A0A077ZFX1_TRITR Loading...

RNA pol 3 Rpc31 and IF4E domain containing protei n

AlphaFold DB , UniProt , Accession A0A077ZFX1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 514 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	38.9	Very low	31.9	Very low	250 Å²	250	171.4 Å²	171.4	100%	1.232	84%	0.842	S	S	*	*				0	93.5	0	-55.9	-168.9	-148.5	0	0	106.1
2	G	33	Very low	31.7	Very low	63 Å²	63	173.8 Å²	173.8	65%	0.649	85%	0.851	S	S	*	*				93.7	93.4	69.5	0	0	0	0	0	108.3
3	T	31	Very low	31.9	Very low	128 Å²	128	167.3 Å²	167.3	79%	0.785	84%	0.842	S	S	*	*				113.8	144.9	122.5	54.3	0	0	0	0	111.1
4	K	31.2	Very low	31.8	Very low	160 Å²	160	170.8 Å²	170.8	70%	0.696	85%	0.849	S	S	*	*			cis	-163.7	138.8	-4	-109.4	165.9	-177.5	-177.5	0	106.5	Y6	K4-Y6 HydrophobicContact CB-CD2 4.44Å; K4-Y6 HydrophobicContact CD-CE2 4.19Å
5	R	28.5	Very low	31.5	Very low	253 Å²	253	163.8 Å²	163.8	96%	0.955	84%	0.838	S	S	*	*			trans	-70.2	133	159.3	-78.7	177.9	-177.7	155.2	0.5	108.3
6	Y	29.4	Very low	31.6	Very low	180 Å²	180	159.6 Å²	159.6	71%	0.706	83%	0.828	S	S	*	*			trans	-121.6	115.2	161.1	-102.1	-87.8	0	0	0	109.2	K4 F8	K4-Y6 HydrophobicContact CB-CD2 4.44Å; K4-Y6 HydrophobicContact CD-CE2 4.19Å; Y6-F8 HydrophobicContact CD1-CD2 4.19Å; Y6-F8 HydrophobicContact CD1-CE2 4.46Å; Y6-F8 HydrophobicContact CE1-CE2 4.43Å
7	R	29.6	Very low	31.8	Very low	232 Å²	232	158.2 Å²	158.2	88%	0.875	83%	0.828	S	S	*	*			trans	-88.6	137.1	154.6	-81.3	-176.2	177.7	168.1	-1.9	106.7
8	F	32.1	Very low	31.8	Very low	186 Å²	186	157.3 Å²	157.3	82%	0.816	83%	0.825	S	S	*	*			trans	-126.4	119.1	160.7	-123.8	-90.3	0	0	0	108.4	Y6	Y6-F8 HydrophobicContact CD1-CD2 4.19Å; Y6-F8 HydrophobicContact CD1-CE2 4.46Å; Y6-F8 HydrophobicContact CE1-CE2 4.43Å
9	N	31.5	Very low	32.2	Very low	151 Å²	151	157.2 Å²	157.2	81%	0.807	82%	0.824	S	S	*	*			trans	-88.2	140.7	170.7	-90.9	-6.3	0	0	0	109.1
10	G	29.6	Very low	32.1	Very low	76 Å²	76	158.2 Å²	158.2	78%	0.784	82%	0.817	S	S	*	*			trans	82.2	100.8	139.5	0	0	0	0	0	117.9
11	Q	36.1	Very low	32.1	Very low	206 Å²	206	155.5 Å²	155.5	96%	0.963	81%	0.81	S	S	*	*			trans	-155.9	140.1	139.2	-108.1	171.3	0.9	0	0	110.1
12	Q	30	Very low	32.2	Very low	201 Å²	201	149.5 Å²	149.5	94%	0.939	79%	0.789	S	S	*	*			trans	-69.2	159.2	-170.3	-85.9	165.2	-40.5	0	0	114.9
13	A	34	Very low	32.7	Very low	89 Å²	89	153.4 Å²	153.4	74%	0.736	80%	0.795	S	S	*	*			trans	-39.9	145.9	-178.4	0	0	0	0	0	118.5
14	F	30.5	Very low	33.6	Very low	216 Å²	216	156.8 Å²	156.8	95%	0.947	80%	0.802	S	S	*	*			trans	-166.2	123.3	138.8	-96.1	-75.4	0	0	0	110.5
15	G	27.8	Very low	34	Very low	66 Å²	66	154.7 Å²	154.7	68%	0.68	80%	0.796	S	S	*	*			trans	68.9	113.3	137.4	0	0	0	0	0	121.9
16	S	31.9	Very low	34.7	Very low	97 Å²	97	152 Å²	152	68%	0.678	79%	0.791	S	S	*	*			trans	56	112	136.6	60.7	0	0	0	0	120
17	T	35.1	Very low	35.1	Very low	135 Å²	135	149.4 Å²	149.4	83%	0.828	80%	0.796	S	S	*	*			trans	-129	97.3	143.3	-35.9	0	0	0	0	106.9	L19	T17-L19 PolarHBondContact O-N 3.41Å; T17-L19 VanDerWaalsContact O-N 3.07Å
18	D	31.5	Very low	35.8	Very low	143 Å²	143	143.3 Å²	143.3	77%	0.765	79%	0.789	S	S	*	*			trans	-65.7	103.8	-179.3	-64.7	-46.1	0	0	0	109.5	Y20	D18-Y20 PolarHBondContact O-N 3.26Å
19	L	40.4	Very low	36.3	Very low	154 Å²	154	140.7 Å²	140.7	81%	0.806	79%	0.791	S	S	*	*			trans	-79.6	5.8	176	-89.1	160	0	0	0	113.2	T17	T17-L19 PolarHBondContact O-N 3.41Å; T17-L19 VanDerWaalsContact O-N 3.07Å
20	Y	30.3	Very low	37.1	Very low	177 Å²	177	137.8 Å²	137.8	69%	0.694	78%	0.778	S	S	*	*	S	Bend	trans	-142.8	141.5	-174.4	-72.5	-84.9	0	0	0	110.9	D18	D18-Y20 PolarHBondContact O-N 3.26Å
21	P	31.9	Very low	38	Very low	102 Å²	102	140 Å²	140	66%	0.662	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-61.3	140.3	164.4	26.1	-30.4	0	0	0	109.1	L23	P21-L23 PolarHBondContact O-N 3.44Å; P21-L23 VanDerWaalsContact O-N 3.15Å
22	P	40.2	Very low	38.4	Very low	124 Å²	124	134.9 Å²	134.9	81%	0.805	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-65.5	116.8	176.4	3.2	7.6	0	0	0	108.5	E24	P22-E24 PolarHBondContact O-N 3.04Å
23	L	44.3	Very low	39.1	Very low	145 Å²	145	130.7 Å²	130.7	76%	0.759	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-71.2	121.1	170	-68.4	168.1	0	0	0	108.4	P21 M25	P21-L23 PolarHBondContact O-N 3.44Å; P21-L23 VanDerWaalsContact O-N 3.15Å; L23-M25 PolarHBondContact O-N 2.92Å; L23-M25 VanDerWaalsContact O-N 3.11Å
24	E	49.8	Very low	39.8	Very low	199 Å²	199	132.4 Å²	132.4	93%	0.93	75%	0.745	S	S	*	*	S	Bend	trans	-62.6	-14.8	179.5	-69.4	-176.3	163.2	0	0	113.6	P22	P22-E24 PolarHBondContact O-N 3.04Å
25	M	39.5	Very low	40.4	Very low	117 Å²	117	125.3 Å²	125.3	58%	0.576	72%	0.719	S	S	*	*	S	Bend	trans	-135.2	122.1	177.9	-66.4	-172.3	76	0	0	111.6	L23	L23-M25 PolarHBondContact O-N 2.92Å; L23-M25 VanDerWaalsContact O-N 3.11Å
26	K	43.5	Very low	41.8	Very low	197 Å²	197	126.2 Å²	126.2	86%	0.857	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-75.9	138.9	167.8	-87	-179.1	175.9	176.5	0	110
27	P	38.5	Very low	42.6	Very low	124 Å²	124	127.5 Å²	127.5	81%	0.805	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-65.6	135.1	173.5	25.7	-31.6	0	0	0	111.1
28	S	43.7	Very low	43.2	Very low	104 Å²	104	125.9 Å²	125.9	73%	0.727	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-76.5	140.6	174.4	-62.1	0	0	0	0	111	V30	S28-V30 PolarHBondContact O-N 3.17Å
29	P	43.2	Very low	44.1	Very low	132 Å²	132	121.5 Å²	121.5	86%	0.857	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-65.5	130.4	174.6	25.7	-31.1	0	0	0	110.7
30	V	47.1	Very low	44.5	Very low	89 Å²	89	115.2 Å²	115.2	54%	0.539	65%	0.646	S	S	.	*	P	Polyproline II helix	trans	-78.6	123.8	175.4	176	0	0	0	0	108.8	S28 A40	S28-V30 PolarHBondContact O-N 3.17Å; V30-A40 HydrophobicContact CG1-CB 3.63Å
31	N	48.4	Very low	45.4	Very low	124 Å²	124	111.9 Å²	111.9	66%	0.663	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-72.9	125.6	172.6	-169.9	8.5	0	0	0	109.6	D33	N31-D33 VanDerWaalsContact C-N 3.26Å; N31-D33 PolarHBondContact ND2-OD2 3.34Å; N31-D33 PolarHBondContact O-N 3.06Å; N31-D33 PolarHBondContact OD1-OD2 3.01Å
32	V	44.7	Very low	46.2	Very low	97 Å²	97	110.3 Å²	110.3	59%	0.588	62%	0.619	S	S	*	*			trans	-94	29	-167.8	-160.7	0	0	0	0	111.7	S34	V32-S34 PolarHBondContact O-N 3.32Å
33	D	44.1	Very low	46.7	Very low	113 Å²	113	111.4 Å²	111.4	60%	0.604	61%	0.607	S	S	*	*	S	Bend	trans	-87.7	106.2	179.7	-63.4	-29.5	0	0	0	109.4	N31 V35	N31-D33 VanDerWaalsContact C-N 3.26Å; N31-D33 PolarHBondContact ND2-OD2 3.34Å; N31-D33 PolarHBondContact O-N 3.06Å; N31-D33 PolarHBondContact OD1-OD2 3.01Å; D33-V35 PolarHBondContact O-N 3.37Å; D33-V35 VanDerWaalsContact O-N 3.15Å
34	S	48.6	Very low	47.3	Very low	125 Å²	125	106.5 Å²	106.5	87%	0.874	59%	0.591	S	S	*	*	S	Bend	trans	71	-5.4	163	74.3	0	0	0	0	120.7	V32	V32-S34 PolarHBondContact O-N 3.32Å
35	V	43.3	Very low	47.5	Very low	67 Å²	67	99.9 Å²	99.9	41%	0.406	56%	0.558	S	S	.	*	S	Bend	trans	-109.4	127.9	177.5	177.8	0	0	0	0	110	D33 L37 V39	D33-V35 PolarHBondContact O-N 3.37Å; D33-V35 VanDerWaalsContact O-N 3.15Å; V35-L37 PolarHBondContact O-N 3.32Å; V35-V39 HydrophobicContact CG1-CB 3.61Å; V35-V39 HydrophobicContact CG1-CG1 3.58Å; V35-V39 HydrophobicContact CG1-CG2 4.48Å
36	S	57.6	Low	48.2	Very low	86 Å²	86	97.4 Å²	97.4	60%	0.601	55%	0.55	S	S	*	.			trans	-49.9	128.3	179.4	-160.3	0	0	0	0	109.7	H38 V39 A40	S36-H38 PolarHBondContact O-N 3.47Å; S36-V39 WeakPolarHBondContact O-CB 3.48Å; S36-V39 PolarHBondContact O-N 3.07Å; S36-A40 PolarHBondContact O-N 3.08Å
37	L	49.2	Very low	48.9	Very low	123 Å²	123	93.6 Å²	93.6	64%	0.644	54%	0.536	S	S	*	.	H	α-helix	trans	-47.7	-29.8	-177.2	-88.8	163.7	0	0	0	113.1	V35 F41	V35-L37 PolarHBondContact O-N 3.32Å; L37-F41 WeakPolarHBondContact O-CB 3.47Å; L37-F41 PolarHBondContact O-N 3.06Å
38	H	47.8	Very low	49.6	Very low	102 Å²	102	93.9 Å²	93.9	47%	0.472	52%	0.521	S	S	.	.	H	α-helix	trans	-61.6	-48.8	174.8	-157.3	72.9	0	0	0	112.8	S36 A40 F41 E42	S36-H38 PolarHBondContact O-N 3.47Å; H38-A40 VanDerWaalsContact C-N 3.32Å; H38-A40 PolarHBondContact O-N 3.32Å; H38-F41 WeakPolarHBondContact O-CB 3.49Å; H38-F41 PolarHBondContact O-N 3.36Å; H38-F41 VanDerWaalsContact O-N 3.14Å; H38-E42 IonicContact CD2-OE1 3.05Å; H38-E42 IonicContact CD2-OE2 3.26Å; H38-E42 IonicContact NE2-OE1 3.96Å; H38-E42 WeakPolarHBondContact O-CG 3.43Å; H38-E42 PolarHBondContact O-N 2.94Å
39	V	49.3	Very low	50.2	Low	50 Å²	50	91.3 Å²	91.3	30%	0.303	50%	0.499	S	S	.	.	H	α-helix	trans	-65.1	-37.9	179.1	175.7	0	0	0	0	110.9	V35 S36 F41 R43	V35-V39 HydrophobicContact CG1-CB 3.61Å; V35-V39 HydrophobicContact CG1-CG1 3.58Å; V35-V39 HydrophobicContact CG1-CG2 4.48Å; S36-V39 WeakPolarHBondContact O-CB 3.48Å; S36-V39 PolarHBondContact O-N 3.07Å; V39-F41 VanDerWaalsContact C-N 3.34Å; V39-R43 WeakPolarHBondContact O-CB 3.39Å; V39-R43 VanDerWaalsContact O-CG 3.25Å; V39-R43 WeakPolarHBondContact O-CG 3.47Å; V39-R43 PolarHBondContact O-N 3.35Å
40	A	48.8	Very low	50.9	Low	23 Å²	23	88.8 Å²	88.8	19%	0.19	48%	0.476	C	S	.	.	H	α-helix	trans	-67.6	-36.3	175.3	0	0	0	0	0	112.2	V30 S36 H38 G44	V30-A40 HydrophobicContact CG1-CB 3.63Å; S36-A40 PolarHBondContact O-N 3.08Å; H38-A40 VanDerWaalsContact C-N 3.32Å; H38-A40 PolarHBondContact O-N 3.32Å; A40-G44 PolarHBondContact O-N 3.39Å
41	F	49.5	Very low	51.7	Low	107 Å²	107	90 Å²	90	47%	0.469	48%	0.476	S	S	.	.	H	α-helix	trans	-68.9	-47.1	175.3	-179.5	-93.7	0	0	0	112	L37 H38 V39 G44 Y45 C208	L37-F41 WeakPolarHBondContact O-CB 3.47Å; L37-F41 PolarHBondContact O-N 3.06Å; H38-F41 WeakPolarHBondContact O-CB 3.49Å; H38-F41 PolarHBondContact O-N 3.36Å; H38-F41 VanDerWaalsContact O-N 3.14Å; V39-F41 VanDerWaalsContact C-N 3.34Å; F41-G44 PolarHBondContact O-N 3.05Å; F41-Y45 WeakPolarHBondContact O-CB 3.34Å; F41-Y45 PolarHBondContact O-N 3.33Å; F41-C208 HydrophobicContact CE2-CB 3.89Å; F41-C208 HydrophobicContact CZ-CB 3.63Å
