.37Å; F127-L200 HydrophobicContact CB-CD2 3.76Å; F127-L200 HydrophobicContact CG-CD2 4.22Å; T129-L200 HydrophobicContact CG2-CD2 4.08Å; T129-L200 HydrophobicContact CG2-CG 4.49Å; G130-L200 PolarHBondContact N-O 2.96Å; V198-L200 VanDerWaalsContact C-N 3.35Å; V198-L200 WeakPolarHBondContact CG2-O 3.5Å; L200-I202 HydrophobicContact CD1-CD1 3.64Å; L200-I202 HydrophobicContact CD1-CG1 4.16Å; L200-I202 HydrophobicContact CG-CD1 4.21Å; L200-W320 HydrophobicContact CB-CH2 4.44Å; L200-W320 HydrophobicContact CB-CZ2 3.63Å; L200-W320 HydrophobicContact CD1-CZ2 4.35Å; L200-W320 HydrophobicContact CD2-CH2 3.81Å; L200-W320 HydrophobicContact CD2-CZ2 3.85Å; L200-W320 HydrophobicContact CD2-CZ3 4.37Å; L200-W320 HydrophobicContact CG-CZ2 4.14Å
201	A	98.8	Very high	96.6	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127.6	169.5	0	0	0	0	0	111.9	L100 I102 I103 G130 F193 I203	L100-A201 HydrophobicContact CB-CB 4.13Å; L100-A201 PolarHBondContact O-N 3.28Å; I102-A201 VanDerWaalsContact CA-O 3.31Å; I102-A201 WeakPolarHBondContact CA-O 3.3Å; I102-A201 HydrophobicContact CG1-CB 4.34Å; I103-A201 PolarHBondContact N-O 3.49Å; G130-A201 CarbonylContact O-C 3.47Å; G130-A201 WeakPolarHBondContact O-CA 3.45Å; F193-A201 HydrophobicContact CD2-CB 3.66Å; F193-A201 HydrophobicContact CE2-CB 4.07Å; F193-A201 HydrophobicContact CG-CB 4.36Å; A201-I203 HydrophobicContact CB-CD1 3.92Å; A201-I203 HydrophobicContact CB-CG1 4.33Å
202	I	98.9	Very high	96.4	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	117.1	168.9	-57.4	83.9	0	0	0	107.1	C115 T118 E119 T129 G130 F131 Y132 L200	C115-I202 HydrophobicContact CB-CG2 3.64Å; T118-I202 HydrophobicContact CG2-CG1 4.03Å; E119-I202 HydrophobicContact CB-CD1 4.19Å; E119-I202 HydrophobicContact CG-CD1 4.43Å; T129-I202 HydrophobicContact CG2-CD1 4.3Å; G130-I202 WeakPolarHBondContact O-CD1 3.27Å; G130-I202 PolarHBondContact O-N 2.94Å; F131-I202 WeakPolarHBondContact CA-O 3.35Å; F131-I202 HydrophobicContact CD2-CB 4.21Å; F131-I202 HydrophobicContact CD2-CG2 4.22Å; Y132-I202 PolarHBondContact N-O 3.04Å; L200-I202 HydrophobicContact CD1-CD1 3.64Å; L200-I202 HydrophobicContact CD1-CG1 4.16Å; L200-I202 HydrophobicContact CG-CD1 4.21Å
203	I	98.8	Very high	96.2	Very high	1 Å²	1	28 Å²	28	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	112.4	-174.3	-54.8	-60.6	0	0	0	109.2	I102 I103 H104 V105 Y132 F190 F193 A201 T214	I102-I203 HydrophobicContact CD1-CG1 4.44Å; I102-I203 HydrophobicContact CG1-CG1 4.43Å; I102-I203 HydrophobicContact CG2-CB 4.16Å; I102-I203 HydrophobicContact CG2-CG1 3.66Å; I103-I203 PolarHBondContact O-N 3.47Å; H104-I203 PolarHBondContact CD2-O 3.29Å; V105-I203 PolarHBondContact N-O 2.87Å; Y132-I203 HydrophobicContact CD1-CG2 4.26Å; F190-I203 HydrophobicContact CE1-CD1 3.95Å; F190-I203 HydrophobicContact CE1-CG1 4.27Å; F193-I203 HydrophobicContact CD2-CD1 4.35Å; F193-I203 HydrophobicContact CE2-CD1 3.9Å; A201-I203 HydrophobicContact CB-CD1 3.92Å; A201-I203 HydrophobicContact CB-CG1 4.33Å; I203-T214 HydrophobicContact CG2-CG2 3.76Å
204	E	98.6	Very high	96.1	Very high	11 Å²	11	28 Å²	28	5%	0.051	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	128.2	168.8	-177.7	175.9	-164.4	0	0	110.4	K111 G112 Y132 S133 S134	K111-E204 HydrophobicContact CB-CG 4.03Å; K111-E204 WeakPolarHBondContact CB-OE1 3.5Å; K111-E204 HydrophobicContact CD-CG 4.34Å; G112-E204 PolarHBondContact N-OE1 3.02Å; G112-E204 VanDerWaalsContact N-OE1 3.16Å; Y132-E204 VanDerWaalsContact O-CB 3.27Å; Y132-E204 WeakPolarHBondContact O-CB 3.49Å; Y132-E204 PolarHBondContact O-N 2.82Å; S133-E204 WeakPolarHBondContact CA-OE2 3.31Å; S133-E204 VanDerWaalsContact CB-OE2 3.32Å; S133-E204 WeakPolarHBondContact CB-OE2 3.45Å; S134-E204 PolarHBondContact N-OE2 3.24Å; S134-E204 VanDerWaalsContact N-OE2 3.09Å
205	V	97.2	Very high	96	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.133	C	C	.	.			trans	-67.7	133.7	169.7	173.5	0	0	0	0	110.3	H104 V105 K111 G208 D212 I250	H104-V205 WeakPolarHBondContact NE2-CG2 3.4Å; V105-V205 WeakPolarHBondContact O-CG2 3.44Å; V105-V205 PolarHBondContact O-N 2.8Å; K111-V205 WeakPolarHBondContact CE-O 3.36Å; V205-G208 WeakPolarHBondContact CG1-O 3.38Å; V205-D212 HydrophobicContact CG1-CB 3.75Å; V205-I250 HydrophobicContact CG2-CG2 3.91Å
206	G	90.8	Very high	96	Very high	14 Å²	14	23.5 Å²	23.5	14%	0.144	12%	0.117	C	C	.	.	S	Bend	trans	-65.3	-74.1	175.2	0	0	0	0	0	112.2	F182 D212	F182-G206 VanDerWaalsContact CZ-CA 3.48Å; G206-D212 WeakPolarHBondContact CA-OD2 3.44Å; G206-D212 PolarHBondContact N-OD2 2.92Å; G206-D212 VanDerWaalsContact N-OD2 3.13Å
207	I	86.8	Confident	95.9	Very high	70 Å²	70	22 Å²	22	36%	0.359	11%	0.11	S	C	.	.	S	Bend	trans	-135.7	131.4	-178.1	-59.3	177.9	0	0	0	109.9	G209 D212 H232 I235 L236	I207-G209 PolarHBondContact O-N 3.05Å; I207-D212 PolarHBondContact N-OD2 2.93Å; I207-H232 HydrophobicContact CG2-CB 4.47Å; I207-I235 HydrophobicContact CD1-CD1 4.45Å; I207-I235 HydrophobicContact CG2-CG2 4.37Å; I207-L236 HydrophobicContact CG2-CD1 4.2Å; I207-L236 HydrophobicContact CG2-CD2 4.04Å; I207-L236 HydrophobicContact CG2-CG 4.2Å
208	G	91.7	Very high	95.8	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.01	10%	0.096	C	C	.	.			trans	75.8	-116	179.5	0	0	0	0	0	112.3	T106 V205 L236 K247	T106-G208 PolarHBondContact OG1-O 2.95Å; V205-G208 WeakPolarHBondContact CG1-O 3.38Å; G208-L236 VanDerWaalsContact CA-CD2 3.45Å; G208-K247 VanDerWaalsContact O-CG 3.3Å; G208-K247 WeakPolarHBondContact O-CG 3.48Å
209	G	94	Very high	95.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.123	C	C	.	.	S	Bend	trans	170.7	-63.1	-177.8	0	0	0	0	0	111.2	I207 Y211 D212 N215 Q246	I207-G209 PolarHBondContact O-N 3.05Å; G209-Y211 VanDerWaalsContact C-N 3.28Å; G209-Y211 PolarHBondContact O-N 3.18Å; G209-D212 PolarHBondContact O-N 3.49Å; G209-N215 VanDerWaalsContact O-CB 3.24Å; G209-N215 WeakPolarHBondContact O-CB 3.45Å; G209-N215 PolarHBondContact O-ND2 3.39Å; G209-Q246 CarbonylContact C-O 3.05Å; G209-Q246 WeakPolarHBondContact CA-O 3.3Å; G209-Q246 PolarHBondContact N-O 3.07Å
210	A	94.6	Very high	95.5	Very high	10 Å²	10	23.1 Å²	23.1	8%	0.083	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-44.2	-175.5	0	0	0	0	0	112.9	L80 N215 W245 Q246	L80-A210 WeakPolarHBondContact CD2-O 3.3Å; A210-N215 PolarHBondContact O-ND2 3.36Å; A210-W245 HydrophobicContact CB-CZ3 4.08Å; A210-Q246 PolarHBondContact N-O 3.49Å
211	Y	93.4	Very high	95.4	Very high	77 Å²	77	25.5 Å²	25.5	30%	0.302	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	11	-176.6	-51.2	-46.7	0	0	0	113.6	P76 Q77 G209 W245 Q246	P76-Y211 HydrophobicContact CB-CD2 3.89Å; P76-Y211 HydrophobicContact CB-CG 3.98Å; Q77-Y211 HydrophobicContact CB-CD1 4.22Å; Q77-Y211 HydrophobicContact CB-CE1 3.98Å; Q77-Y211 HydrophobicContact CG-CE1 4.22Å; G209-Y211 VanDerWaalsContact C-N 3.28Å; G209-Y211 PolarHBondContact O-N 3.18Å; Y211-W245 HydrophobicContact CE2-CZ3 4.11Å; Y211-W245 WeakPolarHBondContact OH-CH2 3.5Å; Y211-Q246 VanDerWaalsContact CE2-NE2 3.3Å
212	D	94.5	Very high	95.4	Very high	11 Å²	11	25.5 Å²	25.5	6%	0.059	12%	0.117	C	C	.	.	S	Bend	trans	-72.1	142.9	174.3	-171.9	-91.1	0	0	0	109.6	V205 G206 I207 G209 T214 N215	V205-D212 HydrophobicContact CG1-CB 3.75Å; G206-D212 WeakPolarHBondContact CA-OD2 3.44Å; G206-D212 PolarHBondContact N-OD2 2.92Å; G206-D212 VanDerWaalsContact N-OD2 3.13Å; I207-D212 PolarHBondContact N-OD2 2.93Å; G209-D212 PolarHBondContact O-N 3.49Å; D212-T214 PolarHBondContact O-N 2.9Å; D212-T214 VanDerWaalsContact O-N 3.17Å; D212-T214 VanDerWaalsContact OD1-CB 3.26Å; D212-T214 WeakPolarHBondContact OD1-CB 3.43Å; D212-T214 VanDerWaalsContact OD1-CG2 3.26Å; D212-T214 WeakPolarHBondContact OD1-CG2 3.38Å; D212-T214 PolarHBondContact OD1-N 3.08Å; D212-T214 PolarHBondContact OD1-OG1 3.3Å; D212-N215 WeakPolarHBondContact O-CB 3.43Å; D212-N215 PolarHBondContact O-N 3.45Å
213	C	93.9	Very high	95.4	Very high	7 Å²	7	25.5 Å²	25.5	5%	0.047	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-65.6	-20.7	-177	55.8	0	0	0	0	113.9	M83 F182 R183 T186 N215 V216	M83-C213 HydrophobicContact CE-CB 3.92Å; M83-C213 HydrophobicContact CG-CB 3.94Å; M83-C213 HydrophobicContact SD-CB 3.6Å; M83-C213 VanDerWaalsContact SD-CB 3.6Å; F182-C213 WeakPolarHBondContact CD1-SG 3.34Å; F182-C213 WeakPolarHBondContact CE1-SG 3.36Å; R183-C213 HydrophobicContact CG-CB 3.79Å; T186-C213 PolarHBondContact OG1-SG 3.05Å; C213-N215 PolarHBondContact O-N 2.95Å; C213-V216 WeakPolarHBondContact O-CG1 3.33Å; C213-V216 PolarHBondContact O-N 2.95Å
214	T	96.9	Very high	95.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-67.5	-19.5	171.2	64.9	0	0	0	0	112.3	H104 Y132 T186 I203 D212 V216 V217	H104-T214 PolarHBondContact NE2-OG1 3.24Å; Y132-T214 HydrophobicContact CD1-CG2 4.22Å; Y132-T214 HydrophobicContact CE1-CG2 3.95Å; T186-T214 HydrophobicContact CG2-CG2 4.07Å; I203-T214 HydrophobicContact CG2-CG2 3.76Å; D212-T214 PolarHBondContact O-N 2.9Å; D212-T214 VanDerWaalsContact O-N 3.17Å; D212-T214 VanDerWaalsContact OD1-CB 3.26Å; D212-T214 WeakPolarHBondContact OD1-CB 3.43Å; D212-T214 VanDerWaalsContact OD1-CG2 3.26Å; D212-T214 WeakPolarHBondContact OD1-CG2 3.38Å; D212-T214 PolarHBondContact OD1-N 3.08Å; D212-T214 PolarHBondContact OD1-OG1 3.3Å; T214-V216 PolarHBondContact O-N 2.56Å; T214-V216 VanDerWaalsContact O-N 3.14Å; T214-V217 VanDerWaalsContact O-CG2 3.28Å; T214-V217 WeakPolarHBondContact O-CG2 3.29Å; T214-V217 PolarHBondContact O-N 3.37Å
215	N	97.4	Very high	95.4	Very high	15 Å²	15	25 Å²	25	8%	0.08	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-76.5	8	178.2	-157.8	28.6	0	0	0	114.2	L80 G209 A210 D212 C213 V217 G249 K252	L80-N215 HydrophobicContact CD2-CB 4.34Å; G209-N215 VanDerWaalsContact O-CB 3.24Å; G209-N215 WeakPolarHBondContact O-CB 3.45Å; G209-N215 PolarHBondContact O-ND2 3.39Å; A210-N215 PolarHBondContact O-ND2 3.36Å; D212-N215 WeakPolarHBondContact O-CB 3.43Å; D212-N215 PolarHBondContact O-N 3.45Å; C213-N215 PolarHBondContact O-N 2.95Å; N215-V217 PolarHBondContact O-N 3.22Å; N215-G249 PolarHBondContact ND2-O 2.97Å; N215-K252 PolarHBondContact O-NZ 2.9Å; N215-K252 VanDerWaalsContact OD1-CE 3.28Å; N215-K252 WeakPolarHBondContact OD1-CE 3.48Å; N215-K252 PolarHBondContact OD1-NZ 3.21Å
216	V	97.2	Very high	95.5	Very high	11 Å²	11	25 Å²	25	7%	0.067	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-64.7	-19.8	162.7	72.5	0	0	0	0	111.7	L80 M83 P84 L87 V94 L97 F190 C213 T214 R218	L80-V216 HydrophobicContact CD1-CB 4.47Å; M83-V216 HydrophobicContact CB-CB 4.06Å; M83-V216 HydrophobicContact CB-CG2 3.86Å; M83-V216 HydrophobicContact CE-CG1 4.43Å; P84-V216 HydrophobicContact CG-CG2 4.3Å; L87-V216 HydrophobicContact CD1-CG1 4.26Å; L87-V216 HydrophobicContact CD1-CG2 3.73Å; V94-V216 HydrophobicContact CG1-CG2 4.33Å; V94-V216 WeakPolarHBondContact CG1-O 3.29Å; V94-V216 HydrophobicContact CG2-CG2 4.32Å; L97-V216 HydrophobicContact CD1-CG1 4.01Å; F190-V216 HydrophobicContact CE2-CG1 3.78Å; F190-V216 HydrophobicContact CZ-CG1 4.35Å; C213-V216 WeakPolarHBondContact O-CG1 3.33Å; C213-V216 PolarHBondContact O-N 2.95Å; T214-V216 PolarHBondContact O-N 2.56Å; T214-V216 VanDerWaalsContact O-N 3.14Å; V216-R218 PolarHBondContact O-N 3.35Å
217	V	96.9	Very high	95.8	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.012	11%	0.112	C	C	.	.			trans	-61.7	123.1	171.9	177	0	0	0	0	109.8	I102 F190 T214 N215 P220 K252	I102-V217 HydrophobicContact CB-CG1 4.27Å; I102-V217 HydrophobicContact CD1-CB 4.34Å; I102-V217 HydrophobicContact CD1-CG1 3.8Å; I102-V217 HydrophobicContact CD1-CG2 3.51Å; I102-V217 HydrophobicContact CG2-CG1 4.2Å; F190-V217 HydrophobicContact CE1-CG2 4.17Å; F190-V217 HydrophobicContact CZ-CG2 3.77Å; T214-V217 VanDerWaalsContact O-CG2 3.28Å; T214-V217 WeakPolarHBondContact O-CG2 3.29Å; T214-V217 PolarHBondContact O-N 3.37Å; N215-V217 PolarHBondContact O-N 3.22Å; V217-P220 HydrophobicContact CG1-CB 4.06Å; V217-P220 HydrophobicContact CG1-CG 4.24Å; V217-K252 VanDerWaalsContact O-CE 3.23Å; V217-K252 WeakPolarHBondContact O-CE 3.44Å; V217-K252 PolarHBondContact O-NZ 3.04Å
218	R	95.1	Very high	96.2	Very high	111 Å²	111	21.6 Å²	21.6	42%	0.419	10%	0.095	S	C	.	.	S	Bend	trans	-95.5	-41	-176.1	-57.9	179.3	-54.7	168.4	5.9	112.6	V94 E95 D98 V216 P220 K252	V94-R218 VanDerWaalsContact CG1-CD 3.48Å; V94-R218 HydrophobicContact CG1-CG 3.67Å; E95-R218 IonicContact OE1-CZ 3.75Å; E95-R218 VanDerWaalsContact OE1-CZ 3.25Å; E95-R218 IonicContact OE1-NH1 3.16Å; E95-R218 PolarHBondContact OE1-NH1 3.19Å; E95-R218 IonicContact OE1-NH2 3.76Å; E95-R218 PolarHBondContact OE1-NH2 2.9Å; D98-R218 IonicContact OD2-CZ 3.25Å; D98-R218 IonicContact OD2-NE 2.68Å; D98-R218 IonicContact OD2-NH2 3.33Å; D98-R218 PolarHBondContact OD2-NH2 3.12Å; V216-R218 PolarHBondContact O-N 3.35Å; R218-P220 VanDerWaalsContact C-CD 3.47Å; R218-P220 WeakPolarHBondContact O-CD 3.17Å; R218-K252 WeakPolarHBondContact O-CG 3.49Å
219	K	94.1	Very high	96.1	Very high	143 Å²	143	22.4 Å²	22.4	62%	0.622	10%	0.103	S	C	*	.			trans	-126.4	65.4	-173.9	-162.6	179.9	179.8	-177.9	0	112
220	P	97.6	Very high	95.8	Very high	1 Å²	1	27 Å²	27	1%	0.006	13%	0.127	C	C	.	.			trans	-63.2	150.6	168.9	27.1	-25	0	0	0	109.4	I102 H104 V217 R218 C223 K252 V255	I102-P220 HydrophobicContact CB-CB 4.49Å; I102-P220 HydrophobicContact CG2-CB 4.36Å; I102-P220 CarbonylContact O-C 3.58Å; I102-P220 WeakPolarHBondContact O-CA 3.05Å; H104-P220 HydrophobicContact CB-CB 4.11Å; V217-P220 HydrophobicContact CG1-CB 4.06Å; V217-P220 HydrophobicContact CG1-CG 4.24Å; R218-P220 VanDerWaalsContact C-CD 3.47Å; R218-P220 WeakPolarHBondContact O-CD 3.17Å; P220-C223 VanDerWaalsContact CG-SG 3.53Å; P220-K252 HydrophobicContact CG-CG 3.88Å; P220-V255 HydrophobicContact CG-CG1 4.22Å; P220-V255 WeakPolarHBondContact O-CG1 3.5Å; P220-V255 VanDerWaalsContact O-CG2 3.3Å; P220-V255 WeakPolarHBondContact O-CG2 3.45Å
221	W	97.1	Very high	95.2	Very high	51 Å²	51	27.4 Å²	27.4	19%	0.193	13%	0.128	C	C	.	.	S	Bend	trans	-76.2	-33.9	178.7	-82.5	41.6	0	0	0	111.8	N101 I102 W320 R323 R324	N101-W221 HydrophobicContact CB-CD2 4.12Å; N101-W221 HydrophobicContact CB-CG 4.38Å; N101-W221 HydrophobicContact CB-CZ2 4.18Å; N101-W221 VanDerWaalsContact OD1-CE2 3.28Å; N101-W221 WeakPolarHBondContact OD1-CZ2 3.39Å; N101-W221 PolarHBondContact OD1-NE1 3.44Å; I102-W221 PolarHBondContact O-N 3.46Å; W221-W320 AromaticContact CD2-NE1 3.95Å; W221-W320 AromaticContact CE3-CD1 3.73Å; W221-W320 HydrophobicContact CE3-CD2 4.41Å; W221-W320 HydrophobicContact CE3-CG 4.19Å; W221-W320 AromaticContact CE3-NE1 3.64Å; W221-R323 HydrophobicContact CE3-CB 3.75Å; W221-R323 HydrophobicContact CZ3-CB 3.72Å; W221-R323 PolarHBondContact O-NH1 2.96Å; W221-R324 HydrophobicContact CH2-CB 4.31Å; W221-R324 HydrophobicContact CZ3-CB 3.78Å
222	V	98.3	Very high	94.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	143.9	175.5	60.3	0	0	0	0	109.8	I103 H104 P256 F258 L316 T319 W320	I103-V222 HydrophobicContact CB-CG1 4.34Å; I103-V222 HydrophobicContact CD1-CG1 4.36Å; I103-V222 HydrophobicContact CG1-CG1 3.84Å; I103-V222 HydrophobicContact CG2-CG1 4.03Å; H104-V222 PolarHBondContact N-O 3.31Å; H104-V222 VanDerWaalsContact N-O 3.1Å; V222-P256 WeakPolarHBondContact CA-O 3.38Å; V222-P256 HydrophobicContact CB-CG 4.35Å; V222-P256 HydrophobicContact CG2-CG 4.26Å; V222-P256 WeakPolarHBondContact CG2-O 3.26Å; V222-F258 HydrophobicContact CG2-CD2 3.71Å; V222-F258 HydrophobicContact CG2-CE2 3.78Å; V222-L316 HydrophobicContact CB-CD2 4.41Å; V222-L316 HydrophobicContact CG1-CB 4.42Å; V222-L316 HydrophobicContact CG1-CD2 4.06Å; V222-L316 HydrophobicContact CG2-CD2 3.56Å; V222-T319 HydrophobicContact CB-CG2 4.43Å; V222-T319 HydrophobicContact CG2-CG2 4.23Å; V222-W320 HydrophobicContact CG1-CB 4.33Å
223	C	98.8	Very high	93.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	145.9	176.9	-64.6	0	0	0	0	111.7	H104 P220 I250 P256 A257 F258 L316	H104-C223 CarbonylContact O-C 3.56Å; H104-C223 VanDerWaalsContact O-CA 3.28Å; H104-C223 WeakPolarHBondContact O-CA 3.42Å; P220-C223 VanDerWaalsContact CG-SG 3.53Å; C223-I250 HydrophobicContact CB-CD1 4.01Å; C223-I250 HydrophobicContact CB-CG1 4.32Å; C223-I250 PolarHBondContact SG-O 2.83Å; C223-I250 VanDerWaalsContact SG-O 3.33Å; C223-P256 PolarHBondContact N-O 3.08Å; C223-A257 HydrophobicContact CB-CB 4.14Å; C223-A257 CarbonylContact O-C 3.59Å; C223-A257 VanDerWaalsContact O-CA 3.26Å; C223-A257 WeakPolarHBondContact O-CA 3.12Å; C223-F258 PolarHBondContact O-N 3.24Å; C223-L316 WeakPolarHBondContact O-CD2 3.26Å
224	G	98.7	Very high	92.9	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	134.6	177.9	0	0	0	0	0	112.8	H104 V105 T106 F258	H104-G224 PolarHBondContact O-N 3.21Å; V105-G224 CarbonylContact C-O 3.54Å; V105-G224 WeakPolarHBondContact CA-O 3.49Å; T106-G224 PolarHBondContact N-O 3.27Å; G224-F258 CarbonylContact C-O 3.54Å; G224-F258 WeakPolarHBondContact CA-O 3.44Å
225	I	98.8	Very high	92	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	103.1	170.1	-57.2	-169.1	0	0	0	109.1	T106 L228 F251 F258 T259 V260 L270	T106-I225 HydrophobicContact CG2-CD1 4.37Å; T106-I225 HydrophobicContact CG2-CG1 3.86Å; T106-I225 CarbonylContact O-C 3.46Å; T106-I225 WeakPolarHBondContact O-CA 3.42Å; I225-L228 HydrophobicContact CG2-CD1 4.31Å; I225-L228 HydrophobicContact CG2-CD2 3.7Å; I225-L228 HydrophobicContact CG2-CG 4.09Å; I225-F251 HydrophobicContact CD1-CD1 4.47Å; I225-F251 HydrophobicContact CD1-CE1 3.44Å; I225-F251 VanDerWaalsContact CD1-CE1 3.44Å; I225-F251 HydrophobicContact CD1-CE2 4.37Å; I225-F251 HydrophobicContact CD1-CZ 3.38Å; I225-F251 HydrophobicContact CG1-CE1 3.97Å; I225-F251 HydrophobicContact CG1-CZ 4.3Å; I225-F258 PolarHBondContact N-O 2.97Å; I225-T259 WeakPolarHBondContact O-CA 3.49Å; I225-T259 PolarHBondContact O-OG1 3.24Å; I225-V260 PolarHBondContact O-N 3.1Å; I225-L270 HydrophobicContact CD1-CD1 4.35Å; I225-L270 HydrophobicContact CD1-CD2 3.62Å; I225-L270 HydrophobicContact CG2-CD1 4.34Å
226	A	98.3	Very high	91.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.205	C	C	.	.			trans	-69.5	-177.9	171	0	0	0	0	0	111.1	T106 K109 L228 Q262 L312	T106-A226 PolarHBondContact O-N 2.92Å; K109-A226 WeakPolarHBondContact O-CB 3.43Å; A226-L228 PolarHBondContact O-N 3.42Å; A226-Q262 PolarHBondContact O-NE2 2.9Å; A226-L312 HydrophobicContact CB-CD2 4.05Å
227	S	97.1	Very high	90.6	Very high	12 Å²	12	42.5 Å²	42.5	8%	0.084	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-54.9	131.7	-173.2	-177.2	0	0	0	0	112.6	T108 K109 R385	T108-S227 WeakPolarHBondContact CA-O 3.42Å; T108-S227 WeakPolarHBondContact CB-O 3.4Å; T108-S227 PolarHBondContact N-O 3.2Å; K109-S227 PolarHBondContact N-O 3.31Å; K109-S227 PolarHBondContact O-N 3.47Å; S227-R385 PolarHBondContact OG-NH1 2.92Å
228	L	95.9	Very high	90.2	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.01	24%	0.237	C	C	.	.			trans	-90.4	155	173.3	-57.2	-169.9	0	0	0	111	I225 A226 I240 A244 K247 Q262 A266 L270 R385	I225-L228 HydrophobicContact CG2-CD1 4.31Å; I225-L228 HydrophobicContact CG2-CD2 3.7Å; I225-L228 HydrophobicContact CG2-CG 4.09Å; A226-L228 PolarHBondContact O-N 3.42Å; L228-I240 HydrophobicContact CB-CD1 4.03Å; L228-A244 HydrophobicContact CD1-CB 3.83Å; L228-K247 HydrophobicContact CD2-CB 4.37Å; L228-K247 HydrophobicContact CD2-CD 3.16Å; L228-K247 HydrophobicContact CD2-CG 4.35Å; L228-K247 HydrophobicContact CG-CD 4.49Å; L228-Q262 HydrophobicContact CD1-CG 4.43Å; L228-Q262 HydrophobicContact CG-CG 4.36Å; L228-A266 HydrophobicContact CD1-CB 4.04Å; L228-L270 HydrophobicContact CD1-CD1 4.17Å; L228-L270 HydrophobicContact CD1-CD2 4.32Å; L228-L270 HydrophobicContact CD1-CG 4.41Å; L228-R385 PolarHBondContact O-NH1 2.67Å
229	G	90.6	Very high	90.2	Very high	18 Å²	18	44.3 Å²	44.3	19%	0.186	23%	0.23	C	C	.	.			trans	179.2	163.1	-179.1	0	0	0	0	0	110.4	T108 D231	T108-G229 WeakPolarHBondContact CG2-O 3.46Å; T108-G229 PolarHBondContact OG1-N 3.41Å; T108-G229 PolarHBondContact OG1-O 3.23Å; G229-D231 PolarHBondContact O-N 3.36Å
230	I	87.2	Confident	90.2	Very high	95 Å²	95	38.7 Å²	38.7	49%	0.487	21%	0.206	S	C	.	.	S	Bend	trans	-67.4	116.1	178.3	-54.7	-55.6	0	0	0	109.6	T233 I240 I243	I230-T233 HydrophobicContact CG2-CG2 3.51Å; I230-I240 HydrophobicContact CD1-CB 4.05Å; I230-I240 HydrophobicContact CD1-CD1 4.43Å; I230-I243 HydrophobicContact CD1-CD1 3.92Å
231	D	81.1	Confident	90.2	Very high	20 Å²	20	42.1 Å²	42.1	11%	0.107	22%	0.223	C	C	.	.			trans	-161.5	155.2	175.3	-156.1	-11.2	0	0	0	108.7	T108 K109 G229 T233	T108-D231 HydrophobicContact CG2-CB 3.49Å; T108-D231 VanDerWaalsContact CG2-CB 3.49Å; K109-D231 IonicContact NZ-OD2 2.8Å; K109-D231 PolarHBondContact NZ-OD2 3.43Å; G229-D231 PolarHBondContact O-N 3.36Å; D231-T233 VanDerWaalsContact C-N 3.29Å; D231-T233 PolarHBondContact O-N 2.98Å
232	H	78.6	Confident	90.1	Very high	76 Å²	76	44.6 Å²	44.6	35%	0.352	24%	0.235	S	C	.	.			trans	51.8	41.6	-179.8	-56.1	-77	0	0	0	114.6	I207 Q234 I235 L236	I207-H232 HydrophobicContact CG2-CB 4.47Å; H232-Q234 PolarHBondContact O-N 2.66Å; H232-Q234 VanDerWaalsContact O-N 3.11Å; H232-I235 PolarHBondContact O-N 3.23Å; H232-L236 HydrophobicContact CB-CD1 4.09Å; H232-L236 HydrophobicContact CB-CG 4.17Å; H232-L236 PolarHBondContact O-N 2.8Å
233	T	79.9	Confident	90	Very high	68 Å²	68	44.6 Å²	44.6	42%	0.417	24%	0.235	S	C	.	.	H	α-helix	trans	-59.9	-27.4	-172.1	53.9	0	0	0	0	114.6	I230 D231 I235 G237	I230-T233 HydrophobicContact CG2-CG2 3.51Å; D231-T233 VanDerWaalsContact C-N 3.29Å; D231-T233 PolarHBondContact O-N 2.98Å; T233-I235 PolarHBondContact O-N 2.91Å; T233-G237 VanDerWaalsContact CA-O 3.25Å; T233-G237 WeakPolarHBondContact CA-O 3.26Å; T233-G237 CarbonylContact O-C 3.56Å; T233-G237 WeakPolarHBondContact O-CA 3.5Å; T233-G237 PolarHBondContact O-N 2.93Å; T233-G237 VanDerWaalsContact O-N 3.16Å
234	Q	76.4	Confident	89.9	Confident	159 Å²	159	44.6 Å²	44.6	74%	0.743	24%	0.235	S	C	*	.	H	α-helix	trans	-65.2	-23	175	-65.5	178.2	1.3	0	0	113.6	H232	H232-Q234 PolarHBondContact O-N 2.66Å; H232-Q234 VanDerWaalsContact O-N 3.11Å
235	I	76.2	Confident	89.8	Confident	108 Å²	108	49.1 Å²	49.1	55%	0.554	25%	0.252	S	S	*	.	H	α-helix	trans	-111.1	-43.4	-175.9	-56.7	174.7	0	0	0	110.7	I207 H232 T233	I207-I235 HydrophobicContact CD1-CD1 4.45Å; I207-I235 HydrophobicContact CG2-CG2 4.37Å; H232-I235 PolarHBondContact O-N 3.23Å; T233-I235 PolarHBondContact O-N 2.91Å
236	L	81.6	Confident	89.7	Confident	10 Å²	10	50.5 Å²	50.5	5%	0.052	26%	0.258	C	S	.	.	H	α-helix	trans	-96.8	-7.2	-170.9	-58.1	-176.2	0	0	0	113.9	I207 G208 H232 K242 I243 Q246	I207-L236 HydrophobicContact CG2-CD1 4.2Å; I207-L236 HydrophobicContact CG2-CD2 4.04Å; I207-L236 HydrophobicContact CG2-CG 4.2Å; G208-L236 VanDerWaalsContact CA-CD2 3.45Å; H232-L236 HydrophobicContact CB-CD1 4.09Å; H232-L236 HydrophobicContact CB-CG 4.17Å; H232-L236 PolarHBondContact O-N 2.8Å; L236-K242 CarbonylContact O-C 3.46Å; L236-K242 WeakPolarHBondContact O-CB 3.37Å; L236-I243 HydrophobicContact CB-CG1 3.92Å; L236-Q246 HydrophobicContact CD2-CB 4.12Å; L236-Q246 HydrophobicContact CD2-CG 4.04Å
237	G	84.6	Confident	89.7	Confident	17 Å²	17	50.8 Å²	50.8	18%	0.175	26%	0.259	C	S	.	.			trans	95.9	163.6	-171.2	0	0	0	0	0	112.9	T233	T233-G237 VanDerWaalsContact CA-O 3.25Å; T233-G237 WeakPolarHBondContact CA-O 3.26Å; T233-G237 CarbonylContact O-C 3.56Å; T233-G237 WeakPolarHBondContact O-CA 3.5Å; T233-G237 PolarHBondContact O-N 2.93Å; T233-G237 VanDerWaalsContact O-N 3.16Å
238	D	89.1	Confident	89.7	Confident	105 Å²	105	50.2 Å²	50.2	56%	0.561	26%	0.255	S	S	*	.	S	Bend	trans	-89	-3	-173	54.9	-15.2	0	0	0	114.6	K242	D238-K242 IonicContact OD1-NZ 3.23Å; D238-K242 PolarHBondContact OD1-NZ 3.43Å
239	T	94	Very high	89.8	Confident	46 Å²	46	50.6 Å²	50.6	28%	0.282	26%	0.26	S	S	.	.	S	Bend	trans	-121.8	156.8	-178.9	86.6	0	0	0	0	112.4	E241 K242 I243	T239-E241 VanDerWaalsContact C-N 3.25Å; T239-E241 WeakPolarHBondContact CB-OE2 3.44Å; T239-E241 PolarHBondContact O-N 2.91Å; T239-E241 PolarHBondContact OG1-OE2 3.33Å; T239-K242 PolarHBondContact O-N 2.91Å; T239-K242 PolarHBondContact OG1-N 3.49Å; T239-I243 WeakPolarHBondContact O-CG1 3.22Å; T239-I243 PolarHBondContact O-N 3.28Å
240	I	94.9	Very high	90.1	Very high	24 Å²	24	49.7 Å²	49.7	12%	0.123	25%	0.251	C	S	.	.	H	α-helix	trans	-66.4	-30.3	-179.1	-168.8	64.4	0	0	0	111.9	L228 I230 I243 A244 E265 A266	L228-I240 HydrophobicContact CB-CD1 4.03Å; I230-I240 HydrophobicContact CD1-CB 4.05Å; I230-I240 HydrophobicContact CD1-CD1 4.43Å; I240-I243 PolarHBondContact O-N 2.78Å; I240-A244 VanDerWaalsContact O-CB 3.26Å; I240-A244 WeakPolarHBondContact O-CB 3.19Å; I240-A244 PolarHBondContact O-N 3.48Å; I240-E265 HydrophobicContact CG2-CB 3.76Å; I240-A266 HydrophobicContact CG1-CB 3.76Å
241	E	97.1	Very high	90.7	Very high	74 Å²	74	45.4 Å²	45.4	35%	0.346	23%	0.229	S	C	.	.	H	α-helix	trans	-65.5	-47	177	-58.5	86.2	167.7	0	0	111	T239 I243 A244 W245 E265 V269	T239-E241 VanDerWaalsContact C-N 3.25Å; T239-E241 WeakPolarHBondContact CB-OE2 3.44Å; T239-E241 PolarHBondContact O-N 2.91Å; T239-E241 PolarHBondContact OG1-OE2 3.33Å; E241-I243 VanDerWaalsContact C-N 3.3Å; E241-I243 PolarHBondContact O-N 3.39Å; E241-A244 PolarHBondContact O-N 3.19Å; E241-W245 WeakPolarHBondContact O-CB 3.28Å; E241-W245 PolarHBondContact O-N 3.48Å; E241-E265 HydrophobicContact CG-CB 4.12Å; E241-E265 WeakPolarHBondContact OE1-CB 3.37Å; E241-V269 HydrophobicContact CB-CG2 3.82Å; E241-V269 HydrophobicContact CG-CG2 4.12Å
242	K	95.3	Very high	91.4	Very high	103 Å²	103	46 Å²	46	45%	0.448	23%	0.23	S	C	.	.	H	α-helix	trans	-61.3	-42	176	-66.9	176.3	-175.2	171.3	0	110.9	L236 D238 T239 W245 Q246	L236-K242 CarbonylContact O-C 3.46Å; L236-K242 WeakPolarHBondContact O-CB 3.37Å; D238-K242 IonicContact OD1-NZ 3.23Å; D238-K242 PolarHBondContact OD1-NZ 3.43Å; T239-K242 PolarHBondContact O-N 2.91Å; T239-K242 PolarHBondContact OG1-N 3.49Å; K242-W245 PolarHBondContact O-N 3.28Å; K242-Q246 WeakPolarHBondContact O-CG 3.43Å; K242-Q246 PolarHBondContact O-N 3.39Å
243	I	94.9	Very high	92.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.9	-44.2	176.5	-66.6	170.4	0	0	0	111.2	I230 L236 T239 I240 E241 Q246 K247	I230-I243 HydrophobicContact CD1-CD1 3.92Å; L236-I243 HydrophobicContact CB-CG1 3.92Å; T239-I243 WeakPolarHBondContact O-CG1 3.22Å; T239-I243 PolarHBondContact O-N 3.28Å; I240-I243 PolarHBondContact O-N 2.78Å; E241-I243 VanDerWaalsContact C-N 3.3Å; E241-I243 PolarHBondContact O-N 3.39Å; I243-Q246 PolarHBondContact O-N 3.39Å; I243-K247 HydrophobicContact CG2-CD 3.91Å; I243-K247 VanDerWaalsContact CG2-CE 3.45Å; I243-K247 WeakPolarHBondContact O-CB 3.45Å; I243-K247 WeakPolarHBondContact O-CG 3.44Å; I243-K247 PolarHBondContact O-N 2.7Å
244	A	97.6	Very high	92.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.2	-41.9	176.7	0	0	0	0	0	111.2	L228 I240 E241 Q246 K247 A248 A266 V269 L270	L228-A244 HydrophobicContact CD1-CB 3.83Å; I240-A244 VanDerWaalsContact O-CB 3.26Å; I240-A244 WeakPolarHBondContact O-CB 3.19Å; I240-A244 PolarHBondContact O-N 3.48Å; E241-A244 PolarHBondContact O-N 3.19Å; A244-Q246 PolarHBondContact O-N 2.95Å; A244-K247 PolarHBondContact O-N 3.07Å; A244-A248 WeakPolarHBondContact O-CB 3.14Å; A244-A248 PolarHBondContact O-N 3.41Å; A244-A266 HydrophobicContact CB-CB 4.11Å; A244-V269 HydrophobicContact CB-CB 3.92Å; A244-V269 HydrophobicContact CB-CG1 3.93Å; A244-L270 HydrophobicContact CB-CD2 4.29Å
245	W	97.5	Very high	93.9	Very high	95 Å²	95	38.1 Å²	38.1	36%	0.36	21%	0.206	S	C	.	.	H	α-helix	trans	-60.7	-46.2	176.7	-174.9	95.4	0	0	0	111.2	A210 Y211 E241 K242 K247 G249 V269 R273	A210-W245 HydrophobicContact CB-CZ3 4.08Å; Y211-W245 HydrophobicContact CE2-CZ3 4.11Å; Y211-W245 WeakPolarHBondContact OH-CH2 3.5Å; E241-W245 WeakPolarHBondContact O-CB 3.28Å; E241-W245 PolarHBondContact O-N 3.48Å; K242-W245 PolarHBondContact O-N 3.28Å; W245-K247 VanDerWaalsContact C-N 3.33Å; W245-K247 PolarHBondContact O-N 2.86Å; W245-G249 PolarHBondContact O-N 2.79Å; W245-V269 HydrophobicContact CB-CG1 3.87Å; W245-R273 VanDerWaalsContact CH2-NH2 3.27Å; W245-R273 VanDerWaalsContact CZ2-CZ 3.49Å; W245-R273 VanDerWaalsContact CZ3-NH2 3.29Å; W245-R273 PolarHBondContact O-NE 3.2Å; W245-R273 PolarHBondContact O-NH2 3.44Å
246	Q	95.9	Very high	94.8	Very high	28 Å²	28	33.1 Å²	33.1	13%	0.131	18%	0.181	C	C	.	.	H	α-helix	trans	-60	-44.1	175.9	-78.3	-68.6	-25.8	0	0	111.2	G209 A210 Y211 L236 K242 I243 A244 G249	G209-Q246 CarbonylContact C-O 3.05Å; G209-Q246 WeakPolarHBondContact CA-O 3.3Å; G209-Q246 PolarHBondContact N-O 3.07Å; A210-Q246 PolarHBondContact N-O 3.49Å; Y211-Q246 VanDerWaalsContact CE2-NE2 3.3Å; L236-Q246 HydrophobicContact CD2-CB 4.12Å; L236-Q246 HydrophobicContact CD2-CG 4.04Å; K242-Q246 WeakPolarHBondContact O-CG 3.43Å; K242-Q246 PolarHBondContact O-N 3.39Å; I243-Q246 PolarHBondContact O-N 3.39Å; A244-Q246 PolarHBondContact O-N 2.95Å; Q246-G249 PolarHBondContact O-N 3.06Å
247	K	97.3	Very high	95.6	Very high	6 Å²	6	32.7 Å²	32.7	3%	0.026	18%	0.179	C	C	.	.	H	α-helix	trans	-73.6	-37	-176.8	-73.1	173.1	-171.9	-55.2	0	113.2	T106 G107 T108 G208 L228 I243 A244 W245 G249 I250	T106-K247 HydrophobicContact CG2-CB 3.81Å; T106-K247 HydrophobicContact CG2-CG 4.2Å; T106-K247 WeakPolarHBondContact CG2-O 3.19Å; G107-K247 VanDerWaalsContact C-NZ 3.34Å; G107-K247 PolarHBondContact O-NZ 3.16Å; T108-K247 WeakPolarHBondContact OG1-CE 3.45Å; G208-K247 VanDerWaalsContact O-CG 3.3Å; G208-K247 WeakPolarHBondContact O-CG 3.48Å; L228-K247 HydrophobicContact CD2-CB 4.37Å; L228-K247 HydrophobicContact CD2-CD 3.16Å; L228-K247 HydrophobicContact CD2-CG 4.35Å; L228-K247 HydrophobicContact CG-CD 4.49Å; I243-K247 HydrophobicContact CG2-CD 3.91Å; I243-K247 VanDerWaalsContact CG2-CE 3.45Å; I243-K247 WeakPolarHBondContact O-CB 3.45Å; I243-K247 WeakPolarHBondContact O-CG 3.44Å; I243-K247 PolarHBondContact O-N 2.7Å; A244-K247 PolarHBondContact O-N 3.07Å; W245-K247 VanDerWaalsContact C-N 3.33Å; W245-K247 PolarHBondContact O-N 2.86Å; K247-G249 PolarHBondContact O-N 2.66Å; K247-G249 VanDerWaalsContact O-N 3.1Å; K247-I250 PolarHBondContact O-N 3.33Å
248	A	98	Very high	96.3	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.7	-14.8	172.1	0	0	0	0	0	113.4	A244 I250 F251 L270 R273	A244-A248 WeakPolarHBondContact O-CB 3.14Å; A244-A248 PolarHBondContact O-N 3.41Å; A248-I250 PolarHBondContact O-N 2.81Å; A248-I250 VanDerWaalsContact O-N 3.08Å; A248-F251 HydrophobicContact CB-CD2 3.89Å; A248-F251 HydrophobicContact CB-CE2 3.7Å; A248-F251 HydrophobicContact CB-CZ 4.35Å; A248-F251 VanDerWaalsContact O-CB 3.26Å; A248-F251 WeakPolarHBondContact O-CB 3.46Å; A248-F251 WeakPolarHBondContact O-CD2 3.32Å; A248-F251 WeakPolarHBondContact O-CG 3.19Å; A248-F251 PolarHBondContact O-N 3.32Å; A248-L270 HydrophobicContact CB-CD2 3.8Å; A248-R273 HydrophobicContact CB-CB 3.7Å; A248-R273 HydrophobicContact CB-CG 3.81Å
249	G	97.2	Very high	96.8	Very high	10 Å²	10	27.1 Å²	27.1	10%	0.103	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-8.2	177.8	0	0	0	0	0	115.5	N215 W245 Q246 K247 F251	N215-G249 PolarHBondContact ND2-O 2.97Å; W245-G249 PolarHBondContact O-N 2.79Å; Q246-G249 PolarHBondContact O-N 3.06Å; K247-G249 PolarHBondContact O-N 2.66Å; K247-G249 VanDerWaalsContact O-N 3.1Å; G249-F251 VanDerWaalsContact C-N 3.33Å
250	I	98.1	Very high	97	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-9.7	169.6	72.3	165	0	0	0	113.3	T106 V205 C223 K247 A248	T106-I250 HydrophobicContact CG2-CD1 3.61Å; T106-I250 HydrophobicContact CG2-CG1 4.04Å; T106-I250 HydrophobicContact CG2-CG2 4.46Å; V205-I250 HydrophobicContact CG2-CG2 3.91Å; C223-I250 HydrophobicContact CB-CD1 4.01Å; C223-I250 HydrophobicContact CB-CG1 4.32Å; C223-I250 PolarHBondContact SG-O 2.83Å; C223-I250 VanDerWaalsContact SG-O 3.33Å; K247-I250 PolarHBondContact O-N 3.33Å; A248-I250 PolarHBondContact O-N 2.81Å; A248-I250 VanDerWaalsContact O-N 3.08Å
251	F	98.3	Very high	97	Very high	5 Å²	5	31 Å²	31	2%	0.022	15%	0.153	C	C	.	.			trans	-62.8	142.9	175.1	-64.8	-20.2	0	0	0	110.3	I225 A248 G249 A257 L270 R273 A274 I277 C279 L281	I225-F251 HydrophobicContact CD1-CD1 4.47Å; I225-F251 HydrophobicContact CD1-CE1 3.44Å; I225-F251 VanDerWaalsContact CD1-CE1 3.44Å; I225-F251 HydrophobicContact CD1-CE2 4.37Å; I225-F251 HydrophobicContact CD1-CZ 3.38Å; I225-F251 HydrophobicContact CG1-CE1 3.97Å; I225-F251 HydrophobicContact CG1-CZ 4.3Å; A248-F251 HydrophobicContact CB-CD2 3.89Å; A248-F251 HydrophobicContact CB-CE2 3.7Å; A248-F251 HydrophobicContact CB-CZ 4.35Å; A248-F251 VanDerWaalsContact O-CB 3.26Å; A248-F251 WeakPolarHBondContact O-CB 3.46Å; A248-F251 WeakPolarHBondContact O-CD2 3.32Å; A248-F251 WeakPolarHBondContact O-CG 3.19Å; A248-F251 PolarHBondContact O-N 3.32Å; G249-F251 VanDerWaalsContact C-N 3.33Å; F251-A257 HydrophobicContact CD1-CB 3.72Å; F251-A257 HydrophobicContact CE1-CB 3.49Å; F251-A257 VanDerWaalsContact CE1-CB 3.49Å; F251-A257 HydrophobicContact CZ-CB 4.32Å; F251-L270 HydrophobicContact CZ-CD2 4.44Å; F251-R273 HydrophobicContact CD2-CB 4.4Å; F251-A274 HydrophobicContact CD2-CB 4.13Å; F251-A274 HydrophobicContact CE2-CB 3.97Å; F251-I277 HydrophobicContact CB-CD1 3.97Å; F251-I277 HydrophobicContact CB-CG2 4.19Å; F251-C279 HydrophobicContact CB-CB 3.91Å; F251-C279 HydrophobicContact CG-CB 4.27Å; F251-L281 HydrophobicContact CE1-CD1 4.25Å; F251-L281 HydrophobicContact CE2-CD2 4.37Å; F251-L281 HydrophobicContact CZ-CD1 3.81Å; F251-L281 HydrophobicContact CZ-CD2 4.2Å
252	K	97.4	Very high	97	Very high	33 Å²	33	28.6 Å²	28.6	14%	0.143	14%	0.142	C	C	.	.			trans	-131.7	148.1	178.8	-54.2	-67.8	169.3	167.7	0	109.3	N215 V217 R218 P220 G254 V255	N215-K252 PolarHBondContact O-NZ 2.9Å; N215-K252 VanDerWaalsContact OD1-CE 3.28Å; N215-K252 WeakPolarHBondContact OD1-CE 3.48Å; N215-K252 PolarHBondContact OD1-NZ 3.21Å; V217-K252 VanDerWaalsContact O-CE 3.23Å; V217-K252 WeakPolarHBondContact O-CE 3.44Å; V217-K252 PolarHBondContact O-NZ 3.04Å; R218-K252 WeakPolarHBondContact O-CG 3.49Å; P220-K252 HydrophobicContact CG-CG 3.88Å; K252-G254 PolarHBondContact O-N 3.12Å; K252-V255 HydrophobicContact CB-CB 4.07Å; K252-V255 HydrophobicContact CB-CG2 3.75Å; K252-V255 PolarHBondContact O-N 3.4Å; K252-V255 VanDerWaalsContact O-N 3.11Å
253	P	96.3	Very high	97	Very high	94 Å²	94	26.2 Å²	26.2	61%	0.61	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	129.9	-179	-25.5	34.2	0	0	0	112.6	V255 I277	P253-V255 PolarHBondContact O-N 3.13Å; P253-I277 VanDerWaalsContact CA-O 3.23Å; P253-I277 WeakPolarHBondContact CA-O 3.3Å; P253-I277 WeakPolarHBondContact CB-O 3.35Å; P253-I277 HydrophobicContact CG-CG2 4.15Å
254	G	93.7	Very high	97	Very high	33 Å²	33	32.7 Å²	32.7	34%	0.34	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.9	-2	179.9	0	0	0	0	0	115.8	K252 Q278	K252-G254 PolarHBondContact O-N 3.12Å; G254-Q278 PolarHBondContact N-O 3.22Å
255	V	96	Very high	97	Very high	9 Å²	9	37.3 Å²	37.3	6%	0.055	19%	0.189	C	C	.	.			trans	-85.6	125.5	177.3	177.3	0	0	0	0	109.3	P220 K252 P253 C279 P280	P220-V255 HydrophobicContact CG-CG1 4.22Å; P220-V255 WeakPolarHBondContact O-CG1 3.5Å; P220-V255 VanDerWaalsContact O-CG2 3.3Å; P220-V255 WeakPolarHBondContact O-CG2 3.45Å; K252-V255 HydrophobicContact CB-CB 4.07Å; K252-V255 HydrophobicContact CB-CG2 3.75Å; K252-V255 PolarHBondContact O-N 3.4Å; K252-V255 VanDerWaalsContact O-N 3.11Å; P253-V255 PolarHBondContact O-N 3.13Å; V255-C279 PolarHBondContact O-SG 2.8Å; V255-P280 WeakPolarHBondContact O-CD 3.05Å
256	P	96.8	Very high	97	Very high	4 Å²	4	32.8 Å²	32.8	3%	0.026	17%	0.172	C	C	.	.			trans	-66.5	139.4	179.3	26.3	-34.2	0	0	0	109.6	V222 C223 F258 P280 T319 P331	V222-P256 WeakPolarHBondContact CA-O 3.38Å; V222-P256 HydrophobicContact CB-CG 4.35Å; V222-P256 HydrophobicContact CG2-CG 4.26Å; V222-P256 WeakPolarHBondContact CG2-O 3.26Å; C223-P256 PolarHBondContact N-O 3.08Å; P256-F258 HydrophobicContact CB-CE2 4.39Å; P256-P280 WeakPolarHBondContact CA-O 3.23Å; P256-T319 HydrophobicContact CB-CG2 4.14Å; P256-T319 HydrophobicContact CG-CG2 3.63Å; P256-P331 HydrophobicContact CB-CB 4.44Å; P256-P331 HydrophobicContact CB-CG 4.25Å; P256-P331 HydrophobicContact CG-CG 4.37Å
257	A	98.3	Very high	97	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	144.5	177	0	0	0	0	0	111	C223 F251 C279 P280 L281 R282	C223-A257 HydrophobicContact CB-CB 4.14Å; C223-A257 CarbonylContact O-C 3.59Å; C223-A257 VanDerWaalsContact O-CA 3.26Å; C223-A257 WeakPolarHBondContact O-CA 3.12Å; F251-A257 HydrophobicContact CD1-CB 3.72Å; F251-A257 HydrophobicContact CE1-CB 3.49Å; F251-A257 VanDerWaalsContact CE1-CB 3.49Å; F251-A257 HydrophobicContact CZ-CB 4.32Å; A257-C279 WeakPolarHBondContact CB-SG 3.49Å; A257-P280 PolarHBondContact N-O 3.43Å; A257-L281 HydrophobicContact CB-CD1 3.89Å; A257-L281 WeakPolarHBondContact O-CA 3.49Å; A257-R282 PolarHBondContact O-N 2.97Å
258	F	98.7	Very high	97	Very high	6 Å²	6	34.2 Å²	34.2	3%	0.026	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	141	176.4	-64.8	-86.7	0	0	0	110.6	V222 C223 G224 I225 P256 R282 L312 Q315 L316 T319 A344	V222-F258 HydrophobicContact CG2-CD2 3.71Å; V222-F258 HydrophobicContact CG2-CE2 3.78Å; C223-F258 PolarHBondContact O-N 3.24Å; G224-F258 CarbonylContact C-O 3.54Å; G224-F258 WeakPolarHBondContact CA-O 3.44Å; I225-F258 PolarHBondContact N-O 2.97Å; P256-F258 HydrophobicContact CB-CE2 4.39Å; F258-R282 WeakPolarHBondContact CA-O 3.48Å; F258-R282 HydrophobicContact CD1-CB 4.09Å; F258-R282 HydrophobicContact CE1-CB 4.1Å; F258-L312 HydrophobicContact CB-CD1 3.56Å; F258-Q315 HydrophobicContact CB-CB 4.44Å; F258-Q315 HydrophobicContact CD1-CB 3.68Å; F258-Q315 HydrophobicContact CD1-CG 4.11Å; F258-Q315 HydrophobicContact CD2-CB 4.24Å; F258-Q315 HydrophobicContact CE1-CB 3.9Å; F258-Q315 HydrophobicContact CE1-CG 4.28Å; F258-Q315 HydrophobicContact CE2-CB 4.44Å; F258-Q315 HydrophobicContact CG-CB 3.85Å; F258-Q315 HydrophobicContact CZ-CB 4.27Å; F258-L316 HydrophobicContact CD2-CD2 4.2Å; F258-T319 HydrophobicContact CE2-CG2 4.15Å; F258-T319 WeakPolarHBondContact CE2-OG1 3.45Å; F258-T319 WeakPolarHBondContact CZ-OG1 3.42Å; F258-A344 HydrophobicContact CD1-CB 4.05Å; F258-A344 HydrophobicContact CE1-CB 3.75Å
259	T	98.8	Very high	97	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	150.6	172	-178.4	0	0	0	0	110.5	I225 Q262 M267 L270 L281 R282 V283 C284	I225-T259 WeakPolarHBondContact O-CA 3.49Å; I225-T259 PolarHBondContact O-OG1 3.24Å; T259-Q262 PolarHBondContact OG1-NE2 2.9Å; T259-M267 HydrophobicContact CG2-CE 4.11Å; T259-M267 HydrophobicContact CG2-SD 4.17Å; T259-L270 HydrophobicContact CG2-CD1 4.27Å; T259-L281 HydrophobicContact CG2-CD1 4.03Å; T259-R282 PolarHBondContact N-O 3.02Å; T259-V283 HydrophobicContact CG2-CG2 4.08Å; T259-V283 CarbonylContact O-C 2.91Å; T259-V283 WeakPolarHBondContact O-CA 3.19Å; T259-C284 PolarHBondContact O-N 2.83Å; T259-C284 PolarHBondContact O-SG 2.84Å
260	V	98	Very high	97	Very high	7 Å²	7	35 Å²	35	4%	0.042	19%	0.185	C	C	.	.			trans	-73.2	171.3	162.8	-58.6	0	0	0	0	110	I225 Q262 S308 L312	I225-V260 PolarHBondContact O-N 3.1Å; V260-Q262 WeakPolarHBondContact O-CG 3.35Å; V260-Q262 PolarHBondContact O-N 3.36Å; V260-Q262 PolarHBondContact O-NE2 3.35Å; V260-S308 WeakPolarHBondContact CG1-O 3.5Å; V260-L312 HydrophobicContact CG1-CB 3.99Å; V260-L312 HydrophobicContact CG1-CD2 4.28Å
261	R	96.3	Very high	96.9	Very high	144 Å²	144	37.6 Å²	37.6	54%	0.543	20%	0.195	S	C	.	.			trans	-57.7	132.6	171.1	-66.6	-174.5	-175.5	163.2	10.8	110.1	V283 D286	R261-V283 HydrophobicContact CG-CG1 4.11Å; R261-D286 IonicContact CZ-OD1 2.7Å; R261-D286 VanDerWaalsContact CZ-OD1 3.29Å; R261-D286 IonicContact CZ-OD2 3.92Å; R261-D286 IonicContact NE-OD1 2.76Å; R261-D286 IonicContact NH1-OD1 3.25Å; R261-D286 IonicContact NH1-OD2 2.79Å; R261-D286 IonicContact NH2-OD1 3.95Å; R261-D286 PolarHBondContact NH2-OD1 3.25Å; R261-D286 VanDerWaalsContact NH2-OD1 3.14Å; R261-D286 IonicContact NH2-OD2 3.41Å; R261-D286 PolarHBondContact NH2-OD2 2.99Å
262	Q	96.7	Very high	96.8	Very high	23 Å²	23	40.6 Å²	40.6	11%	0.107	21%	0.211	C	C	.	.			trans	-122.7	165.7	178.8	-47.5	-67.1	-6.5	0	0	110.4	A226 L228 T259 V260 A266 M267 L270	A226-Q262 PolarHBondContact O-NE2 2.9Å; L228-Q262 HydrophobicContact CD1-CG 4.43Å; L228-Q262 HydrophobicContact CG-CG 4.36Å; T259-Q262 PolarHBondContact OG1-NE2 2.9Å; V260-Q262 WeakPolarHBondContact O-CG 3.35Å; V260-Q262 PolarHBondContact O-N 3.36Å; V260-Q262 PolarHBondContact O-NE2 3.35Å; Q262-A266 HydrophobicContact CB-CB 4Å; Q262-M267 HydrophobicContact CB-CG 3.77Å; Q262-M267 HydrophobicContact CB-SD 3.6Å; Q262-M267 HydrophobicContact CG-CG 4.42Å; Q262-M267 HydrophobicContact CG-SD 3.58Å; Q262-M267 VanDerWaalsContact CG-SD 3.58Å; Q262-L270 HydrophobicContact CG-CD1 4.05Å
263	P	95.5	Very high	96.8	Very high	54 Å²	54	40.4 Å²	40.4	35%	0.351	21%	0.209	S	C	.	.			trans	-52.1	150.4	163	-25.1	35.7	0	0	0	111.6	E265 A266 M267	P263-E265 VanDerWaalsContact C-N 3.28Å; P263-E265 WeakPolarHBondContact CB-OE2 3.37Å; P263-E265 PolarHBondContact O-N 3.29Å; P263-A266 HydrophobicContact CB-CB 4.48Å; P263-A266 WeakPolarHBondContact O-CB 3.32Å; P263-A266 PolarHBondContact O-N 3.06Å; P263-A266 VanDerWaalsContact O-N 3.12Å; P263-M267 PolarHBondContact O-N 3.34Å
264	Q	95.6	Very high	96.8	Very high	135 Å²	135	36.1 Å²	36.1	63%	0.631	18%	0.182	S	C	*	.	H	α-helix	trans	-62.5	-37.3	-170.8	-175.6	57.2	37.4	0	0	112.2	A266 M267 T268	Q264-A266 VanDerWaalsContact C-N 3.34Å; Q264-M267 PolarHBondContact O-N 3.34Å; Q264-T268 WeakPolarHBondContact O-CB 3.26Å; Q264-T268 PolarHBondContact O-N 2.95Å; Q264-T268 PolarHBondContact O-OG1 3.26Å
265	E	96.3	Very high	96.8	Very high	97 Å²	97	37.8 Å²	37.8	45%	0.453	18%	0.178	S	C	.	.	H	α-helix	trans	-62.5	-43.7	177.5	-52.4	81.2	-179.2	0	0	110.4	I240 E241 P263 V269	I240-E265 HydrophobicContact CG2-CB 3.76Å; E241-E265 HydrophobicContact CG-CB 4.12Å; E241-E265 WeakPolarHBondContact OE1-CB 3.37Å; P263-E265 VanDerWaalsContact C-N 3.28Å; P263-E265 WeakPolarHBondContact CB-OE2 3.37Å; P263-E265 PolarHBondContact O-N 3.29Å; E265-V269 PolarHBondContact O-N 2.82Å
266	A	97	Very high	96.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-67.4	-46	176.2	0	0	0	0	0	111.6	L228 I240 A244 Q262 P263 Q264 T268 V269 L270	L228-A266 HydrophobicContact CD1-CB 4.04Å; I240-A266 HydrophobicContact CG1-CB 3.76Å; A244-A266 HydrophobicContact CB-CB 4.11Å; Q262-A266 HydrophobicContact CB-CB 4Å; P263-A266 HydrophobicContact CB-CB 4.48Å; P263-A266 WeakPolarHBondContact O-CB 3.32Å; P263-A266 PolarHBondContact O-N 3.06Å; P263-A266 VanDerWaalsContact O-N 3.12Å; Q264-A266 VanDerWaalsContact C-N 3.34Å; A266-T268 VanDerWaalsContact C-N 3.26Å; A266-T268 PolarHBondContact O-N 2.89Å; A266-V269 PolarHBondContact O-N 3.41Å; A266-L270 WeakPolarHBondContact O-CG 3.43Å; A266-L270 PolarHBondContact O-N 3.26Å
267	M	97.4	Very high	96.7	Very high	21 Å²	21	45.5 Å²	45.5	10%	0.103	21%	0.214	C	C	.	.	H	α-helix	trans	-58.4	-39.4	178.1	-79	-50.3	-57.7	0	0	112.1	T259 Q262 P263 Q264 L270 R271 V283 V341	T259-M267 HydrophobicContact CG2-CE 4.11Å; T259-M267 HydrophobicContact CG2-SD 4.17Å; Q262-M267 HydrophobicContact CB-CG 3.77Å; Q262-M267 HydrophobicContact CB-SD 3.6Å; Q262-M267 HydrophobicContact CG-CG 4.42Å; Q262-M267 HydrophobicContact CG-SD 3.58Å; Q262-M267 VanDerWaalsContact CG-SD 3.58Å; P263-M267 PolarHBondContact O-N 3.34Å; Q264-M267 PolarHBondContact O-N 3.34Å; M267-L270 PolarHBondContact O-N 3.15Å; M267-L270 HydrophobicContact SD-CD1 4.44Å; M267-R271 VanDerWaalsContact O-CB 3.3Å; M267-R271 WeakPolarHBondContact O-CB 3.49Å; M267-R271 PolarHBondContact O-N 2.85Å; M267-V283 HydrophobicContact CE-CG2 3.55Å; M267-V341 HydrophobicContact CE-CB 3.95Å; M267-V341 HydrophobicContact CE-CG1 4.36Å; M267-V341 HydrophobicContact CE-CG2 3.76Å
268	T	96.8	Very high	96.6	Very high	44 Å²	44	51.4 Å²	51.4	27%	0.27	24%	0.241	S	C	.	.	H	α-helix	trans	-60.5	-49.1	177.3	-58.2	0	0	0	0	110.5	Q264 A266 L270 R271 D272	Q264-T268 WeakPolarHBondContact O-CB 3.26Å; Q264-T268 PolarHBondContact O-N 2.95Å; Q264-T268 PolarHBondContact O-OG1 3.26Å; A266-T268 VanDerWaalsContact C-N 3.26Å; A266-T268 PolarHBondContact O-N 2.89Å; T268-L270 PolarHBondContact O-N 3.05Å; T268-R271 WeakPolarHBondContact O-CB 3.41Å; T268-R271 PolarHBondContact O-N 2.85Å; T268-D272 PolarHBondContact O-N 2.92Å
269	V	97.7	Very high	96.4	Very high	26 Å²	26	51.1 Å²	51.1	16%	0.158	24%	0.24	C	C	.	.	H	α-helix	trans	-63.4	-42.9	177.2	175.5	0	0	0	0	112.4	E241 A244 W245 E265 A266 R271 D272 R273	E241-V269 HydrophobicContact CB-CG2 3.82Å; E241-V269 HydrophobicContact CG-CG2 4.12Å; A244-V269 HydrophobicContact CB-CB 3.92Å; A244-V269 HydrophobicContact CB-CG1 3.93Å; W245-V269 HydrophobicContact CB-CG1 3.87Å; E265-V269 PolarHBondContact O-N 2.82Å; A266-V269 PolarHBondContact O-N 3.41Å; V269-R271 VanDerWaalsContact C-N 3.32Å; V269-R271 PolarHBondContact O-N 3.16Å; V269-D272 PolarHBondContact O-N 3.44Å; V269-R273 HydrophobicContact CG1-CG 4.46Å; V269-R273 WeakPolarHBondContact O-CB 3.5Å; V269-R273 WeakPolarHBondContact O-CG 3.5Å; V269-R273 PolarHBondContact O-N 3.19Å
270	L	98	Very high	96.2	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.5	-43.4	177.8	-66.9	-172.5	0	0	0	111.3	I225 L228 A244 A248 F251 T259 Q262 A266 M267 T268 A274 L281	I225-L270 HydrophobicContact CD1-CD1 4.35Å; I225-L270 HydrophobicContact CD1-CD2 3.62Å; I225-L270 HydrophobicContact CG2-CD1 4.34Å; L228-L270 HydrophobicContact CD1-CD1 4.17Å; L228-L270 HydrophobicContact CD1-CD2 4.32Å; L228-L270 HydrophobicContact CD1-CG 4.41Å; A244-L270 HydrophobicContact CB-CD2 4.29Å; A248-L270 HydrophobicContact CB-CD2 3.8Å; F251-L270 HydrophobicContact CZ-CD2 4.44Å; T259-L270 HydrophobicContact CG2-CD1 4.27Å; Q262-L270 HydrophobicContact CG-CD1 4.05Å; A266-L270 WeakPolarHBondContact O-CG 3.43Å; A266-L270 PolarHBondContact O-N 3.26Å; M267-L270 PolarHBondContact O-N 3.15Å; M267-L270 HydrophobicContact SD-CD1 4.44Å; T268-L270 PolarHBondContact O-N 3.05Å; L270-A274 WeakPolarHBondContact O-CB 3.38Å; L270-A274 PolarHBondContact O-N 3.22Å; L270-L281 HydrophobicContact CB-CD2 3.86Å
271	R	96.3	Very high	96.2	Very high	54 Å²	54	51.7 Å²	51.7	20%	0.204	24%	0.243	C	C	.	.	H	α-helix	trans	-61.7	-49.2	177.2	-179.1	-164.5	71.1	170	-4.7	111.6	M267 T268 V269 A274 R275 S339 V341	M267-R271 VanDerWaalsContact O-CB 3.3Å; M267-R271 WeakPolarHBondContact O-CB 3.49Å; M267-R271 PolarHBondContact O-N 2.85Å; T268-R271 WeakPolarHBondContact O-CB 3.41Å; T268-R271 PolarHBondContact O-N 2.85Å; V269-R271 VanDerWaalsContact C-N 3.32Å; V269-R271 PolarHBondContact O-N 3.16Å; R271-A274 PolarHBondContact O-N 3.2Å; R271-R275 VanDerWaalsContact CD-NH2 3.29Å; R271-R275 WeakPolarHBondContact O-CG 3.09Å; R271-R275 PolarHBondContact O-N 3.4Å; R271-S339 PolarHBondContact NH1-O 2.94Å; R271-V341 HydrophobicContact CB-CG2 3.58Å; R271-V341 HydrophobicContact CG-CG2 3.79Å
272	D	96.1	Very high	96.2	Very high	69 Å²	69	48.1 Å²	48.1	37%	0.369	23%	0.229	S	C	.	.	H	α-helix	trans	-66.6	-43	-175.1	-62.6	-10.8	0	0	0	110.8	T268 V269 R275 E276	T268-D272 PolarHBondContact O-N 2.92Å; V269-D272 PolarHBondContact O-N 3.44Å; D272-R275 PolarHBondContact O-N 3.14Å; D272-E276 WeakPolarHBondContact O-CB 3.29Å; D272-E276 PolarHBondContact O-N 3.44Å
273	R	96.6	Very high	96.3	Very high	29 Å²	29	47.9 Å²	47.9	11%	0.109	23%	0.229	C	C	.	.	H	α-helix	trans	-60.9	-43.7	171.6	-82.8	-83.3	-127.7	176.9	1.7	112.7	W245 A248 F251 V269 R275 E276 I277	W245-R273 VanDerWaalsContact CH2-NH2 3.27Å; W245-R273 VanDerWaalsContact CZ2-CZ 3.49Å; W245-R273 VanDerWaalsContact CZ3-NH2 3.29Å; W245-R273 PolarHBondContact O-NE 3.2Å; W245-R273 PolarHBondContact O-NH2 3.44Å; A248-R273 HydrophobicContact CB-CB 3.7Å; A248-R273 HydrophobicContact CB-CG 3.81Å; F251-R273 HydrophobicContact CD2-CB 4.4Å; V269-R273 HydrophobicContact CG1-CG 4.46Å; V269-R273 WeakPolarHBondContact O-CB 3.5Å; V269-R273 WeakPolarHBondContact O-CG 3.5Å; V269-R273 PolarHBondContact O-N 3.19Å; R273-R275 VanDerWaalsContact C-N 3.28Å; R273-R275 PolarHBondContact O-N 2.75Å; R273-E276 PolarHBondContact O-N 3.32Å; R273-I277 WeakPolarHBondContact O-CB 3.49Å; R273-I277 WeakPolarHBondContact O-CG1 3.48Å; R273-I277 PolarHBondContact O-N 2.95Å
274	A	96.3	Very high	96.4	Very high	3 Å²	3	45.5 Å²	45.5	3%	0.025	21%	0.214	C	C	.	.	H	α-helix	trans	-62.5	-37.7	178.8	0	0	0	0	0	111.5	F251 L270 R271 Q278 C279 L281	F251-A274 HydrophobicContact CD2-CB 4.13Å; F251-A274 HydrophobicContact CE2-CB 3.97Å; L270-A274 WeakPolarHBondContact O-CB 3.38Å; L270-A274 PolarHBondContact O-N 3.22Å; R271-A274 PolarHBondContact O-N 3.2Å; A274-Q278 CarbonylContact O-C 3.57Å; A274-Q278 WeakPolarHBondContact O-CA 3.36Å; A274-Q278 PolarHBondContact O-N 3.17Å; A274-C279 HydrophobicContact CB-CB 4.44Å; A274-C279 PolarHBondContact O-N 3.07Å; A274-L281 HydrophobicContact CB-CB 3.63Å; A274-L281 HydrophobicContact CB-CD2 3.96Å; A274-L281 HydrophobicContact CB-CG 4.43Å
275	R	94.4	Very high	96.4	Very high	69 Å²	69	39.2 Å²	39.2	26%	0.26	19%	0.185	S	C	.	.	H	α-helix	trans	-66	-50.6	173.3	-72.8	177.5	-174.8	159	11.6	112.5	R271 D272 R273 I277 Q278 P334 S338	R271-R275 VanDerWaalsContact CD-NH2 3.29Å; R271-R275 WeakPolarHBondContact O-CG 3.09Å; R271-R275 PolarHBondContact O-N 3.4Å; D272-R275 PolarHBondContact O-N 3.14Å; R273-R275 VanDerWaalsContact C-N 3.28Å; R273-R275 PolarHBondContact O-N 2.75Å; R275-I277 PolarHBondContact O-N 3.41Å; R275-Q278 PolarHBondContact O-N 3.14Å; R275-P334 HydrophobicContact CG-CB 4.28Å; R275-S338 PolarHBondContact NH1-O 2.86Å; R275-S338 PolarHBondContact NH2-O 2.94Å
276	E	95.3	Very high	96.4	Very high	143 Å²	143	37.7 Å²	37.7	67%	0.668	18%	0.18	S	C	*	.	H	α-helix	trans	-54.1	-43.3	178.7	-176	-169.6	175.9	0	0	111.5	D272 R273 Q278	D272-E276 WeakPolarHBondContact O-CB 3.29Å; D272-E276 PolarHBondContact O-N 3.44Å; R273-E276 PolarHBondContact O-N 3.32Å; E276-Q278 VanDerWaalsContact C-N 3.34Å
277	I	95.6	Very high	96.3	Very high	32 Å²	32	38 Å²	38	16%	0.164	18%	0.182	C	C	.	.	H	α-helix	trans	-85.2	-8.8	-177.6	-63.9	167.8	0	0	0	112.1	F251 P253 R273 R275 C279	F251-I277 HydrophobicContact CB-CD1 3.97Å; F251-I277 HydrophobicContact CB-CG2 4.19Å; P253-I277 VanDerWaalsContact CA-O 3.23Å; P253-I277 WeakPolarHBondContact CA-O 3.3Å; P253-I277 WeakPolarHBondContact CB-O 3.35Å; P253-I277 HydrophobicContact CG-CG2 4.15Å; R273-I277 WeakPolarHBondContact O-CB 3.49Å; R273-I277 WeakPolarHBondContact O-CG1 3.48Å; R273-I277 PolarHBondContact O-N 2.95Å; R275-I277 PolarHBondContact O-N 3.41Å; I277-C279 VanDerWaalsContact C-N 3.32Å; I277-C279 HydrophobicContact CG2-CB 4.24Å
278	Q	95.1	Very high	96.1	Very high	123 Å²	123	42.3 Å²	42.3	58%	0.575	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.8	43.2	-171.8	-49.9	-179.3	-68.6	0	0	112.7	G254 A274 R275 E276	G254-Q278 PolarHBondContact N-O 3.22Å; A274-Q278 CarbonylContact O-C 3.57Å; A274-Q278 WeakPolarHBondContact O-CA 3.36Å; A274-Q278 PolarHBondContact O-N 3.17Å; R275-Q278 PolarHBondContact O-N 3.14Å; E276-Q278 VanDerWaalsContact C-N 3.34Å
279	C	94.6	Very high	95.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.215	C	C	.	.			trans	-98.6	119.3	178.1	172.9	0	0	0	0	110.3	F251 V255 A257 A274 I277 L281 P334	F251-C279 HydrophobicContact CB-CB 3.91Å; F251-C279 HydrophobicContact CG-CB 4.27Å; V255-C279 PolarHBondContact O-SG 2.8Å; A257-C279 WeakPolarHBondContact CB-SG 3.49Å; A274-C279 HydrophobicContact CB-CB 4.44Å; A274-C279 PolarHBondContact O-N 3.07Å; I277-C279 VanDerWaalsContact C-N 3.32Å; I277-C279 HydrophobicContact CG2-CB 4.24Å; C279-L281 PolarHBondContact O-N 3.3Å; C279-P334 WeakPolarHBondContact O-CG 3.36Å
280	P	94.9	Very high	95.6	Very high	5 Å²	5	45.4 Å²	45.4	3%	0.032	21%	0.209	C	C	.	.			trans	-63.2	95.5	174	-24.9	35.6	0	0	0	112.3	V255 P256 A257 P331 A332 L333	V255-P280 WeakPolarHBondContact O-CD 3.05Å; P256-P280 WeakPolarHBondContact CA-O 3.23Å; A257-P280 PolarHBondContact N-O 3.43Å; P280-P331 HydrophobicContact CB-CB 4.19Å; P280-P331 HydrophobicContact CG-CB 4.19Å; P280-P331 HydrophobicContact CG-CG 4.09Å; P280-A332 WeakPolarHBondContact CB-O 3.48Å; P280-L333 HydrophobicContact CG-CD2 4.21Å
281	L	97.3	Very high	94.8	Very high	15 Å²	15	51.3 Å²	51.3	8%	0.079	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	131.5	178.1	-179.5	65.2	0	0	0	111.3	F251 A257 T259 L270 A274 C279 V341	F251-L281 HydrophobicContact CE1-CD1 4.25Å; F251-L281 HydrophobicContact CE2-CD2 4.37Å; F251-L281 HydrophobicContact CZ-CD1 3.81Å; F251-L281 HydrophobicContact CZ-CD2 4.2Å; A257-L281 HydrophobicContact CB-CD1 3.89Å; A257-L281 WeakPolarHBondContact O-CA 3.49Å; T259-L281 HydrophobicContact CG2-CD1 4.03Å; L270-L281 HydrophobicContact CB-CD2 3.86Å; A274-L281 HydrophobicContact CB-CB 3.63Å; A274-L281 HydrophobicContact CB-CD2 3.96Å; A274-L281 HydrophobicContact CB-CG 4.43Å; C279-L281 PolarHBondContact O-N 3.3Å; L281-V341 HydrophobicContact CB-CG1 4.41Å; L281-V341 HydrophobicContact CD2-CG1 4.14Å; L281-V341 HydrophobicContact CD2-CG2 4.21Å; L281-V341 HydrophobicContact CG-CG1 3.87Å; L281-V341 WeakPolarHBondContact O-CG1 3.28Å
282	R	97.3	Very high	94	Very high	68 Å²	68	51 Å²	51	26%	0.257	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	151.6	171.7	-62.3	-174.9	-179	151.2	-5.5	112.6	A257 F258 T259 L342 A344	A257-R282 PolarHBondContact O-N 2.97Å; F258-R282 WeakPolarHBondContact CA-O 3.48Å; F258-R282 HydrophobicContact CD1-CB 4.09Å; F258-R282 HydrophobicContact CE1-CB 4.1Å; T259-R282 PolarHBondContact N-O 3.02Å; R282-L342 CarbonylContact C-O 3.58Å; R282-L342 VanDerWaalsContact CA-O 3.27Å; R282-L342 WeakPolarHBondContact CA-O 3.25Å; R282-A344 HydrophobicContact CB-CB 3.9Å
283	V	98.2	Very high	92.9	Very high	18 Å²	18	55.1 Å²	55.1	11%	0.109	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	127.3	174.1	-174.9	0	0	0	0	109.9	T259 R261 M267 V341 L342 Q343 A344	T259-V283 HydrophobicContact CG2-CG2 4.08Å; T259-V283 CarbonylContact O-C 2.91Å; T259-V283 WeakPolarHBondContact O-CA 3.19Å; R261-V283 HydrophobicContact CG-CG1 4.11Å; M267-V283 HydrophobicContact CE-CG2 3.55Å; V283-V341 HydrophobicContact CG2-CB 4.01Å; V283-V341 HydrophobicContact CG2-CG1 3.72Å; V283-L342 PolarHBondContact N-O 2.81Å; V283-Q343 CarbonylContact O-C 3.59Å; V283-Q343 WeakPolarHBondContact O-CA 3.4Å; V283-Q343 WeakPolarHBondContact O-CG 3.13Å; V283-A344 PolarHBondContact O-N 3.48Å
284	C	98.1	Very high	91.4	Very high	4 Å²	4	58.6 Å²	58.6	3%	0.027	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-61.4	140.9	177.3	-59.4	0	0	0	0	111.3	T259 Q315	T259-C284 PolarHBondContact O-N 2.83Å; T259-C284 PolarHBondContact O-SG 2.84Å; C284-Q315 HydrophobicContact CB-CG 4.45Å
285	P	96.1	Very high	90.4	Very high	4 Å²	4	60.5 Å²	60.5	3%	0.026	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-69.2	164.1	170.7	30.9	-35.2	0	0	0	111.5	R289 Y290 S311	P285-R289 HydrophobicContact CB-CB 4.14Å; P285-Y290 WeakPolarHBondContact CD-OH 3.37Å; P285-Y290 HydrophobicContact CG-CE1 4.28Å; P285-Y290 HydrophobicContact CG-CE2 3.82Å; P285-Y290 WeakPolarHBondContact CG-OH 3.24Å; P285-S311 WeakPolarHBondContact O-CB 3.21Å; P285-S311 PolarHBondContact O-OG 3.37Å
286	D	95.1	Very high	89.9	Confident	65 Å²	65	60.2 Å²	60.2	35%	0.348	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-63.3	148.5	170.4	-61.1	-32.5	0	0	0	109.6	R261 D288 R289	R261-D286 IonicContact CZ-OD1 2.7Å; R261-D286 VanDerWaalsContact CZ-OD1 3.29Å; R261-D286 IonicContact CZ-OD2 3.92Å; R261-D286 IonicContact NE-OD1 2.76Å; R261-D286 IonicContact NH1-OD1 3.25Å; R261-D286 IonicContact NH1-OD2 2.79Å; R261-D286 IonicContact NH2-OD1 3.95Å; R261-D286 PolarHBondContact NH2-OD1 3.25Å; R261-D286 VanDerWaalsContact NH2-OD1 3.14Å; R261-D286 IonicContact NH2-OD2 3.41Å; R261-D286 PolarHBondContact NH2-OD2 2.99Å; D286-D288 PolarHBondContact O-N 2.7Å; D286-D288 VanDerWaalsContact O-N 3.11Å; D286-R289 WeakPolarHBondContact O-CB 3.45Å; D286-R289 PolarHBondContact O-N 2.85Å
287	L	95.1	Very high	89.7	Confident	7 Å²	7	54 Å²	54	4%	0.037	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-59.4	-27.9	-174.4	-169.7	67.8	0	0	0	113	R289 Y290 L297 L299 R307 A310 L314	L287-R289 PolarHBondContact O-N 3.48Å; L287-Y290 HydrophobicContact CD1-CD2 4.18Å; L287-Y290 HydrophobicContact CD1-CE2 4.36Å; L287-Y290 WeakPolarHBondContact O-CD2 3.47Å; L287-Y290 PolarHBondContact O-N 3.19Å; L287-L297 HydrophobicContact CD1-CD1 3.64Å; L287-L297 HydrophobicContact CD2-CB 4.32Å; L287-L297 HydrophobicContact CG-CB 4.38Å; L287-L297 HydrophobicContact CG-CD1 3.99Å; L287-L299 HydrophobicContact CD2-CD1 3.96Å; L287-L299 HydrophobicContact CD2-CD2 4.02Å; L287-L299 HydrophobicContact CD2-CG 4.24Å; L287-R307 HydrophobicContact CB-CB 4.25Å; L287-R307 HydrophobicContact CD2-CB 4.04Å; L287-R307 HydrophobicContact CD2-CG 4.16Å; L287-A310 HydrophobicContact CD1-CB 4.13Å; L287-A310 HydrophobicContact CD2-CB 4.35Å; L287-L314 HydrophobicContact CD1-CD1 3.91Å
288	D	92.4	Very high	89.6	Confident	111 Å²	111	58.9 Å²	58.9	59%	0.594	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-73.7	-12.3	178.7	-58.4	-52.8	0	0	0	113.8	D286 Y290 R307	D286-D288 PolarHBondContact O-N 2.7Å; D286-D288 VanDerWaalsContact O-N 3.11Å; D288-Y290 VanDerWaalsContact C-N 3.34Å; D288-R307 IonicContact OD1-CZ 3.79Å; D288-R307 IonicContact OD1-NH2 2.61Å; D288-R307 PolarHBondContact OD1-NH2 2.9Å; D288-R307 IonicContact OD2-CZ 3.87Å; D288-R307 IonicContact OD2-NH2 2.68Å; D288-R307 PolarHBondContact OD2-NH2 3.27Å
289	R	93.1	Very high	89.7	Confident	127 Å²	127	54.8 Å²	54.8	48%	0.479	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-82.2	-13.3	177.4	-66.1	-166.5	172.3	-169.2	-3.1	113.1	P285 D286 L287 Q291 S346	P285-R289 HydrophobicContact CB-CB 4.14Å; D286-R289 WeakPolarHBondContact O-CB 3.45Å; D286-R289 PolarHBondContact O-N 2.85Å; L287-R289 PolarHBondContact O-N 3.48Å; R289-Q291 PolarHBondContact O-N 3.21Å; R289-S346 VanDerWaalsContact O-CB 3.23Å; R289-S346 WeakPolarHBondContact O-CB 3.28Å
290	Y	92.4	Very high	89.8	Confident	7 Å²	7	56.6 Å²	56.6	3%	0.027	31%	0.313	C	S	.	.	S	Bend	trans	-75	126.8	174.1	-64.1	-90.2	0	0	0	109.1	P285 L287 D288 S311 L314 Q315 F347 P349	P285-Y290 WeakPolarHBondContact CD-OH 3.37Å; P285-Y290 HydrophobicContact CG-CE1 4.28Å; P285-Y290 HydrophobicContact CG-CE2 3.82Å; P285-Y290 WeakPolarHBondContact CG-OH 3.24Å; L287-Y290 HydrophobicContact CD1-CD2 4.18Å; L287-Y290 HydrophobicContact CD1-CE2 4.36Å; L287-Y290 WeakPolarHBondContact O-CD2 3.47Å; L287-Y290 PolarHBondContact O-N 3.19Å; D288-Y290 VanDerWaalsContact C-N 3.34Å; Y290-S311 VanDerWaalsContact CE2-OG 3.27Å; Y290-S311 WeakPolarHBondContact CE2-OG 3.1Å; Y290-S311 PolarHBondContact OH-O 3.43Å; Y290-S311 PolarHBondContact OH-OG 3.41Å; Y290-L314 HydrophobicContact CD1-CD1 3.95Å; Y290-L314 HydrophobicContact CD2-CD1 4.02Å; Y290-L314 HydrophobicContact CE1-CB 4.15Å; Y290-L314 HydrophobicContact CE1-CD1 4Å; Y290-L314 HydrophobicContact CE2-CD1 4.05Å; Y290-L314 HydrophobicContact CG-CD1 3.96Å; Y290-Q315 VanDerWaalsContact OH-CG 3.31Å; Y290-Q315 WeakPolarHBondContact OH-CG 3.27Å; Y290-Q315 PolarHBondContact OH-NE2 2.73Å; Y290-Q315 VanDerWaalsContact OH-NE2 3.1Å; Y290-F347 HydrophobicContact CD1-CD1 4.32Å; Y290-F347 HydrophobicContact CD1-CE1 4.18Å; Y290-F347 HydrophobicContact CD1-CE2 4.37Å; Y290-F347 HydrophobicContact CD1-CG 4.5Å; Y290-F347 HydrophobicContact CD1-CZ 4.19Å; Y290-F347 HydrophobicContact CE1-CD1 4.01Å; Y290-F347 AromaticContact CE1-CE1 3.62Å; Y290-F347 HydrophobicContact CE1-CE1 3.62Å; Y290-F347 AromaticContact CE1-CZ 3.88Å; Y290-F347 HydrophobicContact CE1-CZ 3.88Å; Y290-P349 HydrophobicContact CD1-CG 4.23Å; Y290-P349 HydrophobicContact CG-CG 4.35Å
291	Q	81.7	Confident	89.9	Confident	125 Å²	125	56.8 Å²	56.8	58%	0.584	31%	0.314	S	S	*	.			trans	-74.5	133.5	-176.3	-62.7	172	9.4	0	0	110.2	R289 F347 R348 P349	R289-Q291 PolarHBondContact O-N 3.21Å; Q291-F347 PolarHBondContact N-O 3.46Å; Q291-R348 HydrophobicContact CB-CB 4.2Å; Q291-R348 WeakPolarHBondContact O-CA 3.33Å; Q291-R348 WeakPolarHBondContact O-CG 3.25Å; Q291-P349 WeakPolarHBondContact O-CD 3.47Å
292	T	78.7	Confident	89.8	Confident	47 Å²	47	58 Å²	58	29%	0.288	33%	0.326	S	S	.	.			trans	-137.8	150.4	178.8	58.8	0	0	0	0	110.4	G295 L297	T292-G295 WeakPolarHBondContact CB-O 3.47Å; T292-G295 PolarHBondContact OG1-O 2.89Å; T292-L297 HydrophobicContact CG2-CD1 4.44Å; T292-L297 HydrophobicContact CG2-CD2 3.48Å; T292-L297 VanDerWaalsContact CG2-CD2 3.48Å; T292-L297 HydrophobicContact CG2-CG 3.69Å
293	E	71.8	Confident	89.7	Confident	155 Å²	155	55.6 Å²	55.6	72%	0.724	32%	0.322	S	S	*	.	S	Bend	trans	-80.8	-24.8	173.4	-71.7	179.8	160.3	0	0	112.5	R348	E293-R348 VanDerWaalsContact CD-CZ 3.43Å; E293-R348 IonicContact OE1-CZ 3.1Å; E293-R348 IonicContact OE1-NH1 2.87Å; E293-R348 PolarHBondContact OE1-NH1 2.89Å; E293-R348 IonicContact OE1-NH2 2.63Å; E293-R348 PolarHBondContact OE1-NH2 3.33Å; E293-R348 IonicContact OE2-CZ 3.96Å; E293-R348 IonicContact OE2-NH2 3.01Å; E293-R348 PolarHBondContact OE2-NH2 3.33Å
294	S	66	Low	89.5	Confident	103 Å²	103	60.5 Å²	60.5	72%	0.72	34%	0.344	S	S	*	.	S	Bend	trans	-107	18.2	-166.5	35.9	0	0	0	0	114.5
295	G	74.8	Confident	89.4	Confident	43 Å²	43	63.4 Å²	63.4	44%	0.443	36%	0.357	S	S	.	.	S	Bend	trans	81.8	-155.2	-177.6	0	0	0	0	0	113.1	T292 L297	T292-G295 WeakPolarHBondContact CB-O 3.47Å; T292-G295 PolarHBondContact OG1-O 2.89Å; G295-L297 PolarHBondContact O-N 3.01Å