42	E	48.9	Very low	52.2	Low	68 Å²	68	88.2 Å²	88.2	32%	0.318	47%	0.466	S	S	.	.	H	α-helix	trans	-59.5	-47.1	176.1	-75.4	-176.2	144.1	0	0	111.5	H38 G44 Y45 V46	H38-E42 IonicContact CD2-OE1 3.05Å; H38-E42 IonicContact CD2-OE2 3.26Å; H38-E42 IonicContact NE2-OE1 3.96Å; H38-E42 WeakPolarHBondContact O-CG 3.43Å; H38-E42 PolarHBondContact O-N 2.94Å; E42-G44 VanDerWaalsContact C-N 3.32Å; E42-G44 PolarHBondContact O-N 3.04Å; E42-Y45 PolarHBondContact O-N 3.5Å; E42-V46 WeakPolarHBondContact O-CB 3.49Å; E42-V46 VanDerWaalsContact O-CG2 3.3Å; E42-V46 WeakPolarHBondContact O-CG2 3.49Å; E42-V46 PolarHBondContact O-N 3Å
43	R	51.6	Low	52.5	Low	147 Å²	147	89 Å²	89	56%	0.555	47%	0.473	S	S	*	.	H	α-helix	trans	-57.6	-44.9	174.4	-75.4	177.4	177.2	-178.7	-0.3	111.4	V39 M47	V39-R43 WeakPolarHBondContact O-CB 3.39Å; V39-R43 VanDerWaalsContact O-CG 3.25Å; V39-R43 WeakPolarHBondContact O-CG 3.47Å; V39-R43 PolarHBondContact O-N 3.35Å; R43-M47 WeakPolarHBondContact O-CB 3.27Å; R43-M47 VanDerWaalsContact O-CG 3.25Å; R43-M47 WeakPolarHBondContact O-CG 3.49Å; R43-M47 PolarHBondContact O-N 2.87Å
44	G	55.6	Low	52.7	Low	42 Å²	42	93.6 Å²	93.6	43%	0.433	48%	0.483	S	S	.	.	H	α-helix	trans	-62.4	-42	176.8	0	0	0	0	0	113.5	A40 F41 E42 R48	A40-G44 PolarHBondContact O-N 3.39Å; F41-G44 PolarHBondContact O-N 3.05Å; E42-G44 VanDerWaalsContact C-N 3.32Å; E42-G44 PolarHBondContact O-N 3.04Å; G44-R48 WeakPolarHBondContact O-CB 3.26Å; G44-R48 PolarHBondContact O-N 3.39Å
45	Y	54.5	Low	52.6	Low	60 Å²	60	91.3 Å²	91.3	24%	0.235	46%	0.456	C	S	.	.	H	α-helix	trans	-67.9	-45.7	179.2	-175.3	-105.5	0	0	0	112	F41 E42 M47 R48 L49 F285	F41-Y45 WeakPolarHBondContact O-CB 3.34Å; F41-Y45 PolarHBondContact O-N 3.33Å; E42-Y45 PolarHBondContact O-N 3.5Å; Y45-M47 PolarHBondContact O-N 2.97Å; Y45-R48 WeakPolarHBondContact O-CB 3.46Å; Y45-R48 PolarHBondContact O-N 3.41Å; Y45-R48 VanDerWaalsContact O-N 3.13Å; Y45-L49 HydrophobicContact CD1-CD1 3.91Å; Y45-L49 HydrophobicContact CD1-CG 4.44Å; Y45-L49 HydrophobicContact CE1-CD1 3.5Å; Y45-L49 VanDerWaalsContact CE1-CD1 3.5Å; Y45-L49 HydrophobicContact CE1-CG 4.13Å; Y45-L49 PolarHBondContact O-N 3.11Å; Y45-F285 HydrophobicContact CD1-CZ 4.33Å; Y45-F285 HydrophobicContact CE1-CE2 4.3Å; Y45-F285 AromaticContact CE1-CZ 3.82Å; Y45-F285 HydrophobicContact CE1-CZ 3.82Å
46	V	53.7	Low	52.8	Low	66 Å²	66	95.8 Å²	95.8	40%	0.4	47%	0.472	S	S	.	.	H	α-helix	trans	-61.9	-43.4	175.8	172	0	0	0	0	111.1	E42 R48 L49 Q50	E42-V46 WeakPolarHBondContact O-CB 3.49Å; E42-V46 VanDerWaalsContact O-CG2 3.3Å; E42-V46 WeakPolarHBondContact O-CG2 3.49Å; E42-V46 PolarHBondContact O-N 3Å; V46-R48 VanDerWaalsContact C-N 3.28Å; V46-R48 PolarHBondContact O-N 3.45Å; V46-L49 PolarHBondContact O-N 3.08Å; V46-Q50 VanDerWaalsContact O-CG 3.31Å; V46-Q50 WeakPolarHBondContact O-CG 3.31Å; V46-Q50 PolarHBondContact O-N 3.4Å
47	M	58.5	Low	52.2	Low	116 Å²	116	100.4 Å²	100.4	57%	0.571	48%	0.476	S	S	*	.	H	α-helix	trans	-62.8	-34.4	174.9	-72.9	-159.2	98.2	0	0	112.6	R43 Y45 Q50 Q51	R43-M47 WeakPolarHBondContact O-CB 3.27Å; R43-M47 VanDerWaalsContact O-CG 3.25Å; R43-M47 WeakPolarHBondContact O-CG 3.49Å; R43-M47 PolarHBondContact O-N 2.87Å; Y45-M47 PolarHBondContact O-N 2.97Å; M47-Q50 PolarHBondContact O-N 3.34Å; M47-Q51 WeakPolarHBondContact O-CG 3.42Å; M47-Q51 PolarHBondContact O-N 3.07Å
48	R	54.7	Low	52	Low	131 Å²	131	97.3 Å²	97.3	49%	0.494	46%	0.463	S	S	.	.	H	α-helix	trans	-69.9	-42.6	176.6	-168.5	67.9	179.1	166.4	0.5	111.7	G44 Y45 V46 Q50 Q51	G44-R48 WeakPolarHBondContact O-CB 3.26Å; G44-R48 PolarHBondContact O-N 3.39Å; Y45-R48 WeakPolarHBondContact O-CB 3.46Å; Y45-R48 PolarHBondContact O-N 3.41Å; Y45-R48 VanDerWaalsContact O-N 3.13Å; V46-R48 VanDerWaalsContact C-N 3.28Å; V46-R48 PolarHBondContact O-N 3.45Å; R48-Q50 VanDerWaalsContact C-N 3.3Å; R48-Q50 PolarHBondContact O-N 3.44Å; R48-Q51 PolarHBondContact O-N 2.91Å; R48-Q51 VanDerWaalsContact O-N 3.16Å
49	L	54.5	Low	51.6	Low	50 Å²	50	96.2 Å²	96.2	26%	0.262	46%	0.461	S	S	.	.	H	α-helix	trans	-57.8	-45.3	173.6	-73.8	175.8	0	0	0	110.5	Y45 V46 Q51 L52 Y55	Y45-L49 HydrophobicContact CD1-CD1 3.91Å; Y45-L49 HydrophobicContact CD1-CG 4.44Å; Y45-L49 HydrophobicContact CE1-CD1 3.5Å; Y45-L49 VanDerWaalsContact CE1-CD1 3.5Å; Y45-L49 HydrophobicContact CE1-CG 4.13Å; Y45-L49 PolarHBondContact O-N 3.11Å; V46-L49 PolarHBondContact O-N 3.08Å; L49-Q51 PolarHBondContact O-N 2.93Å; L49-L52 HydrophobicContact CD2-CD1 3.94Å; L49-L52 WeakPolarHBondContact O-CB 3.46Å; L49-L52 PolarHBondContact O-N 3.36Å; L49-Y55 HydrophobicContact CB-CD2 3.87Å; L49-Y55 HydrophobicContact CB-CE2 4.05Å; L49-Y55 WeakPolarHBondContact O-CB 3.33Å; L49-Y55 WeakPolarHBondContact O-CD2 3.32Å; L49-Y55 VanDerWaalsContact O-CG 3.29Å
50	Q	59.3	Low	51.3	Low	79 Å²	79	99 Å²	99	37%	0.369	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-19.3	177.9	-72.8	174.4	6.7	0	0	115.2	V46 M47 R48 Y55	V46-Q50 VanDerWaalsContact O-CG 3.31Å; V46-Q50 WeakPolarHBondContact O-CG 3.31Å; V46-Q50 PolarHBondContact O-N 3.4Å; M47-Q50 PolarHBondContact O-N 3.34Å; R48-Q50 VanDerWaalsContact C-N 3.3Å; R48-Q50 PolarHBondContact O-N 3.44Å; Q50-Y55 HydrophobicContact CB-CD1 4.32Å; Q50-Y55 HydrophobicContact CB-CE1 4.17Å; Q50-Y55 HydrophobicContact CG-CD1 4.14Å; Q50-Y55 HydrophobicContact CG-CE1 3.5Å; Q50-Y55 HydrophobicContact CG-CE2 4.19Å
51	Q	63.8	Low	50.8	Low	115 Å²	115	99.9 Å²	99.9	54%	0.537	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-8.5	177.7	-68	171.1	3.6	0	0	113.3	M47 R48 L49	M47-Q51 WeakPolarHBondContact O-CG 3.42Å; M47-Q51 PolarHBondContact O-N 3.07Å; R48-Q51 PolarHBondContact O-N 2.91Å; R48-Q51 VanDerWaalsContact O-N 3.16Å; L49-Q51 PolarHBondContact O-N 2.93Å
52	L	59.5	Low	50.2	Low	86 Å²	86	98.3 Å²	98.3	45%	0.45	48%	0.482	S	S	.	.	S	Bend	trans	-76.4	141.5	-179	-67.5	173.9	0	0	0	111	L49 Y54 Y55	L49-L52 HydrophobicContact CD2-CD1 3.94Å; L49-L52 WeakPolarHBondContact O-CB 3.46Å; L49-L52 PolarHBondContact O-N 3.36Å; L52-Y54 PolarHBondContact O-N 3.04Å; L52-Y55 WeakPolarHBondContact O-CB 3.25Å; L52-Y55 PolarHBondContact O-N 3.14Å
53	P	49	Very low	49.4	Very low	113 Å²	113	100 Å²	100	73%	0.734	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-20	-180	-21.7	30.8	0	0	0	114.6
54	Y	48.8	Very low	48.4	Very low	209 Å²	209	96.1 Å²	96.1	82%	0.82	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	3.7	-174.7	-42.9	-76	0	0	0	112.7	L52 H56	L52-Y54 PolarHBondContact O-N 3.04Å; Y54-H56 PolarHBondContact O-N 3.27Å; Y54-H56 VanDerWaalsContact O-N 3.11Å
55	Y	46.4	Very low	47.3	Very low	78 Å²	78	100.9 Å²	100.9	31%	0.306	50%	0.496	S	S	.	.			trans	-74.1	106	177.4	179.5	-95.1	0	0	0	110.1	L49 Q50 L52 R57	L49-Y55 HydrophobicContact CB-CD2 3.87Å; L49-Y55 HydrophobicContact CB-CE2 4.05Å; L49-Y55 WeakPolarHBondContact O-CB 3.33Å; L49-Y55 WeakPolarHBondContact O-CD2 3.32Å; L49-Y55 VanDerWaalsContact O-CG 3.29Å; Q50-Y55 HydrophobicContact CB-CD1 4.32Å; Q50-Y55 HydrophobicContact CB-CE1 4.17Å; Q50-Y55 HydrophobicContact CG-CD1 4.14Å; Q50-Y55 HydrophobicContact CG-CE1 3.5Å; Q50-Y55 HydrophobicContact CG-CE2 4.19Å; L52-Y55 WeakPolarHBondContact O-CB 3.25Å; L52-Y55 PolarHBondContact O-N 3.14Å; Y55-R57 HydrophobicContact CD1-CB 4.4Å; Y55-R57 HydrophobicContact CE1-CB 3.95Å; Y55-R57 HydrophobicContact CE1-CG 4.31Å; Y55-R57 PolarHBondContact O-N 3.1Å
56	H	48	Very low	46.5	Very low	161 Å²	161	102.6 Å²	102.6	75%	0.745	51%	0.513	S	S	*	.			trans	-77.6	106.7	169.8	-167.6	64.8	0	0	0	108.5	Y54 P58	Y54-H56 PolarHBondContact O-N 3.27Å; Y54-H56 VanDerWaalsContact O-N 3.11Å; H56-P58 VanDerWaalsContact O-CD 3.24Å; H56-P58 WeakPolarHBondContact O-CD 3.46Å
57	R	46	Very low	45.7	Very low	182 Å²	182	101.5 Å²	101.5	69%	0.687	51%	0.508	S	S	*	.			trans	-66.2	114.8	173.6	-171	-178.1	-162.4	114	1.6	107.2	Y55 N59	Y55-R57 HydrophobicContact CD1-CB 4.4Å; Y55-R57 HydrophobicContact CE1-CB 3.95Å; Y55-R57 HydrophobicContact CE1-CG 4.31Å; Y55-R57 PolarHBondContact O-N 3.1Å; R57-N59 PolarHBondContact O-N 3.41Å; R57-N59 VanDerWaalsContact O-N 3.14Å
58	P	43.4	Very low	44.6	Very low	58 Å²	58	100.4 Å²	100.4	38%	0.377	51%	0.505	S	S	.	.			trans	-62.6	125	177.3	25.1	-30.8	0	0	0	108	H56 T60 L63	H56-P58 VanDerWaalsContact O-CD 3.24Å; H56-P58 WeakPolarHBondContact O-CD 3.46Å; P58-T60 PolarHBondContact O-N 2.82Å; P58-L63 HydrophobicContact CB-CD1 3.55Å; P58-L63 HydrophobicContact CB-CG 3.94Å; P58-L63 HydrophobicContact CG-CD1 4.05Å
59	N	41	Very low	43.9	Very low	80 Å²	80	101.9 Å²	101.9	43%	0.428	52%	0.522	S	S	.	.			trans	-67.8	116.9	170.1	-176.2	3.8	0	0	0	106.8	R57 A61 D62 L63	R57-N59 PolarHBondContact O-N 3.41Å; R57-N59 VanDerWaalsContact O-N 3.14Å; N59-A61 PolarHBondContact O-N 3.45Å; N59-A61 VanDerWaalsContact O-N 3.13Å; N59-A61 PolarHBondContact OD1-N 2.83Å; N59-D62 HydrophobicContact CB-CB 4.02Å; N59-D62 WeakPolarHBondContact CB-OD2 3.4Å; N59-D62 VanDerWaalsContact ND2-CG 3.33Å; N59-D62 PolarHBondContact ND2-OD2 3.1Å; N59-D62 WeakPolarHBondContact O-CA 3.45Å; N59-D62 PolarHBondContact O-N 2.97Å; N59-L63 PolarHBondContact O-N 2.79Å
60	T	41.9	Very low	43.4	Very low	108 Å²	108	106.2 Å²	106.2	66%	0.663	54%	0.535	S	S	*	.	H	α-helix	trans	-59	-27.5	-178.9	50.1	0	0	0	0	111.4	P58 C64	P58-T60 PolarHBondContact O-N 2.82Å; T60-C64 WeakPolarHBondContact O-CB 2.87Å; T60-C64 PolarHBondContact O-N 2.63Å; T60-C64 VanDerWaalsContact O-N 3.16Å; T60-C64 PolarHBondContact O-SG 2.99Å