296	A	83.8	Confident	89.4	Confident	63 Å²	63	63.2 Å²	63.2	52%	0.521	36%	0.356	S	S	.	.	S	Bend	trans	-58.9	136	-173.5	0	0	0	0	0	112.8	Q298	A296-Q298 PolarHBondContact O-N 3.25Å; A296-Q298 VanDerWaalsContact O-N 3.16Å; A296-Q298 PolarHBondContact O-NE2 2.94Å
297	L	92	Very high	89.5	Confident	12 Å²	12	62.6 Å²	62.6	6%	0.063	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-59.1	118	176.1	-73.7	171.7	0	0	0	110.5	L287 T292 G295 L314 P349 V354 L357	L287-L297 HydrophobicContact CD1-CD1 3.64Å; L287-L297 HydrophobicContact CD2-CB 4.32Å; L287-L297 HydrophobicContact CG-CB 4.38Å; L287-L297 HydrophobicContact CG-CD1 3.99Å; T292-L297 HydrophobicContact CG2-CD1 4.44Å; T292-L297 HydrophobicContact CG2-CD2 3.48Å; T292-L297 VanDerWaalsContact CG2-CD2 3.48Å; T292-L297 HydrophobicContact CG2-CG 3.69Å; G295-L297 PolarHBondContact O-N 3.01Å; L297-L314 HydrophobicContact CD1-CD1 4.05Å; L297-P349 HydrophobicContact CD1-CG 4.39Å; L297-V354 HydrophobicContact CD2-CG1 4.31Å; L297-V354 HydrophobicContact CD2-CG2 3.86Å; L297-L357 HydrophobicContact CD1-CD1 4.22Å; L297-L357 HydrophobicContact CD2-CD1 4.48Å
298	Q	93.6	Very high	89.6	Confident	135 Å²	135	64.5 Å²	64.5	63%	0.631	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-77.8	136.5	173.7	-61.2	-58.8	-42.4	0	0	109.9	A296 A358	A296-Q298 PolarHBondContact O-N 3.25Å; A296-Q298 VanDerWaalsContact O-N 3.16Å; A296-Q298 PolarHBondContact O-NE2 2.94Å; Q298-A358 HydrophobicContact CB-CB 4.45Å; Q298-A358 PolarHBondContact O-N 2.83Å
299	L	96.9	Very high	89.9	Confident	37 Å²	37	59.4 Å²	59.4	19%	0.194	34%	0.335	C	S	.	.			trans	-115.4	137.5	179.1	-55.8	-176.7	0	0	0	109.4	F117 L287 L301 Q306 R307 A310 L357	F117-L299 HydrophobicContact CE1-CB 4.48Å; F117-L299 HydrophobicContact CE1-CD2 4.36Å; F117-L299 HydrophobicContact CZ-CB 4.3Å; F117-L299 HydrophobicContact CZ-CD1 4.48Å; F117-L299 HydrophobicContact CZ-CD2 4.4Å; L287-L299 HydrophobicContact CD2-CD1 3.96Å; L287-L299 HydrophobicContact CD2-CD2 4.02Å; L287-L299 HydrophobicContact CD2-CG 4.24Å; L299-L301 PolarHBondContact O-N 2.97Å; L299-Q306 HydrophobicContact CD1-CB 4.22Å; L299-R307 HydrophobicContact CD1-CG 4.05Å; L299-A310 HydrophobicContact CD1-CB 4.02Å; L299-A310 HydrophobicContact CD2-CB 3.59Å; L299-A310 HydrophobicContact CG-CB 4.48Å; L299-L357 HydrophobicContact CD2-CB 4.03Å; L299-L357 HydrophobicContact CD2-CD1 4.16Å; L299-L357 HydrophobicContact CD2-CD2 4.23Å; L299-L357 HydrophobicContact CD2-CG 4.38Å
300	G	96.9	Very high	90.2	Very high	38 Å²	38	53.3 Å²	53.3	39%	0.392	31%	0.312	S	S	.	.	S	Bend	trans	-73.1	-15.9	173.1	0	0	0	0	0	113.7	L357 A358 T360	G300-L357 PolarHBondContact N-O 3.1Å; G300-A358 WeakPolarHBondContact CA-O 3.44Å; G300-A358 PolarHBondContact N-O 3.45Å; G300-T360 CarbonylContact C-O 3.21Å; G300-T360 VanDerWaalsContact CA-O 3.3Å; G300-T360 WeakPolarHBondContact CA-O 3.36Å
301	L	96.9	Very high	90.5	Very high	8 Å²	8	53.1 Å²	53.1	4%	0.042	31%	0.312	C	S	.	.	S	Bend	trans	-104	126.1	174.3	-52.3	-175.9	0	0	0	110.5	F117 L299 Q306 T360 W362	F117-L301 HydrophobicContact CD2-CD1 4.35Å; F117-L301 HydrophobicContact CE1-CD1 4.34Å; F117-L301 HydrophobicContact CE1-CG 4.15Å; F117-L301 HydrophobicContact CE2-CB 4.44Å; F117-L301 HydrophobicContact CE2-CD1 3.74Å; F117-L301 HydrophobicContact CE2-CG 4.27Å; F117-L301 HydrophobicContact CZ-CB 3.82Å; F117-L301 HydrophobicContact CZ-CD1 3.73Å; F117-L301 HydrophobicContact CZ-CG 3.73Å; L299-L301 PolarHBondContact O-N 2.97Å; L301-Q306 HydrophobicContact CB-CB 4.32Å; L301-Q306 HydrophobicContact CB-CG 3.78Å; L301-T360 HydrophobicContact CD1-CG2 4.08Å; L301-T360 HydrophobicContact CD2-CG2 4.26Å; L301-T360 WeakPolarHBondContact CD2-O 3.38Å; L301-T360 HydrophobicContact CG-CG2 4.02Å; L301-W362 HydrophobicContact CD1-CB 4.07Å; L301-W362 HydrophobicContact CD2-CB 3.78Å
302	A	95.8	Very high	91.3	Very high	42 Å²	42	47.1 Å²	47.1	35%	0.347	28%	0.284	S	S	.	.			trans	-77.3	159.3	179.3	0	0	0	0	0	113	Q306 S366	A302-Q306 WeakPolarHBondContact O-CG 3.33Å; A302-S366 VanDerWaalsContact O-CB 3.3Å; A302-S366 WeakPolarHBondContact O-CB 3.31Å
303	G	94.4	Very high	92.3	Very high	17 Å²	17	44.9 Å²	44.9	18%	0.175	27%	0.27	C	S	.	.	S	Bend	trans	100.9	138.9	175.2	0	0	0	0	0	113.9	H305 Q306	G303-H305 PolarHBondContact O-N 3.47Å; G303-H305 VanDerWaalsContact O-N 3.13Å; G303-Q306 WeakPolarHBondContact O-CB 3.35Å; G303-Q306 PolarHBondContact O-N 2.97Å
304	Q	94.3	Very high	93.5	Very high	120 Å²	120	37.5 Å²	37.5	56%	0.561	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-35.4	-174.9	-173.8	63.6	6.7	0	0	113.4	Q306 R307	Q304-Q306 PolarHBondContact O-N 3.4Å; Q304-R307 WeakPolarHBondContact O-CB 3.44Å; Q304-R307 WeakPolarHBondContact O-CG 3.23Å; Q304-R307 PolarHBondContact O-N 2.8Å; Q304-R307 VanDerWaalsContact O-N 3.15Å
305	H	94.7	Very high	95.1	Very high	66 Å²	66	32.9 Å²	32.9	31%	0.306	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-18.8	179.1	66.7	-85.5	0	0	0	113.5	G303 R307 S308 N309	G303-H305 PolarHBondContact O-N 3.47Å; G303-H305 VanDerWaalsContact O-N 3.13Å; H305-R307 VanDerWaalsContact C-N 3.26Å; H305-R307 PolarHBondContact O-N 3.01Å; H305-S308 PolarHBondContact O-OG 3.19Å; H305-S308 VanDerWaalsContact O-OG 3.07Å; H305-N309 PolarHBondContact O-ND2 3.38Å
306	Q	97.4	Very high	96.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-72.5	-21.1	175.4	-57.9	-60.5	0.2	0	0	112.6	S113 F117 L299 L301 A302 G303 Q304 S308 N309 A310	S113-Q306 PolarHBondContact OG-OE1 3.48Å; F117-Q306 HydrophobicContact CE2-CB 4.32Å; F117-Q306 HydrophobicContact CZ-CB 4.45Å; L299-Q306 HydrophobicContact CD1-CB 4.22Å; L301-Q306 HydrophobicContact CB-CB 4.32Å; L301-Q306 HydrophobicContact CB-CG 3.78Å; A302-Q306 WeakPolarHBondContact O-CG 3.33Å; G303-Q306 WeakPolarHBondContact O-CB 3.35Å; G303-Q306 PolarHBondContact O-N 2.97Å; Q304-Q306 PolarHBondContact O-N 3.4Å; Q306-S308 VanDerWaalsContact C-N 3.35Å; Q306-S308 PolarHBondContact O-N 2.81Å; Q306-N309 WeakPolarHBondContact O-CB 3.42Å; Q306-N309 PolarHBondContact O-N 3.22Å; Q306-N309 VanDerWaalsContact O-N 3.1Å; Q306-N309 PolarHBondContact OE1-ND2 3.26Å; Q306-A310 WeakPolarHBondContact O-CB 3.3Å; Q306-A310 PolarHBondContact O-N 3.21Å
307	R	97.3	Very high	96.9	Very high	51 Å²	51	27.9 Å²	27.9	19%	0.192	16%	0.157	C	C	.	.	H	α-helix	trans	-63.6	-40.1	-178.8	-61.2	170.9	64.9	73.5	3.3	112.3	L287 D288 L299 Q304 H305 S311	L287-R307 HydrophobicContact CB-CB 4.25Å; L287-R307 HydrophobicContact CD2-CB 4.04Å; L287-R307 HydrophobicContact CD2-CG 4.16Å; D288-R307 IonicContact OD1-CZ 3.79Å; D288-R307 IonicContact OD1-NH2 2.61Å; D288-R307 PolarHBondContact OD1-NH2 2.9Å; D288-R307 IonicContact OD2-CZ 3.87Å; D288-R307 IonicContact OD2-NH2 2.68Å; D288-R307 PolarHBondContact OD2-NH2 3.27Å; L299-R307 HydrophobicContact CD1-CG 4.05Å; Q304-R307 WeakPolarHBondContact O-CB 3.44Å; Q304-R307 WeakPolarHBondContact O-CG 3.23Å; Q304-R307 PolarHBondContact O-N 2.8Å; Q304-R307 VanDerWaalsContact O-N 3.15Å; H305-R307 VanDerWaalsContact C-N 3.26Å; H305-R307 PolarHBondContact O-N 3.01Å; R307-S311 PolarHBondContact O-N 3.41Å
308	S	97.7	Very high	97.2	Very high	47 Å²	47	29.6 Å²	29.6	33%	0.329	16%	0.164	S	C	.	.	H	α-helix	trans	-69.2	-35.5	173.6	57.4	0	0	0	0	112.2	V260 H305 Q306 S311 L312	V260-S308 WeakPolarHBondContact CG1-O 3.5Å; H305-S308 PolarHBondContact O-OG 3.19Å; H305-S308 VanDerWaalsContact O-OG 3.07Å; Q306-S308 VanDerWaalsContact C-N 3.35Å; Q306-S308 PolarHBondContact O-N 2.81Å; S308-S311 PolarHBondContact O-N 3.38Å; S308-L312 WeakPolarHBondContact O-CB 3.27Å; S308-L312 PolarHBondContact O-N 3.21Å
309	N	98.6	Very high	97.3	Very high	4 Å²	4	23.8 Å²	23.8	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-67.4	-40.9	176.9	-59.2	-24.8	0	0	0	111.2	G110 F117 H305 Q306 L312 A313	G110-N309 WeakPolarHBondContact CA-ND2 3.35Å; G110-N309 WeakPolarHBondContact CA-OD1 3.29Å; F117-N309 HydrophobicContact CD2-CB 4.36Å; F117-N309 HydrophobicContact CE2-CB 4.34Å; H305-N309 PolarHBondContact O-ND2 3.38Å; Q306-N309 WeakPolarHBondContact O-CB 3.42Å; Q306-N309 PolarHBondContact O-N 3.22Å; Q306-N309 VanDerWaalsContact O-N 3.1Å; Q306-N309 PolarHBondContact OE1-ND2 3.26Å; N309-L312 PolarHBondContact O-N 3.28Å; N309-A313 WeakPolarHBondContact O-CB 3.32Å; N309-A313 PolarHBondContact O-N 3Å
310	A	98.5	Very high	97.3	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-64.4	-43.6	174.5	0	0	0	0	0	111.8	F117 L287 L299 Q306 L312 A313 L314 L357	F117-A310 HydrophobicContact CD2-CB 4.22Å; F117-A310 HydrophobicContact CE2-CB 4.01Å; F117-A310 HydrophobicContact CZ-CB 4.22Å; L287-A310 HydrophobicContact CD1-CB 4.13Å; L287-A310 HydrophobicContact CD2-CB 4.35Å; L299-A310 HydrophobicContact CD1-CB 4.02Å; L299-A310 HydrophobicContact CD2-CB 3.59Å; L299-A310 HydrophobicContact CG-CB 4.48Å; Q306-A310 WeakPolarHBondContact O-CB 3.3Å; Q306-A310 PolarHBondContact O-N 3.21Å; A310-L312 VanDerWaalsContact C-N 3.35Å; A310-L312 PolarHBondContact O-N 2.97Å; A310-A313 PolarHBondContact O-N 3.37Å; A310-L314 WeakPolarHBondContact O-CG 3.34Å; A310-L314 PolarHBondContact O-N 3.43Å; A310-L357 HydrophobicContact CB-CD2 3.79Å
311	S	98.5	Very high	97.2	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.014	12%	0.116	C	C	.	.	H	α-helix	trans	-61.9	-42	175.2	179.9	0	0	0	0	112.1	P285 Y290 R307 S308 L314 Q315	P285-S311 WeakPolarHBondContact O-CB 3.21Å; P285-S311 PolarHBondContact O-OG 3.37Å; Y290-S311 VanDerWaalsContact CE2-OG 3.27Å; Y290-S311 WeakPolarHBondContact CE2-OG 3.1Å; Y290-S311 PolarHBondContact OH-O 3.43Å; Y290-S311 PolarHBondContact OH-OG 3.41Å; R307-S311 PolarHBondContact O-N 3.41Å; S308-S311 PolarHBondContact O-N 3.38Å; S311-L314 PolarHBondContact O-N 3.43Å; S311-Q315 PolarHBondContact O-N 3.26Å
312	L	98.9	Very high	97	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.1	-48.2	173.8	-179.3	58	0	0	0	111	T114 A226 F258 V260 S308 N309 A310 L314 Q315 L316	T114-L312 HydrophobicContact CG2-CB 4.05Å; T114-L312 HydrophobicContact CG2-CD2 3.7Å; T114-L312 HydrophobicContact CG2-CG 3.68Å; A226-L312 HydrophobicContact CB-CD2 4.05Å; F258-L312 HydrophobicContact CB-CD1 3.56Å; V260-L312 HydrophobicContact CG1-CB 3.99Å; V260-L312 HydrophobicContact CG1-CD2 4.28Å; S308-L312 WeakPolarHBondContact O-CB 3.27Å; S308-L312 PolarHBondContact O-N 3.21Å; N309-L312 PolarHBondContact O-N 3.28Å; A310-L312 VanDerWaalsContact C-N 3.35Å; A310-L312 PolarHBondContact O-N 2.97Å; L312-L314 VanDerWaalsContact C-N 3.33Å; L312-L314 PolarHBondContact O-N 2.93Å; L312-Q315 PolarHBondContact O-N 3.05Å; L312-L316 HydrophobicContact CD1-CD1 4.44Å; L312-L316 HydrophobicContact CD1-CG 4.28Å; L312-L316 HydrophobicContact CG-CD1 4.16Å; L312-L316 HydrophobicContact CG-CG 4.44Å; L312-L316 VanDerWaalsContact O-CG 3.28Å; L312-L316 WeakPolarHBondContact O-CG 3.47Å; L312-L316 PolarHBondContact O-N 3.16Å
313	A	98.8	Very high	96.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58	-42.1	177.1	0	0	0	0	0	112.8	T114 F117 T118 I121 N309 A310 Q315 L316 C317	T114-A313 HydrophobicContact CG2-CB 4.32Å; F117-A313 HydrophobicContact CB-CB 3.43Å; F117-A313 VanDerWaalsContact CB-CB 3.43Å; F117-A313 HydrophobicContact CG-CB 4.45Å; T118-A313 WeakPolarHBondContact OG1-CB 3.48Å; I121-A313 HydrophobicContact CD1-CB 4.49Å; N309-A313 WeakPolarHBondContact O-CB 3.32Å; N309-A313 PolarHBondContact O-N 3Å; A310-A313 PolarHBondContact O-N 3.37Å; A313-Q315 PolarHBondContact O-N 3.5Å; A313-L316 PolarHBondContact O-N 2.98Å; A313-C317 WeakPolarHBondContact O-CB 3.23Å; A313-C317 PolarHBondContact O-N 2.97Å; A313-C317 PolarHBondContact O-SG 2.82Å
314	L	98.6	Very high	96.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-57.2	-47.1	175.8	-78.9	176.3	0	0	0	112.1	I121 L287 Y290 L297 A310 S311 L312 C317 H318 F347 P349 M353 L357	I121-L314 HydrophobicContact CD1-CD2 4.28Å; L287-L314 HydrophobicContact CD1-CD1 3.91Å; Y290-L314 HydrophobicContact CD1-CD1 3.95Å; Y290-L314 HydrophobicContact CD2-CD1 4.02Å; Y290-L314 HydrophobicContact CE1-CB 4.15Å; Y290-L314 HydrophobicContact CE1-CD1 4Å; Y290-L314 HydrophobicContact CE2-CD1 4.05Å; Y290-L314 HydrophobicContact CG-CD1 3.96Å; L297-L314 HydrophobicContact CD1-CD1 4.05Å; A310-L314 WeakPolarHBondContact O-CG 3.34Å; A310-L314 PolarHBondContact O-N 3.43Å; S311-L314 PolarHBondContact O-N 3.43Å; L312-L314 VanDerWaalsContact C-N 3.33Å; L312-L314 PolarHBondContact O-N 2.93Å; L314-C317 PolarHBondContact O-N 3.11Å; L314-H318 WeakPolarHBondContact O-CB 3.21Å; L314-H318 PolarHBondContact O-N 3.09Å; L314-F347 HydrophobicContact CB-CZ 4Å; L314-P349 HydrophobicContact CD1-CG 4.32Å; L314-P349 HydrophobicContact CD2-CB 4.24Å; L314-P349 HydrophobicContact CD2-CG 4.41Å; L314-M353 HydrophobicContact CD2-CB 3.86Å; L314-M353 HydrophobicContact CD2-CG 4.16Å; L314-M353 HydrophobicContact CD2-SD 3.91Å; L314-L357 HydrophobicContact CD1-CD1 3.99Å; L314-L357 HydrophobicContact CD2-CD1 3.94Å; L314-L357 HydrophobicContact CD2-CG 4.46Å; L314-L357 HydrophobicContact CG-CD1 4.02Å
315	Q	98.5	Very high	95.9	Very high	6 Å²	6	30.6 Å²	30.6	3%	0.028	15%	0.149	C	C	.	.	H	α-helix	trans	-67.1	-39	179	-67.3	-66.6	-8.9	0	0	112.5	F258 C284 Y290 S311 L312 A313 T319 A344 D345	F258-Q315 HydrophobicContact CB-CB 4.44Å; F258-Q315 HydrophobicContact CD1-CB 3.68Å; F258-Q315 HydrophobicContact CD1-CG 4.11Å; F258-Q315 HydrophobicContact CD2-CB 4.24Å; F258-Q315 HydrophobicContact CE1-CB 3.9Å; F258-Q315 HydrophobicContact CE1-CG 4.28Å; F258-Q315 HydrophobicContact CE2-CB 4.44Å; F258-Q315 HydrophobicContact CG-CB 3.85Å; F258-Q315 HydrophobicContact CZ-CB 4.27Å; C284-Q315 HydrophobicContact CB-CG 4.45Å; Y290-Q315 VanDerWaalsContact OH-CG 3.31Å; Y290-Q315 WeakPolarHBondContact OH-CG 3.27Å; Y290-Q315 PolarHBondContact OH-NE2 2.73Å; Y290-Q315 VanDerWaalsContact OH-NE2 3.1Å; S311-Q315 PolarHBondContact O-N 3.26Å; L312-Q315 PolarHBondContact O-N 3.05Å; A313-Q315 PolarHBondContact O-N 3.5Å; Q315-T319 WeakPolarHBondContact O-CB 3.49Å; Q315-T319 PolarHBondContact O-N 2.95Å; Q315-T319 PolarHBondContact O-OG1 3.01Å; Q315-A344 HydrophobicContact CG-CB 4.45Å; Q315-D345 PolarHBondContact NE2-O 3.07Å
316	L	98.8	Very high	94.8	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.3	-51.3	174.7	-64.7	176.6	0	0	0	110.8	I103 V105 T114 V222 C223 F258 L312 A313 W320	I103-L316 HydrophobicContact CG2-CB 4.34Å; I103-L316 HydrophobicContact CG2-CD1 4.09Å; I103-L316 HydrophobicContact CG2-CD2 4.44Å; V105-L316 HydrophobicContact CG2-CD1 3.86Å; T114-L316 HydrophobicContact CG2-CD1 3.85Å; V222-L316 HydrophobicContact CB-CD2 4.41Å; V222-L316 HydrophobicContact CG1-CB 4.42Å; V222-L316 HydrophobicContact CG1-CD2 4.06Å; V222-L316 HydrophobicContact CG2-CD2 3.56Å; C223-L316 WeakPolarHBondContact O-CD2 3.26Å; F258-L316 HydrophobicContact CD2-CD2 4.2Å; L312-L316 HydrophobicContact CD1-CD1 4.44Å; L312-L316 HydrophobicContact CD1-CG 4.28Å; L312-L316 HydrophobicContact CG-CD1 4.16Å; L312-L316 HydrophobicContact CG-CG 4.44Å; L312-L316 VanDerWaalsContact O-CG 3.28Å; L312-L316 WeakPolarHBondContact O-CG 3.47Å; L312-L316 PolarHBondContact O-N 3.16Å; A313-L316 PolarHBondContact O-N 2.98Å; L316-W320 VanDerWaalsContact O-CB 3.28Å; L316-W320 WeakPolarHBondContact O-CB 3.44Å; L316-W320 PolarHBondContact O-N 2.77Å
317	C	98.5	Very high	93.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.5	-46.4	178.6	-66.8	0	0	0	0	111.9	I121 L122 A313 L314 T319 W320 L321 M353	I121-C317 HydrophobicContact CG2-CB 3.87Å; I121-C317 VanDerWaalsContact CG2-SG 3.59Å; L122-C317 HydrophobicContact CD2-CB 4.17Å; L122-C317 HydrophobicContact CG-CB 4.4Å; A313-C317 WeakPolarHBondContact O-CB 3.23Å; A313-C317 PolarHBondContact O-N 2.97Å; A313-C317 PolarHBondContact O-SG 2.82Å; L314-C317 PolarHBondContact O-N 3.11Å; C317-T319 PolarHBondContact O-N 2.82Å; C317-W320 PolarHBondContact O-N 2.93Å; C317-L321 WeakPolarHBondContact O-CB 3.35Å; C317-L321 WeakPolarHBondContact O-CD1 3.45Å; C317-L321 WeakPolarHBondContact O-CG 3.37Å; C317-L321 PolarHBondContact O-N 2.86Å; C317-M353 HydrophobicContact CB-CE 4.22Å
318	H	96.7	Very high	91.1	Very high	48 Å²	48	40 Å²	40	22%	0.222	22%	0.22	C	C	.	.	H	α-helix	trans	-59.4	-48.4	-179.4	-176.8	69.1	0	0	0	111.7	L314 L321 Q322 F347 M353	L314-H318 WeakPolarHBondContact O-CB 3.21Å; L314-H318 PolarHBondContact O-N 3.09Å; H318-L321 PolarHBondContact O-N 2.87Å; H318-Q322 PolarHBondContact CE1-NE2 3.21Å; H318-Q322 PolarHBondContact NE2-NE2 3.27Å; H318-Q322 WeakPolarHBondContact O-CB 3.19Å; H318-Q322 WeakPolarHBondContact O-CG 3.26Å; H318-Q322 PolarHBondContact O-N 3.44Å; H318-F347 HydrophobicContact CB-CD1 4.33Å; H318-F347 HydrophobicContact CB-CE1 3.55Å; H318-F347 HydrophobicContact CB-CE2 4.21Å; H318-F347 HydrophobicContact CB-CZ 3.49Å; H318-F347 VanDerWaalsContact CB-CZ 3.49Å; H318-F347 AromaticContact CD2-CD1 3.73Å; H318-F347 AromaticContact CD2-CE1 3.79Å; H318-F347 AromaticContact CE1-CG 4Å; H318-F347 AromaticContact CG-CD1 3.84Å; H318-F347 AromaticContact CG-CE1 3.56Å; H318-F347 AromaticContact CG-CZ 3.76Å; H318-F347 AromaticContact ND1-CD2 3.99Å; H318-F347 AromaticContact NE2-CD1 3.95Å; H318-M353 HydrophobicContact CB-CE 4.09Å
319	T	96.4	Very high	89.2	Confident	14 Å²	14	41.4 Å²	41.4	9%	0.086	23%	0.23	C	C	.	.	H	α-helix	trans	-65.3	-41.7	179	-56.9	0	0	0	0	111.8	V222 P256 F258 Q315 C317 Q322 R323	V222-T319 HydrophobicContact CB-CG2 4.43Å; V222-T319 HydrophobicContact CG2-CG2 4.23Å; P256-T319 HydrophobicContact CB-CG2 4.14Å; P256-T319 HydrophobicContact CG-CG2 3.63Å; F258-T319 HydrophobicContact CE2-CG2 4.15Å; F258-T319 WeakPolarHBondContact CE2-OG1 3.45Å; F258-T319 WeakPolarHBondContact CZ-OG1 3.42Å; Q315-T319 WeakPolarHBondContact O-CB 3.49Å; Q315-T319 PolarHBondContact O-N 2.95Å; Q315-T319 PolarHBondContact O-OG1 3.01Å; C317-T319 PolarHBondContact O-N 2.82Å; T319-Q322 PolarHBondContact O-N 2.93Å; T319-R323 WeakPolarHBondContact O-CG 3.32Å; T319-R323 PolarHBondContact O-N 2.97Å; T319-R323 VanDerWaalsContact O-N 3.07Å
320	W	96.8	Very high	87.3	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.3	-45.3	177.2	-173.6	96.8	0	0	0	111.5	N101 I103 L122 F127 L200 W221 V222 L316 C317 R323 R324	N101-W320 HydrophobicContact CB-CZ2 4.16Å; N101-W320 PolarHBondContact O-NE1 2.86Å; I103-W320 HydrophobicContact CD1-CB 4.03Å; I103-W320 HydrophobicContact CD1-CG 3.91Å; I103-W320 HydrophobicContact CG1-CG 4.2Å; L122-W320 HydrophobicContact CD1-CE3 4.45Å; L122-W320 HydrophobicContact CD2-CE3 3.78Å; L122-W320 HydrophobicContact CD2-CZ3 4.17Å; F127-W320 HydrophobicContact CD1-CH2 4.01Å; F127-W320 HydrophobicContact CD1-CZ3 4.33Å; F127-W320 HydrophobicContact CD2-CH2 4.37Å; F127-W320 AromaticContact CD2-CZ3 3.97Å; F127-W320 HydrophobicContact CD2-CZ3 3.97Å; F127-W320 AromaticContact CE1-CH2 3.94Å; F127-W320 HydrophobicContact CE1-CH2 3.94Å; F127-W320 HydrophobicContact CE1-CZ3 4.07Å; F127-W320 HydrophobicContact CE2-CH2 4.34Å; F127-W320 AromaticContact CE2-CZ3 3.72Å; F127-W320 HydrophobicContact CE2-CZ3 3.72Å; F127-W320 HydrophobicContact CG-CH2 4.23Å; F127-W320 HydrophobicContact CG-CZ3 4.29Å; F127-W320 HydrophobicContact CZ-CH2 4.12Å; F127-W320 AromaticContact CZ-CZ3 3.76Å; F127-W320 HydrophobicContact CZ-CZ3 3.76Å; L200-W320 HydrophobicContact CB-CH2 4.44Å; L200-W320 HydrophobicContact CB-CZ2 3.63Å; L200-W320 HydrophobicContact CD1-CZ2 4.35Å; L200-W320 HydrophobicContact CD2-CH2 3.81Å; L200-W320 HydrophobicContact CD2-CZ2 3.85Å; L200-W320 HydrophobicContact CD2-CZ3 4.37Å; L200-W320 HydrophobicContact CG-CZ2 4.14Å; W221-W320 AromaticContact CD2-NE1 3.95Å; W221-W320 AromaticContact CE3-CD1 3.73Å; W221-W320 HydrophobicContact CE3-CD2 4.41Å; W221-W320 HydrophobicContact CE3-CG 4.19Å; W221-W320 AromaticContact CE3-NE1 3.64Å; V222-W320 HydrophobicContact CG1-CB 4.33Å; L316-W320 VanDerWaalsContact O-CB 3.28Å; L316-W320 WeakPolarHBondContact O-CB 3.44Å; L316-W320 PolarHBondContact O-N 2.77Å; C317-W320 PolarHBondContact O-N 2.93Å; W320-R323 PolarHBondContact O-N 2.74Å; W320-R324 HydrophobicContact CE3-CB 4.29Å; W320-R324 HydrophobicContact CH2-CB 4.19Å; W320-R324 HydrophobicContact CH2-CG 3.86Å; W320-R324 HydrophobicContact CZ2-CG 4.48Å; W320-R324 HydrophobicContact CZ3-CB 4.01Å; W320-R324 HydrophobicContact CZ3-CG 4.04Å; W320-R324 WeakPolarHBondContact O-CB 3.49Å; W320-R324 PolarHBondContact O-N 2.84Å
321	L	95.9	Very high	85.6	Confident	23 Å²	23	48.1 Å²	48.1	12%	0.12	28%	0.276	C	S	.	.	H	α-helix	trans	-63.9	-41.1	177.5	-71.5	166.3	0	0	0	112.2	L122 Y125 F127 C317 H318 R323 R324 C325 M353	L122-L321 HydrophobicContact CD2-CD1 4.22Å; L122-L321 HydrophobicContact CD2-CD2 3.96Å; L122-L321 HydrophobicContact CD2-CG 3.9Å; Y125-L321 HydrophobicContact CD1-CD2 4.46Å; Y125-L321 HydrophobicContact CD2-CD1 4.04Å; Y125-L321 HydrophobicContact CE1-CD1 4.16Å; Y125-L321 HydrophobicContact CE2-CD1 3.64Å; Y125-L321 HydrophobicContact CG-CD1 4.47Å; Y125-L321 HydrophobicContact CG-CD2 4.36Å; F127-L321 HydrophobicContact CD2-CD2 4.47Å; F127-L321 HydrophobicContact CE2-CD2 3.52Å; F127-L321 HydrophobicContact CZ-CD2 4.11Å; C317-L321 WeakPolarHBondContact O-CB 3.35Å; C317-L321 WeakPolarHBondContact O-CD1 3.45Å; C317-L321 WeakPolarHBondContact O-CG 3.37Å; C317-L321 PolarHBondContact O-N 2.86Å; H318-L321 PolarHBondContact O-N 2.87Å; L321-R323 VanDerWaalsContact C-N 3.33Å; L321-R323 PolarHBondContact O-N 2.78Å; L321-R324 PolarHBondContact O-N 3.1Å; L321-C325 WeakPolarHBondContact O-CB 2.94Å; L321-C325 PolarHBondContact O-N 2.8Å; L321-M353 HydrophobicContact CD1-CE 3.64Å
322	Q	92.3	Very high	83.9	Confident	88 Å²	88	51.2 Å²	51.2	41%	0.411	30%	0.302	S	S	.	.	H	α-helix	trans	-60.4	-43	174.9	-79.8	-179.5	-25.6	0	0	111.8	H318 T319 R324 G326	H318-Q322 PolarHBondContact CE1-NE2 3.21Å; H318-Q322 PolarHBondContact NE2-NE2 3.27Å; H318-Q322 WeakPolarHBondContact O-CB 3.19Å; H318-Q322 WeakPolarHBondContact O-CG 3.26Å; H318-Q322 PolarHBondContact O-N 3.44Å; T319-Q322 PolarHBondContact O-N 2.93Å; Q322-R324 VanDerWaalsContact C-N 3.3Å; Q322-R324 PolarHBondContact O-N 2.91Å; Q322-G326 WeakPolarHBondContact O-CA 3.2Å; Q322-G326 PolarHBondContact O-N 2.9Å
323	R	90.8	Very high	82.5	Confident	73 Å²	73	56.4 Å²	56.4	28%	0.275	33%	0.329	S	S	.	.	H	α-helix	trans	-68.4	-30.6	175.6	-73.5	179.7	162.4	-150.3	-8.2	113.1	W221 T319 W320 L321	W221-R323 HydrophobicContact CE3-CB 3.75Å; W221-R323 HydrophobicContact CZ3-CB 3.72Å; W221-R323 PolarHBondContact O-NH1 2.96Å; T319-R323 WeakPolarHBondContact O-CG 3.32Å; T319-R323 PolarHBondContact O-N 2.97Å; T319-R323 VanDerWaalsContact O-N 3.07Å; W320-R323 PolarHBondContact O-N 2.74Å; L321-R323 VanDerWaalsContact C-N 3.33Å; L321-R323 PolarHBondContact O-N 2.78Å
324	R	88.9	Confident	80.8	Confident	120 Å²	120	58.3 Å²	58.3	45%	0.453	34%	0.341	S	S	.	.	H	α-helix	trans	-78.1	-39.3	-177.3	-173.3	61.1	176.4	131.3	-2.9	112	F127 W221 W320 L321 Q322	F127-R324 HydrophobicContact CE1-CG 4.46Å; F127-R324 HydrophobicContact CZ-CG 4.5Å; W221-R324 HydrophobicContact CH2-CB 4.31Å; W221-R324 HydrophobicContact CZ3-CB 3.78Å; W320-R324 HydrophobicContact CE3-CB 4.29Å; W320-R324 HydrophobicContact CH2-CB 4.19Å; W320-R324 HydrophobicContact CH2-CG 3.86Å; W320-R324 HydrophobicContact CZ2-CG 4.48Å; W320-R324 HydrophobicContact CZ3-CB 4.01Å; W320-R324 HydrophobicContact CZ3-CG 4.04Å; W320-R324 WeakPolarHBondContact O-CB 3.49Å; W320-R324 PolarHBondContact O-N 2.84Å; L321-R324 PolarHBondContact O-N 3.1Å; Q322-R324 VanDerWaalsContact C-N 3.3Å; Q322-R324 PolarHBondContact O-N 2.91Å
325	C	81.1	Confident	79.2	Confident	100 Å²	100	62.4 Å²	62.4	68%	0.676	36%	0.364	S	S	*	.	H	α-helix	trans	-120.9	-15.2	-166.8	-58.1	0	0	0	0	114	L321	L321-C325 WeakPolarHBondContact O-CB 2.94Å; L321-C325 PolarHBondContact O-N 2.8Å
326	G	72	Confident	77.4	Confident	34 Å²	34	67 Å²	67	35%	0.351	39%	0.394	S	S	.	.	S	Bend	trans	-94.7	167.3	-179.6	0	0	0	0	0	112.9	Q322	Q322-G326 WeakPolarHBondContact O-CA 3.2Å; Q322-G326 PolarHBondContact O-N 2.9Å
327	P	61	Low	75.8	Confident	116 Å²	116	74.1 Å²	74.1	75%	0.753	43%	0.432	S	S	*	.			trans	-60.3	150.7	168	27	-32.6	0	0	0	110	S329	P327-S329 VanDerWaalsContact C-N 3.27Å; P327-S329 PolarHBondContact O-N 3.18Å
328	D	56.8	Low	74.5	Confident	166 Å²	166	75.3 Å²	75.3	89%	0.888	44%	0.44	S	S	*	.			trans	-59	86.8	177.2	-93.3	-27.8	0	0	0	110.7
329	S	57.3	Low	73.3	Confident	76 Å²	76	77.6 Å²	77.6	53%	0.531	46%	0.461	S	S	.	.			trans	-95.1	103.9	170.7	56.8	0	0	0	0	107.9	P327 P331	P327-S329 VanDerWaalsContact C-N 3.27Å; P327-S329 PolarHBondContact O-N 3.18Å; S329-P331 WeakPolarHBondContact O-CD 3.45Å
330	S	58.8	Low	72.3	Confident	112 Å²	112	80.3 Å²	80.3	78%	0.783	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-61.3	122.8	172.2	-66.7	0	0	0	0	109.4	A332	S330-A332 PolarHBondContact O-N 2.82Å
331	P	63.4	Low	71.7	Confident	32 Å²	32	81.8 Å²	81.8	21%	0.208	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-60.3	139.3	174.2	21.8	-29.4	0	0	0	109.9	P256 P280 S329 L333	P256-P331 HydrophobicContact CB-CB 4.44Å; P256-P331 HydrophobicContact CB-CG 4.25Å; P256-P331 HydrophobicContact CG-CG 4.37Å; P280-P331 HydrophobicContact CB-CB 4.19Å; P280-P331 HydrophobicContact CG-CB 4.19Å; P280-P331 HydrophobicContact CG-CG 4.09Å; S329-P331 WeakPolarHBondContact O-CD 3.45Å; P331-L333 PolarHBondContact O-N 3.44Å
332	A	62.4	Low	71.3	Confident	67 Å²	67	85.6 Å²	85.6	55%	0.554	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-56.1	126	177.7	0	0	0	0	0	110.2	P280 S330	P280-A332 WeakPolarHBondContact CB-O 3.48Å; S330-A332 PolarHBondContact O-N 2.82Å
333	L	69.1	Low	71.4	Confident	110 Å²	110	85.1 Å²	85.1	58%	0.576	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-63.2	154.2	176.8	-69.8	172.6	0	0	0	110.4	P280 P331 D335	P280-L333 HydrophobicContact CG-CD2 4.21Å; P331-L333 PolarHBondContact O-N 3.44Å; L333-D335 PolarHBondContact O-N 2.81Å
334	P	62.5	Low	71.5	Confident	39 Å²	39	81.9 Å²	81.9	25%	0.253	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-54.5	128.6	171.7	-20.4	31.5	0	0	0	110.1	R275 C279	R275-P334 HydrophobicContact CG-CB 4.28Å; C279-P334 WeakPolarHBondContact O-CG 3.36Å
335	D	64.9	Low	71.7	Confident	87 Å²	87	82 Å²	82	47%	0.465	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-64.2	122.2	170.6	-179.3	-8.1	0	0	0	108.8	L333 D337 S338	L333-D335 PolarHBondContact O-N 2.81Å; D335-D337 PolarHBondContact O-N 3.13Å; D335-D337 PolarHBondContact OD1-N 3.11Å; D335-S338 PolarHBondContact O-N 3.05Å
336	P	61.9	Low	72.2	Confident	102 Å²	102	79.7 Å²	79.7	66%	0.662	49%	0.491	S	S	*	.	S	Bend	trans	-60.4	-28.5	179.9	24.2	-33.6	0	0	0	113
337	D	65	Low	73.2	Confident	149 Å²	149	79.4 Å²	79.4	80%	0.797	48%	0.48	S	S	*	.	S	Bend	trans	-98.5	-12.9	-173	-66.6	-25.4	0	0	0	113.6	D335	D335-D337 PolarHBondContact O-N 3.13Å; D335-D337 PolarHBondContact OD1-N 3.11Å
338	S	71.1	Confident	74.8	Confident	25 Å²	25	80.4 Å²	80.4	18%	0.175	47%	0.468	C	S	.	.			trans	-63	143.2	176.3	176.2	0	0	0	0	110.2	R275 D335 C340	R275-S338 PolarHBondContact NH1-O 2.86Å; R275-S338 PolarHBondContact NH2-O 2.94Å; D335-S338 PolarHBondContact O-N 3.05Å; S338-C340 PolarHBondContact OG-N 3.44Å; S338-C340 PolarHBondContact OG-O 3.09Å
339	S	70.4	Confident	76.6	Confident	96 Å²	96	72.9 Å²	72.9	67%	0.671	43%	0.429	S	S	*	.	S	Bend	trans	-93.1	-12.1	172.9	63	0	0	0	0	112.7	R271	R271-S339 PolarHBondContact NH1-O 2.94Å
340	C	76.3	Confident	78.3	Confident	72 Å²	72	70.8 Å²	70.8	49%	0.486	42%	0.419	S	S	.	.	S	Bend	trans	-120.1	152.2	-172.9	65.6	0	0	0	0	112.7	S338	S338-C340 PolarHBondContact OG-N 3.44Å; S338-C340 PolarHBondContact OG-O 3.09Å
341	V	83.1	Confident	80	Confident	30 Å²	30	69.6 Å²	69.6	18%	0.182	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-78.6	125.5	166.9	-176.1	0	0	0	0	107.4	M267 R271 L281 V283	M267-V341 HydrophobicContact CE-CB 3.95Å; M267-V341 HydrophobicContact CE-CG1 4.36Å; M267-V341 HydrophobicContact CE-CG2 3.76Å; R271-V341 HydrophobicContact CB-CG2 3.58Å; R271-V341 HydrophobicContact CG-CG2 3.79Å; L281-V341 HydrophobicContact CB-CG1 4.41Å; L281-V341 HydrophobicContact CD2-CG1 4.14Å; L281-V341 HydrophobicContact CD2-CG2 4.21Å; L281-V341 HydrophobicContact CG-CG1 3.87Å; L281-V341 WeakPolarHBondContact O-CG1 3.28Å; V283-V341 HydrophobicContact CG2-CB 4.01Å; V283-V341 HydrophobicContact CG2-CG1 3.72Å
342	L	89.3	Confident	81.5	Confident	104 Å²	104	69.1 Å²	69.1	55%	0.545	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-65.9	144.7	-179.9	-62	177.4	0	0	0	110.9	R282 V283	R282-L342 CarbonylContact C-O 3.58Å; R282-L342 VanDerWaalsContact CA-O 3.27Å; R282-L342 WeakPolarHBondContact CA-O 3.25Å; V283-L342 PolarHBondContact N-O 2.81Å
343	Q	93.3	Very high	83.2	Confident	78 Å²	78	66.1 Å²	66.1	36%	0.364	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-72.3	141.6	168.9	-169.1	167.5	39.2	0	0	109.3	V283	V283-Q343 CarbonylContact O-C 3.59Å; V283-Q343 WeakPolarHBondContact O-CA 3.4Å; V283-Q343 WeakPolarHBondContact O-CG 3.13Å
344	A	93.6	Very high	84.5	Confident	4 Å²	4	62.7 Å²	62.7	3%	0.033	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-72.3	143.2	171	0	0	0	0	0	110.5	F258 R282 V283 Q315 S346	F258-A344 HydrophobicContact CD1-CB 4.05Å; F258-A344 HydrophobicContact CE1-CB 3.75Å; R282-A344 HydrophobicContact CB-CB 3.9Å; V283-A344 PolarHBondContact O-N 3.48Å; Q315-A344 HydrophobicContact CG-CB 4.45Å; A344-S346 PolarHBondContact O-N 3.25Å
345	D	92.2	Very high	86.1	Confident	122 Å²	122	65.8 Å²	65.8	65%	0.652	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-62	137.1	176.3	-59.6	-50.3	0	0	0	110.6	Q315	Q315-D345 PolarHBondContact NE2-O 3.07Å
346	S	91.9	Very high	87.7	Confident	53 Å²	53	61.6 Å²	61.6	37%	0.371	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-74.4	143.5	165.8	53.7	0	0	0	0	109.5	R289 A344	R289-S346 VanDerWaalsContact O-CB 3.23Å; R289-S346 WeakPolarHBondContact O-CB 3.28Å; A344-S346 PolarHBondContact O-N 3.25Å
347	F	93.1	Very high	89.4	Confident	28 Å²	28	56.8 Å²	56.8	12%	0.123	33%	0.328	C	S	.	.			trans	-129.7	172.2	173.6	59	-93.3	0	0	0	109.7	Y290 Q291 L314 H318 P349 M353	Y290-F347 HydrophobicContact CD1-CD1 4.32Å; Y290-F347 HydrophobicContact CD1-CE1 4.18Å; Y290-F347 HydrophobicContact CD1-CE2 4.37Å; Y290-F347 HydrophobicContact CD1-CG 4.5Å; Y290-F347 HydrophobicContact CD1-CZ 4.19Å; Y290-F347 HydrophobicContact CE1-CD1 4.01Å; Y290-F347 AromaticContact CE1-CE1 3.62Å; Y290-F347 HydrophobicContact CE1-CE1 3.62Å; Y290-F347 AromaticContact CE1-CZ 3.88Å; Y290-F347 HydrophobicContact CE1-CZ 3.88Å; Q291-F347 PolarHBondContact N-O 3.46Å; L314-F347 HydrophobicContact CB-CZ 4Å; H318-F347 HydrophobicContact CB-CD1 4.33Å; H318-F347 HydrophobicContact CB-CE1 3.55Å; H318-F347 HydrophobicContact CB-CE2 4.21Å; H318-F347 HydrophobicContact CB-CZ 3.49Å; H318-F347 VanDerWaalsContact CB-CZ 3.49Å; H318-F347 AromaticContact CD2-CD1 3.73Å; H318-F347 AromaticContact CD2-CE1 3.79Å; H318-F347 AromaticContact CE1-CG 4Å; H318-F347 AromaticContact CG-CD1 3.84Å; H318-F347 AromaticContact CG-CE1 3.56Å; H318-F347 AromaticContact CG-CZ 3.76Å; H318-F347 AromaticContact ND1-CD2 3.99Å; H318-F347 AromaticContact NE2-CD1 3.95Å; F347-P349 HydrophobicContact CD2-CG 4.5Å; F347-P349 HydrophobicContact CE2-CB 4.31Å; F347-P349 HydrophobicContact CE2-CG 4.19Å; F347-P349 VanDerWaalsContact O-CD 3.31Å; F347-P349 WeakPolarHBondContact O-CD 3.33Å; F347-M353 HydrophobicContact CE2-CE 4.32Å; F347-M353 HydrophobicContact CE2-SD 3.62Å; F347-M353 HydrophobicContact CZ-SD 4.16Å
348	R	94	Very high	91	Very high	137 Å²	137	51.5 Å²	51.5	52%	0.517	31%	0.306	S	S	.	.			trans	-86.3	109.9	172	178.1	171.4	163.3	174.7	-11.1	109.6	Q291 E293 G350	Q291-R348 HydrophobicContact CB-CB 4.2Å; Q291-R348 WeakPolarHBondContact O-CA 3.33Å; Q291-R348 WeakPolarHBondContact O-CG 3.25Å; E293-R348 VanDerWaalsContact CD-CZ 3.43Å; E293-R348 IonicContact OE1-CZ 3.1Å; E293-R348 IonicContact OE1-NH1 2.87Å; E293-R348 PolarHBondContact OE1-NH1 2.89Å; E293-R348 IonicContact OE1-NH2 2.63Å; E293-R348 PolarHBondContact OE1-NH2 3.33Å; E293-R348 IonicContact OE2-CZ 3.96Å; E293-R348 IonicContact OE2-NH2 3.01Å; E293-R348 PolarHBondContact OE2-NH2 3.33Å; R348-G350 PolarHBondContact O-N 2.76Å
349	P	94.8	Very high	92.3	Very high	8 Å²	8	53.5 Å²	53.5	5%	0.052	31%	0.314	C	S	.	.			trans	-63.7	134.6	179.3	-20.5	35.1	0	0	0	110.7	Y290 Q291 L297 L314 F347 M353 V354	Y290-P349 HydrophobicContact CD1-CG 4.23Å; Y290-P349 HydrophobicContact CG-CG 4.35Å; Q291-P349 WeakPolarHBondContact O-CD 3.47Å; L297-P349 HydrophobicContact CD1-CG 4.39Å; L314-P349 HydrophobicContact CD1-CG 4.32Å; L314-P349 HydrophobicContact CD2-CB 4.24Å; L314-P349 HydrophobicContact CD2-CG 4.41Å; F347-P349 HydrophobicContact CD2-CG 4.5Å; F347-P349 HydrophobicContact CE2-CB 4.31Å; F347-P349 HydrophobicContact CE2-CG 4.19Å; F347-P349 VanDerWaalsContact O-CD 3.31Å; F347-P349 WeakPolarHBondContact O-CD 3.33Å; P349-M353 HydrophobicContact CB-CB 3.9Å; P349-M353 HydrophobicContact CB-SD 4.16Å; P349-V354 HydrophobicContact CB-CG2 4.09Å
350	G	93.4	Very high	93.6	Very high	31 Å²	31	49.1 Å²	49.1	32%	0.32	28%	0.283	S	S	.	.			trans	-69.3	165.7	174.8	0	0	0	0	0	112.2	R348 A352 M353 V354	R348-G350 PolarHBondContact O-N 2.76Å; G350-A352 PolarHBondContact O-N 2.86Å; G350-M353 WeakPolarHBondContact O-CB 3.25Å; G350-M353 PolarHBondContact O-N 2.88Å; G350-V354 PolarHBondContact O-N 2.91Å; G350-V354 VanDerWaalsContact O-N 3.08Å
351	A	94.6	Very high	94.5	Very high	88 Å²	88	51.1 Å²	51.1	73%	0.727	29%	0.285	S	S	*	.	H	α-helix	trans	-54.2	-39.1	-178.6	0	0	0	0	0	113.2	V354 K355	A351-V354 PolarHBondContact O-N 3.26Å; A351-K355 VanDerWaalsContact O-CB 3.29Å; A351-K355 WeakPolarHBondContact O-CB 3.19Å; A351-K355 PolarHBondContact O-N 3.37Å
352	A	95.7	Very high	95	Very high	21 Å²	21	51.1 Å²	51.1	17%	0.174	28%	0.282	C	S	.	.	H	α-helix	trans	-66.3	-34.8	176.8	0	0	0	0	0	113.3	T124 Y125 G350 G356	T124-A352 HydrophobicContact CG2-CB 3.93Å; T124-A352 WeakPolarHBondContact CG2-O 3.35Å; Y125-A352 HydrophobicContact CD1-CB 4.02Å; Y125-A352 HydrophobicContact CD2-CB 3.83Å; Y125-A352 HydrophobicContact CE1-CB 3.88Å; Y125-A352 HydrophobicContact CE2-CB 3.66Å; Y125-A352 HydrophobicContact CG-CB 3.99Å; G350-A352 PolarHBondContact O-N 2.86Å; A352-G356 WeakPolarHBondContact O-CA 3.25Å; A352-G356 PolarHBondContact O-N 2.96Å
353	M	97	Very high	95.2	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.02	27%	0.265	C	S	.	.	H	α-helix	trans	-68	-47.2	173.5	-71.7	178.6	177	0	0	111.4	I121 Y125 L314 C317 H318 L321 F347 P349 G350 G356 L357	I121-M353 HydrophobicContact CG2-CB 4.38Å; I121-M353 HydrophobicContact CG2-CG 3.78Å; Y125-M353 HydrophobicContact CE2-CE 4.34Å; Y125-M353 HydrophobicContact CE2-CG 3.73Å; Y125-M353 WeakPolarHBondContact OH-CG 3.46Å; L314-M353 HydrophobicContact CD2-CB 3.86Å; L314-M353 HydrophobicContact CD2-CG 4.16Å; L314-M353 HydrophobicContact CD2-SD 3.91Å; C317-M353 HydrophobicContact CB-CE 4.22Å; H318-M353 HydrophobicContact CB-CE 4.09Å; L321-M353 HydrophobicContact CD1-CE 3.64Å; F347-M353 HydrophobicContact CE2-CE 4.32Å; F347-M353 HydrophobicContact CE2-SD 3.62Å; F347-M353 HydrophobicContact CZ-SD 4.16Å; P349-M353 HydrophobicContact CB-CB 3.9Å; P349-M353 HydrophobicContact CB-SD 4.16Å; G350-M353 WeakPolarHBondContact O-CB 3.25Å; G350-M353 PolarHBondContact O-N 2.88Å; M353-G356 PolarHBondContact O-N 3.08Å; M353-L357 WeakPolarHBondContact O-CG 3.17Å; M353-L357 PolarHBondContact O-N 3.26Å
354	V	96.9	Very high	95.2	Very high	39 Å²	39	43.5 Å²	43.5	24%	0.236	25%	0.247	C	C	.	.	H	α-helix	trans	-60.2	-49.2	179.3	178	0	0	0	0	110.5	L297 P349 G350 A351 G356 L357 A358	L297-V354 HydrophobicContact CD2-CG1 4.31Å; L297-V354 HydrophobicContact CD2-CG2 3.86Å; P349-V354 HydrophobicContact CB-CG2 4.09Å; G350-V354 PolarHBondContact O-N 2.91Å; G350-V354 VanDerWaalsContact O-N 3.08Å; A351-V354 PolarHBondContact O-N 3.26Å; V354-G356 VanDerWaalsContact C-N 3.35Å; V354-G356 PolarHBondContact O-N 3.03Å; V354-L357 PolarHBondContact O-N 3.29Å; V354-A358 PolarHBondContact O-N 2.98Å
355	K	96.7	Very high	95.2	Very high	103 Å²	103	46.1 Å²	46.1	45%	0.448	26%	0.256	S	S	.	.	H	α-helix	trans	-62.1	-42.4	175.6	-176.2	178.7	-174.6	-60.3	0	111.8	T124 A351 L357 A358 D359	T124-K355 HydrophobicContact CG2-CB 4.29Å; T124-K355 HydrophobicContact CG2-CD 4.09Å; T124-K355 HydrophobicContact CG2-CG 4.3Å; A351-K355 VanDerWaalsContact O-CB 3.29Å; A351-K355 WeakPolarHBondContact O-CB 3.19Å; A351-K355 PolarHBondContact O-N 3.37Å; K355-L357 PolarHBondContact O-N 3.43Å; K355-A358 PolarHBondContact O-N 3.38Å; K355-D359 WeakPolarHBondContact CG-OD2 3.37Å; K355-D359 IonicContact NZ-OD2 3.95Å; K355-D359 PolarHBondContact NZ-OD2 3.45Å; K355-D359 VanDerWaalsContact O-CB 3.27Å; K355-D359 WeakPolarHBondContact O-CB 3.28Å; K355-D359 VanDerWaalsContact O-CG 3.26Å; K355-D359 PolarHBondContact O-N 2.72Å
356	G	98	Very high	95.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58.9	-46.2	177.6	0	0	0	0	0	112.4	R120 A352 M353 V354 T360	R120-G356 WeakPolarHBondContact CG-O 3.5Å; A352-G356 WeakPolarHBondContact O-CA 3.25Å; A352-G356 PolarHBondContact O-N 2.96Å; M353-G356 PolarHBondContact O-N 3.08Å; V354-G356 VanDerWaalsContact C-N 3.35Å; V354-G356 PolarHBondContact O-N 3.03Å; G356-T360 PolarHBondContact O-N 3.39Å; G356-T360 PolarHBondContact O-OG1 3.41Å
357	L	97.9	Very high	95.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.7	-48.3	174.9	-72.4	179.3	0	0	0	112.3	F117 I121 L297 L299 G300 A310 L314 M353 V354 K355 D359 T360	F117-L357 HydrophobicContact CB-CD2 4.24Å; F117-L357 HydrophobicContact CD1-CD2 3.52Å; F117-L357 HydrophobicContact CE1-CD2 4.02Å; F117-L357 HydrophobicContact CG-CD2 3.99Å; I121-L357 HydrophobicContact CD1-CD2 3.81Å; I121-L357 HydrophobicContact CD1-CG 4.07Å; L297-L357 HydrophobicContact CD1-CD1 4.22Å; L297-L357 HydrophobicContact CD2-CD1 4.48Å; L299-L357 HydrophobicContact CD2-CB 4.03Å; L299-L357 HydrophobicContact CD2-CD1 4.16Å; L299-L357 HydrophobicContact CD2-CD2 4.23Å; L299-L357 HydrophobicContact CD2-CG 4.38Å; G300-L357 PolarHBondContact N-O 3.1Å; A310-L357 HydrophobicContact CB-CD2 3.79Å; L314-L357 HydrophobicContact CD1-CD1 3.99Å; L314-L357 HydrophobicContact CD2-CD1 3.94Å; L314-L357 HydrophobicContact CD2-CG 4.46Å; L314-L357 HydrophobicContact CG-CD1 4.02Å; M353-L357 WeakPolarHBondContact O-CG 3.17Å; M353-L357 PolarHBondContact O-N 3.26Å; V354-L357 PolarHBondContact O-N 3.29Å; K355-L357 PolarHBondContact O-N 3.43Å; L357-D359 VanDerWaalsContact C-N 3.35Å; L357-D359 PolarHBondContact O-N 3.4Å; L357-T360 PolarHBondContact O-N 2.79Å
358	A	97.4	Very high	95.7	Very high	39 Å²	39	39.9 Å²	39.9	32%	0.322	22%	0.222	S	C	.	.	H	α-helix	trans	-65.3	-36	-178.3	0	0	0	0	0	112.9	Q298 G300 V354 K355	Q298-A358 HydrophobicContact CB-CB 4.45Å; Q298-A358 PolarHBondContact O-N 2.83Å; G300-A358 WeakPolarHBondContact CA-O 3.44Å; G300-A358 PolarHBondContact N-O 3.45Å; V354-A358 PolarHBondContact O-N 2.98Å; K355-A358 PolarHBondContact O-N 3.38Å
359	D	97.7	Very high	95.7	Very high	67 Å²	67	34.8 Å²	34.8	36%	0.358	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	2.1	-176.8	-68.4	-3.8	0	0	0	113.7	R120 K355 L357 H361	R120-D359 IonicContact CZ-OD2 2.84Å; R120-D359 VanDerWaalsContact NE-CB 3.27Å; R120-D359 IonicContact NE-OD2 2.77Å; R120-D359 VanDerWaalsContact NH2-CB 3.26Å; R120-D359 IonicContact NH2-OD2 3.75Å; R120-D359 PolarHBondContact NH2-OD2 2.98Å; K355-D359 WeakPolarHBondContact CG-OD2 3.37Å; K355-D359 IonicContact NZ-OD2 3.95Å; K355-D359 PolarHBondContact NZ-OD2 3.45Å; K355-D359 VanDerWaalsContact O-CB 3.27Å; K355-D359 WeakPolarHBondContact O-CB 3.28Å; K355-D359 VanDerWaalsContact O-CG 3.26Å; K355-D359 PolarHBondContact O-N 2.72Å; L357-D359 VanDerWaalsContact C-N 3.35Å; L357-D359 PolarHBondContact O-N 3.4Å; D359-H361 PolarHBondContact O-N 2.79Å
360	T	98.3	Very high	95.6	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.018	23%	0.233	C	C	.	.			trans	-70.1	123.5	-177.6	-65.7	0	0	0	0	110.5	A116 F117 R120 G300 L301 G356 L357	A116-T360 HydrophobicContact CB-CG2 4.06Å; F117-T360 VanDerWaalsContact CD1-CB 3.48Å; F117-T360 HydrophobicContact CD1-CG2 3.61Å; F117-T360 VanDerWaalsContact CD1-OG1 3.23Å; F117-T360 WeakPolarHBondContact CD1-OG1 3.24Å; F117-T360 HydrophobicContact CE1-CG2 3.89Å; F117-T360 HydrophobicContact CG-CG2 4.13Å; R120-T360 WeakPolarHBondContact CB-OG1 3.46Å; R120-T360 WeakPolarHBondContact CG-OG1 3.39Å; G300-T360 CarbonylContact C-O 3.21Å; G300-T360 VanDerWaalsContact CA-O 3.3Å; G300-T360 WeakPolarHBondContact CA-O 3.36Å; L301-T360 HydrophobicContact CD1-CG2 4.08Å; L301-T360 HydrophobicContact CD2-CG2 4.26Å; L301-T360 WeakPolarHBondContact CD2-O 3.38Å; L301-T360 HydrophobicContact CG-CG2 4.02Å; G356-T360 PolarHBondContact O-N 3.39Å; G356-T360 PolarHBondContact O-OG1 3.41Å; L357-T360 PolarHBondContact O-N 2.79Å
361	H	94.9	Very high	95.4	Very high	115 Å²	115	45.1 Å²	45.1	53%	0.532	23%	0.233	S	C	.	.			trans	-116.3	136.6	171.8	-179.3	-102.6	0	0	0	110	D359 Q367	D359-H361 PolarHBondContact O-N 2.79Å; H361-Q367 PolarHBondContact NE2-NE2 3.29Å
362	W	94.9	Very high	95.1	Very high	30 Å²	30	44.5 Å²	44.5	11%	0.114	24%	0.235	C	C	.	.			trans	-146.9	105	177.7	-164.8	-129.1	0	0	0	109.7	A116 F131 L301 R365	A116-W362 HydrophobicContact CB-CB 4.12Å; A116-W362 HydrophobicContact CB-CD2 3.86Å; A116-W362 HydrophobicContact CB-CE3 3.86Å; A116-W362 HydrophobicContact CB-CG 3.97Å; F131-W362 HydrophobicContact CD1-CH2 4.38Å; F131-W362 HydrophobicContact CD1-CZ3 4.33Å; F131-W362 HydrophobicContact CE1-CE3 4.32Å; F131-W362 AromaticContact CE1-CH2 3.37Å; F131-W362 HydrophobicContact CE1-CH2 3.37Å; F131-W362 HydrophobicContact CE1-CZ2 4.14Å; F131-W362 AromaticContact CE1-CZ3 3.48Å; F131-W362 HydrophobicContact CE1-CZ3 3.48Å; F131-W362 VanDerWaalsContact CE1-CZ3 3.48Å; F131-W362 AromaticContact CZ-CH2 3.68Å; F131-W362 HydrophobicContact CZ-CH2 3.68Å; F131-W362 HydrophobicContact CZ-CZ2 4.05Å; F131-W362 HydrophobicContact CZ-CZ3 4.22Å; L301-W362 HydrophobicContact CD1-CB 4.07Å; L301-W362 HydrophobicContact CD2-CB 3.78Å; W362-R365 HydrophobicContact CG-CG 4.31Å; W362-R365 PolarHBondContact O-N 3.47Å
363	A	93.7	Very high	94.8	Very high	21 Å²	21	45 Å²	45	17%	0.174	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	144.7	-171.2	0	0	0	0	0	112.2	L137 R365 L569	L137-A363 HydrophobicContact CD1-CB 3.47Å; L137-A363 VanDerWaalsContact CD1-CB 3.47Å; L137-A363 WeakPolarHBondContact CD1-O 3.3Å; A363-R365 PolarHBondContact O-N 3Å; A363-L569 HydrophobicContact CB-CD1 4.04Å
364	G	92.1	Very high	94.6	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	14.4	179.5	0	0	0	0	0	116	D379 G380 V565	G364-D379 WeakPolarHBondContact O-CA 3.28Å; G364-G380 PolarHBondContact O-N 3.24Å; G364-V565 VanDerWaalsContact CA-CG1 3.48Å
365	R	94.9	Very high	94.6	Very high	60 Å²	60	43.3 Å²	43.3	23%	0.226	23%	0.229	C	C	.	.	S	Bend	trans	-116.9	102.3	172	-59.8	-49.9	175.7	-177.6	-4.5	110.7	W362 A363 Q367	W362-R365 HydrophobicContact CG-CG 4.31Å; W362-R365 PolarHBondContact O-N 3.47Å; A363-R365 PolarHBondContact O-N 3Å; R365-Q367 PolarHBondContact O-N 2.88Å; R365-Q367 VanDerWaalsContact O-N 3.09Å
366	S	95.6	Very high	94.6	Very high	5 Å²	5	38.4 Å²	38.4	4%	0.035	21%	0.208	C	C	.	.	S	Bend	trans	46.8	42.4	179.7	-56.1	0	0	0	0	111.4	A302 L378 D379 W393	A302-S366 VanDerWaalsContact O-CB 3.3Å; A302-S366 WeakPolarHBondContact O-CB 3.31Å; S366-L378 PolarHBondContact N-O 2.76Å; S366-D379 PolarHBondContact N-OD2 3.15Å; S366-D379 PolarHBondContact OG-OD2 2.58Å; S366-D379 VanDerWaalsContact OG-OD2 3.06Å; S366-W393 VanDerWaalsContact C-CH2 3.46Å; S366-W393 VanDerWaalsContact CA-CZ2 3.41Å; S366-W393 WeakPolarHBondContact O-CZ2 3.45Å
367	Q	95.6	Very high	94.6	Very high	15 Å²	15	38.4 Å²	38.4	7%	0.07	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	130.4	-172.9	-178.8	-175.5	12.2	0	0	109.2	H361 R365 L369 L378	H361-Q367 PolarHBondContact NE2-NE2 3.29Å; R365-Q367 PolarHBondContact O-N 2.88Å; R365-Q367 VanDerWaalsContact O-N 3.09Å; Q367-L369 HydrophobicContact CG-CD2 4.26Å; Q367-L369 HydrophobicContact CG-CG 4.42Å; Q367-L378 HydrophobicContact CB-CB 4.32Å; Q367-L378 PolarHBondContact N-O 3.07Å; Q367-L378 PolarHBondContact O-N 3.25Å
368	T	95.4	Very high	94.6	Very high	52 Å²	52	38.4 Å²	38.4	32%	0.319	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	122.8	175.5	-58.8	0	0	0	0	109.7	R370 T375 Y376 F377	T368-R370 HydrophobicContact CG2-CG 4.43Å; T368-T375 HydrophobicContact CG2-CG2 3.57Å; T368-Y376 CarbonylContact C-O 3.59Å; T368-Y376 WeakPolarHBondContact CA-O 3.46Å; T368-F377 HydrophobicContact CG2-CD1 4.16Å; T368-F377 HydrophobicContact CG2-CE1 3.9Å; T368-F377 HydrophobicContact CG2-CZ 4.45Å
369	L	93.8	Very high	94.5	Very high	29 Å²	29	36.9 Å²	36.9	15%	0.152	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	125.7	174	-59.2	-179.8	0	0	0	109.4	Q367 T375 Y376 L378 L569 L572	Q367-L369 HydrophobicContact CG-CD2 4.26Å; Q367-L369 HydrophobicContact CG-CG 4.42Å; L369-T375 CarbonylContact O-C 3.56Å; L369-T375 WeakPolarHBondContact O-CA 3.32Å; L369-Y376 PolarHBondContact N-O 3.46Å; L369-Y376 PolarHBondContact O-N 3.29Å; L369-L378 HydrophobicContact CD1-CD1 3.65Å; L369-L378 HydrophobicContact CG-CD1 4.18Å; L369-L569 HydrophobicContact CD1-CD2 3.91Å; L369-L572 HydrophobicContact CD1-CB 4.44Å
370	R	92.3	Very high	94.3	Very high	172 Å²	172	33.7 Å²	33.7	65%	0.649	18%	0.178	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	127.2	178.7	-66.5	179.2	176.7	174.3	-1.9	109.9	T368 T375 S401	T368-R370 HydrophobicContact CG2-CG 4.43Å; R370-T375 HydrophobicContact CG-CG2 4.05Å; R370-S401 PolarHBondContact NH2-OG 3.16Å
371	R	89.4	Confident	94.1	Very high	84 Å²	84	33.6 Å²	33.6	32%	0.317	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	79.2	-178.4	-65.8	-70.3	-171.9	-165.6	-0.8	108.8	A373 L374 Y376 D524 L572	R371-A373 PolarHBondContact O-N 3.11Å; R371-A373 VanDerWaalsContact O-N 3.15Å; R371-L374 CarbonylContact C-O 3.54Å; R371-L374 HydrophobicContact CB-CB 4.3Å; R371-L374 PolarHBondContact N-O 3.08Å; R371-L374 WeakPolarHBondContact O-CB 3.5Å; R371-L374 PolarHBondContact O-N 2.93Å; R371-Y376 HydrophobicContact CB-CE2 4.42Å; R371-Y376 HydrophobicContact CG-CD2 4.44Å; R371-Y376 HydrophobicContact CG-CE2 4.25Å; R371-D524 WeakPolarHBondContact CG-OD2 3.43Å; R371-L572 PolarHBondContact NH2-O 2.94Å
372	G	88.1	Confident	93.8	Very high	75 Å²	75	29.6 Å²	29.6	77%	0.773	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	59	-117.8	-175.8	0	0	0	0	0	112	L374	G372-L374 VanDerWaalsContact C-N 3.27Å; G372-L374 PolarHBondContact O-N 3.28Å
373	A	90.5	Very high	93.4	Very high	31 Å²	31	29.2 Å²	29.2	26%	0.256	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-11	177.6	0	0	0	0	0	114.1	R371 A552 H553 V554	R371-A373 PolarHBondContact O-N 3.11Å; R371-A373 VanDerWaalsContact O-N 3.15Å; A373-A552 WeakPolarHBondContact CB-O 3.07Å; A373-H553 WeakPolarHBondContact O-CA 3.48Å; A373-V554 PolarHBondContact O-N 3.4Å
374	L	93.4	Very high	93.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	134.9	178.2	-75.3	157	0	0	0	110.9	R371 G372 Y376 A520 R523 D524 V554 V556	R371-L374 CarbonylContact C-O 3.54Å; R371-L374 HydrophobicContact CB-CB 4.3Å; R371-L374 PolarHBondContact N-O 3.08Å; R371-L374 WeakPolarHBondContact O-CB 3.5Å; R371-L374 PolarHBondContact O-N 2.93Å; G372-L374 VanDerWaalsContact C-N 3.27Å; G372-L374 PolarHBondContact O-N 3.28Å; L374-Y376 HydrophobicContact CB-CE2 4Å; L374-A520 HydrophobicContact CD1-CB 3.85Å; L374-R523 HydrophobicContact CD1-CB 3.68Å; L374-R523 HydrophobicContact CG-CB 4.31Å; L374-D524 HydrophobicContact CD1-CB 3.81Å; L374-V554 WeakPolarHBondContact CA-O 3.45Å; L374-V554 HydrophobicContact CD2-CB 3.63Å; L374-V554 HydrophobicContact CD2-CG1 3.75Å; L374-V556 HydrophobicContact CD2-CG2 4.41Å
375	T	95.6	Very high	93	Very high	9 Å²	9	40.3 Å²	40.3	6%	0.055	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	118.7	168.1	-57.9	0	0	0	0	109.8	T368 L369 R370 F377 V554 H555 V556	T368-T375 HydrophobicContact CG2-CG2 3.57Å; L369-T375 CarbonylContact O-C 3.56Å; L369-T375 WeakPolarHBondContact O-CA 3.32Å; R370-T375 HydrophobicContact CG-CG2 4.05Å; T375-F377 HydrophobicContact CG2-CD2 4.18Å; T375-F377 HydrophobicContact CG2-CE1 4.15Å; T375-F377 HydrophobicContact CG2-CE2 3.49Å; T375-F377 VanDerWaalsContact CG2-CE2 3.49Å; T375-F377 HydrophobicContact CG2-CZ 3.47Å; T375-F377 VanDerWaalsContact CG2-CZ 3.47Å; T375-V554 PolarHBondContact N-O 2.96Å; T375-H555 CarbonylContact O-C 3.58Å; T375-H555 WeakPolarHBondContact O-CA 3.45Å; T375-V556 PolarHBondContact O-N 3.43Å
376	Y	97.3	Very high	92.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	129.4	175.8	-58.9	-88.5	0	0	0	109.9	T368 L369 R371 L374 L516 V556 L572	T368-Y376 CarbonylContact C-O 3.59Å; T368-Y376 WeakPolarHBondContact CA-O 3.46Å; L369-Y376 PolarHBondContact N-O 3.46Å; L369-Y376 PolarHBondContact O-N 3.29Å; R371-Y376 HydrophobicContact CB-CE2 4.42Å; R371-Y376 HydrophobicContact CG-CD2 4.44Å; R371-Y376 HydrophobicContact CG-CE2 4.25Å; L374-Y376 HydrophobicContact CB-CE2 4Å; Y376-L516 HydrophobicContact CE1-CD2 4.02Å; Y376-V556 CarbonylContact C-O 3.51Å; Y376-V556 WeakPolarHBondContact CA-O 3.35Å; Y376-V556 HydrophobicContact CD1-CB 3.74Å; Y376-V556 HydrophobicContact CD1-CG1 4.09Å; Y376-V556 HydrophobicContact CD1-CG2 4.04Å; Y376-V556 HydrophobicContact CE1-CB 4.16Å; Y376-V556 HydrophobicContact CE1-CG1 4.37Å; Y376-V556 HydrophobicContact CE1-CG2 3.99Å; Y376-L572 HydrophobicContact CD1-CD1 3.78Å; Y376-L572 HydrophobicContact CD2-CD1 3.79Å; Y376-L572 HydrophobicContact CE1-CD1 4.01Å; Y376-L572 HydrophobicContact CE2-CD1 4.02Å; Y376-L572 HydrophobicContact CE2-CD2 4.12Å; Y376-L572 HydrophobicContact CG-CD1 3.67Å
377	F	97.8	Very high	92.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	111.2	174.1	-60.4	-92.3	0	0	0	107.1	T368 T375 W393 F394 A397 A398 H555 V556 L557 V558	T368-F377 HydrophobicContact CG2-CD1 4.16Å; T368-F377 HydrophobicContact CG2-CE1 3.9Å; T368-F377 HydrophobicContact CG2-CZ 4.45Å; T375-F377 HydrophobicContact CG2-CD2 4.18Å; T375-F377 HydrophobicContact CG2-CE1 4.15Å; T375-F377 HydrophobicContact CG2-CE2 3.49Å; T375-F377 VanDerWaalsContact CG2-CE2 3.49Å; T375-F377 HydrophobicContact CG2-CZ 3.47Å; T375-F377 VanDerWaalsContact CG2-CZ 3.47Å; F377-W393 HydrophobicContact CB-CH2 3.63Å; F377-W393 HydrophobicContact CB-CZ2 4.42Å; F377-W393 HydrophobicContact CB-CZ3 4.03Å; F377-W393 HydrophobicContact CD1-CH2 4.11Å; F377-W393 HydrophobicContact CD1-CZ2 4.07Å; F377-W393 HydrophobicContact CG-CH2 4.39Å; F377-F394 HydrophobicContact CB-CD2 3.83Å; F377-F394 HydrophobicContact CB-CE2 4.22Å; F377-F394 HydrophobicContact CD1-CD2 4.12Å; F377-F394 AromaticContact CD2-CD2 3.92Å; F377-F394 HydrophobicContact CD2-CD2 3.92Å; F377-F394 AromaticContact CD2-CE2 3.59Å; F377-F394 HydrophobicContact CD2-CE2 3.59Å; F377-F394 HydrophobicContact CE2-CE2 4.03Å; F377-F394 AromaticContact CG-CD2 3.69Å; F377-F394 HydrophobicContact CG-CD2 3.69Å; F377-F394 AromaticContact CG-CE2 3.87Å; F377-F394 HydrophobicContact CG-CE2 3.87Å; F377-A397 HydrophobicContact CD1-CB 4.04Å; F377-A397 HydrophobicContact CE1-CB 3.63Å; F377-A398 HydrophobicContact CZ-CB 4.23Å; F377-H555 HydrophobicContact CE2-CB 3.9Å; F377-H555 AromaticContact CE2-CG 3.83Å; F377-H555 AromaticContact CE2-ND1 3.95Å; F377-V556 PolarHBondContact N-O 3.41Å; F377-L557 HydrophobicContact CB-CD1 3.91Å; F377-L557 CarbonylContact O-C 3.6Å; F377-L557 WeakPolarHBondContact O-CA 3.23Å; F377-V558 PolarHBondContact O-N 3.05Å
378	L	97.6	Very high	92.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	118.7	-171.1	-51.7	178	0	0	0	110.1	S366 Q367 L369 V558 V565 V568 L569	S366-L378 PolarHBondContact N-O 2.76Å; Q367-L378 HydrophobicContact CB-CB 4.32Å; Q367-L378 PolarHBondContact N-O 3.07Å; Q367-L378 PolarHBondContact O-N 3.25Å; L369-L378 HydrophobicContact CD1-CD1 3.65Å; L369-L378 HydrophobicContact CG-CD1 4.18Å; L378-V558 HydrophobicContact CD2-CB 3.56Å; L378-V558 HydrophobicContact CD2-CG1 4.33Å; L378-V558 HydrophobicContact CD2-CG2 3.41Å; L378-V558 VanDerWaalsContact CD2-CG2 3.41Å; L378-V565 HydrophobicContact CB-CG1 4.07Å; L378-V568 HydrophobicContact CD2-CG1 3.9Å; L378-L569 HydrophobicContact CD1-CD1 4.49Å; L378-L569 HydrophobicContact CD1-CD2 3.41Å; L378-L569 VanDerWaalsContact CD1-CD2 3.41Å; L378-L569 HydrophobicContact CD1-CG 3.82Å
379	D	96.5	Very high	92.9	Very high	7 Å²	7	40.3 Å²	40.3	4%	0.037	21%	0.206	C	C	.	.			trans	-146.4	124.1	174.9	-168.6	-85.3	0	0	0	112.2	G364 S366 A381 C390 W393 V558 T559	G364-D379 WeakPolarHBondContact O-CA 3.28Å; S366-D379 PolarHBondContact N-OD2 3.15Å; S366-D379 PolarHBondContact OG-OD2 2.58Å; S366-D379 VanDerWaalsContact OG-OD2 3.06Å; D379-A381 PolarHBondContact O-N 2.94Å; D379-A381 WeakPolarHBondContact OD1-CB 3.26Å; D379-A381 PolarHBondContact OD1-N 3.05Å; D379-C390 HydrophobicContact CB-CB 4.49Å; D379-W393 HydrophobicContact CB-CE3 4.35Å; D379-W393 HydrophobicContact CB-CZ3 3.87Å; D379-V558 PolarHBondContact N-O 3.19Å; D379-T559 VanDerWaalsContact O-CA 3.29Å; D379-T559 WeakPolarHBondContact O-CA 3.24Å; D379-T559 WeakPolarHBondContact O-CB 3.21Å; D379-T559 PolarHBondContact O-OG1 2.7Å; D379-T559 VanDerWaalsContact O-OG1 3.14Å
380	G	93.4	Very high	93	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.199	C	C	.	.			trans	-78.2	31.7	-179.7	0	0	0	0	0	115.4	G364 H382	G364-G380 PolarHBondContact O-N 3.24Å; G380-H382 PolarHBondContact O-ND1 3.2Å
381	A	93	Very high	93.3	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.008	17%	0.172	C	C	.	.			trans	-60.1	137	175	0	0	0	0	0	111.5	D379 S386 M387 C390 G560	D379-A381 PolarHBondContact O-N 2.94Å; D379-A381 WeakPolarHBondContact OD1-CB 3.26Å; D379-A381 PolarHBondContact OD1-N 3.05Å; A381-S386 WeakPolarHBondContact CB-O 3.21Å; A381-M387 HydrophobicContact CB-CG 4.38Å; A381-M387 HydrophobicContact CB-SD 3.57Å; A381-M387 VanDerWaalsContact CB-SD 3.57Å; A381-C390 HydrophobicContact CB-CB 3.8Å; A381-G560 CarbonylContact O-C 3.59Å; A381-G560 WeakPolarHBondContact O-CA 3.26Å; A381-G560 PolarHBondContact O-N 2.84Å; A381-G560 VanDerWaalsContact O-N 3.07Å
382	H	88.3	Confident	93.6	Very high	30 Å²	30	31.7 Å²	31.7	14%	0.139	18%	0.177	C	C	.	.			trans	-155.4	20.1	-174.1	59.3	-90.1	0	0	0	112.9	K109 G380 S386 R421 G560	K109-H382 PolarHBondContact NZ-NE2 3.43Å; G380-H382 PolarHBondContact O-ND1 3.2Å; H382-S386 PolarHBondContact N-OG 2.98Å; H382-R421 WeakPolarHBondContact O-CD 3.48Å; H382-G560 WeakPolarHBondContact CB-O 3.36Å
383	T	87.7	Confident	94	Very high	23 Å²	23	28.5 Å²	28.5	14%	0.141	14%	0.142	C	C	.	.	S	Bend	trans	-138.6	156.9	174.7	62.3	0	0	0	0	108.4	K109 R385 S386 M387	K109-T383 VanDerWaalsContact CE-CG2 3.42Å; K109-T383 VanDerWaalsContact CE-OG1 3.3Å; K109-T383 WeakPolarHBondContact CE-OG1 3.23Å; K109-T383 VanDerWaalsContact NZ-CG2 3.25Å; T383-R385 VanDerWaalsContact C-N 3.33Å; T383-R385 PolarHBondContact O-N 3.04Å; T383-S386 PolarHBondContact N-OG 3.07Å; T383-S386 PolarHBondContact O-N 3.03Å; T383-S386 VanDerWaalsContact O-N 3.12Å; T383-S386 PolarHBondContact O-OG 3.05Å; T383-S386 WeakPolarHBondContact OG1-CB 3.21Å; T383-S386 PolarHBondContact OG1-N 3.09Å; T383-S386 PolarHBondContact OG1-OG 3.01Å; T383-M387 WeakPolarHBondContact O-CB 3.43Å; T383-M387 VanDerWaalsContact O-CG 3.27Å; T383-M387 WeakPolarHBondContact O-CG 3.41Å; T383-M387 PolarHBondContact O-N 3.14Å
384	H	88.8	Confident	94.4	Very high	109 Å²	109	27 Å²	27	51%	0.505	13%	0.129	S	C	.	.	H	α-helix	trans	-48.1	-53.3	179	-173.8	90.2	0	0	0	112.7	S386 M387 Q388	H384-S386 PolarHBondContact O-N 3.03Å; H384-M387 PolarHBondContact O-N 3.07Å; H384-Q388 PolarHBondContact NE2-NE2 3.45Å; H384-Q388 VanDerWaalsContact NE2-NE2 3.17Å; H384-Q388 WeakPolarHBondContact O-CG 3.46Å; H384-Q388 PolarHBondContact O-N 3.33Å
385	R	88.9	Confident	94.5	Very high	145 Å²	145	30.7 Å²	30.7	55%	0.547	15%	0.146	S	C	.	.	H	α-helix	trans	-64.6	-40.1	-179.8	-170.5	178.2	-177.8	-166.7	-2.5	113.5	S227 L228 T383 M387 Q388 A389	S227-R385 PolarHBondContact OG-NH1 2.92Å; L228-R385 PolarHBondContact O-NH1 2.67Å; T383-R385 VanDerWaalsContact C-N 3.33Å; T383-R385 PolarHBondContact O-N 3.04Å; R385-M387 VanDerWaalsContact C-N 3.34Å; R385-Q388 PolarHBondContact O-N 2.75Å; R385-A389 PolarHBondContact O-N 3.2Å; R385-A389 VanDerWaalsContact O-N 3.15Å
386	S	92.6	Very high	94.4	Very high	20 Å²	20	34.3 Å²	34.3	14%	0.14	16%	0.163	C	C	.	.	H	α-helix	trans	-69.7	-34.1	176.9	63.2	0	0	0	0	111.9	A381 H382 T383 H384 A389 C390	A381-S386 WeakPolarHBondContact CB-O 3.21Å; H382-S386 PolarHBondContact N-OG 2.98Å; T383-S386 PolarHBondContact N-OG 3.07Å; T383-S386 PolarHBondContact O-N 3.03Å; T383-S386 VanDerWaalsContact O-N 3.12Å; T383-S386 PolarHBondContact O-OG 3.05Å; T383-S386 WeakPolarHBondContact OG1-CB 3.21Å; T383-S386 PolarHBondContact OG1-N 3.09Å; T383-S386 PolarHBondContact OG1-OG 3.01Å; H384-S386 PolarHBondContact O-N 3.03Å; S386-A389 PolarHBondContact O-N 2.95Å; S386-C390 VanDerWaalsContact O-CB 3.3Å; S386-C390 WeakPolarHBondContact O-CB 3.43Å; S386-C390 PolarHBondContact O-N 3.28Å
387	M	94.9	Very high	94.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-65.7	-41.3	175.9	-71.7	-56.5	-62.2	0	0	110.9	A381 T383 H384 R385 A389 C390 V391 F415 M426 L429 L430 T559	A381-M387 HydrophobicContact CB-CG 4.38Å; A381-M387 HydrophobicContact CB-SD 3.57Å; A381-M387 VanDerWaalsContact CB-SD 3.57Å; T383-M387 WeakPolarHBondContact O-CB 3.43Å; T383-M387 VanDerWaalsContact O-CG 3.27Å; T383-M387 WeakPolarHBondContact O-CG 3.41Å; T383-M387 PolarHBondContact O-N 3.14Å; H384-M387 PolarHBondContact O-N 3.07Å; R385-M387 VanDerWaalsContact C-N 3.34Å; M387-A389 PolarHBondContact O-N 2.79Å; M387-C390 WeakPolarHBondContact O-CB 3.42Å; M387-C390 PolarHBondContact O-N 3.39Å; M387-V391 VanDerWaalsContact O-CG2 3.26Å; M387-V391 WeakPolarHBondContact O-CG2 3.39Å; M387-V391 PolarHBondContact O-N 3.39Å; M387-F415 HydrophobicContact CE-CE2 4.31Å; M387-M426 HydrophobicContact CG-CB 4.14Å; M387-M426 HydrophobicContact CG-CG 3.94Å; M387-M426 HydrophobicContact CG-SD 4.02Å; M387-L429 HydrophobicContact CB-CD1 3.6Å; M387-L430 HydrophobicContact CE-CD1 3.64Å; M387-L430 HydrophobicContact CE-CD2 3.79Å; M387-L430 HydrophobicContact CE-CG 3.7Å; M387-T559 HydrophobicContact CE-CG2 3.93Å
388	Q	95.3	Very high	94	Very high	88 Å²	88	34.8 Å²	34.8	41%	0.411	17%	0.166	S	C	.	.	H	α-helix	trans	-59.2	-45.8	172.7	-70.8	171.9	-41.7	0	0	112	H384 R385 C390 V391 Q392 L429	H384-Q388 PolarHBondContact NE2-NE2 3.45Å; H384-Q388 VanDerWaalsContact NE2-NE2 3.17Å; H384-Q388 WeakPolarHBondContact O-CG 3.46Å; H384-Q388 PolarHBondContact O-N 3.33Å; R385-Q388 PolarHBondContact O-N 2.75Å; Q388-C390 VanDerWaalsContact C-N 3.32Å; Q388-C390 PolarHBondContact O-N 3.15Å; Q388-V391 PolarHBondContact O-N 2.67Å; Q388-Q392 PolarHBondContact O-N 2.72Å; Q388-L429 HydrophobicContact CG-CD1 4.18Å; Q388-L429 HydrophobicContact CG-CD2 4.11Å
389	A	95.6	Very high	93.7	Very high	23 Å²	23	36.9 Å²	36.9	19%	0.19	18%	0.184	C	C	.	.	H	α-helix	trans	-63.4	-38.4	176.8	0	0	0	0	0	112.5	R385 S386 M387 W393	R385-A389 PolarHBondContact O-N 3.2Å; R385-A389 VanDerWaalsContact O-N 3.15Å; S386-A389 PolarHBondContact O-N 2.95Å; M387-A389 PolarHBondContact O-N 2.79Å; A389-W393 WeakPolarHBondContact O-CB 3.16Å; A389-W393 PolarHBondContact O-N 3.01Å
390	C	97.1	Very high	93.3	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.007	21%	0.213	C	C	.	.	H	α-helix	trans	-64	-46.1	175.1	176.6	0	0	0	0	111.6	D379 A381 S386 M387 Q388 W393 F394	D379-C390 HydrophobicContact CB-CB 4.49Å; A381-C390 HydrophobicContact CB-CB 3.8Å; S386-C390 VanDerWaalsContact O-CB 3.3Å; S386-C390 WeakPolarHBondContact O-CB 3.43Å; S386-C390 PolarHBondContact O-N 3.28Å; M387-C390 WeakPolarHBondContact O-CB 3.42Å; M387-C390 PolarHBondContact O-N 3.39Å; Q388-C390 VanDerWaalsContact C-N 3.32Å; Q388-C390 PolarHBondContact O-N 3.15Å; C390-W393 PolarHBondContact O-N 3.42Å; C390-F394 VanDerWaalsContact O-CB 3.31Å; C390-F394 WeakPolarHBondContact O-CB 3.46Å; C390-F394 PolarHBondContact O-N 2.9Å
391	V	97.1	Very high	92.9	Very high	14 Å²	14	44.1 Å²	44.1	9%	0.085	22%	0.22	C	C	.	.	H	α-helix	trans	-59.1	-49.8	176.8	166.2	0	0	0	0	111	M387 Q388 W393 F394 Q395 L429 L430	M387-V391 VanDerWaalsContact O-CG2 3.26Å; M387-V391 WeakPolarHBondContact O-CG2 3.39Å; M387-V391 PolarHBondContact O-N 3.39Å; Q388-V391 PolarHBondContact O-N 2.67Å; V391-W393 PolarHBondContact O-N 2.81Å; V391-F394 PolarHBondContact O-N 3.25Å; V391-Q395 WeakPolarHBondContact O-CG 3.31Å; V391-Q395 PolarHBondContact O-N 2.98Å; V391-L429 WeakPolarHBondContact CG2-O 3.32Å; V391-L430 HydrophobicContact CG2-CD2 3.83Å
392	Q	96.7	Very high	92.4	Very high	90 Å²	90	46.7 Å²	46.7	42%	0.421	23%	0.232	S	C	.	.	H	α-helix	trans	-58.4	-51.3	178.7	-178.6	-177.4	-3	0	0	111	Q388 F394 Q395 E396	Q388-Q392 PolarHBondContact O-N 2.72Å; Q392-F394 PolarHBondContact O-N 3.14Å; Q392-Q395 PolarHBondContact O-N 2.58Å; Q392-E396 VanDerWaalsContact CG-OE1 3.3Å; Q392-E396 WeakPolarHBondContact CG-OE1 3.28Å; Q392-E396 PolarHBondContact NE2-OE1 2.92Å; Q392-E396 WeakPolarHBondContact O-CG 3.45Å; Q392-E396 PolarHBondContact O-N 3.17Å; Q392-E396 VanDerWaalsContact O-N 3.12Å