61	A	38.7	Very low	42.7	Very low	41 Å²	41	103.7 Å²	103.7	34%	0.339	52%	0.523	S	S	.	.	H	α-helix	trans	-68.2	-31.9	171.9	0	0	0	0	0	113.1	N59 K65	N59-A61 PolarHBondContact O-N 3.45Å; N59-A61 VanDerWaalsContact O-N 3.13Å; N59-A61 PolarHBondContact OD1-N 2.83Å; A61-K65 WeakPolarHBondContact O-CB 3.42Å; A61-K65 WeakPolarHBondContact O-CD 3.43Å; A61-K65 WeakPolarHBondContact O-CG 3.26Å; A61-K65 PolarHBondContact O-N 3.46Å; A61-K65 VanDerWaalsContact O-N 3.09Å
62	D	36.6	Very low	42.1	Very low	75 Å²	75	103.5 Å²	103.5	40%	0.401	52%	0.521	S	S	.	.	H	α-helix	trans	-87.7	-33.1	-177.1	-59.9	-26.5	0	0	0	111.4	N59 C64 K65 V66	N59-D62 HydrophobicContact CB-CB 4.02Å; N59-D62 WeakPolarHBondContact CB-OD2 3.4Å; N59-D62 VanDerWaalsContact ND2-CG 3.33Å; N59-D62 PolarHBondContact ND2-OD2 3.1Å; N59-D62 WeakPolarHBondContact O-CA 3.45Å; N59-D62 PolarHBondContact O-N 2.97Å; D62-C64 VanDerWaalsContact C-N 3.29Å; D62-C64 PolarHBondContact O-N 2.87Å; D62-K65 PolarHBondContact O-N 3.36Å; D62-K65 IonicContact OD1-NZ 3.87Å; D62-V66 WeakPolarHBondContact O-CB 3.47Å; D62-V66 VanDerWaalsContact O-CG2 3.31Å; D62-V66 WeakPolarHBondContact O-CG2 3.46Å; D62-V66 PolarHBondContact O-N 3.35Å
63	L	33	Very low	41.7	Very low	102 Å²	102	101.2 Å²	101.2	53%	0.534	51%	0.511	S	S	.	.	H	α-helix	trans	-59.8	-40.9	165.5	-78.1	173.8	0	0	0	111.4	P58 N59 S67	P58-L63 HydrophobicContact CB-CD1 3.55Å; P58-L63 HydrophobicContact CB-CG 3.94Å; P58-L63 HydrophobicContact CG-CD1 4.05Å; N59-L63 PolarHBondContact O-N 2.79Å; L63-S67 WeakPolarHBondContact O-CB 3.27Å; L63-S67 PolarHBondContact O-N 3.45Å; L63-S67 PolarHBondContact O-OG 3.05Å
64	C	30.1	Very low	41.6	Very low	67 Å²	67	99 Å²	99	45%	0.453	49%	0.489	S	S	.	.	H	α-helix	trans	-72.2	-24.1	175.5	-72.8	0	0	0	0	113.4	T60 D62 N68	T60-C64 WeakPolarHBondContact O-CB 2.87Å; T60-C64 PolarHBondContact O-N 2.63Å; T60-C64 VanDerWaalsContact O-N 3.16Å; T60-C64 PolarHBondContact O-SG 2.99Å; D62-C64 VanDerWaalsContact C-N 3.29Å; D62-C64 PolarHBondContact O-N 2.87Å; C64-N68 WeakPolarHBondContact O-CB 3.39Å; C64-N68 VanDerWaalsContact O-CG 3.22Å; C64-N68 PolarHBondContact O-N 3.13Å; C64-N68 PolarHBondContact O-ND2 2.94Å
65	K	32.2	Very low	41.8	Very low	141 Å²	141	97.8 Å²	97.8	61%	0.613	49%	0.485	S	S	*	.	H	α-helix	trans	-85.7	-37.8	177.3	-75.8	167.4	-171.6	172.5	0	112.8	A61 D62	A61-K65 WeakPolarHBondContact O-CB 3.42Å; A61-K65 WeakPolarHBondContact O-CD 3.43Å; A61-K65 WeakPolarHBondContact O-CG 3.26Å; A61-K65 PolarHBondContact O-N 3.46Å; A61-K65 VanDerWaalsContact O-N 3.09Å; D62-K65 PolarHBondContact O-N 3.36Å; D62-K65 IonicContact OD1-NZ 3.87Å
66	V	36.9	Very low	42.2	Very low	96 Å²	96	102.2 Å²	102.2	58%	0.582	50%	0.501	S	S	*	.	H	α-helix	trans	-76.1	-27	176.7	179.9	0	0	0	0	111.3	D62	D62-V66 WeakPolarHBondContact O-CB 3.47Å; D62-V66 VanDerWaalsContact O-CG2 3.31Å; D62-V66 WeakPolarHBondContact O-CG2 3.46Å; D62-V66 PolarHBondContact O-N 3.35Å
67	S	37.7	Very low	42.8	Very low	43 Å²	43	95.4 Å²	95.4	30%	0.301	47%	0.469	S	S	.	.	H	α-helix	trans	-87.5	-34	178.8	64.9	0	0	0	0	115.1	L63 F71	L63-S67 WeakPolarHBondContact O-CB 3.27Å; L63-S67 PolarHBondContact O-N 3.45Å; L63-S67 PolarHBondContact O-OG 3.05Å; S67-F71 VanDerWaalsContact O-CB 3.28Å; S67-F71 WeakPolarHBondContact O-CB 2.94Å; S67-F71 PolarHBondContact O-N 3.27Å; S67-F71 VanDerWaalsContact O-N 3.08Å
68	N	35.3	Very low	43.7	Very low	94 Å²	94	89 Å²	89	50%	0.503	45%	0.451	S	S	.	.	H	α-helix	trans	-77.1	-26.9	-170.7	-82.6	-39.6	0	0	0	115.3	C64	C64-N68 WeakPolarHBondContact O-CB 3.39Å; C64-N68 VanDerWaalsContact O-CG 3.22Å; C64-N68 PolarHBondContact O-N 3.13Å; C64-N68 PolarHBondContact O-ND2 2.94Å
69	D	40.5	Very low	45	Very low	161 Å²	161	94.5 Å²	94.5	86%	0.861	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-25.1	-176.6	-77.5	-12.5	0	0	0	113.1
70	R	42.5	Very low	46.6	Very low	142 Å²	142	93.6 Å²	93.6	54%	0.536	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-33.4	-179.4	-131.5	-178.9	-164.1	-155	-0.8	113.2	D377	R70-D377 IonicContact NH1-OD2 2.9Å; R70-D377 PolarHBondContact NH1-OD2 3.16Å
71	F	46.3	Very low	48.1	Very low	26 Å²	26	88.5 Å²	88.5	11%	0.114	43%	0.431	C	S	.	.	S	Bend	trans	-105.9	118	-176.7	-60.7	-79.1	0	0	0	109.9	S67 T380 H383 F384	S67-F71 VanDerWaalsContact O-CB 3.28Å; S67-F71 WeakPolarHBondContact O-CB 2.94Å; S67-F71 PolarHBondContact O-N 3.27Å; S67-F71 VanDerWaalsContact O-N 3.08Å; F71-T380 HydrophobicContact CE1-CG2 3.94Å; F71-T380 WeakPolarHBondContact CZ-OG1 3.17Å; F71-H383 HydrophobicContact CD1-CB 4.27Å; F71-H383 AromaticContact CD1-CD2 3.36Å; F71-H383 WeakPolarHBondContact CD1-CD2 3.38Å; F71-H383 AromaticContact CD1-CG 3.71Å; F71-H383 AromaticContact CD1-NE2 3.77Å; F71-H383 HydrophobicContact CE1-CB 4.01Å; F71-H383 AromaticContact CE1-CD2 3.95Å; F71-H383 AromaticContact CE1-CG 3.96Å; F71-H383 AromaticContact CG-NE2 3.98Å; F71-F384 HydrophobicContact CD1-CD2 4.44Å; F71-F384 AromaticContact CD1-CE2 3.8Å; F71-F384 HydrophobicContact CD1-CE2 3.8Å; F71-F384 HydrophobicContact CE1-CE2 4.14Å
72	F	50.9	Low	49.4	Very low	111 Å²	111	88.7 Å²	88.7	49%	0.487	43%	0.425	S	S	.	.			trans	-61.5	133.9	173	-72.1	-66.3	0	0	0	109.3	F74	F72-F74 PolarHBondContact O-N 2.86Å
73	P	50.1	Low	50.3	Low	38 Å²	38	87.4 Å²	87.4	25%	0.247	42%	0.421	C	S	.	.			trans	-55.4	133.6	176.9	-25.2	33.1	0	0	0	110.6	Y75 R76	P73-Y75 HydrophobicContact CB-CD1 3.61Å; P73-Y75 HydrophobicContact CB-CD2 4.21Å; P73-Y75 HydrophobicContact CB-CE1 3.04Å; P73-Y75 HydrophobicContact CB-CE2 3.7Å; P73-Y75 HydrophobicContact CB-CG 4.17Å; P73-Y75 WeakPolarHBondContact CB-OH 3.28Å; P73-Y75 HydrophobicContact CG-CE1 3.96Å; P73-Y75 HydrophobicContact CG-CE2 4.22Å; P73-Y75 VanDerWaalsContact CG-OH 3.27Å; P73-Y75 WeakPolarHBondContact CG-OH 3.08Å; P73-Y75 PolarHBondContact O-N 3.44Å; P73-R76 VanDerWaalsContact O-CB 3.27Å; P73-R76 WeakPolarHBondContact O-CB 3.46Å; P73-R76 PolarHBondContact O-N 3.21Å
74	F	47.4	Very low	51	Low	65 Å²	65	89.4 Å²	89.4	29%	0.285	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-52.1	-30.1	-170.4	164.8	-97.4	0	0	0	114.5	F72 R76 F77 H82 P83 N387	F72-F74 PolarHBondContact O-N 2.86Å; F74-R76 PolarHBondContact O-N 3.1Å; F74-F77 HydrophobicContact CB-CE2 4.49Å; F74-F77 AromaticContact CD2-CD2 3.69Å; F74-F77 HydrophobicContact CD2-CD2 3.69Å; F74-F77 HydrophobicContact CD2-CE2 4.11Å; F74-F77 HydrophobicContact CE2-CD2 4.25Å; F74-F77 HydrophobicContact CG-CD2 4.39Å; F74-F77 WeakPolarHBondContact O-CD2 3.08Å; F74-F77 PolarHBondContact O-N 3.31Å; F74-F77 VanDerWaalsContact O-N 3.12Å; F74-H82 HydrophobicContact CE1-CB 4.07Å; F74-H82 AromaticContact CE1-CD2 3.73Å; F74-H82 AromaticContact CE1-CG 3.64Å; F74-H82 AromaticContact CE1-ND1 3.86Å; F74-H82 HydrophobicContact CE2-CB 4.32Å; F74-H82 AromaticContact CE2-CD2 3.7Å; F74-H82 HydrophobicContact CZ-CB 3.42Å; F74-H82 VanDerWaalsContact CZ-CB 3.42Å; F74-H82 AromaticContact CZ-CD2 3.27Å; F74-H82 WeakPolarHBondContact CZ-CD2 3.49Å; F74-H82 AromaticContact CZ-CG 3.29Å; F74-H82 AromaticContact CZ-ND1 3.99Å; F74-H82 PolarHBondContact O-NE2 3.08Å; F74-P83 HydrophobicContact CE2-CG 4.39Å; F74-P83 HydrophobicContact CZ-CG 4.33Å; F74-N387 HydrophobicContact CD2-CB 4.02Å; F74-N387 HydrophobicContact CE2-CB 4.45Å; F74-N387 WeakPolarHBondContact CE2-O 3.43Å
75	Y	52.7	Low	51.5	Low	184 Å²	184	90.5 Å²	90.5	72%	0.722	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-63	-11.1	174.8	55.1	-104.9	0	0	0	115.2	P73 F77	P73-Y75 HydrophobicContact CB-CD1 3.61Å; P73-Y75 HydrophobicContact CB-CD2 4.21Å; P73-Y75 HydrophobicContact CB-CE1 3.04Å; P73-Y75 HydrophobicContact CB-CE2 3.7Å; P73-Y75 HydrophobicContact CB-CG 4.17Å; P73-Y75 WeakPolarHBondContact CB-OH 3.28Å; P73-Y75 HydrophobicContact CG-CE1 3.96Å; P73-Y75 HydrophobicContact CG-CE2 4.22Å; P73-Y75 VanDerWaalsContact CG-OH 3.27Å; P73-Y75 WeakPolarHBondContact CG-OH 3.08Å; P73-Y75 PolarHBondContact O-N 3.44Å; Y75-F77 VanDerWaalsContact C-N 3.33Å
76	R	55.6	Low	51.4	Low	172 Å²	172	93.3 Å²	93.3	65%	0.649	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-80.4	-15.4	176.2	-162	173.4	-172.9	163.1	3	112.4	P73 F74	P73-R76 VanDerWaalsContact O-CB 3.27Å; P73-R76 WeakPolarHBondContact O-CB 3.46Å; P73-R76 PolarHBondContact O-N 3.21Å; F74-R76 PolarHBondContact O-N 3.1Å
77	F	60.9	Low	51	Low	18 Å²	18	94.7 Å²	94.7	8%	0.079	45%	0.449	C	S	.	.	S	Bend	trans	-70.9	152.3	174.2	-60.6	-55.6	0	0	0	111	F74 Y75 K79 L81 H82 V372 F384	F74-F77 HydrophobicContact CB-CE2 4.49Å; F74-F77 AromaticContact CD2-CD2 3.69Å; F74-F77 HydrophobicContact CD2-CD2 3.69Å; F74-F77 HydrophobicContact CD2-CE2 4.11Å; F74-F77 HydrophobicContact CE2-CD2 4.25Å; F74-F77 HydrophobicContact CG-CD2 4.39Å; F74-F77 WeakPolarHBondContact O-CD2 3.08Å; F74-F77 PolarHBondContact O-N 3.31Å; F74-F77 VanDerWaalsContact O-N 3.12Å; Y75-F77 VanDerWaalsContact C-N 3.33Å; F77-K79 PolarHBondContact O-N 3.22Å; F77-L81 HydrophobicContact CB-CB 4.41Å; F77-H82 PolarHBondContact O-NE2 3.09Å; F77-V372 HydrophobicContact CD1-CG1 4Å; F77-V372 HydrophobicContact CE1-CG1 3.83Å; F77-F384 HydrophobicContact CE1-CD1 4.39Å; F77-F384 AromaticContact CE1-CE1 3.62Å; F77-F384 HydrophobicContact CE1-CE1 3.62Å; F77-F384 HydrophobicContact CE2-CE1 4.12Å; F77-F384 AromaticContact CZ-CD1 3.92Å; F77-F384 HydrophobicContact CZ-CD1 3.92Å; F77-F384 AromaticContact CZ-CE1 3.17Å; F77-F384 HydrophobicContact CZ-CE1 3.17Å; F77-F384 AromaticContact CZ-CZ 3.94Å; F77-F384 HydrophobicContact CZ-CZ 3.94Å
78	P	63.2	Low	50.4	Low	47 Å²	47	98.7 Å²	98.7	31%	0.305	48%	0.476	S	S	.	.			trans	-52.1	133.3	165.6	-22.6	32.7	0	0	0	109.4	E80 L81	P78-E80 WeakPolarHBondContact CB-OE2 3.17Å; P78-E80 PolarHBondContact O-N 2.73Å; P78-L81 WeakPolarHBondContact O-CB 3.48Å; P78-L81 PolarHBondContact O-N 2.53Å