393	W	97.1	Very high	91.8	Very high	8 Å²	8	50.5 Å²	50.5	3%	0.03	26%	0.261	C	S	.	.	H	α-helix	trans	-59.4	-45	178.2	161.8	68.4	0	0	0	112.2	S366 F377 D379 A389 C390 V391 Q395 E396 A397 L557	S366-W393 VanDerWaalsContact C-CH2 3.46Å; S366-W393 VanDerWaalsContact CA-CZ2 3.41Å; S366-W393 WeakPolarHBondContact O-CZ2 3.45Å; F377-W393 HydrophobicContact CB-CH2 3.63Å; F377-W393 HydrophobicContact CB-CZ2 4.42Å; F377-W393 HydrophobicContact CB-CZ3 4.03Å; F377-W393 HydrophobicContact CD1-CH2 4.11Å; F377-W393 HydrophobicContact CD1-CZ2 4.07Å; F377-W393 HydrophobicContact CG-CH2 4.39Å; D379-W393 HydrophobicContact CB-CE3 4.35Å; D379-W393 HydrophobicContact CB-CZ3 3.87Å; A389-W393 WeakPolarHBondContact O-CB 3.16Å; A389-W393 PolarHBondContact O-N 3.01Å; C390-W393 PolarHBondContact O-N 3.42Å; V391-W393 PolarHBondContact O-N 2.81Å; W393-Q395 PolarHBondContact O-N 3.34Å; W393-E396 PolarHBondContact O-N 3.13Å; W393-A397 VanDerWaalsContact O-CB 3.27Å; W393-A397 WeakPolarHBondContact O-CB 3.19Å; W393-A397 PolarHBondContact O-N 2.95Å; W393-L557 HydrophobicContact CZ3-CD1 4.19Å
394	F	97.4	Very high	90.9	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.2	-44.8	179.7	171.7	-103.7	0	0	0	111.5	F377 C390 V391 Q392 E396 A397 A398 C433 F435 L557	F377-F394 HydrophobicContact CB-CD2 3.83Å; F377-F394 HydrophobicContact CB-CE2 4.22Å; F377-F394 HydrophobicContact CD1-CD2 4.12Å; F377-F394 AromaticContact CD2-CD2 3.92Å; F377-F394 HydrophobicContact CD2-CD2 3.92Å; F377-F394 AromaticContact CD2-CE2 3.59Å; F377-F394 HydrophobicContact CD2-CE2 3.59Å; F377-F394 HydrophobicContact CE2-CE2 4.03Å; F377-F394 AromaticContact CG-CD2 3.69Å; F377-F394 HydrophobicContact CG-CD2 3.69Å; F377-F394 AromaticContact CG-CE2 3.87Å; F377-F394 HydrophobicContact CG-CE2 3.87Å; C390-F394 VanDerWaalsContact O-CB 3.31Å; C390-F394 WeakPolarHBondContact O-CB 3.46Å; C390-F394 PolarHBondContact O-N 2.9Å; V391-F394 PolarHBondContact O-N 3.25Å; Q392-F394 PolarHBondContact O-N 3.14Å; F394-E396 VanDerWaalsContact C-N 3.35Å; F394-E396 PolarHBondContact O-N 3.24Å; F394-A397 PolarHBondContact O-N 3.36Å; F394-A398 HydrophobicContact CD2-CB 4.5Å; F394-A398 HydrophobicContact CE2-CB 4.2Å; F394-A398 HydrophobicContact CZ-CB 4.21Å; F394-A398 WeakPolarHBondContact O-CB 3.12Å; F394-A398 PolarHBondContact O-N 3.2Å; F394-C433 HydrophobicContact CD1-CB 3.97Å; F394-C433 HydrophobicContact CE1-CB 3.84Å; F394-F435 HydrophobicContact CD1-CZ 4.41Å; F394-F435 AromaticContact CE1-CE1 3.87Å; F394-F435 HydrophobicContact CE1-CE1 3.87Å; F394-F435 AromaticContact CE1-CZ 3.93Å; F394-F435 HydrophobicContact CE1-CZ 3.93Å; F394-F435 AromaticContact CZ-CE1 3.81Å; F394-F435 HydrophobicContact CZ-CE1 3.81Å; F394-F435 HydrophobicContact CZ-CZ 4.27Å; F394-L557 HydrophobicContact CB-CD1 4.23Å; F394-L557 HydrophobicContact CB-CD2 4.38Å; F394-L557 HydrophobicContact CD1-CD2 4.38Å; F394-L557 HydrophobicContact CD2-CB 3.98Å; F394-L557 HydrophobicContact CD2-CD1 3.87Å; F394-L557 HydrophobicContact CD2-CD2 4.38Å; F394-L557 HydrophobicContact CD2-CG 4.28Å; F394-L557 HydrophobicContact CE2-CB 3.85Å; F394-L557 HydrophobicContact CG-CD1 4.18Å; F394-L557 HydrophobicContact CG-CD2 4.11Å; F394-L557 HydrophobicContact CG-CG 4.5Å; F394-L557 HydrophobicContact CZ-CB 4.29Å
395	Q	95.5	Very high	90	Very high	77 Å²	77	49.4 Å²	49.4	36%	0.36	28%	0.281	S	S	.	.	H	α-helix	trans	-60.3	-45.3	178.3	-73.9	176.5	-33.8	0	0	111.5	V391 Q392 W393 A399 P432	V391-Q395 WeakPolarHBondContact O-CG 3.31Å; V391-Q395 PolarHBondContact O-N 2.98Å; Q392-Q395 PolarHBondContact O-N 2.58Å; W393-Q395 PolarHBondContact O-N 3.34Å; Q395-A399 VanDerWaalsContact O-CB 3.28Å; Q395-A399 WeakPolarHBondContact O-CB 3.33Å; Q395-A399 PolarHBondContact O-N 2.74Å; Q395-A399 VanDerWaalsContact O-N 3.07Å; Q395-P432 PolarHBondContact NE2-O 2.93Å; Q395-P432 VanDerWaalsContact NE2-O 3.13Å
396	E	94.3	Very high	89.3	Confident	84 Å²	84	48 Å²	48	39%	0.393	29%	0.293	S	S	.	.	H	α-helix	trans	-63.1	-51.5	177	-69	168	-170.8	0	0	111.5	Q392 W393 F394 A399 Q400	Q392-E396 VanDerWaalsContact CG-OE1 3.3Å; Q392-E396 WeakPolarHBondContact CG-OE1 3.28Å; Q392-E396 PolarHBondContact NE2-OE1 2.92Å; Q392-E396 WeakPolarHBondContact O-CG 3.45Å; Q392-E396 PolarHBondContact O-N 3.17Å; Q392-E396 VanDerWaalsContact O-N 3.12Å; W393-E396 PolarHBondContact O-N 3.13Å; F394-E396 VanDerWaalsContact C-N 3.35Å; F394-E396 PolarHBondContact O-N 3.24Å; E396-A399 PolarHBondContact O-N 3.2Å; E396-Q400 VanDerWaalsContact O-CG 3.31Å; E396-Q400 WeakPolarHBondContact O-CG 3.45Å; E396-Q400 PolarHBondContact O-N 3.12Å
397	A	93.6	Very high	88.9	Confident	10 Å²	10	49.5 Å²	49.5	8%	0.083	31%	0.313	C	S	.	.	H	α-helix	trans	-69.6	-35.5	-175.8	0	0	0	0	0	112.8	F377 W393 F394 S401	F377-A397 HydrophobicContact CD1-CB 4.04Å; F377-A397 HydrophobicContact CE1-CB 3.63Å; W393-A397 VanDerWaalsContact O-CB 3.27Å; W393-A397 WeakPolarHBondContact O-CB 3.19Å; W393-A397 PolarHBondContact O-N 2.95Å; F394-A397 PolarHBondContact O-N 3.36Å; A397-S401 WeakPolarHBondContact O-CB 3.47Å; A397-S401 PolarHBondContact O-N 3.36Å; A397-S401 PolarHBondContact O-OG 3.31Å
398	A	92.6	Very high	88.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-68.3	-42.1	174.5	0	0	0	0	0	111.3	F377 F394 S401 Q402	F377-A398 HydrophobicContact CZ-CB 4.23Å; F394-A398 HydrophobicContact CD2-CB 4.5Å; F394-A398 HydrophobicContact CE2-CB 4.2Å; F394-A398 HydrophobicContact CZ-CB 4.21Å; F394-A398 WeakPolarHBondContact O-CB 3.12Å; F394-A398 PolarHBondContact O-N 3.2Å; A398-S401 PolarHBondContact O-N 3.37Å; A398-Q402 WeakPolarHBondContact O-CB 3.39Å; A398-Q402 VanDerWaalsContact O-CG 3.3Å; A398-Q402 WeakPolarHBondContact O-CG 3.4Å; A398-Q402 PolarHBondContact O-N 3.37Å
399	A	91.1	Very high	88.5	Confident	44 Å²	44	50 Å²	50	36%	0.364	33%	0.328	S	S	.	.	H	α-helix	trans	-63.8	-42.1	176.8	0	0	0	0	0	112.1	Q395 E396 S401 Q402 S403	Q395-A399 VanDerWaalsContact O-CB 3.28Å; Q395-A399 WeakPolarHBondContact O-CB 3.33Å; Q395-A399 PolarHBondContact O-N 2.74Å; Q395-A399 VanDerWaalsContact O-N 3.07Å; E396-A399 PolarHBondContact O-N 3.2Å; A399-S401 VanDerWaalsContact C-N 3.33Å; A399-S401 PolarHBondContact O-N 2.93Å; A399-Q402 PolarHBondContact O-N 3.23Å; A399-S403 PolarHBondContact O-N 3.41Å; A399-S403 PolarHBondContact O-OG 3.11Å
400	Q	88.3	Confident	88.4	Confident	139 Å²	139	49.5 Å²	49.5	65%	0.65	32%	0.323	S	S	*	.	H	α-helix	trans	-61.5	-41.2	174	-71.5	171.1	18	0	0	112	E396 Q402 S403	E396-Q400 VanDerWaalsContact O-CG 3.31Å; E396-Q400 WeakPolarHBondContact O-CG 3.45Å; E396-Q400 PolarHBondContact O-N 3.12Å; Q400-Q402 VanDerWaalsContact C-N 3.33Å; Q400-S403 PolarHBondContact O-N 3.15Å
401	S	84.4	Confident	88.3	Confident	20 Å²	20	51.6 Å²	51.6	14%	0.14	33%	0.331	C	S	.	.	H	α-helix	trans	-69.9	-31.1	177.6	-57.4	0	0	0	0	112.2	R370 A397 A398 A399	R370-S401 PolarHBondContact NH2-OG 3.16Å; A397-S401 WeakPolarHBondContact O-CB 3.47Å; A397-S401 PolarHBondContact O-N 3.36Å; A397-S401 PolarHBondContact O-OG 3.31Å; A398-S401 PolarHBondContact O-N 3.37Å; A399-S401 VanDerWaalsContact C-N 3.33Å; A399-S401 PolarHBondContact O-N 2.93Å
402	Q	82.9	Confident	88.3	Confident	56 Å²	56	50.9 Å²	50.9	26%	0.262	33%	0.327	S	S	.	.	H	α-helix	trans	-73.3	-31.9	175.1	-76.2	178.1	-22.4	0	0	113.4	A398 A399 Q400 G404 A405 V409	A398-Q402 WeakPolarHBondContact O-CB 3.39Å; A398-Q402 VanDerWaalsContact O-CG 3.3Å; A398-Q402 WeakPolarHBondContact O-CG 3.4Å; A398-Q402 PolarHBondContact O-N 3.37Å; A399-Q402 PolarHBondContact O-N 3.23Å; Q400-Q402 VanDerWaalsContact C-N 3.33Å; Q402-G404 PolarHBondContact O-N 3.04Å; Q402-G404 VanDerWaalsContact O-N 3.11Å; Q402-A405 PolarHBondContact O-N 2.8Å; Q402-V409 HydrophobicContact CG-CB 4.46Å; Q402-V409 HydrophobicContact CG-CG1 4.39Å; Q402-V409 HydrophobicContact CG-CG2 3.98Å
403	S	75.7	Confident	88.4	Confident	109 Å²	109	46.6 Å²	46.6	76%	0.762	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-17.9	-175.2	-61.1	0	0	0	0	114	A399 Q400	A399-S403 PolarHBondContact O-N 3.41Å; A399-S403 PolarHBondContact O-OG 3.11Å; Q400-S403 PolarHBondContact O-N 3.15Å
404	G	68.6	Low	88.4	Confident	78 Å²	78	46.2 Å²	46.2	80%	0.804	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	3.2	175	0	0	0	0	0	114.7	Q402	Q402-G404 PolarHBondContact O-N 3.04Å; Q402-G404 VanDerWaalsContact O-N 3.11Å
405	A	69.6	Low	88.4	Confident	32 Å²	32	46.2 Å²	46.2	26%	0.264	31%	0.305	S	S	.	.			trans	-107.3	138.4	-173.6	0	0	0	0	0	111.3	Q402 H553	Q402-A405 PolarHBondContact O-N 2.8Å; A405-H553 WeakPolarHBondContact CB-NE2 3.19Å
406	S	75.9	Confident	88.2	Confident	114 Å²	114	42.9 Å²	42.9	80%	0.797	29%	0.29	S	S	*	.			trans	-105	126.7	172.8	-178.4	0	0	0	0	109.7
407	G	83.4	Confident	87.8	Confident	53 Å²	53	39.5 Å²	39.5	55%	0.546	28%	0.276	S	S	.	.	S	Bend	trans	115	178.4	176.1	0	0	0	0	0	114.6
408	A	88.6	Confident	86.9	Confident	68 Å²	68	40.9 Å²	40.9	56%	0.562	28%	0.284	S	S	*	.			trans	-69.6	133.3	-176.6	0	0	0	0	0	111.7	A552 H553	A408-A552 PolarHBondContact O-N 3.42Å; A408-H553 PolarHBondContact O-N 2.85Å
409	V	92.3	Very high	85.8	Confident	29 Å²	29	44.4 Å²	44.4	18%	0.176	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	124.2	175.5	-176.1	0	0	0	0	109.9	Q402 H553 H555	Q402-V409 HydrophobicContact CG-CB 4.46Å; Q402-V409 HydrophobicContact CG-CG1 4.39Å; Q402-V409 HydrophobicContact CG-CG2 3.98Å; V409-H553 WeakPolarHBondContact CA-O 3.41Å; V409-H553 HydrophobicContact CG1-CB 4.34Å; V409-H553 HydrophobicContact CG2-CB 4.02Å; V409-H555 HydrophobicContact CG1-CB 4.39Å
410	V	94.3	Very high	84.7	Confident	14 Å²	14	52 Å²	52	9%	0.085	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	131.1	173.4	171.6	0	0	0	0	109.5	V412 D436 L437 L548 A551 H553 V554 H555	V410-V412 HydrophobicContact CG1-CG2 4.29Å; V410-D436 WeakPolarHBondContact CA-OD2 3.33Å; V410-D436 HydrophobicContact CG1-CB 4.17Å; V410-L437 HydrophobicContact CG1-CD1 4.42Å; V410-L548 HydrophobicContact CG1-CD2 3.88Å; V410-A551 HydrophobicContact CB-CB 3.96Å; V410-A551 HydrophobicContact CG2-CB 3.58Å; V410-H553 PolarHBondContact N-O 3.24Å; V410-V554 WeakPolarHBondContact O-CA 3.34Å; V410-H555 PolarHBondContact O-N 3.18Å
411	R	95.8	Very high	84.2	Confident	44 Å²	44	49.5 Å²	49.5	17%	0.166	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	123.9	-180	-66.3	179.2	179.6	-179.2	2.1	110.3	C433 F435 D436 L437 H555	R411-C433 PolarHBondContact NH1-O 2.77Å; R411-F435 HydrophobicContact CB-CD1 4Å; R411-D436 PolarHBondContact N-OD2 2.55Å; R411-D436 PolarHBondContact O-N 3.08Å; R411-L437 PolarHBondContact O-N 3.23Å; R411-H555 CarbonylContact C-O 3.56Å; R411-H555 WeakPolarHBondContact CA-O 3.48Å; R411-H555 HydrophobicContact CG-CB 4.31Å
412	V	97.3	Very high	84.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.5	179.6	-171.5	0	0	0	0	109.7	V410 L437 V439 I519 L548 V554 H555 V556 L557	V410-V412 HydrophobicContact CG1-CG2 4.29Å; V412-L437 CarbonylContact C-O 3.57Å; V412-L437 WeakPolarHBondContact CA-O 3.27Å; V412-L437 HydrophobicContact CG1-CB 4.24Å; V412-L437 HydrophobicContact CG2-CB 4.28Å; V412-L437 HydrophobicContact CG2-CD1 4.35Å; V412-V439 HydrophobicContact CG1-CG2 3.8Å; V412-I519 HydrophobicContact CG1-CD1 3.89Å; V412-I519 HydrophobicContact CG1-CG1 4.05Å; V412-I519 HydrophobicContact CG2-CG2 4.41Å; V412-L548 HydrophobicContact CG2-CD2 3.75Å; V412-V554 HydrophobicContact CG2-CG1 3.99Å; V412-H555 PolarHBondContact N-O 2.86Å; V412-V556 HydrophobicContact CB-CG1 4.5Å; V412-V556 HydrophobicContact CB-CG2 4.46Å; V412-V556 CarbonylContact O-C 3.56Å; V412-V556 WeakPolarHBondContact O-CA 3.28Å; V412-L557 PolarHBondContact O-N 2.83Å
413	L	97.9	Very high	84.6	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	129.6	166.1	173.9	64.1	0	0	0	108.9	F415 L427 L430 F435 L437 A438 V439 W476 L557 T559	L413-F415 HydrophobicContact CD1-CB 4.09Å; L413-F415 HydrophobicContact CD2-CB 4.13Å; L413-F415 HydrophobicContact CG-CB 3.93Å; L413-L427 HydrophobicContact CD2-CD2 4.2Å; L413-L430 HydrophobicContact CD1-CD1 3.91Å; L413-L430 HydrophobicContact CD2-CD1 3.91Å; L413-F435 HydrophobicContact CB-CB 4.33Å; L413-F435 HydrophobicContact CB-CD1 3.79Å; L413-F435 HydrophobicContact CB-CD2 3.82Å; L413-F435 HydrophobicContact CB-CE1 4.02Å; L413-F435 HydrophobicContact CB-CE2 4.03Å; L413-F435 HydrophobicContact CB-CG 3.7Å; L413-F435 HydrophobicContact CB-CZ 4.15Å; L413-F435 HydrophobicContact CD1-CE2 4.15Å; L413-F435 HydrophobicContact CD1-CZ 4.13Å; L413-F435 HydrophobicContact CD2-CD2 4.31Å; L413-F435 HydrophobicContact CD2-CE2 4.36Å; L413-F435 HydrophobicContact CG-CE2 4.41Å; L413-L437 PolarHBondContact N-O 3.2Å; L413-A438 HydrophobicContact CB-CB 4.43Å; L413-A438 HydrophobicContact CD2-CB 4.48Å; L413-V439 WeakPolarHBondContact O-CA 3.38Å; L413-V439 WeakPolarHBondContact O-CB 3.48Å; L413-V439 PolarHBondContact O-N 3.17Å; L413-W476 HydrophobicContact CD2-CE3 4.29Å; L413-W476 HydrophobicContact CD2-CH2 4.15Å; L413-W476 HydrophobicContact CD2-CZ3 3.94Å; L413-L557 HydrophobicContact CD1-CD2 4.35Å; L413-L557 HydrophobicContact CD1-CG 4.49Å; L413-T559 HydrophobicContact CD1-CG2 4.1Å
414	L	97.6	Very high	85.4	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	111.4	165	-178.9	61.3	0	0	0	108.3	V439 A515 L516 I519 V556 L557 V558 T559 L564 V568	L414-V439 WeakPolarHBondContact CA-O 3.5Å; L414-V439 HydrophobicContact CD1-CB 3.98Å; L414-V439 HydrophobicContact CD1-CG1 3.68Å; L414-A515 HydrophobicContact CD1-CB 4.02Å; L414-L516 HydrophobicContact CD2-CD2 4.16Å; L414-I519 HydrophobicContact CB-CD1 4.47Å; L414-V556 HydrophobicContact CB-CG1 4.37Å; L414-L557 PolarHBondContact N-O 3.45Å; L414-V558 HydrophobicContact CB-CG2 4.17Å; L414-V558 HydrophobicContact CD2-CG1 4.26Å; L414-V558 HydrophobicContact CD2-CG2 4.06Å; L414-V558 HydrophobicContact CG-CG1 4.48Å; L414-V558 WeakPolarHBondContact O-CA 3.37Å; L414-T559 PolarHBondContact O-N 2.76Å; L414-L564 HydrophobicContact CG-CD2 4.36Å; L414-V568 HydrophobicContact CD2-CG2 3.84Å
415	F	96.3	Very high	86.5	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	141.1	-168.9	-177.4	-90.1	0	0	0	113.1	M387 L413 A417 A423 M426 L427 L430 V439 F440 T559 G560	M387-F415 HydrophobicContact CE-CE2 4.31Å; L413-F415 HydrophobicContact CD1-CB 4.09Å; L413-F415 HydrophobicContact CD2-CB 4.13Å; L413-F415 HydrophobicContact CG-CB 3.93Å; F415-A417 HydrophobicContact CE1-CB 3.98Å; F415-A417 HydrophobicContact CZ-CB 4.03Å; F415-A423 HydrophobicContact CE1-CB 4.41Å; F415-M426 HydrophobicContact CZ-CB 4.27Å; F415-M426 HydrophobicContact CZ-CE 4.23Å; F415-L427 HydrophobicContact CB-CD2 4.48Å; F415-L427 HydrophobicContact CD1-CD2 3.72Å; F415-L427 HydrophobicContact CD1-CG 4.3Å; F415-L427 HydrophobicContact CD2-CD2 4.2Å; F415-L427 HydrophobicContact CE1-CD1 4.35Å; F415-L427 HydrophobicContact CE1-CD2 3.89Å; F415-L427 HydrophobicContact CE1-CG 3.97Å; F415-L427 HydrophobicContact CE2-CD2 4.35Å; F415-L427 HydrophobicContact CG-CD2 3.88Å; F415-L427 HydrophobicContact CZ-CD2 4.19Å; F415-L427 HydrophobicContact CZ-CG 4.19Å; F415-L430 HydrophobicContact CD2-CD1 3.95Å; F415-L430 HydrophobicContact CE2-CD1 4.18Å; F415-V439 PolarHBondContact N-O 3.4Å; F415-F440 HydrophobicContact CB-CD1 4.15Å; F415-F440 HydrophobicContact CB-CE1 4.02Å; F415-F440 HydrophobicContact CD1-CD1 4.04Å; F415-F440 AromaticContact CD1-CE1 3.88Å; F415-F440 HydrophobicContact CD1-CE1 3.88Å; F415-F440 HydrophobicContact CG-CE1 4.34Å; F415-T559 HydrophobicContact CD2-CG2 4.08Å; F415-G560 VanDerWaalsContact CE2-CA 3.47Å
416	N	92.8	Very high	87.6	Confident	7 Å²	7	45.2 Å²	45.2	4%	0.037	29%	0.287	C	S	.	.			trans	-152.8	146.3	163.1	-167.8	20.5	0	0	0	110.2	C441 N443 T559 G560 S561 L564	N416-C441 VanDerWaalsContact CB-O 3.26Å; N416-C441 WeakPolarHBondContact CB-O 3.2Å; N416-C441 PolarHBondContact ND2-O 3.08Å; N416-N443 VanDerWaalsContact ND2-CG 3.32Å; N416-N443 PolarHBondContact ND2-N 3.48Å; N416-N443 PolarHBondContact ND2-ND2 2.89Å; N416-N443 PolarHBondContact ND2-OD1 3.46Å; N416-T559 PolarHBondContact N-O 3.21Å; N416-G560 CarbonylContact O-C 3.54Å; N416-G560 VanDerWaalsContact O-CA 3.29Å; N416-G560 WeakPolarHBondContact O-CA 3.34Å; N416-S561 VanDerWaalsContact O-CB 3.23Å; N416-S561 WeakPolarHBondContact O-CB 3.47Å; N416-S561 PolarHBondContact O-N 3.23Å; N416-L564 HydrophobicContact CB-CD2 3.95Å
417	A	85.9	Confident	88.5	Confident	13 Å²	13	39.8 Å²	39.8	11%	0.107	25%	0.249	C	C	.	.			trans	-117.5	141	174.9	0	0	0	0	0	110.1	F415 A423 M426	F415-A417 HydrophobicContact CE1-CB 3.98Å; F415-A417 HydrophobicContact CZ-CB 4.03Å; A417-A423 HydrophobicContact CB-CB 3.84Å; A417-M426 HydrophobicContact CB-CE 3.67Å
418	T	73.8	Confident	89.1	Confident	38 Å²	38	42.5 Å²	42.5	23%	0.233	25%	0.246	C	C	.	.			trans	-108.2	151.1	177.1	49.3	0	0	0	0	112.2	R421 N443	T418-R421 WeakPolarHBondContact O-CD 3.31Å; T418-R421 WeakPolarHBondContact O-CG 3.43Å; T418-R421 PolarHBondContact O-NH1 3.37Å; T418-R421 PolarHBondContact OG1-NH1 3.37Å; T418-N443 WeakPolarHBondContact CG2-ND2 3.29Å
419	G	70.3	Confident	89.4	Confident	74 Å²	74	40.9 Å²	40.9	76%	0.763	23%	0.228	S	C	*	.	S	Bend	trans	73.1	-166.6	174.9	0	0	0	0	0	113.7	R421	G419-R421 PolarHBondContact O-N 2.69Å
420	K	68.2	Low	89.6	Confident	203 Å²	203	39.5 Å²	39.5	88%	0.883	22%	0.219	S	C	*	.	S	Bend	trans	-79	36.8	-177.9	-60	-173.8	178.6	-176.1	0	113.5
421	R	77.6	Confident	89.5	Confident	88 Å²	88	40.9 Å²	40.9	33%	0.332	23%	0.226	S	C	.	.			trans	-86.6	150.8	-177.2	-62.9	-175.8	-178.4	111.2	-8.1	110.5	H382 T418 G419 A423 M426	H382-R421 WeakPolarHBondContact O-CD 3.48Å; T418-R421 WeakPolarHBondContact O-CD 3.31Å; T418-R421 WeakPolarHBondContact O-CG 3.43Å; T418-R421 PolarHBondContact O-NH1 3.37Å; T418-R421 PolarHBondContact OG1-NH1 3.37Å; G419-R421 PolarHBondContact O-N 2.69Å; R421-A423 PolarHBondContact O-N 3.16Å; R421-M426 HydrophobicContact CB-CE 4.15Å
422	D	86.1	Confident	89.4	Confident	106 Å²	106	42.3 Å²	42.3	57%	0.567	24%	0.241	S	C	*	.			trans	-77.2	88	174.9	-171.3	-14.9	0	0	0	110.4	A424 A425 M426	D422-A424 VanDerWaalsContact C-N 3.31Å; D422-A424 PolarHBondContact OD1-N 3.2Å; D422-A425 HydrophobicContact CB-CB 4.04Å; D422-A425 PolarHBondContact OD1-N 3.29Å; D422-A425 WeakPolarHBondContact OD2-CB 3.21Å; D422-M426 WeakPolarHBondContact O-CG 3.35Å; D422-M426 PolarHBondContact O-N 2.91Å
423	A	89.5	Confident	89.2	Confident	13 Å²	13	42.3 Å²	42.3	11%	0.107	24%	0.241	C	C	.	.	H	α-helix	trans	-64.7	-35.7	179.1	0	0	0	0	0	112.2	F415 A417 R421 M426 L427 N472	F415-A423 HydrophobicContact CE1-CB 4.41Å; A417-A423 HydrophobicContact CB-CB 3.84Å; R421-A423 PolarHBondContact O-N 3.16Å; A423-M426 PolarHBondContact O-N 3.34Å; A423-L427 WeakPolarHBondContact O-CB 3.28Å; A423-L427 VanDerWaalsContact O-CG 3.31Å; A423-L427 WeakPolarHBondContact O-CG 3.46Å; A423-L427 PolarHBondContact O-N 3.45Å; A423-N472 WeakPolarHBondContact CB-OD1 3.45Å
424	A	91.1	Very high	88.8	Confident	36 Å²	36	51.4 Å²	51.4	30%	0.298	28%	0.275	S	S	.	.	H	α-helix	trans	-63.9	-44.5	178.8	0	0	0	0	0	111.4	D422 M426 L427 K428	D422-A424 VanDerWaalsContact C-N 3.31Å; D422-A424 PolarHBondContact OD1-N 3.2Å; A424-M426 VanDerWaalsContact C-N 3.3Å; A424-M426 PolarHBondContact O-N 3.27Å; A424-L427 PolarHBondContact O-N 3.4Å; A424-K428 PolarHBondContact O-N 2.93Å
425	A	91.8	Very high	88.7	Confident	39 Å²	39	51.7 Å²	51.7	32%	0.322	28%	0.277	S	S	.	.	H	α-helix	trans	-62.2	-36.6	174.6	0	0	0	0	0	112.6	D422	D422-A425 HydrophobicContact CB-CB 4.04Å; D422-A425 PolarHBondContact OD1-N 3.29Å; D422-A425 WeakPolarHBondContact OD2-CB 3.21Å
426	M	93.6	Very high	88.5	Confident	10 Å²	10	53.2 Å²	53.2	5%	0.049	29%	0.285	C	S	.	.	H	α-helix	trans	-69.7	-41.5	175.3	-69	-170.6	-67.4	0	0	112.3	M387 F415 A417 R421 D422 A423 A424 K428 L429	M387-M426 HydrophobicContact CG-CB 4.14Å; M387-M426 HydrophobicContact CG-CG 3.94Å; M387-M426 HydrophobicContact CG-SD 4.02Å; F415-M426 HydrophobicContact CZ-CB 4.27Å; F415-M426 HydrophobicContact CZ-CE 4.23Å; A417-M426 HydrophobicContact CB-CE 3.67Å; R421-M426 HydrophobicContact CB-CE 4.15Å; D422-M426 WeakPolarHBondContact O-CG 3.35Å; D422-M426 PolarHBondContact O-N 2.91Å; A423-M426 PolarHBondContact O-N 3.34Å; A424-M426 VanDerWaalsContact C-N 3.3Å; A424-M426 PolarHBondContact O-N 3.27Å; M426-K428 VanDerWaalsContact C-N 3.3Å; M426-K428 PolarHBondContact O-N 3.31Å; M426-L429 WeakPolarHBondContact O-CB 3.37Å; M426-L429 PolarHBondContact O-N 3.02Å
427	L	94.9	Very high	88.6	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.5	-38	176.1	-74.5	168.2	0	0	0	111.7	L413 F415 A423 A424 L429 L430 F440 N472 W476 L479	L413-L427 HydrophobicContact CD2-CD2 4.2Å; F415-L427 HydrophobicContact CB-CD2 4.48Å; F415-L427 HydrophobicContact CD1-CD2 3.72Å; F415-L427 HydrophobicContact CD1-CG 4.3Å; F415-L427 HydrophobicContact CD2-CD2 4.2Å; F415-L427 HydrophobicContact CE1-CD1 4.35Å; F415-L427 HydrophobicContact CE1-CD2 3.89Å; F415-L427 HydrophobicContact CE1-CG 3.97Å; F415-L427 HydrophobicContact CE2-CD2 4.35Å; F415-L427 HydrophobicContact CG-CD2 3.88Å; F415-L427 HydrophobicContact CZ-CD2 4.19Å; F415-L427 HydrophobicContact CZ-CG 4.19Å; A423-L427 WeakPolarHBondContact O-CB 3.28Å; A423-L427 VanDerWaalsContact O-CG 3.31Å; A423-L427 WeakPolarHBondContact O-CG 3.46Å; A423-L427 PolarHBondContact O-N 3.45Å; A424-L427 PolarHBondContact O-N 3.4Å; L427-L429 PolarHBondContact O-N 2.86Å; L427-L430 HydrophobicContact CD2-CD1 4.32Å; L427-L430 WeakPolarHBondContact O-CB 3.39Å; L427-L430 PolarHBondContact O-N 3.34Å; L427-F440 HydrophobicContact CD1-CE1 4.29Å; L427-F440 HydrophobicContact CD2-CE1 3.88Å; L427-F440 HydrophobicContact CD2-CZ 4.27Å; L427-N472 HydrophobicContact CD1-CB 4.32Å; L427-N472 WeakPolarHBondContact CD1-O 3.19Å; L427-W476 HydrophobicContact CB-CE3 4.15Å; L427-W476 HydrophobicContact CD2-CE3 3.79Å; L427-W476 HydrophobicContact CD2-CZ3 4.31Å; L427-W476 HydrophobicContact CG-CE3 4.47Å; L427-L479 HydrophobicContact CB-CD1 3.98Å
428	K	94.8	Very high	89	Confident	111 Å²	111	52.3 Å²	52.3	48%	0.483	28%	0.278	S	S	.	.	H	α-helix	trans	-57.8	-35.9	175.3	-172.6	172.9	-178.1	173.2	0	112.6	A424 M426 L430 L431 L479	A424-K428 PolarHBondContact O-N 2.93Å; M426-K428 VanDerWaalsContact C-N 3.3Å; M426-K428 PolarHBondContact O-N 3.31Å; K428-L430 PolarHBondContact O-N 3.36Å; K428-L431 HydrophobicContact CG-CD1 4.29Å; K428-L431 WeakPolarHBondContact O-CG 3.49Å; K428-L431 PolarHBondContact O-N 2.94Å; K428-L479 HydrophobicContact CB-CD1 4.09Å; K428-L479 HydrophobicContact CB-CD2 4.16Å; K428-L479 HydrophobicContact CD-CD2 4.3Å; K428-L479 HydrophobicContact CG-CD2 4.19Å
429	L	95.6	Very high	90.1	Very high	33 Å²	33	50.5 Å²	50.5	17%	0.173	27%	0.267	C	S	.	.	H	α-helix	trans	-67.7	-21.6	177	-65.9	173.5	0	0	0	113.5	M387 Q388 V391 M426 L427 P432	M387-L429 HydrophobicContact CB-CD1 3.6Å; Q388-L429 HydrophobicContact CG-CD1 4.18Å; Q388-L429 HydrophobicContact CG-CD2 4.11Å; V391-L429 WeakPolarHBondContact CG2-O 3.32Å; M426-L429 WeakPolarHBondContact O-CB 3.37Å; M426-L429 PolarHBondContact O-N 3.02Å; L427-L429 PolarHBondContact O-N 2.86Å; L429-P432 VanDerWaalsContact O-CD 3.28Å; L429-P432 WeakPolarHBondContact O-CD 3.4Å
430	L	95.8	Very high	91.2	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-87.1	-11.9	-176.6	-71.4	167.7	0	0	0	113.2	M387 V391 L413 F415 L427 K428 P432 C433 F435 W476 L557 T559	M387-L430 HydrophobicContact CE-CD1 3.64Å; M387-L430 HydrophobicContact CE-CD2 3.79Å; M387-L430 HydrophobicContact CE-CG 3.7Å; V391-L430 HydrophobicContact CG2-CD2 3.83Å; L413-L430 HydrophobicContact CD1-CD1 3.91Å; L413-L430 HydrophobicContact CD2-CD1 3.91Å; F415-L430 HydrophobicContact CD2-CD1 3.95Å; F415-L430 HydrophobicContact CE2-CD1 4.18Å; L427-L430 HydrophobicContact CD2-CD1 4.32Å; L427-L430 WeakPolarHBondContact O-CB 3.39Å; L427-L430 PolarHBondContact O-N 3.34Å; K428-L430 PolarHBondContact O-N 3.36Å; L430-P432 VanDerWaalsContact C-CD 3.42Å; L430-C433 VanDerWaalsContact O-CB 3.24Å; L430-C433 WeakPolarHBondContact O-CB 3.34Å; L430-C433 PolarHBondContact O-N 2.88Å; L430-C433 VanDerWaalsContact O-N 3.08Å; L430-F435 HydrophobicContact CB-CE2 4.17Å; L430-F435 HydrophobicContact CD2-CE2 4.34Å; L430-W476 HydrophobicContact CB-CZ3 4.22Å; L430-L557 HydrophobicContact CD2-CD2 3.78Å; L430-T559 HydrophobicContact CD1-CG2 4.16Å; L430-T559 HydrophobicContact CD2-CG2 4.21Å
431	L	93.1	Very high	92.3	Very high	44 Å²	44	37.3 Å²	37.3	23%	0.23	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-54.4	-41.5	179.2	-63	174.1	0	0	0	113.9	K428 C433 R434 W476 L479	K428-L431 HydrophobicContact CG-CD1 4.29Å; K428-L431 WeakPolarHBondContact O-CG 3.49Å; K428-L431 PolarHBondContact O-N 2.94Å; L431-C433 PolarHBondContact O-N 2.89Å; L431-R434 PolarHBondContact O-N 3.28Å; L431-R434 VanDerWaalsContact O-N 3.12Å; L431-W476 HydrophobicContact CD2-CH2 4.03Å; L431-W476 HydrophobicContact CD2-CZ3 4.04Å; L431-L479 HydrophobicContact CD1-CB 4.38Å; L431-L479 HydrophobicContact CD2-CB 4.41Å
432	P	93.2	Very high	92.8	Very high	73 Å²	73	33.1 Å²	33.1	47%	0.474	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-62.8	-14.6	178.5	-23.5	36.1	0	0	0	114.8	Q395 L429 L430 R434	Q395-P432 PolarHBondContact NE2-O 2.93Å; Q395-P432 VanDerWaalsContact NE2-O 3.13Å; L429-P432 VanDerWaalsContact O-CD 3.28Å; L429-P432 WeakPolarHBondContact O-CD 3.4Å; L430-P432 VanDerWaalsContact C-CD 3.42Å; P432-R434 PolarHBondContact O-N 3.04Å
433	C	93.3	Very high	92.7	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-73.5	-15.7	177.1	-64.7	0	0	0	0	113.2	F394 R411 L430 L431 F435	F394-C433 HydrophobicContact CD1-CB 3.97Å; F394-C433 HydrophobicContact CE1-CB 3.84Å; R411-C433 PolarHBondContact NH1-O 2.77Å; L430-C433 VanDerWaalsContact O-CB 3.24Å; L430-C433 WeakPolarHBondContact O-CB 3.34Å; L430-C433 PolarHBondContact O-N 2.88Å; L430-C433 VanDerWaalsContact O-N 3.08Å; L431-C433 PolarHBondContact O-N 2.89Å; C433-F435 HydrophobicContact CB-CD2 3.89Å; C433-F435 HydrophobicContact CB-CE1 4.29Å; C433-F435 HydrophobicContact CB-CE2 3.25Å; C433-F435 HydrophobicContact CB-CZ 3.47Å; C433-F435 VanDerWaalsContact CB-CZ 3.47Å
434	R	90.4	Very high	92.4	Very high	191 Å²	191	31 Å²	31	72%	0.721	16%	0.159	S	C	*	.			trans	52.1	62.8	179.2	-60.2	-177.5	177	175.7	-1.9	112.3	L431 P432	L431-R434 PolarHBondContact O-N 3.28Å; L431-R434 VanDerWaalsContact O-N 3.12Å; P432-R434 PolarHBondContact O-N 3.04Å
435	F	94.4	Very high	91.8	Very high	7 Å²	7	30.4 Å²	30.4	3%	0.031	15%	0.152	C	C	.	.			trans	-71.5	138.1	172.8	-63	-73	0	0	0	110.3	F394 R411 L413 L430 C433 W476 A504 L557	F394-F435 HydrophobicContact CD1-CZ 4.41Å; F394-F435 AromaticContact CE1-CE1 3.87Å; F394-F435 HydrophobicContact CE1-CE1 3.87Å; F394-F435 AromaticContact CE1-CZ 3.93Å; F394-F435 HydrophobicContact CE1-CZ 3.93Å; F394-F435 AromaticContact CZ-CE1 3.81Å; F394-F435 HydrophobicContact CZ-CE1 3.81Å; F394-F435 HydrophobicContact CZ-CZ 4.27Å; R411-F435 HydrophobicContact CB-CD1 4Å; L413-F435 HydrophobicContact CB-CB 4.33Å; L413-F435 HydrophobicContact CB-CD1 3.79Å; L413-F435 HydrophobicContact CB-CD2 3.82Å; L413-F435 HydrophobicContact CB-CE1 4.02Å; L413-F435 HydrophobicContact CB-CE2 4.03Å; L413-F435 HydrophobicContact CB-CG 3.7Å; L413-F435 HydrophobicContact CB-CZ 4.15Å; L413-F435 HydrophobicContact CD1-CE2 4.15Å; L413-F435 HydrophobicContact CD1-CZ 4.13Å; L413-F435 HydrophobicContact CD2-CD2 4.31Å; L413-F435 HydrophobicContact CD2-CE2 4.36Å; L413-F435 HydrophobicContact CG-CE2 4.41Å; L430-F435 HydrophobicContact CB-CE2 4.17Å; L430-F435 HydrophobicContact CD2-CE2 4.34Å; C433-F435 HydrophobicContact CB-CD2 3.89Å; C433-F435 HydrophobicContact CB-CE1 4.29Å; C433-F435 HydrophobicContact CB-CE2 3.25Å; C433-F435 HydrophobicContact CB-CZ 3.47Å; C433-F435 VanDerWaalsContact CB-CZ 3.47Å; F435-W476 HydrophobicContact CB-CZ2 4.5Å; F435-W476 HydrophobicContact CD2-CH2 4.02Å; F435-A504 VanDerWaalsContact O-CB 3.26Å; F435-A504 WeakPolarHBondContact O-CB 3.41Å; F435-L557 HydrophobicContact CE1-CB 3.79Å; F435-L557 HydrophobicContact CE1-CD2 4.4Å; F435-L557 HydrophobicContact CE2-CD2 4.47Å; F435-L557 HydrophobicContact CZ-CB 3.85Å; F435-L557 HydrophobicContact CZ-CD2 3.61Å; F435-L557 HydrophobicContact CZ-CG 4.35Å
436	D	93.1	Very high	91.2	Very high	31 Å²	31	30.8 Å²	30.8	17%	0.166	15%	0.147	C	C	.	.	S	Bend	trans	-82.9	-29	172.2	-51.9	-75.3	0	0	0	110.3	V410 R411 R502 D505	V410-D436 WeakPolarHBondContact CA-OD2 3.33Å; V410-D436 HydrophobicContact CG1-CB 4.17Å; R411-D436 PolarHBondContact N-OD2 2.55Å; R411-D436 PolarHBondContact O-N 3.08Å; D436-R502 IonicContact OD1-CZ 3.97Å; D436-R502 IonicContact OD1-NH1 3.41Å; D436-R502 PolarHBondContact OD1-NH1 3.07Å; D436-D505 PolarHBondContact O-N 3.1Å
437	L	93.9	Very high	89.5	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	140.4	178.2	-66	167.8	0	0	0	111.6	V410 R411 V412 L413 D505 W518 L548	V410-L437 HydrophobicContact CG1-CD1 4.42Å; R411-L437 PolarHBondContact O-N 3.23Å; V412-L437 CarbonylContact C-O 3.57Å; V412-L437 WeakPolarHBondContact CA-O 3.27Å; V412-L437 HydrophobicContact CG1-CB 4.24Å; V412-L437 HydrophobicContact CG2-CB 4.28Å; V412-L437 HydrophobicContact CG2-CD1 4.35Å; L413-L437 PolarHBondContact N-O 3.2Å; L437-D505 CarbonylContact C-O 3.43Å; L437-D505 WeakPolarHBondContact CA-O 3.35Å; L437-D505 HydrophobicContact CD2-CB 3.62Å; L437-W518 HydrophobicContact CD1-CH2 3.9Å; L437-W518 HydrophobicContact CD1-CZ3 4.27Å; L437-L548 HydrophobicContact CD1-CD1 4.07Å; L437-L548 HydrophobicContact CD1-CD2 3.88Å; L437-L548 HydrophobicContact CD1-CG 3.8Å
438	A	95.3	Very high	87.4	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	126	171.6	0	0	0	0	0	111.4	L413 F440 W476 D505 S506 L507	L413-A438 HydrophobicContact CB-CB 4.43Å; L413-A438 HydrophobicContact CD2-CB 4.48Å; A438-F440 HydrophobicContact CB-CE2 3.95Å; A438-F440 HydrophobicContact CB-CZ 4.12Å; A438-W476 HydrophobicContact CB-CD2 4.04Å; A438-W476 HydrophobicContact CB-CG 4.09Å; A438-W476 HydrophobicContact CB-CZ2 4.14Å; A438-D505 PolarHBondContact N-O 2.92Å; A438-S506 CarbonylContact O-C 3.57Å; A438-S506 VanDerWaalsContact O-CA 3.24Å; A438-S506 WeakPolarHBondContact O-CA 3.32Å; A438-L507 PolarHBondContact O-N 3.27Å
439	V	95.3	Very high	85.1	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	129.4	-174.5	-177	0	0	0	0	109.3	V412 L413 L414 F415 L507 F509 A515 W518 I519	V412-V439 HydrophobicContact CG1-CG2 3.8Å; L413-V439 WeakPolarHBondContact O-CA 3.38Å; L413-V439 WeakPolarHBondContact O-CB 3.48Å; L413-V439 PolarHBondContact O-N 3.17Å; L414-V439 WeakPolarHBondContact CA-O 3.5Å; L414-V439 HydrophobicContact CD1-CB 3.98Å; L414-V439 HydrophobicContact CD1-CG1 3.68Å; F415-V439 PolarHBondContact N-O 3.4Å; V439-L507 WeakPolarHBondContact CA-O 3.48Å; V439-F509 HydrophobicContact CG1-CD2 3.49Å; V439-F509 VanDerWaalsContact CG1-CD2 3.49Å; V439-F509 HydrophobicContact CG1-CE2 3.72Å; V439-A515 HydrophobicContact CG1-CB 3.92Å; V439-W518 HydrophobicContact CG2-CE3 4.47Å; V439-W518 HydrophobicContact CG2-CZ3 4.05Å; V439-I519 HydrophobicContact CB-CD1 4.37Å; V439-I519 HydrophobicContact CG1-CD1 4.42Å; V439-I519 HydrophobicContact CG2-CD1 4.17Å; V439-I519 HydrophobicContact CG2-CG1 4.3Å
440	F	94.8	Very high	82.6	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	134.6	178.7	-55.4	-84.5	0	0	0	110.1	F415 L427 A438 C469 N472 E473 W476 L507 V508 F509	F415-F440 HydrophobicContact CB-CD1 4.15Å; F415-F440 HydrophobicContact CB-CE1 4.02Å; F415-F440 HydrophobicContact CD1-CD1 4.04Å; F415-F440 AromaticContact CD1-CE1 3.88Å; F415-F440 HydrophobicContact CD1-CE1 3.88Å; F415-F440 HydrophobicContact CG-CE1 4.34Å; L427-F440 HydrophobicContact CD1-CE1 4.29Å; L427-F440 HydrophobicContact CD2-CE1 3.88Å; L427-F440 HydrophobicContact CD2-CZ 4.27Å; A438-F440 HydrophobicContact CB-CE2 3.95Å; A438-F440 HydrophobicContact CB-CZ 4.12Å; F440-C469 HydrophobicContact CB-CB 4.25Å; F440-N472 HydrophobicContact CD1-CB 3.54Å; F440-N472 HydrophobicContact CE1-CB 3.78Å; F440-N472 HydrophobicContact CG-CB 4.26Å; F440-E473 HydrophobicContact CD2-CB 3.76Å; F440-E473 HydrophobicContact CD2-CG 4.01Å; F440-E473 HydrophobicContact CE2-CB 4.05Å; F440-E473 HydrophobicContact CE2-CG 4.12Å; F440-E473 HydrophobicContact CG-CB 4.44Å; F440-W476 HydrophobicContact CE2-CB 4.1Å; F440-W476 HydrophobicContact CE2-CG 4.34Å; F440-W476 HydrophobicContact CZ-CB 3.62Å; F440-W476 HydrophobicContact CZ-CD2 4.46Å; F440-W476 AromaticContact CZ-CG 3.94Å; F440-W476 HydrophobicContact CZ-CG 3.94Å; F440-L507 PolarHBondContact N-O 3.32Å; F440-V508 HydrophobicContact CB-CG2 4.27Å; F440-V508 CarbonylContact O-C 3.57Å; F440-V508 VanDerWaalsContact O-CA 3.29Å; F440-V508 WeakPolarHBondContact O-CA 3.22Å; F440-F509 PolarHBondContact O-N 3.07Å
441	C	90.6	Very high	80.1	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.261	C	S	.	.			trans	-149.7	152.5	175.2	68.1	0	0	0	0	111.2	N416 F509 A515	N416-C441 VanDerWaalsContact CB-O 3.26Å; N416-C441 WeakPolarHBondContact CB-O 3.2Å; N416-C441 PolarHBondContact ND2-O 3.08Å; C441-F509 HydrophobicContact CB-CB 4.18Å; C441-A515 HydrophobicContact CB-CB 4.35Å
442	P	88.3	Confident	78.3	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.262	C	S	.	.			trans	-69	163.1	175.9	31.4	-35.9	0	0	0	109.7	I444 M465 L466 F509 P510	P442-I444 HydrophobicContact CB-CD1 3.95Å; P442-I444 HydrophobicContact CB-CG1 4.02Å; P442-I444 HydrophobicContact CG-CB 4.16Å; P442-I444 HydrophobicContact CG-CD1 3.81Å; P442-I444 HydrophobicContact CG-CG1 4.07Å; P442-I444 PolarHBondContact O-N 3.31Å; P442-M465 HydrophobicContact CB-CB 3.85Å; P442-L466 HydrophobicContact CG-CD2 3.91Å; P442-F509 WeakPolarHBondContact CD-O 3.44Å; P442-P510 WeakPolarHBondContact CG-O 3.37Å
443	N	84.8	Confident	76.6	Confident	38 Å²	38	40.6 Å²	40.6	20%	0.203	24%	0.241	C	C	.	.	S	Bend	trans	-77.1	47.5	174.9	-55.4	-36.4	0	0	0	111.5	N416 T418 S561 H563 L564	N416-N443 VanDerWaalsContact ND2-CG 3.32Å; N416-N443 PolarHBondContact ND2-N 3.48Å; N416-N443 PolarHBondContact ND2-ND2 2.89Å; N416-N443 PolarHBondContact ND2-OD1 3.46Å; T418-N443 WeakPolarHBondContact CG2-ND2 3.29Å; N443-S561 PolarHBondContact ND2-OG 2.73Å; N443-H563 HydrophobicContact CB-CB 4.07Å; N443-L564 WeakPolarHBondContact OD1-CA 3.39Å; N443-L564 WeakPolarHBondContact OD1-CB 3.44Å; N443-L564 PolarHBondContact OD1-N 2.82Å
444	I	82.9	Confident	74.8	Confident	38 Å²	38	41 Å²	41	20%	0.195	24%	0.242	C	C	.	.			trans	-108.7	119.9	178	-63.1	173	0	0	0	106	P442 E446 V462 M465 S511 I512	P442-I444 HydrophobicContact CB-CD1 3.95Å; P442-I444 HydrophobicContact CB-CG1 4.02Å; P442-I444 HydrophobicContact CG-CB 4.16Å; P442-I444 HydrophobicContact CG-CD1 3.81Å; P442-I444 HydrophobicContact CG-CG1 4.07Å; P442-I444 PolarHBondContact O-N 3.31Å; I444-E446 WeakPolarHBondContact CG2-O 3.18Å; I444-V462 HydrophobicContact CD1-CG1 3.9Å; I444-V462 HydrophobicContact CD1-CG2 4.34Å; I444-M465 HydrophobicContact CD1-SD 4.3Å; I444-M465 HydrophobicContact CG1-SD 4.2Å; I444-S511 WeakPolarHBondContact O-CA 3.11Å; I444-S511 WeakPolarHBondContact O-CB 3.34Å; I444-I512 WeakPolarHBondContact O-CG1 3.27Å; I444-I512 PolarHBondContact O-N 3.18Å
445	T	78.8	Confident	73.5	Confident	23 Å²	23	34.3 Å²	34.3	14%	0.141	22%	0.22	C	C	.	.	S	Bend	trans	-71.2	-43	-174.2	39.1	0	0	0	0	112.7	I512 L513 K570 H571	T445-I512 HydrophobicContact CG2-CD1 4.32Å; T445-L513 VanDerWaalsContact O-CB 3.26Å; T445-L513 WeakPolarHBondContact O-CB 3.41Å; T445-L513 PolarHBondContact O-N 3.42Å; T445-K570 HydrophobicContact CG2-CD 3.82Å; T445-H571 PolarHBondContact O-NE2 2.94Å; T445-H571 VanDerWaalsContact O-NE2 3.07Å
446	E	77.9	Confident	71.8	Confident	46 Å²	46	37.9 Å²	37.9	22%	0.215	24%	0.237	C	C	.	.			trans	-140.4	148.2	-179.3	-73.5	146.3	-125	0	0	110.2	I444 V448 S450 L513 K570 H571	I444-E446 WeakPolarHBondContact CG2-O 3.18Å; E446-V448 VanDerWaalsContact C-N 3.34Å; E446-S450 WeakPolarHBondContact OE2-CB 2.97Å; E446-S450 PolarHBondContact OE2-OG 3.33Å; E446-L513 HydrophobicContact CG-CB 4.46Å; E446-L513 HydrophobicContact CG-CD2 3.77Å; E446-K570 IonicContact OE1-NZ 3.93Å; E446-K570 PolarHBondContact OE1-NZ 3.07Å; E446-H571 IonicContact OE1-CE1 3.45Å; E446-H571 PolarHBondContact OE1-CE1 3.09Å; E446-H571 VanDerWaalsContact OE1-CE1 3.25Å; E446-H571 IonicContact OE1-NE2 3.73Å
447	T	58.3	Low	70.1	Confident	103 Å²	103	40.3 Å²	40.3	63%	0.632	25%	0.249	S	C	*	.	S	Bend	trans	-74.4	-21.3	-179.5	44.4	0	0	0	0	113.9	P510	T447-P510 HydrophobicContact CG2-CB 3.96Å; T447-P510 HydrophobicContact CG2-CG 3.98Å
448	V	51.7	Low	68.3	Low	115 Å²	115	46 Å²	46	70%	0.697	27%	0.274	S	S	*	.	S	Bend	trans	-98.3	130.7	169.2	-176.2	0	0	0	0	106.8	E446 S450	E446-V448 VanDerWaalsContact C-N 3.34Å; V448-S450 PolarHBondContact O-N 3.07Å
449	A	45.4	Very low	66.4	Low	93 Å²	93	48.6 Å²	48.6	77%	0.769	29%	0.288	S	S	*	.			trans	-66.1	77.8	177.9	0	0	0	0	0	110.7	G451	A449-G451 PolarHBondContact O-N 3.31Å
450	S	42.4	Very low	64.9	Low	60 Å²	60	51.6 Å²	51.6	42%	0.42	31%	0.306	S	S	.	.			trans	-68.4	126.7	161.1	82.7	0	0	0	0	107	E446 V448 N452	E446-S450 WeakPolarHBondContact OE2-CB 2.97Å; E446-S450 PolarHBondContact OE2-OG 3.33Å; V448-S450 PolarHBondContact O-N 3.07Å; S450-N452 PolarHBondContact O-N 2.95Å
451	G	44.9	Very low	63.9	Low	57 Å²	57	54 Å²	54	59%	0.588	33%	0.327	S	S	*	.	S	Bend	trans	-68	43	-155.3	0	0	0	0	0	117.8	Q50 A449 A453	Q50-G451 PolarHBondContact NE2-O 3.22Å; A449-G451 PolarHBondContact O-N 3.31Å; G451-A453 PolarHBondContact O-N 3.36Å
452	N	54.1	Low	63.2	Low	48 Å²	48	57.6 Å²	57.6	26%	0.257	35%	0.348	S	S	.	.			trans	-88.5	88.6	-179.4	-125.6	7.2	0	0	0	111.3	S450 D454 Q455	S450-N452 PolarHBondContact O-N 2.95Å; N452-D454 PolarHBondContact O-N 3.49Å; N452-D454 VanDerWaalsContact O-N 3.1Å; N452-Q455 PolarHBondContact O-N 3.05Å
453	A	57.4	Low	62.6	Low	2 Å²	2	64 Å²	64	2%	0.017	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-62	-14	178.7	0	0	0	0	0	114.3	I53 N57 G451 Q455 Q456	I53-A453 HydrophobicContact CG2-CB 3.7Å; N57-A453 PolarHBondContact ND2-O 3.17Å; G451-A453 PolarHBondContact O-N 3.36Å; A453-Q455 PolarHBondContact O-N 3.1Å; A453-Q456 PolarHBondContact O-N 3.01Å
454	D	56.9	Low	62.4	Low	7 Å²	7	65.8 Å²	65.8	4%	0.037	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-58	-32.6	176.7	-83.6	-72.3	0	0	0	113.3	Y49 H136 V140 N452	Y49-D454 WeakPolarHBondContact CE1-OD2 3.41Å; Y49-D454 PolarHBondContact OH-OD1 3.11Å; Y49-D454 VanDerWaalsContact OH-OD1 3.07Å; Y49-D454 PolarHBondContact OH-OD2 3.46Å; Y49-D454 VanDerWaalsContact OH-OD2 3.07Å; H136-D454 PolarHBondContact NE2-O 3.46Å; V140-D454 WeakPolarHBondContact CB-OD1 3.4Å; V140-D454 WeakPolarHBondContact CG2-OD1 3.47Å; V140-D454 PolarHBondContact N-OD1 3.34Å; N452-D454 PolarHBondContact O-N 3.49Å; N452-D454 VanDerWaalsContact O-N 3.1Å
455	Q	61.5	Low	62.3	Low	52 Å²	52	65.8 Å²	65.8	24%	0.243	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-109.8	4.7	-175.5	-67	-175	-28.8	0	0	113.9	L137 V138 N452 A453 N457	L137-Q455 PolarHBondContact O-NE2 2.95Å; V138-Q455 WeakPolarHBondContact O-CG 3.4Å; N452-Q455 PolarHBondContact O-N 3.05Å; A453-Q455 PolarHBondContact O-N 3.1Å; Q455-N457 PolarHBondContact O-N 3.42Å
456	Q	60	Low	62.5	Low	82 Å²	82	67.4 Å²	67.4	38%	0.383	40%	0.398	S	S	.	.			trans	-73.5	115.2	-179.6	-73.4	-178	-9.5	0	0	110.7	A453 F458	A453-Q456 PolarHBondContact O-N 3.01Å; Q456-F458 HydrophobicContact CB-CE1 4.48Å; Q456-F458 HydrophobicContact CB-CE2 3.91Å; Q456-F458 HydrophobicContact CB-CZ 3.89Å
457	N	57.7	Low	62.8	Low	81 Å²	81	68.7 Å²	68.7	43%	0.433	41%	0.409	S	S	.	.			trans	-98.4	95.6	171.4	-172.1	0.6	0	0	0	109.5	Q455 N459	Q455-N457 PolarHBondContact O-N 3.42Å; N457-N459 PolarHBondContact O-N 3.23Å; N457-N459 WeakPolarHBondContact OD1-CB 3.4Å; N457-N459 PolarHBondContact OD1-N 2.74Å; N457-N459 PolarHBondContact OD1-ND2 3.19Å
458	F	54.3	Low	64.2	Low	122 Å²	122	66.4 Å²	66.4	54%	0.535	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-1.2	-179.5	-62	-79.6	0	0	0	114.4	N57 Q456	N57-F458 HydrophobicContact CB-CE2 4Å; Q456-F458 HydrophobicContact CB-CE1 4.48Å; Q456-F458 HydrophobicContact CB-CE2 3.91Å; Q456-F458 HydrophobicContact CB-CZ 3.89Å
459	N	55.8	Low	66	Low	53 Å²	53	60.9 Å²	60.9	28%	0.283	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-7.3	-169.7	-61.5	-57.4	0	0	0	114.8	A63 N457	A63-N459 HydrophobicContact CB-CB 4.11Å; A63-N459 PolarHBondContact N-OD1 3.45Å; A63-N459 VanDerWaalsContact N-OD1 3.17Å; N457-N459 PolarHBondContact O-N 3.23Å; N457-N459 WeakPolarHBondContact OD1-CB 3.4Å; N457-N459 PolarHBondContact OD1-N 2.74Å; N457-N459 PolarHBondContact OD1-ND2 3.19Å
460	V	64.7	Low	68	Low	63 Å²	63	60.7 Å²	60.7	38%	0.382	35%	0.348	S	S	.	.	S	Bend	trans	-140.7	132.2	-176.5	-174.2	0	0	0	0	110.2	T464 M465	V460-T464 HydrophobicContact CG1-CG2 3.96Å; V460-M465 HydrophobicContact CB-CE 3.84Å; V460-M465 HydrophobicContact CG1-CE 4.23Å; V460-M465 HydrophobicContact CG1-CG 3.96Å; V460-M465 WeakPolarHBondContact O-CE 3.49Å
461	A	73	Confident	70.3	Confident	52 Å²	52	61.1 Å²	61.1	43%	0.43	35%	0.346	S	S	.	.			trans	-70.6	149.4	176.8	0	0	0	0	0	112.1	E463 T464 M465	A461-E463 VanDerWaalsContact C-N 3.3Å; A461-E463 PolarHBondContact O-N 3.4Å; A461-T464 WeakPolarHBondContact O-CB 3.42Å; A461-T464 PolarHBondContact O-N 3.42Å; A461-T464 VanDerWaalsContact O-N 3.15Å; A461-M465 PolarHBondContact O-N 3.01Å
462	V	75.9	Confident	72.5	Confident	75 Å²	75	58.8 Å²	58.8	46%	0.455	32%	0.32	S	S	.	.	H	α-helix	trans	-60.5	-39.8	-177.6	173.7	0	0	0	0	111.5	I444 T464 M465 L466	I444-V462 HydrophobicContact CD1-CG1 3.9Å; I444-V462 HydrophobicContact CD1-CG2 4.34Å; V462-T464 VanDerWaalsContact C-N 3.29Å; V462-T464 PolarHBondContact O-N 3.21Å; V462-M465 WeakPolarHBondContact O-CB 3.45Å; V462-M465 PolarHBondContact O-N 3.46Å; V462-M465 VanDerWaalsContact O-N 3.12Å; V462-L466 HydrophobicContact CG1-CD1 4.28Å; V462-L466 PolarHBondContact O-N 3.06Å; V462-L466 VanDerWaalsContact O-N 3.07Å
463	E	77	Confident	74.4	Confident	135 Å²	135	57.4 Å²	57.4	63%	0.631	31%	0.312	S	S	*	.	H	α-helix	trans	-59.6	-42.7	178	-61.9	78.3	-168.7	0	0	111.1	A461 M465 L466 T467	A461-E463 VanDerWaalsContact C-N 3.3Å; A461-E463 PolarHBondContact O-N 3.4Å; E463-M465 VanDerWaalsContact C-N 3.31Å; E463-M465 PolarHBondContact O-N 3.06Å; E463-L466 PolarHBondContact O-N 2.95Å; E463-T467 PolarHBondContact O-N 3.12Å; E463-T467 PolarHBondContact O-OG1 3.46Å; E463-T467 VanDerWaalsContact O-OG1 3.05Å
464	T	79.8	Confident	75.9	Confident	74 Å²	74	64.9 Å²	64.9	45%	0.454	34%	0.34	S	S	.	.	H	α-helix	trans	-62.9	-39.3	177.6	-55.9	0	0	0	0	111.3	V460 A461 V462 T467 C468	V460-T464 HydrophobicContact CG1-CG2 3.96Å; A461-T464 WeakPolarHBondContact O-CB 3.42Å; A461-T464 PolarHBondContact O-N 3.42Å; A461-T464 VanDerWaalsContact O-N 3.15Å; V462-T464 VanDerWaalsContact C-N 3.29Å; V462-T464 PolarHBondContact O-N 3.21Å; T464-T467 PolarHBondContact O-N 2.93Å; T464-C468 PolarHBondContact O-N 2.87Å; T464-C468 VanDerWaalsContact O-N 3.08Å; T464-C468 PolarHBondContact O-SG 3.08Å
465	M	80.9	Confident	77.6	Confident	38 Å²	38	66 Å²	66	19%	0.187	35%	0.348	C	S	.	.	H	α-helix	trans	-64.5	-40.4	177.5	-60.1	-171.7	-171.7	0	0	112.1	P442 I444 V460 A461 V462 E463 C468 C469	P442-M465 HydrophobicContact CB-CB 3.85Å; I444-M465 HydrophobicContact CD1-SD 4.3Å; I444-M465 HydrophobicContact CG1-SD 4.2Å; V460-M465 HydrophobicContact CB-CE 3.84Å; V460-M465 HydrophobicContact CG1-CE 4.23Å; V460-M465 HydrophobicContact CG1-CG 3.96Å; V460-M465 WeakPolarHBondContact O-CE 3.49Å; A461-M465 PolarHBondContact O-N 3.01Å; V462-M465 WeakPolarHBondContact O-CB 3.45Å; V462-M465 PolarHBondContact O-N 3.46Å; V462-M465 VanDerWaalsContact O-N 3.12Å; E463-M465 VanDerWaalsContact C-N 3.31Å; E463-M465 PolarHBondContact O-N 3.06Å; M465-C468 PolarHBondContact O-N 3.25Å; M465-C469 PolarHBondContact O-N 3.31Å; M465-C469 PolarHBondContact O-SG 2.93Å
466	L	82.8	Confident	79.1	Confident	58 Å²	58	63.7 Å²	63.7	30%	0.304	34%	0.337	S	S	.	.	H	α-helix	trans	-68.5	-41.2	177.1	-71.3	171.1	0	0	0	111.9	P442 V462 E463 C468 C469 L470	P442-L466 HydrophobicContact CG-CD2 3.91Å; V462-L466 HydrophobicContact CG1-CD1 4.28Å; V462-L466 PolarHBondContact O-N 3.06Å; V462-L466 VanDerWaalsContact O-N 3.07Å; E463-L466 PolarHBondContact O-N 2.95Å; L466-C468 VanDerWaalsContact C-N 3.31Å; L466-C468 PolarHBondContact O-N 3.17Å; L466-C469 WeakPolarHBondContact O-CB 3.46Å; L466-C469 PolarHBondContact O-N 3.2Å; L466-L470 PolarHBondContact O-N 2.95Å; L466-L470 VanDerWaalsContact O-N 3.09Å
467	T	85.3	Confident	80.5	Confident	73 Å²	73	65.5 Å²	65.5	45%	0.448	34%	0.341	S	S	.	.	H	α-helix	trans	-57.4	-44.6	173.7	-56.6	0	0	0	0	111.4	E463 T464 C469 L470 D471	E463-T467 PolarHBondContact O-N 3.12Å; E463-T467 PolarHBondContact O-OG1 3.46Å; E463-T467 VanDerWaalsContact O-OG1 3.05Å; T464-T467 PolarHBondContact O-N 2.93Å; T467-C469 PolarHBondContact O-N 2.68Å; T467-L470 WeakPolarHBondContact O-CB 3.44Å; T467-L470 PolarHBondContact O-N 3.46Å; T467-L470 VanDerWaalsContact O-N 3.11Å; T467-D471 PolarHBondContact O-N 3.33Å
468	C	86.1	Confident	82	Confident	54 Å²	54	67.5 Å²	67.5	37%	0.365	35%	0.351	S	S	.	.	H	α-helix	trans	-58.7	-35.8	175.4	-67.8	0	0	0	0	112.9	T464 M465 L466 D471 N472	T464-C468 PolarHBondContact O-N 2.87Å; T464-C468 VanDerWaalsContact O-N 3.08Å; T464-C468 PolarHBondContact O-SG 3.08Å; M465-C468 PolarHBondContact O-N 3.25Å; L466-C468 VanDerWaalsContact C-N 3.31Å; L466-C468 PolarHBondContact O-N 3.17Å; C468-D471 PolarHBondContact O-N 3.45Å; C468-N472 WeakPolarHBondContact O-CB 3.3Å; C468-N472 PolarHBondContact O-N 3.44Å; C468-N472 PolarHBondContact O-ND2 2.77Å; C468-N472 PolarHBondContact O-OD1 3.45Å
469	C	89.1	Confident	83.6	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-68.5	-38.8	177.2	-60.9	0	0	0	0	112	F440 M465 L466 T467 N472 E473 V508	F440-C469 HydrophobicContact CB-CB 4.25Å; M465-C469 PolarHBondContact O-N 3.31Å; M465-C469 PolarHBondContact O-SG 2.93Å; L466-C469 WeakPolarHBondContact O-CB 3.46Å; L466-C469 PolarHBondContact O-N 3.2Å; T467-C469 PolarHBondContact O-N 2.68Å; C469-N472 PolarHBondContact O-N 3.07Å; C469-E473 PolarHBondContact O-N 3.32Å; C469-V508 HydrophobicContact CB-CG1 3.79Å
470	L	89	Confident	84.7	Confident	88 Å²	88	63.5 Å²	63.5	46%	0.461	34%	0.337	S	S	.	.	H	α-helix	trans	-66.3	-38	174.3	-67.3	167.7	0	0	0	112	L466 T467 E473 R474 V508	L466-L470 PolarHBondContact O-N 2.95Å; L466-L470 VanDerWaalsContact O-N 3.09Å; T467-L470 WeakPolarHBondContact O-CB 3.44Å; T467-L470 PolarHBondContact O-N 3.46Å; T467-L470 VanDerWaalsContact O-N 3.11Å; L470-E473 PolarHBondContact O-N 3.46Å; L470-R474 WeakPolarHBondContact O-CB 3.33Å; L470-R474 PolarHBondContact O-N 3.38Å; L470-V508 HydrophobicContact CD2-CB 4.43Å; L470-V508 HydrophobicContact CD2-CG1 4.49Å; L470-V508 HydrophobicContact CD2-CG2 4.06Å
471	D	89.8	Confident	85.1	Confident	69 Å²	69	65 Å²	65	37%	0.369	34%	0.344	S	S	.	.	H	α-helix	trans	-67.7	-39	175.8	-69.6	-26.3	0	0	0	111.9	T467 C468 R474 S475	T467-D471 PolarHBondContact O-N 3.33Å; C468-D471 PolarHBondContact O-N 3.45Å; D471-R474 PolarHBondContact O-N 2.99Å; D471-S475 WeakPolarHBondContact O-CB 3.46Å; D471-S475 PolarHBondContact O-N 3.2Å; D471-S475 PolarHBondContact O-OG 3.38Å
472	N	92.1	Very high	84.3	Confident	9 Å²	9	65.3 Å²	65.3	5%	0.048	35%	0.352	C	S	.	.	H	α-helix	trans	-61.4	-45	172.5	-68.6	-24.4	0	0	0	111	A423 L427 F440 C468 C469 S475 W476	A423-N472 WeakPolarHBondContact CB-OD1 3.45Å; L427-N472 HydrophobicContact CD1-CB 4.32Å; L427-N472 WeakPolarHBondContact CD1-O 3.19Å; F440-N472 HydrophobicContact CD1-CB 3.54Å; F440-N472 HydrophobicContact CE1-CB 3.78Å; F440-N472 HydrophobicContact CG-CB 4.26Å; C468-N472 WeakPolarHBondContact O-CB 3.3Å; C468-N472 PolarHBondContact O-N 3.44Å; C468-N472 PolarHBondContact O-ND2 2.77Å; C468-N472 PolarHBondContact O-OD1 3.45Å; C469-N472 PolarHBondContact O-N 3.07Å; N472-S475 PolarHBondContact O-N 3.43Å; N472-W476 PolarHBondContact O-N 3.37Å
473	E	92.4	Very high	82.9	Confident	19 Å²	19	63.8 Å²	63.8	9%	0.089	35%	0.351	C	S	.	.	H	α-helix	trans	-60.5	-47.6	176.7	-169.3	-166.8	-155.7	0	0	111.6	F440 C469 L470 S475 W476 R477 S506 L507 V508	F440-E473 HydrophobicContact CD2-CB 3.76Å; F440-E473 HydrophobicContact CD2-CG 4.01Å; F440-E473 HydrophobicContact CE2-CB 4.05Å; F440-E473 HydrophobicContact CE2-CG 4.12Å; F440-E473 HydrophobicContact CG-CB 4.44Å; C469-E473 PolarHBondContact O-N 3.32Å; L470-E473 PolarHBondContact O-N 3.46Å; E473-S475 VanDerWaalsContact C-N 3.31Å; E473-S475 PolarHBondContact O-N 3.22Å; E473-W476 WeakPolarHBondContact O-CB 3.44Å; E473-W476 PolarHBondContact O-N 3.01Å; E473-R477 WeakPolarHBondContact O-CG 3.27Å; E473-R477 PolarHBondContact O-N 3.2Å; E473-R477 IonicContact OE1-CZ 3.14Å; E473-R477 IonicContact OE1-NE 3.92Å; E473-R477 IonicContact OE1-NH2 3.72Å; E473-R477 PolarHBondContact OE1-NH2 2.94Å; E473-R477 IonicContact OE2-CZ 3.29Å; E473-R477 IonicContact OE2-NH2 3.68Å; E473-R477 PolarHBondContact OE2-NH2 3.32Å; E473-S506 WeakPolarHBondContact CG-OG 3.43Å; E473-S506 PolarHBondContact OE1-OG 3.31Å; E473-L507 PolarHBondContact OE1-N 3.16Å; E473-V508 HydrophobicContact CB-CG2 3.78Å; E473-V508 HydrophobicContact CG-CG2 4.06Å; E473-V508 WeakPolarHBondContact OE2-CG2 3.43Å
474	R	90.3	Very high	81.2	Confident	158 Å²	158	65 Å²	65	60%	0.596	36%	0.361	S	S	*	.	H	α-helix	trans	-58.7	-44.8	176.9	-173.1	-174.2	-61.8	169.9	3.7	111.3	L470 D471 W476 R477 L478	L470-R474 WeakPolarHBondContact O-CB 3.33Å; L470-R474 PolarHBondContact O-N 3.38Å; D471-R474 PolarHBondContact O-N 2.99Å; R474-W476 VanDerWaalsContact C-N 3.33Å; R474-W476 PolarHBondContact O-N 3.18Å; R474-R477 PolarHBondContact O-N 3.28Å; R474-L478 HydrophobicContact CG-CD1 4.32Å; R474-L478 WeakPolarHBondContact O-CG 3.46Å; R474-L478 PolarHBondContact O-N 2.68Å
475	S	91.7	Very high	79.1	Confident	31 Å²	31	68.6 Å²	68.6	22%	0.217	38%	0.378	C	S	.	.	H	α-helix	trans	-61	-42.4	177.7	-58.5	0	0	0	0	111.5	D471 N472 E473 L478 L479	D471-S475 WeakPolarHBondContact O-CB 3.46Å; D471-S475 PolarHBondContact O-N 3.2Å; D471-S475 PolarHBondContact O-OG 3.38Å; N472-S475 PolarHBondContact O-N 3.43Å; E473-S475 VanDerWaalsContact C-N 3.31Å; E473-S475 PolarHBondContact O-N 3.22Å; S475-L478 PolarHBondContact O-N 3.05Å; S475-L479 WeakPolarHBondContact O-CB 3.3Å; S475-L479 VanDerWaalsContact O-CG 3.26Å; S475-L479 WeakPolarHBondContact O-CG 3.34Å; S475-L479 PolarHBondContact O-N 2.84Å
476	W	92.5	Very high	77	Confident	4 Å²	4	74.6 Å²	74.6	2%	0.015	40%	0.4	C	S	.	.	H	α-helix	trans	-62.4	-43.9	176.2	-178.8	-96	0	0	0	112.7	L413 L427 L430 L431 F435 A438 F440 N472 E473 R474 L479 S480 A504	L413-W476 HydrophobicContact CD2-CE3 4.29Å; L413-W476 HydrophobicContact CD2-CH2 4.15Å; L413-W476 HydrophobicContact CD2-CZ3 3.94Å; L427-W476 HydrophobicContact CB-CE3 4.15Å; L427-W476 HydrophobicContact CD2-CE3 3.79Å; L427-W476 HydrophobicContact CD2-CZ3 4.31Å; L427-W476 HydrophobicContact CG-CE3 4.47Å; L430-W476 HydrophobicContact CB-CZ3 4.22Å; L431-W476 HydrophobicContact CD2-CH2 4.03Å; L431-W476 HydrophobicContact CD2-CZ3 4.04Å; F435-W476 HydrophobicContact CB-CZ2 4.5Å; F435-W476 HydrophobicContact CD2-CH2 4.02Å; A438-W476 HydrophobicContact CB-CD2 4.04Å; A438-W476 HydrophobicContact CB-CG 4.09Å; A438-W476 HydrophobicContact CB-CZ2 4.14Å; F440-W476 HydrophobicContact CE2-CB 4.1Å; F440-W476 HydrophobicContact CE2-CG 4.34Å; F440-W476 HydrophobicContact CZ-CB 3.62Å; F440-W476 HydrophobicContact CZ-CD2 4.46Å; F440-W476 AromaticContact CZ-CG 3.94Å; F440-W476 HydrophobicContact CZ-CG 3.94Å; N472-W476 PolarHBondContact O-N 3.37Å; E473-W476 WeakPolarHBondContact O-CB 3.44Å; E473-W476 PolarHBondContact O-N 3.01Å; R474-W476 VanDerWaalsContact C-N 3.33Å; R474-W476 PolarHBondContact O-N 3.18Å; W476-L479 PolarHBondContact O-N 3.08Å; W476-S480 PolarHBondContact NE1-OG 3.46Å; W476-S480 WeakPolarHBondContact O-CB 3.3Å; W476-S480 PolarHBondContact O-N 3.41Å; W476-S480 PolarHBondContact O-OG 3.22Å; W476-A504 HydrophobicContact CZ2-CB 4.13Å
477	R	89.3	Confident	74.5	Confident	120 Å²	120	77.6 Å²	77.6	45%	0.453	42%	0.423	S	S	.	.	H	α-helix	trans	-61.4	-47.1	176.9	-69.4	-178.8	-171.8	167.6	3.4	111.7	E473 R474 L479 S480 D481 S506	E473-R477 WeakPolarHBondContact O-CG 3.27Å; E473-R477 PolarHBondContact O-N 3.2Å; E473-R477 IonicContact OE1-CZ 3.14Å; E473-R477 IonicContact OE1-NE 3.92Å; E473-R477 IonicContact OE1-NH2 3.72Å; E473-R477 PolarHBondContact OE1-NH2 2.94Å; E473-R477 IonicContact OE2-CZ 3.29Å; E473-R477 IonicContact OE2-NH2 3.68Å; E473-R477 PolarHBondContact OE2-NH2 3.32Å; R474-R477 PolarHBondContact O-N 3.28Å; R477-L479 VanDerWaalsContact C-N 3.3Å; R477-L479 PolarHBondContact O-N 2.85Å; R477-S480 PolarHBondContact O-N 3.33Å; R477-S480 VanDerWaalsContact O-N 3.12Å; R477-D481 WeakPolarHBondContact O-CB 3.47Å; R477-D481 PolarHBondContact O-N 2.92Å; R477-S506 PolarHBondContact NE-OG 3.23Å
478	L	89.5	Confident	71.8	Confident	123 Å²	123	78 Å²	78	64%	0.644	43%	0.434	S	S	*	.	H	α-helix	trans	-59.3	-41.2	177.2	-70.8	171.4	0	0	0	112.3	R474 S475 S480 G482	R474-L478 HydrophobicContact CG-CD1 4.32Å; R474-L478 WeakPolarHBondContact O-CG 3.46Å; R474-L478 PolarHBondContact O-N 2.68Å; S475-L478 PolarHBondContact O-N 3.05Å; L478-S480 VanDerWaalsContact C-N 3.34Å; L478-G482 PolarHBondContact O-N 3.38Å
479	L	88.4	Confident	69.2	Low	52 Å²	52	81.4 Å²	81.4	27%	0.272	46%	0.455	S	S	.	.	H	α-helix	trans	-70.2	-30.7	177.1	-72.4	169.5	0	0	0	113.1	L427 K428 L431 S475 W476 R477	L427-L479 HydrophobicContact CB-CD1 3.98Å; K428-L479 HydrophobicContact CB-CD1 4.09Å; K428-L479 HydrophobicContact CB-CD2 4.16Å; K428-L479 HydrophobicContact CD-CD2 4.3Å; K428-L479 HydrophobicContact CG-CD2 4.19Å; L431-L479 HydrophobicContact CD1-CB 4.38Å; L431-L479 HydrophobicContact CD2-CB 4.41Å; S475-L479 WeakPolarHBondContact O-CB 3.3Å; S475-L479 VanDerWaalsContact O-CG 3.26Å; S475-L479 WeakPolarHBondContact O-CG 3.34Å; S475-L479 PolarHBondContact O-N 2.84Å; W476-L479 PolarHBondContact O-N 3.08Å; R477-L479 VanDerWaalsContact C-N 3.3Å; R477-L479 PolarHBondContact O-N 2.85Å
480	S	79.4	Confident	66.5	Low	38 Å²	38	89.4 Å²	89.4	27%	0.266	50%	0.497	S	S	.	.	H	α-helix	trans	-82.7	-24	-179.2	-56.1	0	0	0	0	113	W476 R477 L478	W476-S480 PolarHBondContact NE1-OG 3.46Å; W476-S480 WeakPolarHBondContact O-CB 3.3Å; W476-S480 PolarHBondContact O-N 3.41Å; W476-S480 PolarHBondContact O-OG 3.22Å; R477-S480 PolarHBondContact O-N 3.33Å; R477-S480 VanDerWaalsContact O-N 3.12Å; L478-S480 VanDerWaalsContact C-N 3.34Å
481	D	71.9	Confident	63.6	Low	96 Å²	96	92.5 Å²	92.5	51%	0.513	51%	0.513	S	S	.	.	H	α-helix	trans	-91.8	-15.8	-179.8	-75.2	-26.1	0	0	0	113.6	R477 K503	R477-D481 WeakPolarHBondContact O-CB 3.47Å; R477-D481 PolarHBondContact O-N 2.92Å; D481-K503 WeakPolarHBondContact OD1-CE 3.35Å; D481-K503 IonicContact OD1-NZ 3.59Å; D481-K503 PolarHBondContact OD1-NZ 3.3Å; D481-K503 IonicContact OD2-NZ 2.7Å
482	G	56.7	Low	60.7	Low	58 Å²	58	96.8 Å²	96.8	60%	0.598	53%	0.534	S	S	*	.			trans	-99.2	43.3	-170	0	0	0	0	0	117	L478 D484	L478-G482 PolarHBondContact O-N 3.38Å; G482-D484 VanDerWaalsContact C-N 3.26Å; G482-D484 PolarHBondContact O-N 3.17Å
483	G	47.4	Very low	57.8	Low	42 Å²	42	107.5 Å²	107.5	43%	0.433	57%	0.574	S	S	.	*			trans	-64.2	14.9	-169.1	0	0	0	0	0	120.3
484	D	41.3	Very low	54.7	Low	160 Å²	160	114.6 Å²	114.6	86%	0.856	61%	0.612	S	S	*	*			trans	-117.3	23	-161.4	-101.6	-12.2	0	0	0	118	G482	G482-D484 VanDerWaalsContact C-N 3.26Å; G482-D484 PolarHBondContact O-N 3.17Å
485	D	35.9	Very low	51.8	Low	150 Å²	150	110.2 Å²	110.2	80%	0.802	62%	0.616	S	S	*	*			trans	-149.8	86.4	170.6	-136.1	-2	0	0	0	113.6
486	Y	35.5	Very low	48.8	Very low	165 Å²	165	115.2 Å²	115.2	65%	0.647	65%	0.648	S	S	*	*			trans	-123.3	122.7	164.4	-79.3	-79.8	0	0	0	109.9	A488	Y486-A488 PolarHBondContact O-N 2.94Å
487	P	30.7	Very low	45.6	Very low	121 Å²	121	118.9 Å²	118.9	79%	0.786	68%	0.68	S	S	*	*			trans	-72.7	112.8	165.1	23.2	-19.1	0	0	0	108.3
488	A	28.3	Very low	42.9	Very low	82 Å²	82	119.5 Å²	119.5	68%	0.678	70%	0.699	S	S	*	*			trans	-56.1	141.1	173.2	0	0	0	0	0	110.9	Y486 L490	Y486-A488 PolarHBondContact O-N 2.94Å; A488-L490 PolarHBondContact O-N 2.98Å
489	P	32.5	Very low	40.3	Very low	125 Å²	125	121.3 Å²	121.3	81%	0.812	71%	0.708	S	S	*	*			trans	-65.9	124.9	158.7	0.9	14	0	0	0	107.6	L491	P489-L491 PolarHBondContact O-N 2.92Å; P489-L491 VanDerWaalsContact O-N 3.11Å
490	L	31.9	Very low	37.8	Very low	167 Å²	167	123.2 Å²	123.2	87%	0.874	73%	0.732	S	S	*	*			trans	-49.3	115.9	166.6	-72	157.9	0	0	0	109.4	A488	A488-L490 PolarHBondContact O-N 2.98Å
491	L	28.7	Very low	35.9	Very low	154 Å²	154	129.4 Å²	129.4	81%	0.806	76%	0.756	S	S	*	*				161.4	129.8	122.6	-83	166.9	0	0	0	113.5	P489	P489-L491 PolarHBondContact O-N 2.92Å; P489-L491 VanDerWaalsContact O-N 3.11Å
492	I	27.6	Very low	34.7	Very low	158 Å²	158	134 Å²	134	81%	0.81	77%	0.767	S	S	*	*			trans	78.5	101.3	159.3	-52.4	164.7	0	0	0	117.2
493	R	31.5	Very low	34.7	Very low	235 Å²	235	138.6 Å²	138.6	89%	0.887	77%	0.77	S	S	*	*			trans	-66.1	120	160.2	-82.8	177.2	163.9	177.4	-5.3	109.3
494	D	28.2	Very low	35.3	Very low	167 Å²	167	137.2 Å²	137.2	89%	0.893	76%	0.755	S	S	*	*			trans	172.7	89.9	134.1	-83.4	-20	0	0	0	108.5
495	G	29.7	Very low	37.1	Very low	66 Å²	66	132.9 Å²	132.9	68%	0.68	73%	0.732	S	S	*	*	S	Bend	trans	-153.4	150.1	176.2	0	0	0	0	0	110.1
496	P	27.4	Very low	39.6	Very low	136 Å²	136	126 Å²	126	88%	0.883	70%	0.695	S	S	*	*			trans	-64.2	152.6	-171.3	27.2	-32.6	0	0	0	111.7
497	A	26.5	Very low	42.2	Very low	82 Å²	82	118.9 Å²	118.9	68%	0.678	67%	0.668	S	S	*	*			trans	-43.9	146.3	-170.1	0	0	0	0	0	115.2	L499	A497-L499 PolarHBondContact O-N 3.26Å; A497-L499 VanDerWaalsContact O-N 3.15Å
498	P	32	Very low	45	Very low	132 Å²	132	115 Å²	115	86%	0.857	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-60.8	118.9	178.4	24.3	-31.1	0	0	0	110.3
499	L	34.4	Very low	47.9	Very low	161 Å²	161	111.5 Å²	111.5	84%	0.843	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-63.1	133.2	173.2	-77.5	155.3	0	0	0	109.7	A497	A497-L499 PolarHBondContact O-N 3.26Å; A497-L499 VanDerWaalsContact O-N 3.15Å
500	A	35.2	Very low	50.3	Low	93 Å²	93	108.2 Å²	108.2	77%	0.769	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-46.4	138.8	-174.8	0	0	0	0	0	114.5	R502	A500-R502 PolarHBondContact O-N 3.01Å
501	E	40.6	Very low	53	Low	167 Å²	167	100.4 Å²	100.4	78%	0.78	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-58.5	123.2	177	-65.9	-178.6	156.1	0	0	111.2
502	R	46.8	Very low	55.9	Low	193 Å²	193	93.1 Å²	93.1	73%	0.728	51%	0.512	S	S	*	.			trans	-90.5	114	173.8	-76.9	-172.4	178.8	-173.7	1.7	109.5	D436 A500 A504	D436-R502 IonicContact OD1-CZ 3.97Å; D436-R502 IonicContact OD1-NH1 3.41Å; D436-R502 PolarHBondContact OD1-NH1 3.07Å; A500-R502 PolarHBondContact O-N 3.01Å; R502-A504 PolarHBondContact O-N 3.31Å
503	K	56.4	Low	58.9	Low	155 Å²	155	86.6 Å²	86.6	67%	0.674	48%	0.478	S	S	*	.			trans	-74.8	113.9	172.5	-169.6	168.1	-178.2	145.5	0	109.6	D481	D481-K503 WeakPolarHBondContact OD1-CE 3.35Å; D481-K503 IonicContact OD1-NZ 3.59Å; D481-K503 PolarHBondContact OD1-NZ 3.3Å; D481-K503 IonicContact OD2-NZ 2.7Å
504	A	60.3	Low	61.6	Low	13 Å²	13	76 Å²	76	11%	0.107	44%	0.44	C	S	.	.			trans	-80.3	123.7	179.6	0	0	0	0	0	110.8	F435 W476 R502	F435-A504 VanDerWaalsContact O-CB 3.26Å; F435-A504 WeakPolarHBondContact O-CB 3.41Å; W476-A504 HydrophobicContact CZ2-CB 4.13Å; R502-A504 PolarHBondContact O-N 3.31Å
505	D	79.4	Confident	64.6	Low	69 Å²	69	68 Å²	68	37%	0.369	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	141.6	175.8	-104.6	-39.1	0	0	0	110.9	D436 L437 A438 K544	D436-D505 PolarHBondContact O-N 3.1Å; L437-D505 CarbonylContact C-O 3.43Å; L437-D505 WeakPolarHBondContact CA-O 3.35Å; L437-D505 HydrophobicContact CD2-CB 3.62Å; A438-D505 PolarHBondContact N-O 2.92Å; D505-K544 HydrophobicContact CB-CD 4.28Å; D505-K544 VanDerWaalsContact CG-NZ 3.32Å; D505-K544 WeakPolarHBondContact OD1-CE 3.45Å; D505-K544 IonicContact OD1-NZ 2.94Å; D505-K544 PolarHBondContact OD1-NZ 2.78Å; D505-K544 WeakPolarHBondContact OD2-CE 3.49Å; D505-K544 IonicContact OD2-NZ 2.7Å
506	S	87.8	Confident	67.6	Low	5 Å²	5	64.9 Å²	64.9	4%	0.035	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	150.5	-179.7	77.2	0	0	0	0	113.7	A438 E473 R477 K544	A438-S506 CarbonylContact O-C 3.57Å; A438-S506 VanDerWaalsContact O-CA 3.24Å; A438-S506 WeakPolarHBondContact O-CA 3.32Å; E473-S506 WeakPolarHBondContact CG-OG 3.43Å; E473-S506 PolarHBondContact OE1-OG 3.31Å; R477-S506 PolarHBondContact NE-OG 3.23Å; S506-K544 PolarHBondContact O-NZ 2.91Å
507	L	90.2	Very high	70.6	Confident	15 Å²	15	60 Å²	60	8%	0.079	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	150.2	-179.9	-69.9	166.9	0	0	0	112.3	A438 V439 F440 E473 F509 W518 M541 K544	A438-L507 PolarHBondContact O-N 3.27Å; V439-L507 WeakPolarHBondContact CA-O 3.48Å; F440-L507 PolarHBondContact N-O 3.32Å; E473-L507 PolarHBondContact OE1-N 3.16Å; L507-F509 HydrophobicContact CB-CD2 4.42Å; L507-F509 HydrophobicContact CB-CE2 3.78Å; L507-F509 HydrophobicContact CD1-CE2 4.21Å; L507-F509 HydrophobicContact CD1-CZ 4.44Å; L507-W518 HydrophobicContact CD1-CD2 4.4Å; L507-W518 HydrophobicContact CD1-CE3 4.24Å; L507-W518 HydrophobicContact CD1-CH2 3.18Å; L507-W518 HydrophobicContact CD1-CZ2 3.33Å; L507-W518 HydrophobicContact CD1-CZ3 3.66Å; L507-M541 HydrophobicContact CD2-CG 3.87Å; L507-K544 HydrophobicContact CD1-CD 4.23Å; L507-K544 HydrophobicContact CD2-CD 3.98Å; L507-K544 HydrophobicContact CG-CD 4.18Å
508	V	89.1	Confident	73.7	Confident	39 Å²	39	56.8 Å²	56.8	24%	0.236	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	134.8	173.1	-175.1	0	0	0	0	110.7	F440 C469 L470 E473	F440-V508 HydrophobicContact CB-CG2 4.27Å; F440-V508 CarbonylContact O-C 3.57Å; F440-V508 VanDerWaalsContact O-CA 3.29Å; F440-V508 WeakPolarHBondContact O-CA 3.22Å; C469-V508 HydrophobicContact CB-CG1 3.79Å; L470-V508 HydrophobicContact CD2-CB 4.43Å; L470-V508 HydrophobicContact CD2-CG1 4.49Å; L470-V508 HydrophobicContact CD2-CG2 4.06Å; E473-V508 HydrophobicContact CB-CG2 3.78Å; E473-V508 HydrophobicContact CG-CG2 4.06Å; E473-V508 WeakPolarHBondContact OE2-CG2 3.43Å