79	K	72	Confident	50	Low	173 Å²	173	102.1 Å²	102.1	75%	0.752	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-53.9	-25.3	-176.3	-64.6	-179	-179.2	180	0	112.6	F77 L81 H82	F77-K79 PolarHBondContact O-N 3.22Å; K79-L81 PolarHBondContact O-N 3.16Å; K79-H82 WeakPolarHBondContact O-CB 3.37Å; K79-H82 PolarHBondContact O-N 3.19Å
80	E	74.7	Confident	49.2	Very low	62 Å²	62	99.4 Å²	99.4	29%	0.29	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-63.8	-23.1	177.1	-58.2	81.5	179.2	0	0	113.1	P78 K356 K389	P78-E80 WeakPolarHBondContact CB-OE2 3.17Å; P78-E80 PolarHBondContact O-N 2.73Å; E80-K356 VanDerWaalsContact CD-NZ 3.29Å; E80-K356 WeakPolarHBondContact OE1-CE 3.19Å; E80-K356 IonicContact OE1-NZ 2.75Å; E80-K356 PolarHBondContact OE1-NZ 3.25Å; E80-K356 IonicContact OE2-NZ 2.82Å; E80-K389 WeakPolarHBondContact O-CD 3.47Å; E80-K389 WeakPolarHBondContact O-CE 3.25Å; E80-K389 PolarHBondContact O-NZ 3.35Å
81	L	73	Confident	48.6	Very low	0 Å²	0	96.9 Å²	96.9	0%	0	48%	0.484	C	S	.	.	G	3₁₀ helix	trans	-92.2	-7.8	178.5	-59.3	-169.1	0	0	0	113.8	F77 P78 K79 Y354 V372 L388 K389 L394 Y400	F77-L81 HydrophobicContact CB-CB 4.41Å; P78-L81 WeakPolarHBondContact O-CB 3.48Å; P78-L81 PolarHBondContact O-N 2.53Å; K79-L81 PolarHBondContact O-N 3.16Å; L81-Y354 HydrophobicContact CD1-CD1 3.91Å; L81-Y354 HydrophobicContact CD1-CE1 4.47Å; L81-Y354 HydrophobicContact CD1-CG 4.01Å; L81-Y354 HydrophobicContact CD2-CD1 3.72Å; L81-Y354 HydrophobicContact CD2-CD2 3.59Å; L81-Y354 HydrophobicContact CD2-CE1 3.6Å; L81-Y354 HydrophobicContact CD2-CE2 3.45Å; L81-Y354 VanDerWaalsContact CD2-CE2 3.45Å; L81-Y354 HydrophobicContact CD2-CG 3.7Å; L81-Y354 VanDerWaalsContact CD2-CZ 3.47Å; L81-Y354 HydrophobicContact CG-CD1 4.02Å; L81-Y354 HydrophobicContact CG-CE1 4.07Å; L81-Y354 HydrophobicContact CG-CG 4.31Å; L81-V372 HydrophobicContact CD1-CG2 4.07Å; L81-L388 HydrophobicContact CB-CD2 3.96Å; L81-L388 HydrophobicContact CD1-CD2 4.07Å; L81-K389 PolarHBondContact O-N 2.91Å; L81-K389 VanDerWaalsContact O-N 3.17Å; L81-L394 HydrophobicContact CD2-CD2 4.25Å; L81-Y400 HydrophobicContact CD2-CE1 3.86Å; L81-Y400 VanDerWaalsContact CD2-OH 3.28Å; L81-Y400 WeakPolarHBondContact CD2-OH 3.35Å
82	H	66.5	Low	47.8	Very low	45 Å²	45	100.2 Å²	100.2	21%	0.208	52%	0.516	C	S	.	.	S	Bend	trans	-69	132.9	-177	-69.4	-172.8	0	0	0	111.4	F74 F77 K79 K84 K389	F74-H82 HydrophobicContact CE1-CB 4.07Å; F74-H82 AromaticContact CE1-CD2 3.73Å; F74-H82 AromaticContact CE1-CG 3.64Å; F74-H82 AromaticContact CE1-ND1 3.86Å; F74-H82 HydrophobicContact CE2-CB 4.32Å; F74-H82 AromaticContact CE2-CD2 3.7Å; F74-H82 HydrophobicContact CZ-CB 3.42Å; F74-H82 VanDerWaalsContact CZ-CB 3.42Å; F74-H82 AromaticContact CZ-CD2 3.27Å; F74-H82 WeakPolarHBondContact CZ-CD2 3.49Å; F74-H82 AromaticContact CZ-CG 3.29Å; F74-H82 AromaticContact CZ-ND1 3.99Å; F74-H82 PolarHBondContact O-NE2 3.08Å; F77-H82 PolarHBondContact O-NE2 3.09Å; K79-H82 WeakPolarHBondContact O-CB 3.37Å; K79-H82 PolarHBondContact O-N 3.19Å; H82-K84 PolarHBondContact O-N 3.44Å; H82-K389 WeakPolarHBondContact O-CE 3.4Å; H82-K389 VanDerWaalsContact O-CG 3.28Å; H82-K389 WeakPolarHBondContact O-CG 2.92Å
83	P	54.7	Low	46.9	Very low	49 Å²	49	97.2 Å²	97.2	32%	0.318	51%	0.509	S	S	.	.			trans	-52.6	141.8	173.8	-21.9	33.5	0	0	0	108.5	F74 S85 N387	F74-P83 HydrophobicContact CE2-CG 4.39Å; F74-P83 HydrophobicContact CZ-CG 4.33Å; P83-S85 VanDerWaalsContact C-N 3.31Å; P83-S85 PolarHBondContact O-N 2.75Å; P83-N387 WeakPolarHBondContact CD-O 3.31Å; P83-N387 VanDerWaalsContact CG-O 3.25Å; P83-N387 WeakPolarHBondContact CG-O 3.26Å
84	K	48.9	Very low	46.3	Very low	144 Å²	144	101.6 Å²	101.6	63%	0.626	53%	0.53	S	S	*	.			trans	-63.8	101.8	172.4	-70.7	-177.7	-179.9	176.7	0	106.6	H82 K86	H82-K84 PolarHBondContact O-N 3.44Å; K84-K86 VanDerWaalsContact C-N 3.3Å; K84-K86 PolarHBondContact O-N 2.82Å
85	S	39.1	Very low	45.9	Very low	90 Å²	90	104.6 Å²	104.6	63%	0.629	55%	0.545	S	S	*	.			trans	-60.5	97.2	170.8	59.7	0	0	0	0	107.3	P83	P83-S85 VanDerWaalsContact C-N 3.31Å; P83-S85 PolarHBondContact O-N 2.75Å
86	K	31.1	Very low	45	Very low	199 Å²	199	100 Å²	100	87%	0.865	53%	0.533	S	S	*	.			trans	-91.6	53.6	155.2	-72	-169.3	-179.4	-178.8	0	108.5	K84	K84-K86 VanDerWaalsContact C-N 3.3Å; K84-K86 PolarHBondContact O-N 2.82Å
87	L	28	Very low	44.3	Very low	125 Å²	125	99.4 Å²	99.4	65%	0.654	54%	0.535	S	S	*	.	S	Bend		-72.9	122.7	129.4	-97.7	93.5	0	0	0	104.2	Q89	L87-Q89 VanDerWaalsContact C-N 3.25Å; L87-Q89 PolarHBondContact O-N 2.91Å
88	C	24.8	Very low	43.4	Very low	127 Å²	127	102.8 Å²	102.8	86%	0.858	55%	0.551	S	S	*	*			trans	-44.9	91.4	171	-89.5	0	0	0	0	109.9	P90	C88-P90 VanDerWaalsContact O-CD 3.27Å; C88-P90 WeakPolarHBondContact O-CD 3.42Å
89	Q	26.5	Very low	42.2	Very low	166 Å²	166	105.2 Å²	105.2	78%	0.776	56%	0.56	S	S	*	*			trans	-66.9	117.4	149.4	-68.2	-149.5	-6.4	0	0	103.5	L87 S91	L87-Q89 VanDerWaalsContact C-N 3.25Å; L87-Q89 PolarHBondContact O-N 2.91Å; Q89-S91 VanDerWaalsContact C-N 3.26Å; Q89-S91 PolarHBondContact O-N 3.36Å
90	P	24.8	Very low	41	Very low	104 Å²	104	100.6 Å²	100.6	68%	0.675	55%	0.548	S	S	*	.			trans	-59.1	106	172.5	24.3	-28.4	0	0	0	104	C88 A92 L96	C88-P90 VanDerWaalsContact O-CD 3.27Å; C88-P90 WeakPolarHBondContact O-CD 3.42Å; P90-A92 PolarHBondContact O-N 2.87Å; P90-L96 HydrophobicContact CB-CD1 4.36Å
91	S	28.8	Very low	40.2	Very low	89 Å²	89	105.2 Å²	105.2	62%	0.622	57%	0.567	S	S	*	*			trans	-49.7	117.1	164.8	57.6	0	0	0	0	103.3	Q89 S93	Q89-S91 VanDerWaalsContact C-N 3.26Å; Q89-S91 PolarHBondContact O-N 3.36Å; S91-S93 PolarHBondContact O-N 3.11Å
92	A	30.2	Very low	39.2	Very low	96 Å²	96	111.1 Å²	111.1	79%	0.793	59%	0.593	S	S	*	*			trans	-65	65.3	167.4	0	0	0	0	0	106.7	P90	P90-A92 PolarHBondContact O-N 2.87Å
93	S	32.3	Very low	38.5	Very low	48 Å²	48	113.7 Å²	113.7	34%	0.336	61%	0.607	S	S	.	*			trans	-68.7	130.7	164.4	73.8	0	0	0	0	104	S91 H95 L96	S91-S93 PolarHBondContact O-N 3.11Å; S93-H95 PolarHBondContact O-N 2.69Å; S93-H95 WeakPolarHBondContact OG-CB 3.15Å; S93-L96 PolarHBondContact O-N 2.74Å
94	N	36.9	Very low	39.1	Very low	130 Å²	130	119.3 Å²	119.3	70%	0.695	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	-5.9	174.2	-71.3	-43.7	0	0	0	112.6
95	H	39.3	Very low	40.1	Very low	129 Å²	129	115 Å²	115	60%	0.597	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-29.6	167.9	-87.8	-64.8	0	0	0	114.9	S93 K97 E98 I99	S93-H95 PolarHBondContact O-N 2.69Å; S93-H95 WeakPolarHBondContact OG-CB 3.15Å; H95-K97 VanDerWaalsContact C-N 3.27Å; H95-K97 PolarHBondContact O-N 2.83Å; H95-E98 PolarHBondContact O-N 3.27Å; H95-E98 VanDerWaalsContact O-N 3.07Å; H95-I99 WeakPolarHBondContact O-CG1 3.44Å; H95-I99 PolarHBondContact O-N 3.34Å
96	L	33.9	Very low	41.3	Very low	88 Å²	88	115.8 Å²	115.8	46%	0.461	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70	-22.8	178.9	-80.9	158.6	0	0	0	113	P90 S93 E98 I99 P100	P90-L96 HydrophobicContact CB-CD1 4.36Å; S93-L96 PolarHBondContact O-N 2.74Å; L96-E98 VanDerWaalsContact C-N 3.33Å; L96-I99 HydrophobicContact CD2-CD1 3.91Å; L96-P100 VanDerWaalsContact O-CD 3.26Å; L96-P100 WeakPolarHBondContact O-CD 3.5Å
97	K	40.5	Very low	43.1	Very low	159 Å²	159	113.3 Å²	113.3	69%	0.691	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-17.1	171.4	-69.1	-179.4	-179.2	173.2	0	113	H95	H95-K97 VanDerWaalsContact C-N 3.27Å; H95-K97 PolarHBondContact O-N 2.83Å
98	E	42.2	Very low	45.4	Very low	89 Å²	89	111.2 Å²	111.2	42%	0.416	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.2	-27.6	176.1	-69.9	-148.2	150.5	0	0	113.6	H95 L96 K101 K102	H95-E98 PolarHBondContact O-N 3.27Å; H95-E98 VanDerWaalsContact O-N 3.07Å; L96-E98 VanDerWaalsContact C-N 3.33Å; E98-K101 PolarHBondContact O-N 2.94Å; E98-K102 PolarHBondContact O-N 3.15Å; E98-K102 IonicContact OE2-NZ 3.52Å
99	I	38.9	Very low	47.5	Very low	97 Å²	97	109.3 Å²	109.3	50%	0.497	57%	0.571	S	S	.	*	H	α-helix	trans	-57.1	-44.1	-178	-60.6	177.8	0	0	0	111.9	H95 L96 K101 K102 L103	H95-I99 WeakPolarHBondContact O-CG1 3.44Å; H95-I99 PolarHBondContact O-N 3.34Å; L96-I99 HydrophobicContact CD2-CD1 3.91Å; I99-K101 VanDerWaalsContact C-N 3.3Å; I99-K101 PolarHBondContact O-N 3.25Å; I99-K102 PolarHBondContact O-N 3.18Å; I99-L103 VanDerWaalsContact O-CB 3.27Å; I99-L103 WeakPolarHBondContact O-CB 3.27Å; I99-L103 PolarHBondContact O-N 3.23Å
100	P	45.9	Very low	49.3	Very low	77 Å²	77	106.2 Å²	106.2	50%	0.5	56%	0.557	S	S	.	*	H	α-helix	trans	-64.7	-31.1	176.1	-20.3	31.7	0	0	0	113.6	L96 K104	L96-P100 VanDerWaalsContact O-CD 3.26Å; L96-P100 WeakPolarHBondContact O-CD 3.5Å; P100-K104 PolarHBondContact O-N 2.57Å; P100-K104 VanDerWaalsContact O-N 3.14Å
101	K	57.6	Low	51.5	Low	159 Å²	159	107.8 Å²	107.8	69%	0.691	55%	0.549	S	S	*	.	H	α-helix	trans	-74.8	-45.2	178.5	-66.6	-177.2	-179.3	178.7	0	111.3	E98 I99 L103 K104 A105	E98-K101 PolarHBondContact O-N 2.94Å; I99-K101 VanDerWaalsContact C-N 3.3Å; I99-K101 PolarHBondContact O-N 3.25Å; K101-L103 VanDerWaalsContact C-N 3.33Å; K101-L103 PolarHBondContact O-N 2.89Å; K101-K104 PolarHBondContact O-N 3.05Å; K101-A105 PolarHBondContact O-N 2.63Å
102	K	52.5	Low	53.4	Low	124 Å²	124	110.8 Å²	110.8	54%	0.539	55%	0.547	S	S	.	.	H	α-helix	trans	-64.6	-36.8	175.2	-74.8	-175.7	179	174	0	111.9	E98 I99 A105 L106	E98-K102 PolarHBondContact O-N 3.15Å; E98-K102 IonicContact OE2-NZ 3.52Å; I99-K102 PolarHBondContact O-N 3.18Å; K102-A105 PolarHBondContact O-N 3.03Å; K102-L106 WeakPolarHBondContact O-CB 3.34Å; K102-L106 PolarHBondContact O-N 3.45Å