509	F	88.8	Confident	76.6	Confident	9 Å²	9	50.6 Å²	50.6	4%	0.039	26%	0.264	C	S	.	.			trans	-120.8	151.1	179.2	-73.3	-96.8	0	0	0	111.7	V439 F440 C441 P442 L507 S511 A515 W518 M541	V439-F509 HydrophobicContact CG1-CD2 3.49Å; V439-F509 VanDerWaalsContact CG1-CD2 3.49Å; V439-F509 HydrophobicContact CG1-CE2 3.72Å; F440-F509 PolarHBondContact O-N 3.07Å; C441-F509 HydrophobicContact CB-CB 4.18Å; P442-F509 WeakPolarHBondContact CD-O 3.44Å; L507-F509 HydrophobicContact CB-CD2 4.42Å; L507-F509 HydrophobicContact CB-CE2 3.78Å; L507-F509 HydrophobicContact CD1-CE2 4.21Å; L507-F509 HydrophobicContact CD1-CZ 4.44Å; F509-S511 VanDerWaalsContact C-N 3.33Å; F509-S511 PolarHBondContact O-N 3.33Å; F509-A515 HydrophobicContact CB-CB 3.94Å; F509-A515 HydrophobicContact CD2-CB 4.12Å; F509-A515 HydrophobicContact CG-CB 3.96Å; F509-W518 HydrophobicContact CE1-CB 3.56Å; F509-W518 HydrophobicContact CE1-CD2 4.34Å; F509-W518 AromaticContact CE1-CG 3.74Å; F509-W518 HydrophobicContact CE1-CG 3.74Å; F509-W518 HydrophobicContact CE2-CD2 4.25Å; F509-W518 HydrophobicContact CE2-CE3 4.11Å; F509-W518 HydrophobicContact CE2-CG 4.47Å; F509-W518 HydrophobicContact CZ-CB 3.6Å; F509-W518 AromaticContact CZ-CD1 3.94Å; F509-W518 AromaticContact CZ-CD2 3.5Å; F509-W518 HydrophobicContact CZ-CD2 3.5Å; F509-W518 VanDerWaalsContact CZ-CD2 3.5Å; F509-W518 AromaticContact CZ-CE3 3.81Å; F509-W518 HydrophobicContact CZ-CE3 3.81Å; F509-W518 AromaticContact CZ-CG 3.38Å; F509-W518 HydrophobicContact CZ-CG 3.38Å; F509-M541 HydrophobicContact CD1-CE 4.24Å; F509-M541 HydrophobicContact CE1-CE 3.35Å; F509-M541 HydrophobicContact CE2-CE 4.32Å; F509-M541 HydrophobicContact CZ-CE 3.4Å
510	P	84.3	Confident	79.3	Confident	57 Å²	57	43 Å²	43	37%	0.37	22%	0.224	S	C	.	.	S	Bend	trans	-75.6	-18.7	-177.8	30.7	-36.6	0	0	0	114	P442 T447 S514	P442-P510 WeakPolarHBondContact CG-O 3.37Å; T447-P510 HydrophobicContact CG2-CB 3.96Å; T447-P510 HydrophobicContact CG2-CG 3.98Å; P510-S514 WeakPolarHBondContact CD-OG 3.36Å
511	S	87.1	Confident	81.9	Confident	3 Å²	3	41 Å²	41	2%	0.021	20%	0.199	C	C	.	.	S	Bend	trans	-152.6	162.5	179.8	67.2	0	0	0	0	112.5	I444 F509 S514 A515	I444-S511 WeakPolarHBondContact O-CA 3.11Å; I444-S511 WeakPolarHBondContact O-CB 3.34Å; F509-S511 VanDerWaalsContact C-N 3.33Å; F509-S511 PolarHBondContact O-N 3.33Å; S511-S514 PolarHBondContact N-OG 3.21Å; S511-S514 VanDerWaalsContact N-OG 3.14Å; S511-S514 PolarHBondContact O-N 2.95Å; S511-S514 PolarHBondContact O-OG 3.09Å; S511-S514 WeakPolarHBondContact OG-CB 3.43Å; S511-S514 PolarHBondContact OG-N 3.1Å; S511-S514 PolarHBondContact OG-OG 3.09Å; S511-A515 PolarHBondContact O-N 3.23Å; S511-A515 VanDerWaalsContact O-N 3.14Å
512	I	90.8	Very high	84	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-59.2	-48.6	175.1	-63.7	173.3	0	0	0	110.7	I444 T445 S514 A515 L516 L564 V568	I444-I512 WeakPolarHBondContact O-CG1 3.27Å; I444-I512 PolarHBondContact O-N 3.18Å; T445-I512 HydrophobicContact CG2-CD1 4.32Å; I512-S514 PolarHBondContact O-N 3.49Å; I512-A515 WeakPolarHBondContact O-CB 3.39Å; I512-A515 PolarHBondContact O-N 3.25Å; I512-A515 VanDerWaalsContact O-N 3.17Å; I512-L516 HydrophobicContact CG2-CD1 3.84Å; I512-L516 HydrophobicContact CG2-CG 4.16Å; I512-L516 WeakPolarHBondContact O-CG 3.18Å; I512-L516 PolarHBondContact O-N 2.83Å; I512-L564 HydrophobicContact CD1-CD1 3.89Å; I512-L564 HydrophobicContact CG1-CD1 3.81Å; I512-V568 HydrophobicContact CG2-CB 4.38Å; I512-V568 HydrophobicContact CG2-CG2 3.54Å
513	L	89.8	Confident	85.9	Confident	21 Å²	21	29.7 Å²	29.7	11%	0.11	17%	0.166	C	C	.	.	H	α-helix	trans	-57	-47.8	179.2	178.7	62.7	0	0	0	111.7	T445 E446 A515 L516 C517 L527	T445-L513 VanDerWaalsContact O-CB 3.26Å; T445-L513 WeakPolarHBondContact O-CB 3.41Å; T445-L513 PolarHBondContact O-N 3.42Å; E446-L513 HydrophobicContact CG-CB 4.46Å; E446-L513 HydrophobicContact CG-CD2 3.77Å; L513-A515 VanDerWaalsContact C-N 3.29Å; L513-A515 PolarHBondContact O-N 3.04Å; L513-L516 PolarHBondContact O-N 3.01Å; L513-L516 VanDerWaalsContact O-N 3.17Å; L513-C517 PolarHBondContact O-N 3.37Å; L513-C517 PolarHBondContact O-SG 3.31Å; L513-C517 VanDerWaalsContact O-SG 3.34Å; L513-L527 HydrophobicContact CD1-CD2 4.4Å
514	S	88.3	Confident	87.4	Confident	11 Å²	11	22.3 Å²	22.3	8%	0.077	13%	0.133	C	C	.	.	H	α-helix	trans	-61.2	-36.9	179	60	0	0	0	0	113.1	P510 S511 I512 W518	P510-S514 WeakPolarHBondContact CD-OG 3.36Å; S511-S514 PolarHBondContact N-OG 3.21Å; S511-S514 VanDerWaalsContact N-OG 3.14Å; S511-S514 PolarHBondContact O-N 2.95Å; S511-S514 PolarHBondContact O-OG 3.09Å; S511-S514 WeakPolarHBondContact OG-CB 3.43Å; S511-S514 PolarHBondContact OG-N 3.1Å; S511-S514 PolarHBondContact OG-OG 3.09Å; I512-S514 PolarHBondContact O-N 3.49Å; S514-W518 WeakPolarHBondContact O-CB 3.48Å; S514-W518 PolarHBondContact O-N 3.33Å
515	A	91.9	Very high	88.4	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-67.7	-45.9	174.7	0	0	0	0	0	111.1	L414 V439 C441 F509 S511 I512 L513 W518 I519	L414-A515 HydrophobicContact CD1-CB 4.02Å; V439-A515 HydrophobicContact CG1-CB 3.92Å; C441-A515 HydrophobicContact CB-CB 4.35Å; F509-A515 HydrophobicContact CB-CB 3.94Å; F509-A515 HydrophobicContact CD2-CB 4.12Å; F509-A515 HydrophobicContact CG-CB 3.96Å; S511-A515 PolarHBondContact O-N 3.23Å; S511-A515 VanDerWaalsContact O-N 3.14Å; I512-A515 WeakPolarHBondContact O-CB 3.39Å; I512-A515 PolarHBondContact O-N 3.25Å; I512-A515 VanDerWaalsContact O-N 3.17Å; L513-A515 VanDerWaalsContact C-N 3.29Å; L513-A515 PolarHBondContact O-N 3.04Å; A515-W518 PolarHBondContact O-N 2.58Å; A515-I519 VanDerWaalsContact O-CG1 3.22Å; A515-I519 WeakPolarHBondContact O-CG1 3.44Å; A515-I519 PolarHBondContact O-N 2.81Å
516	L	93.1	Very high	88.7	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.7	-45.7	179.9	-72.4	177.9	0	0	0	112.2	Y376 L414 I512 L513 W518 I519 A520 L527 V568 H571 L572	Y376-L516 HydrophobicContact CE1-CD2 4.02Å; L414-L516 HydrophobicContact CD2-CD2 4.16Å; I512-L516 HydrophobicContact CG2-CD1 3.84Å; I512-L516 HydrophobicContact CG2-CG 4.16Å; I512-L516 WeakPolarHBondContact O-CG 3.18Å; I512-L516 PolarHBondContact O-N 2.83Å; L513-L516 PolarHBondContact O-N 3.01Å; L513-L516 VanDerWaalsContact O-N 3.17Å; L516-W518 VanDerWaalsContact C-N 3.31Å; L516-W518 PolarHBondContact O-N 3.25Å; L516-I519 PolarHBondContact O-N 3.1Å; L516-A520 VanDerWaalsContact O-CB 3.25Å; L516-A520 WeakPolarHBondContact O-CB 3.22Å; L516-A520 PolarHBondContact O-N 3.29Å; L516-L527 HydrophobicContact CB-CD1 3.81Å; L516-L527 HydrophobicContact CB-CD2 4.3Å; L516-L527 HydrophobicContact CD1-CD2 4.33Å; L516-V568 HydrophobicContact CD1-CB 4.45Å; L516-V568 HydrophobicContact CD1-CG1 4.2Å; L516-V568 HydrophobicContact CD1-CG2 4.25Å; L516-V568 HydrophobicContact CD2-CG1 4.17Å; L516-V568 HydrophobicContact CD2-CG2 4.27Å; L516-H571 HydrophobicContact CD1-CB 4Å; L516-L572 HydrophobicContact CD1-CD2 4.49Å
517	C	90.4	Very high	88.5	Confident	35 Å²	35	26.1 Å²	26.1	24%	0.236	16%	0.159	C	C	.	.	H	α-helix	trans	-60.9	-41.4	177.1	-65.7	0	0	0	0	111.5	L513 A520 Q521	L513-C517 PolarHBondContact O-N 3.37Å; L513-C517 PolarHBondContact O-SG 3.31Å; L513-C517 VanDerWaalsContact O-SG 3.34Å; C517-A520 PolarHBondContact O-N 2.94Å; C517-Q521 PolarHBondContact O-N 3.47Å; C517-Q521 VanDerWaalsContact O-N 3.1Å
518	W	90.8	Very high	87.3	Confident	14 Å²	14	29 Å²	29	5%	0.053	18%	0.177	C	C	.	.	H	α-helix	trans	-68.1	-37.8	175.5	-175.9	89.8	0	0	0	112.5	L437 V439 L507 F509 S514 A515 L516 Q521 M541 K544 A545 L548	L437-W518 HydrophobicContact CD1-CH2 3.9Å; L437-W518 HydrophobicContact CD1-CZ3 4.27Å; V439-W518 HydrophobicContact CG2-CE3 4.47Å; V439-W518 HydrophobicContact CG2-CZ3 4.05Å; L507-W518 HydrophobicContact CD1-CD2 4.4Å; L507-W518 HydrophobicContact CD1-CE3 4.24Å; L507-W518 HydrophobicContact CD1-CH2 3.18Å; L507-W518 HydrophobicContact CD1-CZ2 3.33Å; L507-W518 HydrophobicContact CD1-CZ3 3.66Å; F509-W518 HydrophobicContact CE1-CB 3.56Å; F509-W518 HydrophobicContact CE1-CD2 4.34Å; F509-W518 AromaticContact CE1-CG 3.74Å; F509-W518 HydrophobicContact CE1-CG 3.74Å; F509-W518 HydrophobicContact CE2-CD2 4.25Å; F509-W518 HydrophobicContact CE2-CE3 4.11Å; F509-W518 HydrophobicContact CE2-CG 4.47Å; F509-W518 HydrophobicContact CZ-CB 3.6Å; F509-W518 AromaticContact CZ-CD1 3.94Å; F509-W518 AromaticContact CZ-CD2 3.5Å; F509-W518 HydrophobicContact CZ-CD2 3.5Å; F509-W518 VanDerWaalsContact CZ-CD2 3.5Å; F509-W518 AromaticContact CZ-CE3 3.81Å; F509-W518 HydrophobicContact CZ-CE3 3.81Å; F509-W518 AromaticContact CZ-CG 3.38Å; F509-W518 HydrophobicContact CZ-CG 3.38Å; S514-W518 WeakPolarHBondContact O-CB 3.48Å; S514-W518 PolarHBondContact O-N 3.33Å; A515-W518 PolarHBondContact O-N 2.58Å; L516-W518 VanDerWaalsContact C-N 3.31Å; L516-W518 PolarHBondContact O-N 3.25Å; W518-Q521 WeakPolarHBondContact O-CG 3.42Å; W518-Q521 PolarHBondContact O-NE2 2.93Å; W518-M541 PolarHBondContact NE1-O 2.91Å; W518-K544 HydrophobicContact CZ2-CB 4.05Å; W518-A545 HydrophobicContact CZ2-CB 4.35Å; W518-L548 HydrophobicContact CD2-CD1 4.38Å; W518-L548 HydrophobicContact CE3-CD1 3.93Å; W518-L548 HydrophobicContact CH2-CD1 3.66Å; W518-L548 HydrophobicContact CZ2-CD1 4.15Å; W518-L548 HydrophobicContact CZ3-CD1 3.55Å
519	I	92.9	Very high	85.6	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-68.4	-40.5	176.2	-68.2	168.2	0	0	0	110.9	V412 L414 V439 A515 L516 V554 V556	V412-I519 HydrophobicContact CG1-CD1 3.89Å; V412-I519 HydrophobicContact CG1-CG1 4.05Å; V412-I519 HydrophobicContact CG2-CG2 4.41Å; L414-I519 HydrophobicContact CB-CD1 4.47Å; V439-I519 HydrophobicContact CB-CD1 4.37Å; V439-I519 HydrophobicContact CG1-CD1 4.42Å; V439-I519 HydrophobicContact CG2-CD1 4.17Å; V439-I519 HydrophobicContact CG2-CG1 4.3Å; A515-I519 VanDerWaalsContact O-CG1 3.22Å; A515-I519 WeakPolarHBondContact O-CG1 3.44Å; A515-I519 PolarHBondContact O-N 2.81Å; L516-I519 PolarHBondContact O-N 3.1Å; I519-V554 HydrophobicContact CG2-CG1 4.34Å; I519-V556 HydrophobicContact CD1-CG1 4.26Å; I519-V556 HydrophobicContact CG2-CG1 4.34Å; I519-V556 HydrophobicContact CG2-CG2 3.48Å; I519-V556 VanDerWaalsContact CG2-CG2 3.48Å
520	A	91.8	Very high	83.4	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.008	22%	0.223	C	C	.	.	H	α-helix	trans	-74.4	-28.5	-173.8	0	0	0	0	0	113.3	L374 L516 C517 G522 R523 D524 L527	L374-A520 HydrophobicContact CD1-CB 3.85Å; L516-A520 VanDerWaalsContact O-CB 3.25Å; L516-A520 WeakPolarHBondContact O-CB 3.22Å; L516-A520 PolarHBondContact O-N 3.29Å; C517-A520 PolarHBondContact O-N 2.94Å; A520-G522 PolarHBondContact O-N 3.47Å; A520-G522 VanDerWaalsContact O-N 3.13Å; A520-R523 WeakPolarHBondContact O-CB 3.46Å; A520-R523 VanDerWaalsContact O-CG 3.24Å; A520-R523 WeakPolarHBondContact O-CG 3.4Å; A520-R523 PolarHBondContact O-N 3.45Å; A520-D524 HydrophobicContact CB-CB 4.11Å; A520-L527 HydrophobicContact CB-CD1 3.83Å
521	Q	89.5	Confident	81.5	Confident	53 Å²	53	37.7 Å²	37.7	25%	0.248	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	38.4	-178.9	-64.6	-66.9	-51.4	0	0	112.7	C517 W518 R523 L548 Q549	C517-Q521 PolarHBondContact O-N 3.47Å; C517-Q521 VanDerWaalsContact O-N 3.1Å; W518-Q521 WeakPolarHBondContact O-CG 3.42Å; W518-Q521 PolarHBondContact O-NE2 2.93Å; Q521-R523 VanDerWaalsContact C-N 3.27Å; Q521-R523 PolarHBondContact O-N 3.39Å; Q521-L548 HydrophobicContact CG-CB 3.79Å; Q521-L548 HydrophobicContact CG-CD1 4.27Å; Q521-Q549 HydrophobicContact CB-CG 4.38Å; Q521-Q549 HydrophobicContact CG-CG 4.22Å
522	G	84.4	Confident	79.8	Confident	53 Å²	53	41.8 Å²	41.8	55%	0.546	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	4.9	-178.7	0	0	0	0	0	115.9	A520	A520-G522 PolarHBondContact O-N 3.47Å; A520-G522 VanDerWaalsContact O-N 3.13Å
523	R	87.1	Confident	77.5	Confident	68 Å²	68	48.1 Å²	48.1	26%	0.257	30%	0.296	S	S	.	.			trans	-78.5	-18.8	178.9	-59.4	168.9	177	-145.6	-7.4	113.7	L374 A520 Q521 L548 Q549 A551	L374-R523 HydrophobicContact CD1-CB 3.68Å; L374-R523 HydrophobicContact CG-CB 4.31Å; A520-R523 WeakPolarHBondContact O-CB 3.46Å; A520-R523 VanDerWaalsContact O-CG 3.24Å; A520-R523 WeakPolarHBondContact O-CG 3.4Å; A520-R523 PolarHBondContact O-N 3.45Å; Q521-R523 VanDerWaalsContact C-N 3.27Å; Q521-R523 PolarHBondContact O-N 3.39Å; R523-L548 PolarHBondContact NH2-O 3.06Å; R523-Q549 PolarHBondContact NH2-O 3.16Å; R523-A551 VanDerWaalsContact CZ-O 3.22Å; R523-A551 PolarHBondContact NH1-O 3.32Å; R523-A551 PolarHBondContact NH2-O 3.39Å
524	D	87.2	Confident	75.5	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	32%	0.318	C	S	.	.			trans	-101.9	111.6	175.4	-164.3	-29.8	0	0	0	110.1	R371 L374 A520 V526 L527	R371-D524 WeakPolarHBondContact CG-OD2 3.43Å; L374-D524 HydrophobicContact CD1-CB 3.81Å; A520-D524 HydrophobicContact CB-CB 4.11Å; D524-V526 PolarHBondContact O-N 3.47Å; D524-V526 WeakPolarHBondContact OD1-CB 3.46Å; D524-V526 PolarHBondContact OD1-N 3.36Å; D524-L527 HydrophobicContact CB-CB 4.43Å; D524-L527 HydrophobicContact CB-CD1 4.03Å; D524-L527 HydrophobicContact CB-CG 4.23Å; D524-L527 PolarHBondContact O-N 3.06Å
525	P	82.2	Confident	73.6	Confident	95 Å²	95	52.9 Å²	52.9	62%	0.617	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-66.2	-21.9	-177.5	27.4	-35.2	0	0	0	113.4	L527 T528	P525-L527 PolarHBondContact O-N 3.47Å; P525-T528 VanDerWaalsContact CA-OG1 3.29Å; P525-T528 WeakPolarHBondContact CA-OG1 3.34Å; P525-T528 PolarHBondContact O-N 2.86Å; P525-T528 PolarHBondContact O-OG1 3.23Å
526	V	85	Confident	71.5	Confident	59 Å²	59	59.1 Å²	59.1	36%	0.358	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-71.6	-25.7	179.2	-173.1	0	0	0	0	111	D524 H571 P574	D524-V526 PolarHBondContact O-N 3.47Å; D524-V526 WeakPolarHBondContact OD1-CB 3.46Å; D524-V526 PolarHBondContact OD1-N 3.36Å; V526-H571 WeakPolarHBondContact CG1-O 3.29Å; V526-P574 HydrophobicContact CG1-CG 4.43Å
527	L	83.4	Confident	69.6	Low	14 Å²	14	62.5 Å²	62.5	7%	0.073	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-92.8	-6.8	179.8	-61.3	176.6	0	0	0	113.2	L513 L516 A520 D524 P525 D529 H571 L572	L513-L527 HydrophobicContact CD1-CD2 4.4Å; L516-L527 HydrophobicContact CB-CD1 3.81Å; L516-L527 HydrophobicContact CB-CD2 4.3Å; L516-L527 HydrophobicContact CD1-CD2 4.33Å; A520-L527 HydrophobicContact CB-CD1 3.83Å; D524-L527 HydrophobicContact CB-CB 4.43Å; D524-L527 HydrophobicContact CB-CD1 4.03Å; D524-L527 HydrophobicContact CB-CG 4.23Å; D524-L527 PolarHBondContact O-N 3.06Å; P525-L527 PolarHBondContact O-N 3.47Å; L527-D529 PolarHBondContact O-N 3.15Å; L527-H571 HydrophobicContact CD2-CB 3.97Å; L527-L572 HydrophobicContact CD1-CD2 4.03Å; L527-L572 HydrophobicContact CD2-CD2 4.11Å; L527-L572 HydrophobicContact CG-CD2 4.15Å
528	T	65.1	Low	68.2	Low	76 Å²	76	64.3 Å²	64.3	47%	0.466	41%	0.405	S	S	.	.			trans	-94.7	80.7	178.3	49.1	0	0	0	0	110.9	P525	P525-T528 VanDerWaalsContact CA-OG1 3.29Å; P525-T528 WeakPolarHBondContact CA-OG1 3.34Å; P525-T528 PolarHBondContact O-N 2.86Å; P525-T528 PolarHBondContact O-OG1 3.23Å
529	D	54.7	Low	66.4	Low	72 Å²	72	69.2 Å²	69.2	39%	0.385	44%	0.439	S	S	.	.			trans	-94.4	123.2	163.9	-177.3	-5.1	0	0	0	109.3	L527 A531 Q532	L527-D529 PolarHBondContact O-N 3.15Å; D529-A531 PolarHBondContact O-N 2.84Å; D529-A531 VanDerWaalsContact O-N 3.08Å; D529-A531 WeakPolarHBondContact OD1-CB 3.26Å; D529-A531 PolarHBondContact OD1-N 3.43Å; D529-Q532 HydrophobicContact CB-CB 4.33Å; D529-Q532 HydrophobicContact CB-CG 4.04Å; D529-Q532 PolarHBondContact O-N 3.42Å; D529-Q532 VanDerWaalsContact O-N 3.13Å; D529-Q532 PolarHBondContact OD2-NE2 2.91Å; D529-Q532 VanDerWaalsContact OD2-NE2 3.13Å
530	P	42	Very low	65	Low	132 Å²	132	72.9 Å²	72.9	86%	0.857	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-19.5	175.4	-22.2	31.7	0	0	0	114.6
531	A	43.8	Very low	63.9	Low	82 Å²	82	74.5 Å²	74.5	68%	0.678	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-11.1	180	0	0	0	0	0	114.2	D529	D529-A531 PolarHBondContact O-N 2.84Å; D529-A531 VanDerWaalsContact O-N 3.08Å; D529-A531 WeakPolarHBondContact OD1-CB 3.26Å; D529-A531 PolarHBondContact OD1-N 3.43Å
532	Q	50.9	Low	62.9	Low	89 Å²	89	74.5 Å²	74.5	42%	0.416	48%	0.481	S	S	.	.			trans	-103	88.8	-177.4	-65.5	176.6	32.2	0	0	109.9	D529 A534	D529-Q532 HydrophobicContact CB-CB 4.33Å; D529-Q532 HydrophobicContact CB-CG 4.04Å; D529-Q532 PolarHBondContact O-N 3.42Å; D529-Q532 VanDerWaalsContact O-N 3.13Å; D529-Q532 PolarHBondContact OD2-NE2 2.91Å; D529-Q532 VanDerWaalsContact OD2-NE2 3.13Å; Q532-A534 PolarHBondContact O-N 3.46Å; Q532-A534 VanDerWaalsContact O-N 3.15Å
533	T	43.6	Very low	62.2	Low	135 Å²	135	75.3 Å²	75.3	83%	0.828	48%	0.483	S	S	*	.			trans	-65.1	113.9	173.1	29.2	0	0	0	0	109.9
534	A	47.5	Very low	61.7	Low	68 Å²	68	73.7 Å²	73.7	56%	0.562	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-54.2	135.8	168.2	0	0	0	0	0	109.1	Q532	Q532-A534 PolarHBondContact O-N 3.46Å; Q532-A534 VanDerWaalsContact O-N 3.15Å
535	P	48.3	Very low	61.5	Low	64 Å²	64	73.9 Å²	73.9	42%	0.416	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-59.1	149.3	179.1	23.2	-31.7	0	0	0	110.4	V537	P535-V537 PolarHBondContact O-N 3.28Å
536	P	47.8	Very low	61.6	Low	131 Å²	131	71.1 Å²	71.1	85%	0.851	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-56.4	118.1	-177.3	20.7	-30.9	0	0	0	110.5
537	V	54.1	Low	61.7	Low	71 Å²	71	72.6 Å²	72.6	43%	0.43	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-78.2	125	-177.2	-175.5	0	0	0	0	108.1	P535 M541 A542	P535-V537 PolarHBondContact O-N 3.28Å; V537-M541 HydrophobicContact CG1-CB 3.3Å; V537-M541 HydrophobicContact CG1-CG 4.48Å; V537-A542 HydrophobicContact CG1-CB 4.28Å
538	T	60.1	Low	62	Low	72 Å²	72	71.9 Å²	71.9	44%	0.442	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-64.2	153	174	60.1	0	0	0	0	110.3	S540 M541 A542	T538-S540 PolarHBondContact O-N 3.14Å; T538-S540 VanDerWaalsContact O-N 3.08Å; T538-M541 WeakPolarHBondContact O-CA 3.46Å; T538-M541 WeakPolarHBondContact O-CB 3.2Å; T538-M541 PolarHBondContact O-N 3.35Å; T538-M541 VanDerWaalsContact OG1-CG 3.32Å; T538-M541 WeakPolarHBondContact OG1-CG 3.45Å; T538-A542 PolarHBondContact O-N 3.35Å
539	P	53.7	Low	63.1	Low	118 Å²	118	73.5 Å²	73.5	77%	0.766	47%	0.468	S	S	*	.	H	α-helix	trans	-54.1	-33.1	179.8	-27.4	34.5	0	0	0	114	A542 A543	P539-A542 PolarHBondContact O-N 2.85Å; P539-A543 PolarHBondContact O-N 3.17Å; P539-A543 VanDerWaalsContact O-N 3.1Å
540	S	63.9	Low	64.7	Low	78 Å²	78	76.5 Å²	76.5	55%	0.545	48%	0.484	S	S	.	.	H	α-helix	trans	-65.1	-38.8	174.6	178.8	0	0	0	0	112.8	T538 K544	T538-S540 PolarHBondContact O-N 3.14Å; T538-S540 VanDerWaalsContact O-N 3.08Å; S540-K544 WeakPolarHBondContact O-CG 3.28Å; S540-K544 PolarHBondContact O-N 3.24Å
541	M	68.6	Low	67	Low	35 Å²	35	70.5 Å²	70.5	17%	0.172	45%	0.446	C	S	.	.	H	α-helix	trans	-74	-30.2	176.5	-69.2	174.5	72.8	0	0	112.5	L507 F509 W518 V537 T538 A545	L507-M541 HydrophobicContact CD2-CG 3.87Å; F509-M541 HydrophobicContact CD1-CE 4.24Å; F509-M541 HydrophobicContact CE1-CE 3.35Å; F509-M541 HydrophobicContact CE2-CE 4.32Å; F509-M541 HydrophobicContact CZ-CE 3.4Å; W518-M541 PolarHBondContact NE1-O 2.91Å; V537-M541 HydrophobicContact CG1-CB 3.3Å; V537-M541 HydrophobicContact CG1-CG 4.48Å; T538-M541 WeakPolarHBondContact O-CA 3.46Å; T538-M541 WeakPolarHBondContact O-CB 3.2Å; T538-M541 PolarHBondContact O-N 3.35Å; T538-M541 VanDerWaalsContact OG1-CG 3.32Å; T538-M541 WeakPolarHBondContact OG1-CG 3.45Å; M541-A545 PolarHBondContact O-N 3.1Å
542	A	67.9	Low	69.3	Low	53 Å²	53	68.4 Å²	68.4	44%	0.438	43%	0.428	S	S	.	.	H	α-helix	trans	-68.2	-41.7	174.7	0	0	0	0	0	111.5	V537 T538 P539 K544 A545	V537-A542 HydrophobicContact CG1-CB 4.28Å; T538-A542 PolarHBondContact O-N 3.35Å; P539-A542 PolarHBondContact O-N 2.85Å; A542-K544 VanDerWaalsContact C-N 3.33Å; A542-K544 PolarHBondContact O-N 2.88Å; A542-A545 WeakPolarHBondContact O-CB 3.29Å; A542-A545 PolarHBondContact O-N 3.4Å; A542-A545 VanDerWaalsContact O-N 3.15Å
543	A	68.8	Low	71.3	Confident	70 Å²	70	66.4 Å²	66.4	58%	0.579	42%	0.419	S	S	*	.	H	α-helix	trans	-60.7	-41.5	174.8	0	0	0	0	0	112.3	P539 A545 A546	P539-A543 PolarHBondContact O-N 3.17Å; P539-A543 VanDerWaalsContact O-N 3.1Å; A543-A545 VanDerWaalsContact C-N 3.26Å; A543-A545 PolarHBondContact O-N 3.13Å; A543-A546 WeakPolarHBondContact O-CB 3.44Å; A543-A546 PolarHBondContact O-N 3.15Å
544	K	77.3	Confident	73.8	Confident	33 Å²	33	60 Å²	60	14%	0.143	38%	0.38	C	S	.	.	H	α-helix	trans	-67.8	-24.6	176.6	-69.9	-179.9	175.2	-158.8	0	113.5	D505 S506 L507 W518 S540 A542 A546	D505-K544 HydrophobicContact CB-CD 4.28Å; D505-K544 VanDerWaalsContact CG-NZ 3.32Å; D505-K544 WeakPolarHBondContact OD1-CE 3.45Å; D505-K544 IonicContact OD1-NZ 2.94Å; D505-K544 PolarHBondContact OD1-NZ 2.78Å; D505-K544 WeakPolarHBondContact OD2-CE 3.49Å; D505-K544 IonicContact OD2-NZ 2.7Å; S506-K544 PolarHBondContact O-NZ 2.91Å; L507-K544 HydrophobicContact CD1-CD 4.23Å; L507-K544 HydrophobicContact CD2-CD 3.98Å; L507-K544 HydrophobicContact CG-CD 4.18Å; W518-K544 HydrophobicContact CZ2-CB 4.05Å; S540-K544 WeakPolarHBondContact O-CG 3.28Å; S540-K544 PolarHBondContact O-N 3.24Å; A542-K544 VanDerWaalsContact C-N 3.33Å; A542-K544 PolarHBondContact O-N 2.88Å; K544-A546 VanDerWaalsContact C-N 3.29Å; K544-A546 PolarHBondContact O-N 3.04Å
545	A	82.3	Confident	76.1	Confident	4 Å²	4	57 Å²	57	3%	0.033	35%	0.354	C	S	.	.	H	α-helix	trans	-71.5	-21.8	177	0	0	0	0	0	113.1	W518 M541 A542 A543 L547 L548 Q549	W518-A545 HydrophobicContact CZ2-CB 4.35Å; M541-A545 PolarHBondContact O-N 3.1Å; A542-A545 WeakPolarHBondContact O-CB 3.29Å; A542-A545 PolarHBondContact O-N 3.4Å; A542-A545 VanDerWaalsContact O-N 3.15Å; A543-A545 VanDerWaalsContact C-N 3.26Å; A543-A545 PolarHBondContact O-N 3.13Å; A545-L547 VanDerWaalsContact C-N 3.29Å; A545-L547 PolarHBondContact O-N 2.99Å; A545-L548 WeakPolarHBondContact O-CB 3.5Å; A545-L548 PolarHBondContact O-N 3.41Å; A545-Q549 WeakPolarHBondContact O-CG 3.22Å; A545-Q549 PolarHBondContact O-N 2.83Å
546	A	84.3	Confident	78.5	Confident	38 Å²	38	53.9 Å²	53.9	31%	0.314	33%	0.334	S	S	.	.	H	α-helix	trans	-56.9	-41.7	178.7	0	0	0	0	0	112.2	A543 K544 L548 Q549 D550	A543-A546 WeakPolarHBondContact O-CB 3.44Å; A543-A546 PolarHBondContact O-N 3.15Å; K544-A546 VanDerWaalsContact C-N 3.29Å; K544-A546 PolarHBondContact O-N 3.04Å; A546-L548 PolarHBondContact O-N 2.91Å; A546-Q549 PolarHBondContact O-N 3.29Å; A546-Q549 VanDerWaalsContact O-N 3.08Å; A546-D550 WeakPolarHBondContact O-CB 3.4Å; A546-D550 VanDerWaalsContact O-CG 3.31Å; A546-D550 PolarHBondContact O-N 2.63Å
547	L	87.8	Confident	80.9	Confident	89 Å²	89	47.7 Å²	47.7	47%	0.466	29%	0.293	S	S	.	.	H	α-helix	trans	-56.5	-39.4	175.1	-70.6	175.8	0	0	0	112.6	A545 A551	A545-L547 VanDerWaalsContact C-N 3.29Å; A545-L547 PolarHBondContact O-N 2.99Å; L547-A551 WeakPolarHBondContact O-CB 3.46Å; L547-A551 PolarHBondContact O-N 3.34Å
548	L	89.9	Confident	82.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-74	-36.1	178	-66.6	171.1	0	0	0	111.8	V410 V412 L437 W518 Q521 R523 A545 A546 V554	V410-L548 HydrophobicContact CG1-CD2 3.88Å; V412-L548 HydrophobicContact CG2-CD2 3.75Å; L437-L548 HydrophobicContact CD1-CD1 4.07Å; L437-L548 HydrophobicContact CD1-CD2 3.88Å; L437-L548 HydrophobicContact CD1-CG 3.8Å; W518-L548 HydrophobicContact CD2-CD1 4.38Å; W518-L548 HydrophobicContact CE3-CD1 3.93Å; W518-L548 HydrophobicContact CH2-CD1 3.66Å; W518-L548 HydrophobicContact CZ2-CD1 4.15Å; W518-L548 HydrophobicContact CZ3-CD1 3.55Å; Q521-L548 HydrophobicContact CG-CB 3.79Å; Q521-L548 HydrophobicContact CG-CD1 4.27Å; R523-L548 PolarHBondContact NH2-O 3.06Å; A545-L548 WeakPolarHBondContact O-CB 3.5Å; A545-L548 PolarHBondContact O-N 3.41Å; A546-L548 PolarHBondContact O-N 2.91Å; L548-V554 HydrophobicContact CD2-CG1 3.96Å; L548-V554 HydrophobicContact CD2-CG2 4.1Å
549	Q	87.4	Confident	84.7	Confident	110 Å²	110	40.9 Å²	40.9	51%	0.514	25%	0.252	S	S	.	.	H	α-helix	trans	-69.5	-37.5	178.9	-69.7	173.7	-0.7	0	0	112.1	Q521 R523 A545 A546	Q521-Q549 HydrophobicContact CB-CG 4.38Å; Q521-Q549 HydrophobicContact CG-CG 4.22Å; R523-Q549 PolarHBondContact NH2-O 3.16Å; A545-Q549 WeakPolarHBondContact O-CG 3.22Å; A545-Q549 PolarHBondContact O-N 2.83Å; A546-Q549 PolarHBondContact O-N 3.29Å; A546-Q549 VanDerWaalsContact O-N 3.08Å
550	D	89.3	Confident	86.5	Confident	135 Å²	135	35.2 Å²	35.2	72%	0.722	22%	0.215	S	C	*	.	H	α-helix	trans	-81.9	-17.9	-179.3	-64.5	-21.4	0	0	0	113.3	A546	A546-D550 WeakPolarHBondContact O-CB 3.4Å; A546-D550 VanDerWaalsContact O-CG 3.31Å; A546-D550 PolarHBondContact O-N 2.63Å
551	A	91.1	Very high	87.7	Confident	5 Å²	5	31.5 Å²	31.5	4%	0.041	19%	0.189	C	C	.	.			trans	-65.6	135.6	-177.5	0	0	0	0	0	112.1	V410 R523 L547 V554	V410-A551 HydrophobicContact CB-CB 3.96Å; V410-A551 HydrophobicContact CG2-CB 3.58Å; R523-A551 VanDerWaalsContact CZ-O 3.22Å; R523-A551 PolarHBondContact NH1-O 3.32Å; R523-A551 PolarHBondContact NH2-O 3.39Å; L547-A551 WeakPolarHBondContact O-CB 3.46Å; L547-A551 PolarHBondContact O-N 3.34Å; A551-V554 HydrophobicContact CB-CG2 3.9Å
552	A	91.4	Very high	88.7	Confident	38 Å²	38	30.7 Å²	30.7	31%	0.314	19%	0.186	S	C	.	.	S	Bend	trans	-69	-40	170.5	0	0	0	0	0	110.9	A373 A408	A373-A552 WeakPolarHBondContact CB-O 3.07Å; A408-A552 PolarHBondContact O-N 3.42Å
553	H	93.1	Very high	89.6	Confident	48 Å²	48	32.3 Å²	32.3	22%	0.222	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	147.1	177.2	-60.8	-84.8	0	0	0	111.6	A373 A405 A408 V409 V410	A373-H553 WeakPolarHBondContact O-CA 3.48Å; A405-H553 WeakPolarHBondContact CB-NE2 3.19Å; A408-H553 PolarHBondContact O-N 2.85Å; V409-H553 WeakPolarHBondContact CA-O 3.41Å; V409-H553 HydrophobicContact CG1-CB 4.34Å; V409-H553 HydrophobicContact CG2-CB 4.02Å; V410-H553 PolarHBondContact N-O 3.24Å
554	V	94.9	Very high	90.7	Very high	1 Å²	1	29 Å²	29	1%	0.006	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	121.3	176.7	177.2	0	0	0	0	109	A373 L374 T375 V410 V412 I519 L548 A551 V556	A373-V554 PolarHBondContact O-N 3.4Å; L374-V554 WeakPolarHBondContact CA-O 3.45Å; L374-V554 HydrophobicContact CD2-CB 3.63Å; L374-V554 HydrophobicContact CD2-CG1 3.75Å; T375-V554 PolarHBondContact N-O 2.96Å; V410-V554 WeakPolarHBondContact O-CA 3.34Å; V412-V554 HydrophobicContact CG2-CG1 3.99Å; I519-V554 HydrophobicContact CG2-CG1 4.34Å; L548-V554 HydrophobicContact CD2-CG1 3.96Å; L548-V554 HydrophobicContact CD2-CG2 4.1Å; A551-V554 HydrophobicContact CB-CG2 3.9Å; V554-V556 HydrophobicContact CG1-CG2 3.96Å
555	H	96.5	Very high	91.5	Very high	3 Å²	3	27.4 Å²	27.4	1%	0.014	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.9	177.1	-73.9	-167.9	0	0	0	109.4	T375 F377 V409 V410 R411 V412	T375-H555 CarbonylContact O-C 3.58Å; T375-H555 WeakPolarHBondContact O-CA 3.45Å; F377-H555 HydrophobicContact CE2-CB 3.9Å; F377-H555 AromaticContact CE2-CG 3.83Å; F377-H555 AromaticContact CE2-ND1 3.95Å; V409-H555 HydrophobicContact CG1-CB 4.39Å; V410-H555 PolarHBondContact O-N 3.18Å; R411-H555 CarbonylContact C-O 3.56Å; R411-H555 WeakPolarHBondContact CA-O 3.48Å; R411-H555 HydrophobicContact CG-CB 4.31Å; V412-H555 PolarHBondContact N-O 2.86Å
556	V	97.6	Very high	91.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	113	-175.3	-170.2	0	0	0	0	109.4	L374 T375 Y376 F377 V412 L414 I519 V554 V558	L374-V556 HydrophobicContact CD2-CG2 4.41Å; T375-V556 PolarHBondContact O-N 3.43Å; Y376-V556 CarbonylContact C-O 3.51Å; Y376-V556 WeakPolarHBondContact CA-O 3.35Å; Y376-V556 HydrophobicContact CD1-CB 3.74Å; Y376-V556 HydrophobicContact CD1-CG1 4.09Å; Y376-V556 HydrophobicContact CD1-CG2 4.04Å; Y376-V556 HydrophobicContact CE1-CB 4.16Å; Y376-V556 HydrophobicContact CE1-CG1 4.37Å; Y376-V556 HydrophobicContact CE1-CG2 3.99Å; F377-V556 PolarHBondContact N-O 3.41Å; V412-V556 HydrophobicContact CB-CG1 4.5Å; V412-V556 HydrophobicContact CB-CG2 4.46Å; V412-V556 CarbonylContact O-C 3.56Å; V412-V556 WeakPolarHBondContact O-CA 3.28Å; L414-V556 HydrophobicContact CB-CG1 4.37Å; I519-V556 HydrophobicContact CD1-CG1 4.26Å; I519-V556 HydrophobicContact CG2-CG1 4.34Å; I519-V556 HydrophobicContact CG2-CG2 3.48Å; I519-V556 VanDerWaalsContact CG2-CG2 3.48Å; V554-V556 HydrophobicContact CG1-CG2 3.96Å; V556-V558 HydrophobicContact CG1-CG2 4.19Å
557	L	98.3	Very high	92.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	121.8	169.2	179.9	64.5	0	0	0	109.8	F377 W393 F394 V412 L413 L414 L430 F435 T559	F377-L557 HydrophobicContact CB-CD1 3.91Å; F377-L557 CarbonylContact O-C 3.6Å; F377-L557 WeakPolarHBondContact O-CA 3.23Å; W393-L557 HydrophobicContact CZ3-CD1 4.19Å; F394-L557 HydrophobicContact CB-CD1 4.23Å; F394-L557 HydrophobicContact CB-CD2 4.38Å; F394-L557 HydrophobicContact CD1-CD2 4.38Å; F394-L557 HydrophobicContact CD2-CB 3.98Å; F394-L557 HydrophobicContact CD2-CD1 3.87Å; F394-L557 HydrophobicContact CD2-CD2 4.38Å; F394-L557 HydrophobicContact CD2-CG 4.28Å; F394-L557 HydrophobicContact CE2-CB 3.85Å; F394-L557 HydrophobicContact CG-CD1 4.18Å; F394-L557 HydrophobicContact CG-CD2 4.11Å; F394-L557 HydrophobicContact CG-CG 4.5Å; F394-L557 HydrophobicContact CZ-CB 4.29Å; V412-L557 PolarHBondContact O-N 2.83Å; L413-L557 HydrophobicContact CD1-CD2 4.35Å; L413-L557 HydrophobicContact CD1-CG 4.49Å; L414-L557 PolarHBondContact N-O 3.45Å; L430-L557 HydrophobicContact CD2-CD2 3.78Å; F435-L557 HydrophobicContact CE1-CB 3.79Å; F435-L557 HydrophobicContact CE1-CD2 4.4Å; F435-L557 HydrophobicContact CE2-CD2 4.47Å; F435-L557 HydrophobicContact CZ-CB 3.85Å; F435-L557 HydrophobicContact CZ-CD2 3.61Å; F435-L557 HydrophobicContact CZ-CG 4.35Å; L557-T559 HydrophobicContact CD2-CG2 3.97Å; L557-T559 HydrophobicContact CG-CG2 4.05Å
558	V	97.9	Very high	92.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	115	173.5	-171.9	0	0	0	0	109.1	F377 L378 D379 L414 V556 L564 V565 V568	F377-V558 PolarHBondContact O-N 3.05Å; L378-V558 HydrophobicContact CD2-CB 3.56Å; L378-V558 HydrophobicContact CD2-CG1 4.33Å; L378-V558 HydrophobicContact CD2-CG2 3.41Å; L378-V558 VanDerWaalsContact CD2-CG2 3.41Å; D379-V558 PolarHBondContact N-O 3.19Å; L414-V558 HydrophobicContact CB-CG2 4.17Å; L414-V558 HydrophobicContact CD2-CG1 4.26Å; L414-V558 HydrophobicContact CD2-CG2 4.06Å; L414-V558 HydrophobicContact CG-CG1 4.48Å; L414-V558 WeakPolarHBondContact O-CA 3.37Å; V556-V558 HydrophobicContact CG1-CG2 4.19Å; V558-L564 HydrophobicContact CG1-CD2 3.95Å; V558-L564 HydrophobicContact CG1-CG 3.78Å; V558-V565 HydrophobicContact CG1-CG2 4.07Å; V558-V568 HydrophobicContact CG1-CB 4.41Å; V558-V568 HydrophobicContact CG1-CG2 3.84Å; V558-V568 HydrophobicContact CG2-CG1 4.36Å; V558-V568 HydrophobicContact CG2-CG2 4.39Å