103	L	51.3	Low	54.9	Low	98 Å²	98	112.7 Å²	112.7	51%	0.513	54%	0.537	S	S	.	.	H	α-helix	trans	-69.7	-37	177.1	-155.1	76	0	0	0	112.7	I99 K101 K107	I99-L103 VanDerWaalsContact O-CB 3.27Å; I99-L103 WeakPolarHBondContact O-CB 3.27Å; I99-L103 PolarHBondContact O-N 3.23Å; K101-L103 VanDerWaalsContact C-N 3.33Å; K101-L103 PolarHBondContact O-N 2.89Å; L103-K107 WeakPolarHBondContact O-CG 3.44Å; L103-K107 PolarHBondContact O-N 2.91Å; L103-K107 VanDerWaalsContact O-N 3.08Å
104	K	67.6	Low	56.1	Low	168 Å²	168	118.3 Å²	118.3	73%	0.73	55%	0.551	S	S	*	*	H	α-helix	trans	-65.1	-42	171.1	-85.7	-174.5	176.5	-178.2	0	112.2	P100 K101 K107 E108	P100-K104 PolarHBondContact O-N 2.57Å; P100-K104 VanDerWaalsContact O-N 3.14Å; K101-K104 PolarHBondContact O-N 3.05Å; K104-K107 PolarHBondContact O-N 2.82Å; K104-E108 PolarHBondContact O-N 2.83Å; K104-E108 VanDerWaalsContact O-N 3.11Å
105	A	69.6	Low	57.1	Low	52 Å²	52	116.9 Å²	116.9	43%	0.43	54%	0.54	S	S	.	.	H	α-helix	trans	-64.6	-41.3	177.2	0	0	0	0	0	112.4	K101 K102 E108 I109	K101-A105 PolarHBondContact O-N 2.63Å; K102-A105 PolarHBondContact O-N 3.03Å; A105-E108 PolarHBondContact O-N 3.37Å; A105-I109 WeakPolarHBondContact O-CG1 3.16Å; A105-I109 PolarHBondContact O-N 2.8Å
106	L	65.4	Low	57.9	Low	107 Å²	107	116.6 Å²	116.6	56%	0.56	54%	0.543	S	S	*	.	H	α-helix	trans	-64.7	-42.4	175.7	-83.9	160.6	0	0	0	112.5	K102 E108 I109 E110	K102-L106 WeakPolarHBondContact O-CB 3.34Å; K102-L106 PolarHBondContact O-N 3.45Å; L106-E108 VanDerWaalsContact C-N 3.3Å; L106-E108 PolarHBondContact O-N 3.46Å; L106-I109 PolarHBondContact O-N 3.17Å; L106-E110 WeakPolarHBondContact O-CB 3.33Å; L106-E110 PolarHBondContact O-N 2.85Å
107	K	68.8	Low	58.7	Low	148 Å²	148	118.8 Å²	118.8	64%	0.643	56%	0.555	S	S	*	*	H	α-helix	trans	-62.7	-35.7	175.2	-76.8	-176.5	177.4	-174.8	0	112.7	L103 K104 R111	L103-K107 WeakPolarHBondContact O-CG 3.44Å; L103-K107 PolarHBondContact O-N 2.91Å; L103-K107 VanDerWaalsContact O-N 3.08Å; K104-K107 PolarHBondContact O-N 2.82Å; K107-R111 WeakPolarHBondContact O-CB 3.41Å; K107-R111 PolarHBondContact O-N 3.35Å
108	E	74.6	Confident	59.2	Low	80 Å²	80	118.1 Å²	118.1	37%	0.374	56%	0.559	S	S	.	*	H	α-helix	trans	-70.7	-40.3	176.6	-177	59.5	-160.4	0	0	112.1	K104 A105 L106 E110 R111 R112	K104-E108 PolarHBondContact O-N 2.83Å; K104-E108 VanDerWaalsContact O-N 3.11Å; A105-E108 PolarHBondContact O-N 3.37Å; L106-E108 VanDerWaalsContact C-N 3.3Å; L106-E108 PolarHBondContact O-N 3.46Å; E108-E110 VanDerWaalsContact C-N 3.31Å; E108-E110 PolarHBondContact O-N 3.26Å; E108-R111 PolarHBondContact O-N 3.47Å; E108-R112 WeakPolarHBondContact O-CG 3.39Å; E108-R112 PolarHBondContact O-N 3.41Å; E108-R112 IonicContact OE1-CZ 3.95Å; E108-R112 IonicContact OE1-NE 3.33Å; E108-R112 PolarHBondContact OE1-NE 3.16Å; E108-R112 IonicContact OE1-NH2 3.65Å
109	I	69.4	Low	59.5	Low	88 Å²	88	120.8 Å²	120.8	45%	0.451	58%	0.575	S	S	.	*	H	α-helix	trans	-62.5	-40.9	173.9	-68.4	165.6	0	0	0	110.7	A105 L106 R112 K113	A105-I109 WeakPolarHBondContact O-CG1 3.16Å; A105-I109 PolarHBondContact O-N 2.8Å; L106-I109 PolarHBondContact O-N 3.17Å; I109-R112 PolarHBondContact O-N 3.37Å; I109-K113 HydrophobicContact CG2-CD 4.44Å; I109-K113 WeakPolarHBondContact O-CG 3.46Å; I109-K113 PolarHBondContact O-N 2.96Å
110	E	64.6	Low	59.5	Low	101 Å²	101	123 Å²	123	47%	0.472	59%	0.587	S	S	.	*	H	α-helix	trans	-70.6	-32.6	179	-155.3	171.3	155.3	0	0	112.4	L106 E108 R114	L106-E110 WeakPolarHBondContact O-CB 3.33Å; L106-E110 PolarHBondContact O-N 2.85Å; E108-E110 VanDerWaalsContact C-N 3.31Å; E108-E110 PolarHBondContact O-N 3.26Å; E110-R114 VanDerWaalsContact O-CG 3.31Å; E110-R114 WeakPolarHBondContact O-CG 3.42Å; E110-R114 PolarHBondContact O-N 3.31Å; E110-R114 IonicContact OE1-CZ 2.65Å; E110-R114 IonicContact OE1-NE 3.87Å; E110-R114 IonicContact OE1-NH2 2.87Å; E110-R114 PolarHBondContact OE1-NH2 3.39Å
111	R	70.9	Confident	59.2	Low	137 Å²	137	127.3 Å²	127.3	52%	0.517	60%	0.601	S	S	.	*	H	α-helix	trans	-64.9	-41.3	172	-154.4	-177.2	97.3	97.5	2.8	111.8	K107 E108 R114 Q115	K107-R111 WeakPolarHBondContact O-CB 3.41Å; K107-R111 PolarHBondContact O-N 3.35Å; E108-R111 PolarHBondContact O-N 3.47Å; R111-R114 PolarHBondContact O-N 2.81Å; R111-Q115 WeakPolarHBondContact O-CG 3.27Å; R111-Q115 PolarHBondContact O-N 3.15Å
112	R	68.6	Low	58.3	Low	152 Å²	152	124.5 Å²	124.5	57%	0.574	60%	0.599	S	S	*	*	H	α-helix	trans	-65.7	-43.9	176.1	-69.7	178.6	-171.9	-166.7	-1.3	112.1	E108 I109 R114 Q115 D116	E108-R112 WeakPolarHBondContact O-CG 3.39Å; E108-R112 PolarHBondContact O-N 3.41Å; E108-R112 IonicContact OE1-CZ 3.95Å; E108-R112 IonicContact OE1-NE 3.33Å; E108-R112 PolarHBondContact OE1-NE 3.16Å; E108-R112 IonicContact OE1-NH2 3.65Å; I109-R112 PolarHBondContact O-N 3.37Å; R112-R114 VanDerWaalsContact C-N 3.27Å; R112-R114 PolarHBondContact O-N 3.3Å; R112-Q115 PolarHBondContact O-N 3.3Å; R112-Q115 VanDerWaalsContact O-N 3.08Å; R112-D116 PolarHBondContact O-N 3.17Å
113	K	62.9	Low	57.3	Low	135 Å²	135	126.7 Å²	126.7	59%	0.587	61%	0.611	S	S	*	*	H	α-helix	trans	-63.6	-29.9	175.5	-73.4	-175.7	177.6	-174.2	0	113.6	I109 N117	I109-K113 HydrophobicContact CG2-CD 4.44Å; I109-K113 WeakPolarHBondContact O-CG 3.46Å; I109-K113 PolarHBondContact O-N 2.96Å; K113-N117 WeakPolarHBondContact O-CB 3.25Å; K113-N117 PolarHBondContact O-N 3.03Å; K113-N117 PolarHBondContact O-ND2 3.2Å
114	R	56	Low	56.7	Low	167 Å²	167	128.7 Å²	128.7	63%	0.63	63%	0.627	S	S	*	*	H	α-helix	trans	-75.9	-31.3	172.9	-70.7	177.6	-168.2	-162.6	4.6	112.3	E110 R111 R112	E110-R114 VanDerWaalsContact O-CG 3.31Å; E110-R114 WeakPolarHBondContact O-CG 3.42Å; E110-R114 PolarHBondContact O-N 3.31Å; E110-R114 IonicContact OE1-CZ 2.65Å; E110-R114 IonicContact OE1-NE 3.87Å; E110-R114 IonicContact OE1-NH2 2.87Å; E110-R114 PolarHBondContact OE1-NH2 3.39Å; R111-R114 PolarHBondContact O-N 2.81Å; R112-R114 VanDerWaalsContact C-N 3.27Å; R112-R114 PolarHBondContact O-N 3.3Å
115	Q	59	Low	55	Low	99 Å²	99	129.1 Å²	129.1	46%	0.463	63%	0.632	S	S	.	*	H	α-helix	trans	-75.9	-30.1	175.4	-73.6	-179.1	-38.9	0	0	113	R111 R112	R111-Q115 WeakPolarHBondContact O-CG 3.27Å; R111-Q115 PolarHBondContact O-N 3.15Å; R112-Q115 PolarHBondContact O-N 3.3Å; R112-Q115 VanDerWaalsContact O-N 3.08Å
116	D	56.7	Low	53.6	Low	123 Å²	123	135.2 Å²	135.2	66%	0.658	65%	0.649	S	S	*	*	H	α-helix	trans	-80.2	-15.1	176.4	-74.1	-23	0	0	0	113.4	R112	R112-D116 PolarHBondContact O-N 3.17Å
117	N	49.7	Very low	52.3	Low	134 Å²	134	137 Å²	137	72%	0.717	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	4.6	178.4	-78.1	-14.6	0	0	0	114	K113	K113-N117 WeakPolarHBondContact O-CB 3.25Å; K113-N117 PolarHBondContact O-N 3.03Å; K113-N117 PolarHBondContact O-ND2 3.2Å
118	D	50.1	Low	50.9	Low	146 Å²	146	134.5 Å²	134.5	78%	0.781	67%	0.666	S	S	*	*			trans	-107.3	25.5	-179.4	-100.4	-19.1	0	0	0	113
119	I	49	Very low	49	Very low	144 Å²	144	134.6 Å²	134.6	74%	0.738	68%	0.681	S	S	*	*			trans	-118.2	85.4	175.2	-52	178.2	0	0	0	109.6
120	D	39.9	Very low	47.5	Very low	143 Å²	143	138.6 Å²	138.6	77%	0.765	70%	0.697	S	S	*	*			trans	-98.4	114.5	171.2	-98.8	-25.5	0	0	0	112.1
121	H	38.1	Very low	46.1	Very low	169 Å²	169	141 Å²	141	78%	0.782	71%	0.708	S	S	*	*			trans	68.4	160.8	137.5	-77.1	-10.3	0	0	0	121.6
122	P	38.7	Very low	44.5	Very low	100 Å²	100	143 Å²	143	65%	0.649	72%	0.723	S	S	*	*			cis	-142.6	-175.6	9.1	31	-5	0	0	0	117.1
123	E	33.1	Very low	42.9	Very low	170 Å²	170	144.9 Å²	144.9	79%	0.794	74%	0.739	S	S	*	*			trans	76.3	114	154.2	-38.5	-170.1	169.4	0	0	121.3
124	T	38.1	Very low	41.6	Very low	140 Å²	140	143.6 Å²	143.6	86%	0.859	74%	0.744	S	S	*	*				170.8	142.3	99.1	18.2	0	0	0	0	113.4
125	E	31.9	Very low	40.6	Very low	176 Å²	176	141.9 Å²	141.9	82%	0.822	75%	0.753	S	S	*	*			trans	-63.8	150.5	176.6	-62.3	165.6	136.9	0	0	114.3
126	K	40.3	Very low	39.5	Very low	180 Å²	180	142.7 Å²	142.7	78%	0.783	76%	0.76	S	S	*	*				167	120.8	117.3	-89.9	175.7	-179.7	178.5	0	114.5
127	D	38	Very low	38.7	Very low	144 Å²	144	144.3 Å²	144.3	77%	0.77	76%	0.764	S	S	*	*				59.9	132.5	127.3	-54	-26.4	0	0	0	124.8
128	A	38.2	Very low	38.1	Very low	96 Å²	96	143.8 Å²	143.8	79%	0.793	77%	0.766	S	S	*	*			trans	75.6	110.2	146.7	0	0	0	0	0	118
129	A	36	Very low	37.2	Very low	83 Å²	83	147.7 Å²	147.7	69%	0.686	77%	0.769	S	S	*	*				97.3	135.1	59.8	0	0	0	0	0	112.2
130	E	37.8	Very low	36.7	Very low	172 Å²	172	146 Å²	146	80%	0.804	77%	0.768	S	S	*	*			trans	75.1	140.1	160.7	-65.3	165.6	-168.3	0	0	115.6
131	E	35.8	Very low	36.4	Very low	150 Å²	150	144.2 Å²	144.2	70%	0.701	77%	0.773	S	S	*	*			cis	-171.5	154	12.2	-120.4	176.3	171.8	0	0	109.9
132	E	37.3	Very low	36.2	Very low	179 Å²	179	139.6 Å²	139.6	84%	0.836	77%	0.771	S	S	*	*			trans	79.6	159.2	142.4	-66.6	-161.9	162.7	0	0	125.3
133	Q	33.4	Very low	36.1	Very low	192 Å²	192	143.7 Å²	143.7	90%	0.897	78%	0.781	S	S	*	*			trans	-109.8	-178.8	-142.4	-102.7	-170.2	14.1	0	0	113.6
134	P	37.4	Very low	36	Very low	108 Å²	108	145 Å²	145	70%	0.701	79%	0.788	S	S	*	*			trans	-107.3	160	-157.2	40.9	-33.2	0	0	0	115.6
135	T	34.2	Very low	35.9	Very low	132 Å²	132	142.1 Å²	142.1	81%	0.81	79%	0.786	S	S	*	*			trans	-167	149.3	163.6	46.2	0	0	0	0	106.1
136	D	36	Very low	36	Very low	115 Å²	115	143.7 Å²	143.7	62%	0.615	79%	0.793	S	S	*	*			cis	179.1	152.3	35.9	-144	-7.5	0	0	0	110.1
137	Q	39.4	Very low	35.8	Very low	157 Å²	157	138.3 Å²	138.3	73%	0.734	79%	0.788	S	S	*	*			trans	48.4	153.6	142.8	-72	162.5	46.9	0	0	122.4
138	T	36.7	Very low	35.7	Very low	123 Å²	123	139 Å²	139	76%	0.755	79%	0.792	S	S	*	*			cis	-175.8	143.2	-18.3	-76.5	0	0	0	0	106
139	R	31	Very low	35.5	Very low	229 Å²	229	143.8 Å²	143.8	86%	0.864	80%	0.798	S	S	*	*			trans	-28.7	179.9	163.5	-94.2	-174.6	173.3	178.2	-2.3	119.8
140	P	39.5	Very low	35.6	Very low	108 Å²	108	147.9 Å²	147.9	70%	0.701	81%	0.805	S	S	*	*			cis	-144.4	-179.8	-28.7	38.1	-18.4	0	0	0	116.4