559	T	96.8	Very high	92.6	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	179.9	-174.9	-167.4	0	0	0	0	113.6	D379 M387 L413 L414 F415 N416 L430 L557 S561	D379-T559 VanDerWaalsContact O-CA 3.29Å; D379-T559 WeakPolarHBondContact O-CA 3.24Å; D379-T559 WeakPolarHBondContact O-CB 3.21Å; D379-T559 PolarHBondContact O-OG1 2.7Å; D379-T559 VanDerWaalsContact O-OG1 3.14Å; M387-T559 HydrophobicContact CE-CG2 3.93Å; L413-T559 HydrophobicContact CD1-CG2 4.1Å; L414-T559 PolarHBondContact O-N 2.76Å; F415-T559 HydrophobicContact CD2-CG2 4.08Å; N416-T559 PolarHBondContact N-O 3.21Å; L430-T559 HydrophobicContact CD1-CG2 4.16Å; L430-T559 HydrophobicContact CD2-CG2 4.21Å; L557-T559 HydrophobicContact CD2-CG2 3.97Å; L557-T559 HydrophobicContact CG-CG2 4.05Å; T559-S561 PolarHBondContact O-N 3.36Å
560	G	92.1	Very high	92.6	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	95.3	-25	178.3	0	0	0	0	0	114.3	A381 H382 F415 N416	A381-G560 CarbonylContact O-C 3.59Å; A381-G560 WeakPolarHBondContact O-CA 3.26Å; A381-G560 PolarHBondContact O-N 2.84Å; A381-G560 VanDerWaalsContact O-N 3.07Å; H382-G560 WeakPolarHBondContact CB-O 3.36Å; F415-G560 VanDerWaalsContact CE2-CA 3.47Å; N416-G560 CarbonylContact O-C 3.54Å; N416-G560 VanDerWaalsContact O-CA 3.29Å; N416-G560 WeakPolarHBondContact O-CA 3.34Å
561	S	89.2	Confident	92.6	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.068	C	C	.	.			trans	-153	132.1	-179.9	178.1	0	0	0	0	111.3	N416 N443 T559 H563 L564 V565	N416-S561 VanDerWaalsContact O-CB 3.23Å; N416-S561 WeakPolarHBondContact O-CB 3.47Å; N416-S561 PolarHBondContact O-N 3.23Å; N443-S561 PolarHBondContact ND2-OG 2.73Å; T559-S561 PolarHBondContact O-N 3.36Å; S561-H563 PolarHBondContact O-N 2.79Å; S561-H563 PolarHBondContact OG-N 3.34Å; S561-L564 WeakPolarHBondContact O-CB 3.17Å; S561-L564 PolarHBondContact O-N 2.74Å; S561-V565 PolarHBondContact O-N 3.36Å
562	L	88.3	Confident	92.5	Very high	17 Å²	17	12.8 Å²	12.8	9%	0.089	7%	0.066	C	C	.	.	H	α-helix	trans	-64.8	-30.1	173.5	-166.4	68.4	0	0	0	112.1	P135 L137 V565 G566	P135-L562 HydrophobicContact CG-CD2 3.53Å; L137-L562 HydrophobicContact CD2-CD1 3.38Å; L137-L562 HydrophobicContact CD2-CD2 4.14Å; L137-L562 HydrophobicContact CD2-CG 3.48Å; L137-L562 VanDerWaalsContact CD2-CG 3.48Å; L562-V565 PolarHBondContact O-N 3.37Å; L562-G566 PolarHBondContact O-N 3.39Å
563	H	88.4	Confident	91.9	Very high	88 Å²	88	13.7 Å²	13.7	41%	0.407	7%	0.066	S	C	.	.	H	α-helix	trans	-69.3	-34.6	174.7	-65.1	-74	0	0	0	112.5	N443 S561 G567	N443-H563 HydrophobicContact CB-CB 4.07Å; S561-H563 PolarHBondContact O-N 2.79Å; S561-H563 PolarHBondContact OG-N 3.34Å; H563-G567 PolarHBondContact O-N 2.92Å
564	L	91.9	Very high	90.3	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-64.1	-48.5	173.9	177.4	61.8	0	0	0	109.7	L414 N416 N443 I512 V558 S561 G566 G567 V568	L414-L564 HydrophobicContact CG-CD2 4.36Å; N416-L564 HydrophobicContact CB-CD2 3.95Å; N443-L564 WeakPolarHBondContact OD1-CA 3.39Å; N443-L564 WeakPolarHBondContact OD1-CB 3.44Å; N443-L564 PolarHBondContact OD1-N 2.82Å; I512-L564 HydrophobicContact CD1-CD1 3.89Å; I512-L564 HydrophobicContact CG1-CD1 3.81Å; V558-L564 HydrophobicContact CG1-CD2 3.95Å; V558-L564 HydrophobicContact CG1-CG 3.78Å; S561-L564 WeakPolarHBondContact O-CB 3.17Å; S561-L564 PolarHBondContact O-N 2.74Å; L564-G566 VanDerWaalsContact C-N 3.35Å; L564-G566 PolarHBondContact O-N 3.41Å; L564-G567 PolarHBondContact O-N 3.4Å; L564-V568 HydrophobicContact CD1-CG2 4.47Å; L564-V568 WeakPolarHBondContact O-CG2 3.41Å; L564-V568 PolarHBondContact O-N 3.22Å
565	V	93.7	Very high	88.2	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-59.2	-45.2	177.8	172.2	0	0	0	0	111.6	G364 L378 V558 S561 L562 V568 L569	G364-V565 VanDerWaalsContact CA-CG1 3.48Å; L378-V565 HydrophobicContact CB-CG1 4.07Å; V558-V565 HydrophobicContact CG1-CG2 4.07Å; S561-V565 PolarHBondContact O-N 3.36Å; L562-V565 PolarHBondContact O-N 3.37Å; V565-V568 PolarHBondContact O-N 3.39Å; V565-L569 HydrophobicContact CG1-CD1 4.03Å; V565-L569 WeakPolarHBondContact O-CG 3.43Å; V565-L569 PolarHBondContact O-N 3.16Å
566	G	90.8	Very high	85.8	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.3	-43.1	175.3	0	0	0	0	0	113	L137 V138 L562 L564 V568 L569 K570	L137-G566 WeakPolarHBondContact O-CA 3.38Å; V138-G566 WeakPolarHBondContact CG2-O 3.31Å; L562-G566 PolarHBondContact O-N 3.39Å; L564-G566 VanDerWaalsContact C-N 3.35Å; L564-G566 PolarHBondContact O-N 3.41Å; G566-V568 VanDerWaalsContact C-N 3.3Å; G566-V568 PolarHBondContact O-N 3.47Å; G566-L569 PolarHBondContact O-N 3.47Å; G566-K570 PolarHBondContact O-N 3.08Å
567	G	89.9	Confident	83	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-65.1	-32.2	175.7	0	0	0	0	0	113.5	H563 L564 H571	H563-G567 PolarHBondContact O-N 2.92Å; L564-G567 PolarHBondContact O-N 3.4Å; G567-H571 PolarHBondContact O-CD2 3.2Å; G567-H571 VanDerWaalsContact O-CD2 3.26Å
568	V	92.9	Very high	79.8	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-69	-46.9	171.5	167.5	0	0	0	0	110.9	L378 L414 I512 L516 V558 L564 V565 G566 K570 H571 L572	L378-V568 HydrophobicContact CD2-CG1 3.9Å; L414-V568 HydrophobicContact CD2-CG2 3.84Å; I512-V568 HydrophobicContact CG2-CB 4.38Å; I512-V568 HydrophobicContact CG2-CG2 3.54Å; L516-V568 HydrophobicContact CD1-CB 4.45Å; L516-V568 HydrophobicContact CD1-CG1 4.2Å; L516-V568 HydrophobicContact CD1-CG2 4.25Å; L516-V568 HydrophobicContact CD2-CG1 4.17Å; L516-V568 HydrophobicContact CD2-CG2 4.27Å; V558-V568 HydrophobicContact CG1-CB 4.41Å; V558-V568 HydrophobicContact CG1-CG2 3.84Å; V558-V568 HydrophobicContact CG2-CG1 4.36Å; V558-V568 HydrophobicContact CG2-CG2 4.39Å; L564-V568 HydrophobicContact CD1-CG2 4.47Å; L564-V568 WeakPolarHBondContact O-CG2 3.41Å; L564-V568 PolarHBondContact O-N 3.22Å; V565-V568 PolarHBondContact O-N 3.39Å; G566-V568 VanDerWaalsContact C-N 3.3Å; G566-V568 PolarHBondContact O-N 3.47Å; V568-K570 VanDerWaalsContact C-N 3.28Å; V568-K570 PolarHBondContact O-N 3.33Å; V568-H571 PolarHBondContact O-N 3.46Å; V568-L572 HydrophobicContact CG1-CD1 3.43Å; V568-L572 VanDerWaalsContact CG1-CD1 3.43Å; V568-L572 HydrophobicContact CG1-CG 3.96Å; V568-L572 WeakPolarHBondContact O-CG 3.41Å; V568-L572 PolarHBondContact O-N 3.47Å
569	L	92.1	Very high	76.5	Confident	10 Å²	10	38.8 Å²	38.8	5%	0.052	22%	0.216	C	C	.	.	H	α-helix	trans	-60.6	-36.2	178.9	-77.9	169.1	0	0	0	112.8	L137 V138 A363 L369 L378 V565 G566 H571 L572 D573	L137-L569 HydrophobicContact CD1-CD1 3.8Å; V138-L569 HydrophobicContact CG2-CB 4.4Å; A363-L569 HydrophobicContact CB-CD1 4.04Å; L369-L569 HydrophobicContact CD1-CD2 3.91Å; L378-L569 HydrophobicContact CD1-CD1 4.49Å; L378-L569 HydrophobicContact CD1-CD2 3.41Å; L378-L569 VanDerWaalsContact CD1-CD2 3.41Å; L378-L569 HydrophobicContact CD1-CG 3.82Å; V565-L569 HydrophobicContact CG1-CD1 4.03Å; V565-L569 WeakPolarHBondContact O-CG 3.43Å; V565-L569 PolarHBondContact O-N 3.16Å; G566-L569 PolarHBondContact O-N 3.47Å; L569-H571 PolarHBondContact O-N 3.2Å; L569-H571 VanDerWaalsContact O-N 3.12Å; L569-L572 PolarHBondContact O-N 3.44Å; L569-D573 PolarHBondContact O-N 3.43Å
570	K	89.2	Confident	73.5	Confident	37 Å²	37	43 Å²	43	16%	0.161	26%	0.259	C	S	.	.	H	α-helix	trans	-49.9	-38.6	173.3	-172.5	-164.4	172.8	-159.3	0	112.1	V138 T445 E446 G566 V568	V138-K570 HydrophobicContact CG1-CB 3.93Å; V138-K570 HydrophobicContact CG1-CG 3.96Å; T445-K570 HydrophobicContact CG2-CD 3.82Å; E446-K570 IonicContact OE1-NZ 3.93Å; E446-K570 PolarHBondContact OE1-NZ 3.07Å; G566-K570 PolarHBondContact O-N 3.08Å; V568-K570 VanDerWaalsContact C-N 3.28Å; V568-K570 PolarHBondContact O-N 3.33Å
571	H	88.8	Confident	70.3	Confident	24 Å²	24	50.5 Å²	50.5	11%	0.111	30%	0.3	C	S	.	.	H	α-helix	trans	-91	-31.2	-177.6	-68.2	-59.8	0	0	0	113.3	T445 E446 L516 V526 L527 G567 V568 L569	T445-H571 PolarHBondContact O-NE2 2.94Å; T445-H571 VanDerWaalsContact O-NE2 3.07Å; E446-H571 IonicContact OE1-CE1 3.45Å; E446-H571 PolarHBondContact OE1-CE1 3.09Å; E446-H571 VanDerWaalsContact OE1-CE1 3.25Å; E446-H571 IonicContact OE1-NE2 3.73Å; L516-H571 HydrophobicContact CD1-CB 4Å; V526-H571 WeakPolarHBondContact CG1-O 3.29Å; L527-H571 HydrophobicContact CD2-CB 3.97Å; G567-H571 PolarHBondContact O-CD2 3.2Å; G567-H571 VanDerWaalsContact O-CD2 3.26Å; V568-H571 PolarHBondContact O-N 3.46Å; L569-H571 PolarHBondContact O-N 3.2Å; L569-H571 VanDerWaalsContact O-N 3.12Å
572	L	88.7	Confident	67.4	Low	1 Å²	1	55.1 Å²	55.1	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-90.5	-20	-175.6	-62.7	-175	0	0	0	114.3	L369 R371 Y376 L516 L527 V568 L569	L369-L572 HydrophobicContact CD1-CB 4.44Å; R371-L572 PolarHBondContact NH2-O 2.94Å; Y376-L572 HydrophobicContact CD1-CD1 3.78Å; Y376-L572 HydrophobicContact CD2-CD1 3.79Å; Y376-L572 HydrophobicContact CE1-CD1 4.01Å; Y376-L572 HydrophobicContact CE2-CD1 4.02Å; Y376-L572 HydrophobicContact CE2-CD2 4.12Å; Y376-L572 HydrophobicContact CG-CD1 3.67Å; L516-L572 HydrophobicContact CD1-CD2 4.49Å; L527-L572 HydrophobicContact CD1-CD2 4.03Å; L527-L572 HydrophobicContact CD2-CD2 4.11Å; L527-L572 HydrophobicContact CG-CD2 4.15Å; V568-L572 HydrophobicContact CG1-CD1 3.43Å; V568-L572 VanDerWaalsContact CG1-CD1 3.43Å; V568-L572 HydrophobicContact CG1-CG 3.96Å; V568-L572 WeakPolarHBondContact O-CG 3.41Å; V568-L572 PolarHBondContact O-N 3.47Å; L569-L572 PolarHBondContact O-N 3.44Å
573	D	78.8	Confident	64.4	Low	57 Å²	57	57.8 Å²	57.8	31%	0.305	37%	0.369	S	S	.	.			trans	-144.5	67.9	-175.1	-158.9	6.4	0	0	0	112	L569 E575	L569-D573 PolarHBondContact O-N 3.43Å; D573-E575 VanDerWaalsContact C-N 3.28Å; D573-E575 PolarHBondContact O-N 3.18Å
574	P	58.8	Low	61.3	Low	66 Å²	66	59.3 Å²	59.3	43%	0.429	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-72.6	-14.6	-172.5	28.1	-34.5	0	0	0	114.4	V526 D576 G577	V526-P574 HydrophobicContact CG1-CG 4.43Å; P574-D576 PolarHBondContact O-N 2.8Å; P574-G577 PolarHBondContact O-N 3.31Å
575	E	51.3	Low	58.3	Low	170 Å²	170	65.1 Å²	65.1	79%	0.794	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-69.4	-17.5	-175.6	-69.2	-154.2	162.7	0	0	114.1	D573 G577	D573-E575 VanDerWaalsContact C-N 3.28Å; D573-E575 PolarHBondContact O-N 3.18Å; E575-G577 PolarHBondContact O-N 3.45Å
576	D	46.9	Very low	55.1	Low	110 Å²	110	69 Å²	69	59%	0.588	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-77.7	-8	169.5	-100.2	-11.4	0	0	0	112.9	P574	P574-D576 PolarHBondContact O-N 2.8Å
577	G	38.5	Very low	51.9	Low	21 Å²	21	76.9 Å²	76.9	22%	0.216	51%	0.513	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-24.2	-169.7	0	0	0	0	0	116.6	Q139 P574 E575	Q139-G577 VanDerWaalsContact NE2-CA 3.33Å; Q139-G577 PolarHBondContact NE2-O 3.33Å; P574-G577 PolarHBondContact O-N 3.31Å; E575-G577 PolarHBondContact O-N 3.45Å
578	S	30.6	Very low	49	Very low	84 Å²	84	81.3 Å²	81.3	59%	0.587	55%	0.549	S	S	*	.	S	Bend	trans	-161.1	87.9	-175.1	57.2	0	0	0	0	112.2
579	T	29.4	Very low	45.7	Very low	128 Å²	128	85 Å²	85	79%	0.785	59%	0.588	S	S	*	*			trans	165.8	108	136.9	41.6	0	0	0	0	109.3	N581	T579-N581 PolarHBondContact O-N 3.32Å; T579-N581 VanDerWaalsContact O-N 3.16Å
580	G	33.1	Very low	42.6	Very low	88 Å²	88	90.3 Å²	90.3	91%	0.907	63%	0.625	S	S	*	*			trans	-71.8	98.3	154.7	0	0	0	0	0	107.6
581	N	25.4	Very low	39.6	Very low	158 Å²	158	94.3 Å²	94.3	85%	0.845	66%	0.658	S	S	*	*			trans	-135.9	131.6	156.5	-139.1	1.7	0	0	0	110.6	T579	T579-N581 PolarHBondContact O-N 3.32Å; T579-N581 VanDerWaalsContact O-N 3.16Å
582	A	28	Very low	36.6	Very low	98 Å²	98	97 Å²	97	81%	0.81	69%	0.692	S	S	*	*			trans	-69.7	133.5	-171.9	0	0	0	0	0	111.8
583	G	24.8	Very low	33.6	Very low	72 Å²	72	104.8 Å²	104.8	74%	0.742	73%	0.734	S	S	*	*			trans	78.8	101.6	147.4	0	0	0	0	0	117.9
584	S	24.6	Very low	31.1	Very low	121 Å²	121	106.9 Å²	106.9	85%	0.846	76%	0.759	S	S	*	*				-168.6	122.2	113.3	44.2	0	0	0	0	109.8
585	S	28.7	Very low	29.5	Very low	122 Å²	122	106.8 Å²	106.8	85%	0.853	77%	0.77	S	S	*	*			trans	-58.9	135	170	44.8	0	0	0	0	110.7
586	G	26.5	Very low	28.3	Very low	80 Å²	80	104.2 Å²	104.2	83%	0.825	77%	0.771	S	S	*	*			trans	-58.1	141.4	-179.7	0	0	0	0	0	114.1
587	N	23.7	Very low	27.4	Very low	167 Å²	167	105 Å²	105	89%	0.893	78%	0.784	S	S	*	*			trans	-90.5	105.3	165.3	-153.7	14.2	0	0	0	107.3	G589	N587-G589 PolarHBondContact O-N 3.5Å
588	A	28.4	Very low	26.8	Very low	93 Å²	93	107.5 Å²	107.5	77%	0.769	81%	0.811	S	S	*	*			trans	-73.2	105.9	172.3	0	0	0	0	0	108.8	S590	A588-S590 PolarHBondContact O-N 3.2Å
589	G	23.8	Very low	26.6	Very low	79 Å²	79	111.4 Å²	111.4	81%	0.814	83%	0.825	S	S	*	*			trans	-74.7	103.9	169.3	0	0	0	0	0	110.2	N587	N587-G589 PolarHBondContact O-N 3.5Å
590	S	26.3	Very low	26.6	Very low	121 Å²	121	110.1 Å²	110.1	85%	0.846	83%	0.827	S	S	*	*			trans	-84.1	123.9	164.4	54.8	0	0	0	0	109.6	A588	A588-S590 PolarHBondContact O-N 3.2Å
591	S	27.4	Very low	26.3	Very low	120 Å²	120	109 Å²	109	84%	0.839	82%	0.815	S	S	*	*			trans	-116.7	119.6	170.7	48.7	0	0	0	0	111.9
592	G	24.4	Very low	26.3	Very low	80 Å²	80	106.6 Å²	106.6	83%	0.825	81%	0.811	S	S	*	*			trans	78.9	145.3	152.9	0	0	0	0	0	117.8
593	N	26	Very low	26.3	Very low	166 Å²	166	107.8 Å²	107.8	89%	0.888	81%	0.814	S	S	*	*			cis	-174.4	133.4	-2.2	-167.7	16.6	0	0	0	107.5
594	A	27.3	Very low	26.4	Very low	100 Å²	100	107.6 Å²	107.6	83%	0.826	81%	0.812	S	S	*	*			trans	172.2	127.6	155.6	0	0	0	0	0	105.6
595	G	24.6	Very low	26.5	Very low	65 Å²	65	109.6 Å²	109.6	67%	0.67	81%	0.813	S	S	*	*			cis	126.2	93.9	29.4	0	0	0	0	0	107.5
596	S	25.8	Very low	26.4	Very low	116 Å²	116	108.6 Å²	108.6	81%	0.811	81%	0.812	S	S	*	*			trans	80.3	126.6	156.1	72.2	0	0	0	0	122.5
597	S	27.5	Very low	26.4	Very low	125 Å²	125	108.9 Å²	108.9	87%	0.874	82%	0.815	S	S	*	*			trans	89.1	129.5	135.8	74.6	0	0	0	0	120.3
598	G	26.1	Very low	26.5	Very low	75 Å²	75	106.3 Å²	106.3	77%	0.773	81%	0.81	S	S	*	*			trans	126.9	69.4	144.5	0	0	0	0	0	118.5
599	N	26.3	Very low	26.5	Very low	166 Å²	166	107.6 Å²	107.6	89%	0.888	81%	0.813	S	S	*	*				42.8	145.1	126.3	-135.3	10	0	0	0	123.5
600	A	29.5	Very low	26.6	Very low	100 Å²	100	107.1 Å²	107.1	83%	0.826	81%	0.809	S	S	*	*			trans	75.2	139	164.9	0	0	0	0	0	117.2
601	G	26.3	Very low	26.6	Very low	64 Å²	64	108.7 Å²	108.7	66%	0.66	81%	0.814	S	S	*	*			cis	171.1	143	1.6	0	0	0	0	0	109.3
602	S	27	Very low	26.5	Very low	109 Å²	109	107 Å²	107	76%	0.762	82%	0.815	S	S	*	*			trans	55.7	124.4	146.8	61	0	0	0	0	123.2
603	S	27.8	Very low	26.5	Very low	122 Å²	122	114.2 Å²	114.2	85%	0.853	82%	0.817	S	S	*	*			trans	60.1	140.9	132.4	62.5	0	0	0	0	119.7
604	G	26.3	Very low	26.4	Very low	69 Å²	69	112.9 Å²	112.9	71%	0.711	82%	0.819	S	S	*	*			cis	158.7	160.9	13	0	0	0	0	0	108.9
605	N	26.6	Very low	26.2	Very low	163 Å²	163	112.8 Å²	112.8	87%	0.872	81%	0.812	S	S	*	*			trans	70.6	117	173.3	-76.8	-6.6	0	0	0	118.8
606	A	27.3	Very low	26.1	Very low	101 Å²	101	120 Å²	120	84%	0.835	83%	0.825	S	S	*	*				80.1	117.6	53.8	0	0	0	0	0	113.6
607	G	25.2	Very low	26	Very low	85 Å²	85	120.5 Å²	120.5	88%	0.876	82%	0.823	S	S	*	*			trans	174.3	94.9	174.5	0	0	0	0	0	111.9
608	S	26.7	Very low	25.9	Very low	114 Å²	114	120.6 Å²	120.6	80%	0.797	82%	0.824	S	S	*	*			trans	-86.9	152.6	-173.1	52.8	0	0	0	0	115.4
609	S	27.2	Very low	25.7	Very low	119 Å²	119	128.2 Å²	128.2	83%	0.832	83%	0.829	S	S	*	*				160.1	111.6	126.6	58.7	0	0	0	0	109.1
610	G	26.3	Very low	25.7	Very low	70 Å²	70	128.6 Å²	128.6	72%	0.722	83%	0.831	S	S	*	*				97.8	133.3	86.5	0	0	0	0	0	108.8
611	T	27.3	Very low	25.4	Very low	154 Å²	154	127.5 Å²	127.5	95%	0.945	83%	0.829	S	S	*	*			cis	-170.4	155.8	21.5	35.9	0	0	0	0	108.6
612	G	24.8	Very low	25.4	Very low	84 Å²	84	133.5 Å²	133.5	87%	0.866	84%	0.839	S	S	*	*			trans	135.9	74.9	155.3	0	0	0	0	0	117.1
613	R	25.4	Very low	25.4	Very low	232 Å²	232	135.1 Å²	135.1	88%	0.875	85%	0.845	S	S	*	*			trans	-99.7	142.2	161.5	-80.5	-175.4	-172.6	-167.1	1.8	109.6
614	C	22.6	Very low	25.2	Very low	137 Å²	137	132.7 Å²	132.7	93%	0.926	84%	0.839	S	S	*	*			trans	-123.6	113.9	150.4	-105.4	0	0	0	0	108
615	C	23.8	Very low	25.5	Very low	99 Å²	99	135.2 Å²	135.2	67%	0.669	84%	0.843	S	S	*	*			trans	-96.6	140.4	166	-78.1	0	0	0	0	108.3
616	F	23	Very low	25.4	Very low	215 Å²	215	132.4 Å²	132.4	94%	0.943	84%	0.836	S	S	*	*			trans	-125.7	118.2	155.2	-119.6	-88.3	0	0	0	108.7
617	T	23.9	Very low	25.3	Very low	128 Å²	128	138.1 Å²	138.1	79%	0.785	84%	0.836	S	S	*	*			trans	-93.3	141.2	169.6	45.4	0	0	0	0	109.1
618	S	23.6	Very low	25.2	Very low	127 Å²	127	145.7 Å²	145.7	89%	0.888	84%	0.838	S	S	*	*			trans	-153.6	126.6	148.5	55.3	0	0	0	0	110.5
619	R	23	Very low	25.1	Very low	235 Å²	235	146.6 Å²	146.6	89%	0.887	83%	0.833	S	S	*	*			trans	-114	159.2	175.7	-142	-173.2	-143.1	-165.2	5.6	107
620	L	25.7	Very low	25.1	Very low	174 Å²	174	147 Å²	147	91%	0.911	83%	0.831	S	S	*	*			trans	97.9	132	161.7	-62	159.9	0	0	0	117.9
621	G	22.9	Very low	25	Very low	76 Å²	76	154.9 Å²	154.9	78%	0.784	84%	0.839	S	S	*	*			trans	154.6	69.1	158.7	0	0	0	0	0	115.5
622	E	26.8	Very low	24.9	Very low	190 Å²	190	157.5 Å²	157.5	89%	0.888	84%	0.837	S	S	*	*			trans	-65.3	140.3	157.1	-69.8	178	147.7	0	0	110.2
623	T	26.2	Very low	24.9	Very low	144 Å²	144	159.1 Å²	159.1	88%	0.883	83%	0.834	S	S	*	*			trans	-176.6	123.7	140	43.2	0	0	0	0	110.4
624	G	24.9	Very low	25.2	Very low	70 Å²	70	154.4 Å²	154.4	72%	0.722	83%	0.834	S	S	*	*			trans	-80.5	171	158.7	0	0	0	0	0	111.8
625	P	32.2	Very low	26	Very low	122 Å²	122	151.6 Å²	151.6	79%	0.792	83%	0.827	S	S	*	*				-149.6	147.6	104.5	33.7	-14.6	0	0	0	117.2
626	S	24.9	Very low	26.5	Very low	105 Å²	105	151.4 Å²	151.4	73%	0.734	83%	0.827	S	S	*	*				53.5	113.5	127.2	-47.5	0	0	0	0	123.6
627	R	24.6	Very low	27.2	Very low	220 Å²	220	149.7 Å²	149.7	83%	0.83	82%	0.822	S	S	*	*				37	115.3	124.6	-72.6	-178.5	171.7	-177.5	-2.2	119.3
628	W	23	Very low	28	Very low	245 Å²	245	147.6 Å²	147.6	93%	0.928	82%	0.818	S	S	*	*			trans	-122.4	120.6	141	-81.2	85.2	0	0	0	109.9
629	I	24.9	Very low	28.7	Very low	132 Å²	132	147.4 Å²	147.4	68%	0.677	81%	0.806	S	S	*	*			trans	-96.3	125.8	170.8	-73.1	166.5	0	0	0	106.6
630	T	27.1	Very low	29.5	Very low	129 Å²	129	142.5 Å²	142.5	79%	0.791	80%	0.797	S	S	*	*			trans	-130.4	116.6	158.1	18.6	0	0	0	0	109.4
631	R	25	Very low	30.2	Very low	235 Å²	235	138.8 Å²	138.8	89%	0.887	78%	0.781	S	S	*	*			trans	-60.2	140.4	170.2	-75.7	171.8	166	174.5	-5.2	110.3
632	F	25.6	Very low	31	Very low	208 Å²	208	145.1 Å²	145.1	91%	0.912	78%	0.782	S	S	*	*			trans	-127.3	130.4	156.4	-106	-86.3	0	0	0	110.2
633	C	24.7	Very low	31.5	Very low	118 Å²	118	144.3 Å²	144.3	80%	0.797	77%	0.771	S	S	*	*			trans	-72.6	153.6	173.2	-77.7	0	0	0	0	111.6
634	P	30	Very low	32.5	Very low	134 Å²	134	141.5 Å²	141.5	87%	0.87	75%	0.753	S	S	*	*			trans	-85.8	130.2	179.1	33.5	-29.7	0	0	0	111
635	G	40.7	Very low	33.6	Very low	77 Å²	77	142.2 Å²	142.2	79%	0.794	74%	0.743	S	S	*	*			trans	164.1	64.9	174.8	0	0	0	0	0	114.9
636	S	34.3	Very low	34	Very low	95 Å²	95	142.1 Å²	142.1	66%	0.664	74%	0.735	S	S	*	*			trans	-154.9	8.3	166.6	59	0	0	0	0	115.9	A638	S636-A638 PolarHBondContact O-N 3.18Å
637	E	37.8	Very low	35.1	Very low	179 Å²	179	142.5 Å²	142.5	84%	0.836	73%	0.729	S	S	*	*	H	α-helix	trans	-80.1	-9.9	178.5	-70.7	-162.8	154.7	0	0	114.7	T641	E637-T641 PolarHBondContact O-OG1 3Å
638	A	40	Very low	36	Very low	85 Å²	85	139.4 Å²	139.4	70%	0.702	72%	0.722	S	S	*	*	H	α-helix	trans	-86.5	-8.4	-177.8	0	0	0	0	0	115	S636	S636-A638 PolarHBondContact O-N 3.18Å
639	L	38.3	Very low	37	Very low	123 Å²	123	136.4 Å²	136.4	64%	0.644	71%	0.71	S	S	*	*	H	α-helix	trans	-99	-26.4	-177.9	-89.6	156.2	0	0	0	113.7
640	L	39.2	Very low	38.3	Very low	132 Å²	132	134.2 Å²	134.2	69%	0.691	70%	0.703	S	S	*	*	H	α-helix	trans	-71.9	-33.5	177.4	-108	92.7	0	0	0	112.8	R642 W643 V644	L640-R642 VanDerWaalsContact C-N 3.28Å; L640-R642 PolarHBondContact O-N 3.49Å; L640-W643 PolarHBondContact O-N 3.45Å; L640-V644 PolarHBondContact O-N 3.38Å
641	T	42	Very low	39.2	Very low	95 Å²	95	135.3 Å²	135.3	58%	0.583	70%	0.697	S	S	*	*	H	α-helix	trans	-70.9	-22.6	-176.1	-29	0	0	0	0	112.8	E637 V645	E637-T641 PolarHBondContact O-OG1 3Å; T641-V645 WeakPolarHBondContact O-CG2 3.39Å
642	R	38.2	Very low	40.3	Very low	210 Å²	210	130.9 Å²	130.9	79%	0.792	69%	0.685	S	S	*	*	H	α-helix	trans	-81.2	-24.9	176.7	-89.2	-178	161.4	-175.9	-4.6	114	L640	L640-R642 VanDerWaalsContact C-N 3.28Å; L640-R642 PolarHBondContact O-N 3.49Å
643	W	38.2	Very low	41.6	Very low	172 Å²	172	125.6 Å²	125.6	65%	0.652	67%	0.665	S	S	*	*	H	α-helix	trans	-82.9	-34.2	178.2	-79.8	95.9	0	0	0	113	L640 V645 L646 L647	L640-W643 PolarHBondContact O-N 3.45Å; W643-V645 PolarHBondContact O-N 2.99Å; W643-L646 PolarHBondContact O-N 3.23Å; W643-L647 PolarHBondContact O-N 3.4Å
644	V	46.4	Very low	42.5	Very low	85 Å²	85	127.4 Å²	127.4	52%	0.515	66%	0.659	S	S	.	*	H	α-helix	trans	-68.3	-35.3	178.7	177.2	0	0	0	0	111.9	L640 F648	L640-V644 PolarHBondContact O-N 3.38Å; V644-F648 HydrophobicContact CG1-CD2 4.39Å; V644-F648 PolarHBondContact O-N 3.45Å
645	V	47.6	Very low	43.3	Very low	85 Å²	85	126.3 Å²	126.3	52%	0.515	64%	0.643	S	S	.	*	H	α-helix	trans	-71.9	-33.4	177.8	177.1	0	0	0	0	112	T641 W643 W649	T641-V645 WeakPolarHBondContact O-CG2 3.39Å; W643-V645 PolarHBondContact O-N 2.99Å; V645-W649 PolarHBondContact O-N 3.31Å
646	L	41.2	Very low	43.9	Very low	120 Å²	120	126.3 Å²	126.3	63%	0.628	63%	0.627	S	S	*	*	H	α-helix	trans	-72.3	-36.9	179	-140.9	86	0	0	0	112.4	W643 T650	W643-L646 PolarHBondContact O-N 3.23Å; L646-T650 PolarHBondContact O-N 2.73Å; L646-T650 PolarHBondContact O-OG1 3.19Å
647	L	49.1	Very low	44.8	Very low	113 Å²	113	125.6 Å²	125.6	59%	0.592	62%	0.618	S	S	*	*	H	α-helix	trans	-68.9	-37.3	175.6	-97.9	147	0	0	0	112.4	W643 T650 F651	W643-L647 PolarHBondContact O-N 3.4Å; L647-T650 WeakPolarHBondContact CA-OG1 3.37Å; L647-T650 PolarHBondContact O-OG1 3.25Å; L647-F651 PolarHBondContact O-N 3.5Å
648	F	42.9	Very low	45.3	Very low	155 Å²	155	122.5 Å²	122.5	68%	0.68	61%	0.607	S	S	*	*	H	α-helix	trans	-66.9	-38	175.4	-106.6	-91.4	0	0	0	112.6	V644 F652	V644-F648 HydrophobicContact CG1-CD2 4.39Å; V644-F648 PolarHBondContact O-N 3.45Å; F648-F652 PolarHBondContact O-N 3.21Å
649	W	44.2	Very low	45.9	Very low	183 Å²	183	123.2 Å²	123.2	69%	0.693	60%	0.598	S	S	*	*	H	α-helix	trans	-71.9	-35.9	178.3	-96.4	70.7	0	0	0	113.4	V645 F652 I653	V645-W649 PolarHBondContact O-N 3.31Å; W649-F652 PolarHBondContact O-N 3.39Å; W649-I653 HydrophobicContact CE3-CD1 4.26Å; W649-I653 WeakPolarHBondContact O-CG1 3.49Å; W649-I653 PolarHBondContact O-N 3.47Å; W649-I653 VanDerWaalsContact O-N 3.17Å
650	T	52	Low	46.1	Very low	85 Å²	85	120 Å²	120	52%	0.521	59%	0.586	S	S	.	*	H	α-helix	trans	-69.1	-35.5	176.2	21	0	0	0	0	112.2	L646 L647 F654	L646-T650 PolarHBondContact O-N 2.73Å; L646-T650 PolarHBondContact O-OG1 3.19Å; L647-T650 WeakPolarHBondContact CA-OG1 3.37Å; L647-T650 PolarHBondContact O-OG1 3.25Å; T650-F654 PolarHBondContact O-N 3.49Å
651	F	45.3	Very low	46.3	Very low	152 Å²	152	119 Å²	119	67%	0.667	58%	0.581	S	S	*	*	H	α-helix	trans	-69.9	-36.1	176.4	-137.8	-93.1	0	0	0	112.6	L647 F654 Q655	L647-F651 PolarHBondContact O-N 3.5Å; F651-F654 PolarHBondContact O-N 3.29Å; F651-Q655 PolarHBondContact O-N 3.22Å
652	F	47.9	Very low	46.4	Very low	143 Å²	143	123.3 Å²	123.3	63%	0.627	59%	0.587	S	S	*	*	H	α-helix	trans	-71.5	-38.7	179.2	-154.8	-97.5	0	0	0	112.4	F648 W649 F654 Q655 V656	F648-F652 PolarHBondContact O-N 3.21Å; W649-F652 PolarHBondContact O-N 3.39Å; F652-F654 VanDerWaalsContact C-N 3.33Å; F652-F654 PolarHBondContact O-N 3.17Å; F652-Q655 PolarHBondContact O-N 3.48Å; F652-V656 HydrophobicContact CD1-CG2 4.34Å; F652-V656 HydrophobicContact CE1-CG2 4.3Å; F652-V656 WeakPolarHBondContact O-CG2 3.41Å; F652-V656 PolarHBondContact O-N 3.29Å
653	I	53.2	Low	46.6	Very low	97 Å²	97	118.1 Å²	118.1	50%	0.497	57%	0.574	S	S	.	*	H	α-helix	trans	-65.5	-37.2	175.6	-68	170.1	0	0	0	111	W649 Q655 V656 V657	W649-I653 HydrophobicContact CE3-CD1 4.26Å; W649-I653 WeakPolarHBondContact O-CG1 3.49Å; W649-I653 PolarHBondContact O-N 3.47Å; W649-I653 VanDerWaalsContact O-N 3.17Å; I653-Q655 PolarHBondContact O-N 3.21Å; I653-V656 PolarHBondContact O-N 3.39Å; I653-V657 WeakPolarHBondContact O-CG2 3.35Å; I653-V657 PolarHBondContact O-N 3.22Å
654	F	44.4	Very low	46.8	Very low	156 Å²	156	116.7 Å²	116.7	68%	0.684	58%	0.579	S	S	*	*	H	α-helix	trans	-66.6	-35.8	178	-125.4	-90.4	0	0	0	113	T650 F651 F652 L658	T650-F654 PolarHBondContact O-N 3.49Å; F651-F654 PolarHBondContact O-N 3.29Å; F652-F654 VanDerWaalsContact C-N 3.33Å; F652-F654 PolarHBondContact O-N 3.17Å; F654-L658 HydrophobicContact CD1-CD1 4.26Å; F654-L658 PolarHBondContact O-N 3.38Å
655	Q	45.5	Very low	46.7	Very low	111 Å²	111	115.6 Å²	115.6	52%	0.519	59%	0.585	S	S	.	*	H	α-helix	trans	-70.9	-35.3	175.2	-86.1	-160.8	-27.9	0	0	113.2	F651 F652 I653 I659	F651-Q655 PolarHBondContact O-N 3.22Å; F652-Q655 PolarHBondContact O-N 3.48Å; I653-Q655 PolarHBondContact O-N 3.21Å; Q655-I659 WeakPolarHBondContact O-CD1 3.45Å; Q655-I659 VanDerWaalsContact O-CG1 3.29Å; Q655-I659 WeakPolarHBondContact O-CG1 3.43Å; Q655-I659 PolarHBondContact O-N 3.39Å
656	V	54.4	Low	46.5	Very low	77 Å²	77	116.1 Å²	116.1	47%	0.467	59%	0.589	S	S	.	*	H	α-helix	trans	-69.9	-36.6	179.5	174.5	0	0	0	0	111.5	F652 I653 S660	F652-V656 HydrophobicContact CD1-CG2 4.34Å; F652-V656 HydrophobicContact CE1-CG2 4.3Å; F652-V656 WeakPolarHBondContact O-CG2 3.41Å; F652-V656 PolarHBondContact O-N 3.29Å; I653-V656 PolarHBondContact O-N 3.39Å; V656-S660 PolarHBondContact O-N 3.27Å; V656-S660 PolarHBondContact O-OG 3.34Å
657	V	53.8	Low	46.4	Very low	79 Å²	79	117.7 Å²	117.7	48%	0.479	60%	0.596	S	S	.	*	H	α-helix	trans	-67.9	-42.1	176.7	175.7	0	0	0	0	111.7	I653 I659 S660 D661	I653-V657 WeakPolarHBondContact O-CG2 3.35Å; I653-V657 PolarHBondContact O-N 3.22Å; V657-I659 VanDerWaalsContact C-N 3.33Å; V657-I659 PolarHBondContact O-N 3.18Å; V657-S660 WeakPolarHBondContact O-CB 3.42Å; V657-S660 PolarHBondContact O-N 2.69Å; V657-D661 PolarHBondContact O-N 3.45Å; V657-D661 VanDerWaalsContact O-N 3.17Å
658	L	48.1	Very low	46	Very low	115 Å²	115	115.7 Å²	115.7	60%	0.602	60%	0.602	S	S	*	*	H	α-helix	trans	-65.7	-32	178.2	-86.3	159.9	0	0	0	113.8	F654 W662	F654-L658 HydrophobicContact CD1-CD1 4.26Å; F654-L658 PolarHBondContact O-N 3.38Å; L658-W662 PolarHBondContact O-N 3.32Å
659	I	51.6	Low	45.5	Very low	100 Å²	100	113.9 Å²	113.9	51%	0.513	61%	0.609	S	S	.	*	H	α-helix	trans	-76	-31	176.6	-68.3	167.5	0	0	0	111.1	Q655 V657 L663	Q655-I659 WeakPolarHBondContact O-CD1 3.45Å; Q655-I659 VanDerWaalsContact O-CG1 3.29Å; Q655-I659 WeakPolarHBondContact O-CG1 3.43Å; Q655-I659 PolarHBondContact O-N 3.39Å; V657-I659 VanDerWaalsContact C-N 3.33Å; V657-I659 PolarHBondContact O-N 3.18Å; I659-L663 HydrophobicContact CG2-CD1 4.04Å; I659-L663 PolarHBondContact O-N 3.2Å
660	S	42.4	Very low	45	Very low	56 Å²	56	114.5 Å²	114.5	39%	0.392	62%	0.619	S	S	.	*	H	α-helix	trans	-68.8	-42.5	177.5	-52.4	0	0	0	0	112.1	V656 V657 L663 L664	V656-S660 PolarHBondContact O-N 3.27Å; V656-S660 PolarHBondContact O-OG 3.34Å; V657-S660 WeakPolarHBondContact O-CB 3.42Å; V657-S660 PolarHBondContact O-N 2.69Å; S660-L663 PolarHBondContact O-N 3.46Å; S660-L664 PolarHBondContact O-N 3.24Å
661	D	43.6	Very low	44	Very low	111 Å²	111	122 Å²	122	59%	0.594	64%	0.638	S	S	*	*	H	α-helix	trans	-72	-29.4	179.4	-77.1	-21	0	0	0	112.8	V657 G665	V657-D661 PolarHBondContact O-N 3.45Å; V657-D661 VanDerWaalsContact O-N 3.17Å; D661-G665 PolarHBondContact O-N 3.13Å
662	W	45.3	Very low	43.3	Very low	185 Å²	185	119.4 Å²	119.4	70%	0.701	64%	0.639	S	S	*	*	H	α-helix	trans	-72.2	-38.2	175.6	-168.2	77	0	0	0	112.3	L658 G665 T666	L658-W662 PolarHBondContact O-N 3.32Å; W662-G665 PolarHBondContact O-N 3.48Å; W662-T666 PolarHBondContact O-OG1 3.45Å; W662-T666 VanDerWaalsContact O-OG1 3.13Å
663	L	41.5	Very low	42.5	Very low	100 Å²	100	122.1 Å²	122.1	52%	0.524	65%	0.651	S	S	.	*	H	α-helix	trans	-71.5	-30.4	179.3	-91.5	153.2	0	0	0	113.5	I659 S660 T666	I659-L663 HydrophobicContact CG2-CD1 4.04Å; I659-L663 PolarHBondContact O-N 3.2Å; S660-L663 PolarHBondContact O-N 3.46Å; L663-T666 PolarHBondContact O-OG1 3.17Å
664	L	42.9	Very low	41.7	Very low	142 Å²	142	122.8 Å²	122.8	74%	0.743	66%	0.661	S	S	*	*	H	α-helix	trans	-78.8	-21.2	176.6	-80.6	158.6	0	0	0	113.6	S660	S660-L664 PolarHBondContact O-N 3.24Å
665	G	44.2	Very low	41.2	Very low	63 Å²	63	120.5 Å²	120.5	65%	0.649	67%	0.665	S	S	*	*	H	α-helix	trans	-78.6	-19	177.9	0	0	0	0	0	115.4	D661 W662	D661-G665 PolarHBondContact O-N 3.13Å; W662-G665 PolarHBondContact O-N 3.48Å
666	T	42.8	Very low	41	Very low	96 Å²	96	121.3 Å²	121.3	59%	0.589	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	-1.6	-173.2	18.9	0	0	0	0	116	W662 L663	W662-T666 PolarHBondContact O-OG1 3.45Å; W662-T666 VanDerWaalsContact O-OG1 3.13Å; L663-T666 PolarHBondContact O-OG1 3.17Å
667	I	39.6	Very low	40	Very low	153 Å²	153	123.6 Å²	123.6	79%	0.785	69%	0.694	S	S	*	*	S	Bend	trans	-101.8	-2.8	-177.4	-63.7	175.1	0	0	0	112.8
668	G	39.4	Very low	38.8	Very low	70 Å²	70	125.3 Å²	125.3	72%	0.722	71%	0.708	S	S	*	*	S	Bend	trans	-114.7	44.9	-170.2	0	0	0	0	0	117.1
669	S	33.9	Very low	38.3	Very low	117 Å²	117	129.9 Å²	129.9	82%	0.818	74%	0.74	S	S	*	*			trans	-166.2	81.5	161.3	-164.6	0	0	0	0	113.7
670	Q	34.2	Very low	37.7	Very low	196 Å²	196	131.4 Å²	131.4	92%	0.916	75%	0.751	S	S	*	*			trans	-135.6	99.8	155.1	-84.2	-159.6	-4.4	0	0	109.5
671	R	29.8	Very low	37.4	Very low	242 Å²	242	135.4 Å²	135.4	91%	0.913	77%	0.77	S	S	*	*			trans	-142.4	99.6	157.9	-88	-168.4	177.2	-179.8	-0.5	111.3
672	S	31.4	Very low	37.1	Very low	98 Å²	98	136.7 Å²	136.7	69%	0.685	78%	0.78	S	S	*	*			trans	51.9	120	131.6	63.2	0	0	0	0	123.3
673	K	29.9	Very low	36.6	Very low	200 Å²	200	133.9 Å²	133.9	87%	0.87	79%	0.785	S	S	*	*			trans	80.9	158.6	134.8	-70.9	-176.3	179.2	-176.8	0	119.9
674	P	37.8	Very low	36.3	Very low	112 Å²	112	136 Å²	136	73%	0.727	80%	0.801	S	S	*	*				-130.9	174.7	-58.6	35.8	-16.6	0	0	0	112.6
675	S	32.9	Very low	35.8	Very low	108 Å²	108	135.6 Å²	135.6	76%	0.755	81%	0.805	S	S	*	*			trans	-46.5	160.9	173.9	41.1	0	0	0	0	117.3
676	P	41.7	Very low	35.2	Very low	127 Å²	127	140.8 Å²	140.8	83%	0.825	82%	0.816	S	S	*	*				-133.6	156.4	117.4	36	-23.6	0	0	0	115.3
677	V	33.7	Very low	34.7	Very low	126 Å²	126	144.2 Å²	144.2	76%	0.764	83%	0.833	S	S	*	*			trans	-71.6	149.5	176.6	169.4	0	0	0	0	111.4
678	C	28.6	Very low	34.2	Very low	115 Å²	115	143.5 Å²	143.5	78%	0.777	84%	0.838	S	S	*	*				177	128.8	123.7	-97.6	0	0	0	0	113.3
679	V	37.7	Very low	33.8	Very low	211 Å²	211	150.2 Å²	150.2	100%	1.279	85%	0.848	S	S	*	*			trans	47.6	0	141.9	-168.4	0	0	0	0	119.2

Retrieved 679 of 679 residues in 760.9 ms (Link to these results)

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