141	A	33.4	Very low	35.4	Very low	105 Å²	105	145.8 Å²	145.8	87%	0.868	80%	0.799	S	S	*	*			trans	77	124.6	142.9	0	0	0	0	0	122.4
142	G	33.2	Very low	35.7	Very low	72 Å²	72	146 Å²	146	74%	0.742	80%	0.803	S	S	*	*			trans	137.3	131	150	0	0	0	0	0	115.3
143	E	36.5	Very low	35.5	Very low	186 Å²	186	148.1 Å²	148.1	87%	0.869	80%	0.804	S	S	*	*			trans	85.1	94.6	161.8	-58.5	175.2	-178.4	0	0	116.4
144	E	32.1	Very low	35.4	Very low	199 Å²	199	142.3 Å²	142.3	93%	0.93	80%	0.796	S	S	*	*				75	102.7	89.5	-75.6	-173.1	-167.5	0	0	112.4
145	G	36.3	Very low	35.1	Very low	79 Å²	79	144.3 Å²	144.3	81%	0.814	80%	0.8	S	S	*	*			trans	-150.2	110.8	174	0	0	0	0	0	109.6
146	E	33.7	Very low	35.1	Very low	209 Å²	209	141.2 Å²	141.2	98%	0.977	78%	0.784	S	S	*	*			trans	-49.9	138.9	172.9	-70.2	165.4	127.9	0	0	112
147	G	36.1	Very low	35.2	Very low	66 Å²	66	139.3 Å²	139.3	68%	0.68	78%	0.784	S	S	*	*			trans	-161.3	101.2	177.9	0	0	0	0	0	112.3
148	D	35	Very low	35.4	Very low	160 Å²	160	136.8 Å²	136.8	86%	0.856	78%	0.775	S	S	*	*			trans	66.4	95.7	148.4	-57.2	-20.3	0	0	0	120	M150	D148-M150 PolarHBondContact O-N 3.33Å
149	E	34.1	Very low	35.7	Very low	195 Å²	195	137.3 Å²	137.3	91%	0.911	77%	0.769	S	S	*	*			trans	-54.4	105.9	157.8	-167.7	173.3	-159.6	0	0	110.8	D151	E149-D151 PolarHBondContact O-N 2.68Å
150	M	38.4	Very low	36.1	Very low	169 Å²	169	133.4 Å²	133.4	83%	0.833	76%	0.764	S	S	*	*			trans	-80.5	106.7	166.4	-95	-167.1	-78.1	0	0	109.8	D148 I152	D148-M150 PolarHBondContact O-N 3.33Å; M150-I152 PolarHBondContact O-N 3.37Å
151	D	35	Very low	36.4	Very low	129 Å²	129	132 Å²	132	69%	0.69	75%	0.751	S	S	*	*			trans	-68.5	92.7	169.5	-166.5	6.3	0	0	0	110.1	E149 R153	E149-D151 PolarHBondContact O-N 2.68Å; D151-R153 VanDerWaalsContact C-N 3.26Å; D151-R153 PolarHBondContact O-N 3.31Å; D151-R153 WeakPolarHBondContact OD1-CB 3.32Å; D151-R153 WeakPolarHBondContact OD1-CG 3.41Å
152	I	40.2	Very low	37.1	Very low	153 Å²	153	130.7 Å²	130.7	79%	0.785	73%	0.727	S	S	*	*			trans	-84.4	74.5	167.7	-54.4	179.2	0	0	0	107.7	M150	M150-I152 PolarHBondContact O-N 3.37Å
153	R	33.9	Very low	37.6	Very low	224 Å²	224	131.8 Å²	131.8	85%	0.845	72%	0.716	S	S	*	*			trans	-131.1	79.5	165.7	-75.6	-176.8	177	-173.3	2.6	108.9	D151	D151-R153 VanDerWaalsContact C-N 3.26Å; D151-R153 PolarHBondContact O-N 3.31Å; D151-R153 WeakPolarHBondContact OD1-CB 3.32Å; D151-R153 WeakPolarHBondContact OD1-CG 3.41Å
154	G	31.7	Very low	38.1	Very low	71 Å²	71	128.2 Å²	128.2	73%	0.732	70%	0.703	S	S	*	*			trans	-158.7	20	-176.3	0	0	0	0	0	115.9	S156	G154-S156 PolarHBondContact O-N 2.96Å
155	L	31.8	Very low	39.1	Very low	150 Å²	150	120.1 Å²	120.1	79%	0.785	67%	0.666	S	S	*	*			trans	-79.2	110.1	162.3	-66.7	175.5	0	0	0	107.1
156	S	34.1	Very low	39.9	Very low	67 Å²	67	117.2 Å²	117.2	47%	0.469	63%	0.631	S	S	.	*			trans	-62.5	144	172.7	52.7	0	0	0	0	109.1	G154 D158	G154-S156 PolarHBondContact O-N 2.96Å; S156-D158 PolarHBondContact O-N 2.93Å
157	A	38	Very low	40.7	Very low	75 Å²	75	114.4 Å²	114.4	62%	0.62	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	8.2	175.5	0	0	0	0	0	114.1	N161	A157-N161 PolarHBondContact O-ND2 2.97Å
158	D	43	Very low	41.4	Very low	103 Å²	103	116.7 Å²	116.7	55%	0.551	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-27.3	-175.4	-65.9	-43.2	0	0	0	113	S156	S156-D158 PolarHBondContact O-N 2.93Å
159	E	43	Very low	42.5	Very low	135 Å²	135	109.7 Å²	109.7	63%	0.631	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-76.9	-23.7	178.1	-76.1	-175.8	160.8	0	0	113	N161	E159-N161 VanDerWaalsContact C-N 3.3Å; E159-N161 PolarHBondContact O-N 2.94Å
160	L	38.9	Very low	44	Very low	146 Å²	146	101.1 Å²	101.1	76%	0.764	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-85	2.9	178	-70	170.4	0	0	0	114
161	N	45.5	Very low	45.4	Very low	79 Å²	79	94.3 Å²	94.3	42%	0.422	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-114.8	-1.7	179.7	-80.4	-54.2	0	0	0	113.2	A157 E159 L165	A157-N161 PolarHBondContact O-ND2 2.97Å; E159-N161 VanDerWaalsContact C-N 3.3Å; E159-N161 PolarHBondContact O-N 2.94Å; N161-L165 VanDerWaalsContact O-CD1 3.25Å; N161-L165 WeakPolarHBondContact O-CD1 3.35Å; N161-L165 VanDerWaalsContact O-CG 3.32Å; N161-L165 WeakPolarHBondContact O-CG 2.92Å
162	E	49.4	Very low	46.8	Very low	78 Å²	78	88.6 Å²	88.6	36%	0.364	47%	0.468	S	S	.	.	H	α-helix	trans	-76	-41	-179.6	-63.9	-159.1	153.4	0	0	111.9	D164 L165 E166 R359	E162-D164 PolarHBondContact O-N 2.7Å; E162-L165 WeakPolarHBondContact O-CB 3.07Å; E162-L165 PolarHBondContact O-N 2.91Å; E162-E166 WeakPolarHBondContact O-CG 3.46Å; E162-R359 IonicContact OE1-NH2 2.66Å
163	D	42.7	Very low	48	Very low	95 Å²	95	83.1 Å²	83.1	51%	0.508	44%	0.44	S	S	.	.	H	α-helix	trans	-61.2	-43	-178.7	-67.2	-40.7	0	0	0	112.2	L165 E166	D163-L165 PolarHBondContact O-N 2.77Å; D163-L165 VanDerWaalsContact O-N 3.16Å; D163-E166 WeakPolarHBondContact O-CB 3.13Å; D163-E166 PolarHBondContact O-N 2.86Å; D163-E166 VanDerWaalsContact O-N 3.08Å
164	D	48.1	Very low	49.2	Very low	110 Å²	110	75.1 Å²	75.1	59%	0.588	42%	0.419	S	S	*	.	H	α-helix	trans	-60.3	-28.4	179.5	-72	-14.4	0	0	0	112.8	E162	E162-D164 PolarHBondContact O-N 2.7Å
165	L	51.7	Low	50.3	Low	30 Å²	30	78.7 Å²	78.7	16%	0.157	41%	0.411	C	S	.	.	H	α-helix	trans	-81.7	-19.9	-178.8	-62.3	166.8	0	0	0	113	N161 E162 D163 N169 R359	N161-L165 VanDerWaalsContact O-CD1 3.25Å; N161-L165 WeakPolarHBondContact O-CD1 3.35Å; N161-L165 VanDerWaalsContact O-CG 3.32Å; N161-L165 WeakPolarHBondContact O-CG 2.92Å; E162-L165 WeakPolarHBondContact O-CB 3.07Å; E162-L165 PolarHBondContact O-N 2.91Å; D163-L165 PolarHBondContact O-N 2.77Å; D163-L165 VanDerWaalsContact O-N 3.16Å; L165-N169 PolarHBondContact O-N 2.86Å; L165-N169 PolarHBondContact O-ND2 2.7Å; L165-R359 VanDerWaalsContact CD1-CD 3.43Å; L165-R359 HydrophobicContact CD1-CG 3.62Å; L165-R359 HydrophobicContact CD2-CB 3.85Å; L165-R359 HydrophobicContact CD2-CG 3.62Å; L165-R359 HydrophobicContact CG-CG 4.26Å
166	E	53.2	Low	51.2	Low	17 Å²	17	73.4 Å²	73.4	8%	0.079	38%	0.382	C	S	.	.	H	α-helix	trans	-77.9	-40.1	-175.9	-68.2	174.1	-141.1	0	0	111.8	E162 D163 E168 N169 D170 I396 S469	E162-E166 WeakPolarHBondContact O-CG 3.46Å; D163-E166 WeakPolarHBondContact O-CB 3.13Å; D163-E166 PolarHBondContact O-N 2.86Å; D163-E166 VanDerWaalsContact O-N 3.08Å; E166-E168 VanDerWaalsContact C-N 3.31Å; E166-N169 PolarHBondContact O-N 2.82Å; E166-D170 PolarHBondContact O-N 2.94Å; E166-I396 HydrophobicContact CG-CG2 4.41Å; E166-S469 WeakPolarHBondContact OE1-CB 3.26Å; E166-S469 PolarHBondContact OE1-OG 3.5Å; E166-S469 WeakPolarHBondContact OE2-CB 3.37Å; E166-S469 PolarHBondContact OE2-N 2.98Å; E166-S469 PolarHBondContact OE2-OG 3.28Å
167	E	50.6	Low	51.6	Low	150 Å²	150	75.2 Å²	75.2	70%	0.701	39%	0.387	S	S	*	.	H	α-helix	trans	-63.4	-39.8	176.2	-67	-170.8	176.8	0	0	110.3	N169 S174	E167-N169 PolarHBondContact O-N 3.33Å; E167-S174 WeakPolarHBondContact O-CB 3.4Å
168	E	52.1	Low	51.4	Low	115 Å²	115	79.4 Å²	79.4	54%	0.537	40%	0.398	S	S	.	.	H	α-helix	trans	-72	-30.6	-178.5	-163.4	172.5	-161.8	0	0	113.3	E166	E166-E168 VanDerWaalsContact C-N 3.31Å
169	N	56.9	Low	50.9	Low	13 Å²	13	77.7 Å²	77.7	7%	0.07	41%	0.406	C	S	.	.	H	α-helix	trans	-94.3	-13.3	-171.9	-73.2	-59.6	0	0	0	115.5	L165 E166 E167 Y171 R468	L165-N169 PolarHBondContact O-N 2.86Å; L165-N169 PolarHBondContact O-ND2 2.7Å; E166-N169 PolarHBondContact O-N 2.82Å; E167-N169 PolarHBondContact O-N 3.33Å; N169-Y171 PolarHBondContact O-N 3.44Å; N169-R468 PolarHBondContact O-NH2 3.35Å
170	D	65.4	Low	50.6	Low	14 Å²	14	79.4 Å²	79.4	8%	0.075	41%	0.414	C	S	.	.			trans	-77.9	75.2	167.7	-159.6	-24.3	0	0	0	109.9	E166 I172 D173 S174 R421 K473	E166-D170 PolarHBondContact O-N 2.94Å; D170-I172 CarbonylContact O-C 3.58Å; D170-I172 PolarHBondContact O-N 3.48Å; D170-D173 HydrophobicContact CB-CB 4.08Å; D170-D173 PolarHBondContact O-N 3.48Å; D170-D173 VanDerWaalsContact OD2-OD2 3.04Å; D170-S174 WeakPolarHBondContact O-CB 3.35Å; D170-S174 PolarHBondContact O-N 3.15Å; D170-S174 PolarHBondContact O-OG 3.2Å; D170-R421 IonicContact OD1-NH1 2.77Å; D170-K473 IonicContact OD2-NZ 3.77Å; D170-K473 PolarHBondContact OD2-NZ 3.42Å
171	Y	68.5	Low	50.3	Low	27 Å²	27	76.9 Å²	76.9	11%	0.106	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-34.9	-36.8	-172.8	-179.3	-136.3	0	0	0	116.9	N169 S174 W365 W411 E412	N169-Y171 PolarHBondContact O-N 3.44Å; Y171-S174 PolarHBondContact O-OG 3.45Å; Y171-W365 HydrophobicContact CD1-CD2 4.07Å; Y171-W365 AromaticContact CD1-CE3 3.87Å; Y171-W365 HydrophobicContact CD1-CE3 3.87Å; Y171-W365 HydrophobicContact CD1-CH2 4.11Å; Y171-W365 HydrophobicContact CD1-CZ2 4.3Å; Y171-W365 AromaticContact CD1-CZ3 3.88Å; Y171-W365 HydrophobicContact CD1-CZ3 3.88Å; Y171-W365 HydrophobicContact CD2-CB 3.69Å; Y171-W365 AromaticContact CD2-CD1 3.98Å; Y171-W365 AromaticContact CD2-CD2 3.52Å; Y171-W365 HydrophobicContact CD2-CD2 3.52Å; Y171-W365 AromaticContact CD2-CE3 3.79Å; Y171-W365 HydrophobicContact CD2-CE3 3.79Å; Y171-W365 AromaticContact CD2-CG 3.44Å; Y171-W365 HydrophobicContact CD2-CG 3.44Å; Y171-W365 VanDerWaalsContact CD2-CG 3.44Å; Y171-W365 HydrophobicContact CE1-CD2 4.42Å; Y171-W365 AromaticContact CE1-CE3 3.82Å; Y171-W365 HydrophobicContact CE1-CE3 3.82Å; Y171-W365 HydrophobicContact CE1-CH2 4.48Å; Y171-W365 AromaticContact CE1-CZ3 3.85Å; Y171-W365 HydrophobicContact CE1-CZ3 3.85Å; Y171-W365 HydrophobicContact CE2-CB 3.91Å; Y171-W365 AromaticContact CE2-CD2 3.97Å; Y171-W365 HydrophobicContact CE2-CD2 3.97Å; Y171-W365 AromaticContact CE2-CE3 3.79Å; Y171-W365 HydrophobicContact CE2-CE3 3.79Å; Y171-W365 HydrophobicContact CE2-CG 4.02Å; Y171-W365 AromaticContact CG-CD2 3.55Å; Y171-W365 HydrophobicContact CG-CD2 3.55Å; Y171-W365 AromaticContact CG-CE2 3.76Å; Y171-W365 AromaticContact CG-CE3 3.81Å; Y171-W365 HydrophobicContact CG-CE3 3.81Å; Y171-W365 AromaticContact CG-CG 3.88Å; Y171-W365 HydrophobicContact CG-CG 3.88Å; Y171-W365 HydrophobicContact CG-CH2 4.44Å; Y171-W365 HydrophobicContact CG-CZ2 4.23Å; Y171-W365 HydrophobicContact CG-CZ3 4.24Å; Y171-W365 AromaticContact CZ-CE3 3.76Å; Y171-W411 AromaticContact CD1-CD1 3.63Å; Y171-W411 AromaticContact CE1-CD1 3.25Å; Y171-W411 HydrophobicContact CE1-CG 4.25Å; Y171-W411 AromaticContact CE1-NE1 3.83Å; Y171-W411 AromaticContact CE2-NE1 3.94Å; Y171-W411 AromaticContact CZ-CD1 3.6Å; Y171-W411 AromaticContact CZ-NE1 3.68Å; Y171-E412 VanDerWaalsContact CZ-OE1 3.28Å; Y171-E412 PolarHBondContact OH-OE1 3.05Å; Y171-E412 PolarHBondContact OH-OE2 3.05Å
172	I	64.2	Low	49.8	Very low	8 Å²	8	79.3 Å²	79.3	4%	0.041	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-36.3	-179.2	-167.3	172.3	0	0	0	113.5	D170 F176 W411 R421 H509	D170-I172 CarbonylContact O-C 3.58Å; D170-I172 PolarHBondContact O-N 3.48Å; I172-F176 WeakPolarHBondContact O-CD2 3.5Å; I172-W411 HydrophobicContact CD1-CB 4.38Å; I172-R421 VanDerWaalsContact CG2-NH2 3.32Å; I172-H509 HydrophobicContact CD1-CB 4.02Å; I172-H509 WeakPolarHBondContact CD1-ND1 3.47Å
173	D	64.9	Low	49	Very low	38 Å²	38	82.9 Å²	82.9	20%	0.203	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-34.3	177.3	-73	-24.5	0	0	0	110.1	D170 Y175 F176 D177 R421 K473	D170-D173 HydrophobicContact CB-CB 4.08Å; D170-D173 PolarHBondContact O-N 3.48Å; D170-D173 VanDerWaalsContact OD2-OD2 3.04Å; D173-Y175 PolarHBondContact O-N 3.27Å; D173-F176 PolarHBondContact O-N 2.8Å; D173-F176 VanDerWaalsContact O-N 3.15Å; D173-D177 WeakPolarHBondContact O-CB 3.02Å; D173-D177 PolarHBondContact O-N 2.87Å; D173-D177 VanDerWaalsContact O-N 3.11Å; D173-R421 IonicContact OD1-CZ 3.62Å; D173-R421 IonicContact OD1-NH2 2.69Å; D173-R421 PolarHBondContact OD1-NH2 3.33Å; D173-R421 IonicContact OD2-CZ 2.96Å; D173-R421 IonicContact OD2-NH2 2.74Å; D173-R421 PolarHBondContact OD2-NH2 2.97Å; D173-K473 IonicContact OD2-NZ 3.95Å; D173-K473 PolarHBondContact OD2-NZ 3.03Å
174	S	60.2	Low	48.4	Very low	56 Å²	56	87.3 Å²	87.3	39%	0.392	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-25.4	176.4	75.3	0	0	0	0	114	E167 D170 Y171	E167-S174 WeakPolarHBondContact O-CB 3.4Å; D170-S174 WeakPolarHBondContact O-CB 3.35Å; D170-S174 PolarHBondContact O-N 3.15Å; D170-S174 PolarHBondContact O-OG 3.2Å; Y171-S174 PolarHBondContact O-OG 3.45Å
175	Y	55.1	Low	47.7	Very low	146 Å²	146	89.6 Å²	89.6	57%	0.573	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-22.9	179.5	-164.8	-91	0	0	0	113.1	D173 W411	D173-Y175 PolarHBondContact O-N 3.27Å; Y175-W411 AromaticContact CD1-CH2 3.95Å; Y175-W411 HydrophobicContact CD1-CH2 3.95Å; Y175-W411 AromaticContact CD1-CZ2 3.74Å; Y175-W411 HydrophobicContact CD1-CZ2 3.74Å; Y175-W411 AromaticContact CD2-CZ2 3.79Å; Y175-W411 HydrophobicContact CD2-CZ2 3.79Å; Y175-W411 AromaticContact CE1-CH2 3.63Å; Y175-W411 HydrophobicContact CE1-CH2 3.63Å; Y175-W411 AromaticContact CE1-CZ2 3.79Å; Y175-W411 HydrophobicContact CE1-CZ2 3.79Å; Y175-W411 HydrophobicContact CE2-CH2 4.3Å; Y175-W411 AromaticContact CE2-CZ2 3.85Å; Y175-W411 HydrophobicContact CE2-CZ2 3.85Å; Y175-W411 HydrophobicContact CG-CH2 4.4Å; Y175-W411 AromaticContact CG-CZ2 3.73Å; Y175-W411 HydrophobicContact CG-CZ2 3.73Å; Y175-W411 AromaticContact CZ-CH2 3.82Å; Y175-W411 AromaticContact CZ-CZ2 3.84Å
176	F	49.8	Very low	46.7	Very low	40 Å²	40	97 Å²	97	18%	0.175	51%	0.511	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.1	7.1	-170.5	-67.3	-74.5	0	0	0	114.6	I172 D173 H509 I510 K511	I172-F176 WeakPolarHBondContact O-CD2 3.5Å; D173-F176 PolarHBondContact O-N 2.8Å; D173-F176 VanDerWaalsContact O-N 3.15Å; F176-H509 WeakPolarHBondContact CE2-O 3.27Å; F176-I510 HydrophobicContact CZ-CB 4.43Å; F176-I510 HydrophobicContact CZ-CG1 4.49Å; F176-I510 HydrophobicContact CZ-CG2 4.42Å; F176-K511 HydrophobicContact CB-CD 3.99Å; F176-K511 HydrophobicContact CB-CG 4.45Å; F176-K511 HydrophobicContact CD1-CB 4.06Å; F176-K511 HydrophobicContact CD1-CD 4.32Å; F176-K511 HydrophobicContact CD1-CG 4.21Å; F176-K511 HydrophobicContact CE1-CB 4.28Å; F176-K511 HydrophobicContact CG-CD 4.32Å; F176-K511 HydrophobicContact CG-CG 4.3Å; F176-K511 PolarHBondContact O-NZ 2.99Å
177	D	42.1	Very low	45.7	Very low	105 Å²	105	101.5 Å²	101.5	56%	0.561	54%	0.544	S	S	*	.			trans	-94.6	112.8	177.4	-151.3	-14.7	0	0	0	110.8	D173 G179	D173-D177 WeakPolarHBondContact O-CB 3.02Å; D173-D177 PolarHBondContact O-N 2.87Å; D173-D177 VanDerWaalsContact O-N 3.11Å; D177-G179 PolarHBondContact OD1-N 2.78Å
178	N	34.6	Very low	44.5	Very low	162 Å²	162	100.1 Å²	100.1	87%	0.866	55%	0.551	S	S	*	*			trans	-102.5	26.2	177.1	-72.5	-15.9	0	0	0	111.4
179	G	33.1	Very low	43.3	Very low	68 Å²	68	97.7 Å²	97.7	70%	0.701	56%	0.558	S	S	*	*			trans	76.4	35.2	171.6	0	0	0	0	0	114.7	D177 A181	D177-G179 PolarHBondContact OD1-N 2.78Å; G179-A181 PolarHBondContact O-N 2.97Å
180	E	36.3	Very low	41.6	Very low	171 Å²	171	105 Å²	105	80%	0.799	60%	0.595	S	S	*	*			trans	-91.6	92.1	171.1	-128.7	167.7	-160.8	0	0	109.3	D182	E180-D182 PolarHBondContact O-N 3.05Å
181	A	31.6	Very low	39.7	Very low	93 Å²	93	114.3 Å²	114.3	77%	0.769	64%	0.636	S	S	*	*			trans	-68.1	118.3	170.6	0	0	0	0	0	109.6	G179	G179-A181 PolarHBondContact O-N 2.97Å
182	D	34.9	Very low	37.5	Very low	130 Å²	130	118.4 Å²	118.4	70%	0.695	67%	0.667	S	S	*	*			trans	-134.6	105.7	168.3	-83.2	-39	0	0	0	112.3	E180	E180-D182 PolarHBondContact O-N 3.05Å
183	L	34.2	Very low	35.4	Very low	153 Å²	153	127.3 Å²	127.3	80%	0.801	71%	0.706	S	S	*	*			trans	73.5	100.6	132.3	-56.4	173.8	0	0	0	118.6
184	E	30	Very low	33.5	Very low	187 Å²	187	133.9 Å²	133.9	87%	0.874	74%	0.74	S	S	*	*			trans	-56.1	124.4	152.4	-61	170.9	172	0	0	110.2
185	D	33.4	Very low	31.7	Very low	159 Å²	159	134.8 Å²	134.8	85%	0.85	75%	0.747	S	S	*	*			trans	-114.9	103.8	158.9	-87.5	-31.9	0	0	0	108.7	S187	D185-S187 PolarHBondContact O-N 2.81Å
186	E	29.7	Very low	30.3	Very low	184 Å²	184	136.5 Å²	136.5	86%	0.86	76%	0.764	S	S	*	*			trans	-56.3	122.6	160.5	-66.2	-168.7	143.9	0	0	109.9
187	S	32.1	Very low	28.9	Very low	112 Å²	112	141.1 Å²	141.1	78%	0.783	79%	0.791	S	S	*	*			trans	-138.8	83.5	152.4	57.1	0	0	0	0	110.3	D185 G189	D185-S187 PolarHBondContact O-N 2.81Å; S187-G189 PolarHBondContact O-N 2.82Å; S187-G189 VanDerWaalsContact O-N 3.1Å
188	S	25.9	Very low	28	Very low	121 Å²	121	140.2 Å²	140.2	85%	0.846	80%	0.798	S	S	*	*			trans	-55.1	104.5	151.2	51.7	0	0	0	0	109.3
189	G	26.8	Very low	27.5	Very low	65 Å²	65	143.6 Å²	143.6	67%	0.67	80%	0.799	S	S	*	*			trans	-128.1	83.2	173.4	0	0	0	0	0	110.4	S187 F191	S187-G189 PolarHBondContact O-N 2.82Å; S187-G189 VanDerWaalsContact O-N 3.1Å; G189-F191 PolarHBondContact O-N 3.42Å
190	L	22	Very low	27	Very low	165 Å²	165	144.9 Å²	144.9	86%	0.864	80%	0.803	S	S	*	*			trans	-52.6	120.5	157.1	-110.3	93.3	0	0	0	108.1
191	F	24.3	Very low	26.4	Very low	211 Å²	211	143.7 Å²	143.7	93%	0.925	80%	0.8	S	S	*	*			trans	-141.4	137.7	154.7	-101.4	-78.9	0	0	0	112.5	G189	G189-F191 PolarHBondContact O-N 3.42Å
192	C	22.2	Very low	26	Very low	112 Å²	112	143.8 Å²	143.8	76%	0.757	80%	0.795	S	S	*	*			trans	-76.3	154.9	-157.3	-68.9	0	0	0	0	116.2
193	F	21.2	Very low	25.5	Very low	195 Å²	195	142.3 Å²	142.3	86%	0.855	80%	0.795	S	S	*	*			trans	-27.4	135.9	149.9	-80.4	-99.9	0	0	0	115.5
194	L	24.3	Very low	25.1	Very low	177 Å²	177	143.8 Å²	143.8	93%	0.927	80%	0.798	S	S	*	*			trans	-126.9	117.8	138.7	-77	176.7	0	0	0	109.3
195	S	21.8	Very low	25	Very low	75 Å²	75	139.9 Å²	139.9	52%	0.524	79%	0.791	S	S	.	*			trans	-64.8	146.1	165.3	142.9	0	0	0	0	110	D197	S195-D197 PolarHBondContact OG-OD2 2.75Å; S195-D197 VanDerWaalsContact OG-OD2 3.1Å
196	L	25.2	Very low	24.7	Very low	181 Å²	181	138.8 Å²	138.8	95%	0.948	78%	0.784	S	S	*	*			trans	-139.8	102.1	143.7	-114.1	151.9	0	0	0	107.5
197	D	22	Very low	24.8	Very low	138 Å²	138	134 Å²	134	74%	0.738	76%	0.762	S	S	*	*			trans	-69	157.1	178	-73.3	-56.6	0	0	0	113.6	S195	S195-D197 PolarHBondContact OG-OD2 2.75Å; S195-D197 VanDerWaalsContact OG-OD2 3.1Å
198	A	22.6	Very low	25	Very low	86 Å²	86	132.1 Å²	132.1	71%	0.711	75%	0.748	S	S	*	*			trans	77.9	110.1	148.1	0	0	0	0	0	119.3
199	W	24.9	Very low	25.4	Very low	233 Å²	233	131.3 Å²	131.3	88%	0.883	73%	0.734	S	S	*	*				-162.4	123.1	103.6	-112	47.4	0	0	0	110.6	I201	W199-I201 HydrophobicContact CE3-CD1 3.87Å; W199-I201 HydrophobicContact CZ3-CD1 3.76Å
200	A	21.3	Very low	25.8	Very low	94 Å²	94	134 Å²	134	78%	0.777	72%	0.724	S	S	*	*			trans	-78.4	140.5	164.4	0	0	0	0	0	109.2
201	I	25.1	Very low	26.5	Very low	146 Å²	146	128.5 Å²	128.5	75%	0.749	70%	0.695	S	S	*	*			trans	-154.1	136.8	143.2	-91.8	143.5	0	0	0	107.3	W199	W199-I201 HydrophobicContact CE3-CD1 3.87Å; W199-I201 HydrophobicContact CZ3-CD1 3.76Å
202	S	22.8	Very low	27.1	Very low	95 Å²	95	122.2 Å²	122.2	66%	0.664	67%	0.669	S	S	*	*			trans	-69.9	168.2	-175.7	62.4	0	0	0	0	114.4
203	S	24.3	Very low	27.8	Very low	99 Å²	99	123.1 Å²	123.1	69%	0.692	66%	0.662	S	S	*	*			trans	72.5	141.1	142.5	62.3	0	0	0	0	119.3
204	E	25.4	Very low	28.6	Very low	184 Å²	184	116.5 Å²	116.5	86%	0.86	64%	0.643	S	S	*	*			trans	97.2	96.6	165.6	-58	-175.9	171.6	0	0	115.5
205	S	27.2	Very low	29.2	Very low	105 Å²	105	110.7 Å²	110.7	73%	0.734	61%	0.613	S	S	*	*			trans	-52.8	171.7	155.4	58.5	0	0	0	0	111.4
206	I	27.7	Very low	30	Very low	136 Å²	136	114.1 Å²	114.1	70%	0.697	62%	0.615	S	S	*	*			trans	98.3	135.5	-170.2	-53.4	152.4	0	0	0	109.4
207	Q	31.1	Very low	30.6	Very low	83 Å²	83	108.2 Å²	108.2	39%	0.388	59%	0.593	S	S	.	*			trans	123.7	61.4	160	-60.1	-177.4	52.6	0	0	116.7	R210	Q207-R210 HydrophobicContact CB-CB 4.09Å; Q207-R210 HydrophobicContact CB-CG 4.33Å; Q207-R210 VanDerWaalsContact CD-CD 3.48Å; Q207-R210 VanDerWaalsContact CD-NH1 3.32Å; Q207-R210 HydrophobicContact CG-CB 3.95Å; Q207-R210 VanDerWaalsContact CG-CD 3.48Å; Q207-R210 HydrophobicContact CG-CG 3.72Å
208	C	36.9	Very low	31.4	Very low	74 Å²	74	103.3 Å²	103.3	50%	0.5	57%	0.569	S	S	.	*	S	Bend	trans	-98.2	-38.3	149.9	-121.8	0	0	0	0	110.8	F41 R210 L211	F41-C208 HydrophobicContact CE2-CB 3.89Å; F41-C208 HydrophobicContact CZ-CB 3.63Å; C208-R210 PolarHBondContact O-N 2.7Å; C208-L211 PolarHBondContact O-N 3.44Å
209	D	35.2	Very low	32	Very low	103 Å²	103	104 Å²	104	55%	0.551	56%	0.56	S	S	*	*	H	α-helix	trans	-62.1	-26.4	175	-81.9	-4.9	0	0	0	114.4	Q213	D209-Q213 WeakPolarHBondContact O-CB 3.28Å; D209-Q213 WeakPolarHBondContact O-CG 3.05Å; D209-Q213 PolarHBondContact O-N 3.22Å
210	R	35.1	Very low	32.6	Very low	121 Å²	121	97.4 Å²	97.4	46%	0.457	55%	0.55	S	S	.	.	H	α-helix	trans	-75	-26.8	-179.4	-69.2	-157.5	-165.2	162	-10.5	113.2	Q207 C208 A214	Q207-R210 HydrophobicContact CB-CB 4.09Å; Q207-R210 HydrophobicContact CB-CG 4.33Å; Q207-R210 VanDerWaalsContact CD-CD 3.48Å; Q207-R210 VanDerWaalsContact CD-NH1 3.32Å; Q207-R210 HydrophobicContact CG-CB 3.95Å; Q207-R210 VanDerWaalsContact CG-CD 3.48Å; Q207-R210 HydrophobicContact CG-CG 3.72Å; C208-R210 PolarHBondContact O-N 2.7Å; R210-A214 WeakPolarHBondContact O-CB 3.21Å; R210-A214 PolarHBondContact O-N 2.96Å
211	L	36.6	Very low	33.2	Very low	51 Å²	51	100.6 Å²	100.6	27%	0.267	55%	0.546	S	S	.	.	H	α-helix	trans	-72	-44.1	175.6	-101.4	155.3	0	0	0	110.4	C208 A214 L215 M243	C208-L211 PolarHBondContact O-N 3.44Å; L211-A214 PolarHBondContact O-N 3.11Å; L211-L215 VanDerWaalsContact O-CB 3.3Å; L211-L215 WeakPolarHBondContact O-CB 3.41Å; L211-L215 WeakPolarHBondContact O-CD1 3.46Å; L211-L215 VanDerWaalsContact O-CG 3.24Å; L211-L215 WeakPolarHBondContact O-CG 3.42Å; L211-L215 PolarHBondContact O-N 2.82Å; L211-M243 HydrophobicContact CD2-CE 4.46Å
212	Q	36.9	Very low	33.8	Very low	79 Å²	79	98.2 Å²	98.2	37%	0.369	53%	0.528	S	S	.	.	H	α-helix	trans	-66.4	-43.7	178	-161.9	172.5	-7	0	0	111.5	L215 Y216	Q212-L215 PolarHBondContact O-N 3.32Å; Q212-Y216 HydrophobicContact CG-CD2 4.13Å; Q212-Y216 HydrophobicContact CG-CE2 4.21Å; Q212-Y216 WeakPolarHBondContact O-CB 3.4Å; Q212-Y216 WeakPolarHBondContact O-CD2 2.73Å; Q212-Y216 PolarHBondContact O-N 2.89Å
213	Q	35.6	Very low	34.8	Very low	131 Å²	131	96.8 Å²	96.8	61%	0.612	52%	0.518	S	S	*	.	H	α-helix	trans	-69.5	-34.1	176.7	-70.4	175.6	22.7	0	0	113.3	D209 A217	D209-Q213 WeakPolarHBondContact O-CB 3.28Å; D209-Q213 WeakPolarHBondContact O-CG 3.05Å; D209-Q213 PolarHBondContact O-N 3.22Å; Q213-A217 VanDerWaalsContact O-CB 3.25Å; Q213-A217 WeakPolarHBondContact O-CB 3.21Å; Q213-A217 PolarHBondContact O-N 2.95Å
214	A	37.9	Very low	35.4	Very low	56 Å²	56	96.5 Å²	96.5	46%	0.463	51%	0.505	S	S	.	.	H	α-helix	trans	-69.7	-38.1	173.8	0	0	0	0	0	112	R210 L211 S218	R210-A214 WeakPolarHBondContact O-CB 3.21Å; R210-A214 PolarHBondContact O-N 2.96Å; L211-A214 PolarHBondContact O-N 3.11Å; A214-S218 VanDerWaalsContact O-CB 3.23Å; A214-S218 WeakPolarHBondContact O-CB 3.44Å; A214-S218 PolarHBondContact O-N 3.48Å; A214-S218 VanDerWaalsContact O-N 3.11Å
215	L	38.2	Very low	35.8	Very low	55 Å²	55	95.8 Å²	95.8	29%	0.288	50%	0.499	S	S	.	.	H	α-helix	trans	-62.4	-50.2	172.6	-79.3	159.7	0	0	0	110.5	L211 Q212 A217 S218 I219	L211-L215 VanDerWaalsContact O-CB 3.3Å; L211-L215 WeakPolarHBondContact O-CB 3.41Å; L211-L215 WeakPolarHBondContact O-CD1 3.46Å; L211-L215 VanDerWaalsContact O-CG 3.24Å; L211-L215 WeakPolarHBondContact O-CG 3.42Å; L211-L215 PolarHBondContact O-N 2.82Å; Q212-L215 PolarHBondContact O-N 3.32Å; L215-A217 PolarHBondContact O-N 3Å; L215-S218 PolarHBondContact O-N 3.32Å; L215-I219 WeakPolarHBondContact O-CD1 3.11Å; L215-I219 WeakPolarHBondContact O-CG1 3.45Å; L215-I219 PolarHBondContact O-N 3.4Å; L215-I219 VanDerWaalsContact O-N 3.08Å
216	Y	37.8	Very low	36.4	Very low	146 Å²	146	95.6 Å²	95.6	57%	0.573	49%	0.486	S	S	*	.	H	α-helix	trans	-62.1	-39.3	177.7	-95	-83.4	0	0	0	113.8	Q212 S218	Q212-Y216 HydrophobicContact CG-CD2 4.13Å; Q212-Y216 HydrophobicContact CG-CE2 4.21Å; Q212-Y216 WeakPolarHBondContact O-CB 3.4Å; Q212-Y216 WeakPolarHBondContact O-CD2 2.73Å; Q212-Y216 PolarHBondContact O-N 2.89Å; Y216-S218 VanDerWaalsContact C-N 3.3Å; Y216-S218 PolarHBondContact O-N 3.06Å
217	A	37.8	Very low	37.1	Very low	58 Å²	58	90.8 Å²	90.8	48%	0.479	46%	0.46	S	S	.	.	H	α-helix	trans	-74	-21	178.3	0	0	0	0	0	113.5	Q213 L215 S220	Q213-A217 VanDerWaalsContact O-CB 3.25Å; Q213-A217 WeakPolarHBondContact O-CB 3.21Å; Q213-A217 PolarHBondContact O-N 2.95Å; L215-A217 PolarHBondContact O-N 3Å; A217-S220 PolarHBondContact O-OG 3.44Å
218	S	38.4	Very low	37.4	Very low	34 Å²	34	89 Å²	89	24%	0.238	45%	0.452	C	S	.	.	H	α-helix	trans	-88.2	-30.6	179.2	-160.2	0	0	0	0	112.2	A214 L215 Y216 S220 K221 Y222	A214-S218 VanDerWaalsContact O-CB 3.23Å; A214-S218 WeakPolarHBondContact O-CB 3.44Å; A214-S218 PolarHBondContact O-N 3.48Å; A214-S218 VanDerWaalsContact O-N 3.11Å; L215-S218 PolarHBondContact O-N 3.32Å; Y216-S218 VanDerWaalsContact C-N 3.3Å; Y216-S218 PolarHBondContact O-N 3.06Å; S218-S220 PolarHBondContact O-N 3.16Å; S218-K221 PolarHBondContact O-N 3.29Å; S218-Y222 WeakPolarHBondContact O-CD2 3.38Å
219	I	36.9	Very low	37.3	Very low	101 Å²	101	91.5 Å²	91.5	52%	0.518	46%	0.456	S	S	.	.	H	α-helix	trans	-61.9	-27.4	176.8	-70.4	160.9	0	0	0	112.6	L215 W227	L215-I219 WeakPolarHBondContact O-CD1 3.11Å; L215-I219 WeakPolarHBondContact O-CG1 3.45Å; L215-I219 PolarHBondContact O-N 3.4Å; L215-I219 VanDerWaalsContact O-N 3.08Å; I219-W227 HydrophobicContact CG1-CZ2 4.16Å
220	S	35.9	Very low	37.6	Very low	95 Å²	95	90.2 Å²	90.2	66%	0.664	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-3.4	-175.4	61.9	0	0	0	0	115.9	A217 S218	A217-S220 PolarHBondContact O-OG 3.44Å; S218-S220 PolarHBondContact O-N 3.16Å
221	K	35	Very low	37.7	Very low	160 Å²	160	86.7 Å²	86.7	70%	0.696	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.3	-11.7	-166.4	-75.3	-173.7	179	178.9	0	116.7	S218	S218-K221 PolarHBondContact O-N 3.29Å
222	Y	37	Very low	37.7	Very low	97 Å²	97	87.9 Å²	87.9	38%	0.38	45%	0.449	S	S	.	.	S	Bend	trans	-125.8	140.9	-171.1	-63.3	-75.4	0	0	0	111.1	S218 E226 Q230	S218-Y222 WeakPolarHBondContact O-CD2 3.38Å; Y222-E226 HydrophobicContact CD1-CB 4.22Å; Y222-Q230 HydrophobicContact CD1-CG 4.21Å; Y222-Q230 HydrophobicContact CE1-CG 4Å
223	S	43.6	Very low	37.6	Very low	65 Å²	65	90 Å²	90	46%	0.455	46%	0.461	S	S	.	.			trans	-60.7	148.3	163.6	70	0	0	0	0	109.1	F225 E226 W227	S223-F225 PolarHBondContact O-N 3.2Å; S223-E226 WeakPolarHBondContact CB-OE2 3.13Å; S223-E226 PolarHBondContact N-OE2 2.82Å; S223-E226 CarbonylContact O-C 3.56Å; S223-E226 WeakPolarHBondContact O-CA 3.05Å; S223-E226 PolarHBondContact O-N 3.33Å; S223-E226 VanDerWaalsContact OG-CD 3.26Å; S223-E226 WeakPolarHBondContact OG-CG 3.3Å; S223-E226 PolarHBondContact OG-OE2 3.49Å; S223-W227 PolarHBondContact O-N 3.18Å
224	F	37.6	Very low	37.5	Very low	93 Å²	93	85.5 Å²	85.5	41%	0.408	45%	0.445	S	S	.	.	H	α-helix	trans	-48.5	-37.2	-173.4	176.9	-106.1	0	0	0	114.1	I228 M273	F224-I228 HydrophobicContact CE1-CD1 4.08Å; F224-I228 HydrophobicContact CE2-CD1 4.26Å; F224-I228 HydrophobicContact CZ-CD1 3.85Å; F224-I228 PolarHBondContact O-N 2.75Å; F224-M273 HydrophobicContact CD2-CE 3.72Å; F224-M273 HydrophobicContact CD2-SD 4.33Å; F224-M273 HydrophobicContact CE2-CE 3.4Å; F224-M273 VanDerWaalsContact CE2-CE 3.4Å; F224-M273 HydrophobicContact CE2-SD 3.46Å; F224-M273 WeakPolarHBondContact CE2-SD 3.13Å; F224-M273 HydrophobicContact CZ-CE 3.99Å; F224-M273 HydrophobicContact CZ-SD 3.91Å
225	F	34.2	Very low	37.1	Very low	169 Å²	169	86.8 Å²	86.8	74%	0.741	45%	0.448	S	S	*	.	H	α-helix	trans	-74.6	-38.6	176.7	-83.1	-82.7	0	0	0	113.5	S223 W227 E229	S223-F225 PolarHBondContact O-N 3.2Å; F225-W227 VanDerWaalsContact C-N 3.28Å; F225-W227 PolarHBondContact O-N 3.35Å; F225-E229 PolarHBondContact O-N 3.23Å
226	E	39.8	Very low	36.9	Very low	100 Å²	100	85.8 Å²	85.8	47%	0.467	44%	0.444	S	S	.	.	H	α-helix	trans	-69.3	-29.4	173.9	-70.1	168.6	141.8	0	0	111.5	Y222 S223 E229 Q230	Y222-E226 HydrophobicContact CD1-CB 4.22Å; S223-E226 WeakPolarHBondContact CB-OE2 3.13Å; S223-E226 PolarHBondContact N-OE2 2.82Å; S223-E226 CarbonylContact O-C 3.56Å; S223-E226 WeakPolarHBondContact O-CA 3.05Å; S223-E226 PolarHBondContact O-N 3.33Å; S223-E226 VanDerWaalsContact OG-CD 3.26Å; S223-E226 WeakPolarHBondContact OG-CG 3.3Å; S223-E226 PolarHBondContact OG-OE2 3.49Å; E226-E229 PolarHBondContact O-N 2.82Å; E226-Q230 WeakPolarHBondContact O-CB 3.11Å; E226-Q230 WeakPolarHBondContact O-CG 3.25Å; E226-Q230 PolarHBondContact O-N 3.35Å
227	W	41.4	Very low	36.8	Very low	36 Å²	36	87.9 Å²	87.9	14%	0.136	45%	0.451	C	S	.	.	H	α-helix	trans	-68	-43	178.5	-174.8	78.8	0	0	0	112.4	I219 S223 F225 Q230 L231 I253	I219-W227 HydrophobicContact CG1-CZ2 4.16Å; S223-W227 PolarHBondContact O-N 3.18Å; F225-W227 VanDerWaalsContact C-N 3.28Å; F225-W227 PolarHBondContact O-N 3.35Å; W227-Q230 PolarHBondContact O-N 2.85Å; W227-L231 HydrophobicContact CD2-CD1 3.84Å; W227-L231 HydrophobicContact CE3-CD1 3.8Å; W227-L231 HydrophobicContact CH2-CD1 3.46Å; W227-L231 VanDerWaalsContact CH2-CD1 3.46Å; W227-L231 HydrophobicContact CZ2-CD1 3.49Å; W227-L231 VanDerWaalsContact CZ2-CD1 3.49Å; W227-L231 HydrophobicContact CZ3-CD1 3.61Å; W227-L231 PolarHBondContact O-N 3.3Å; W227-I253 HydrophobicContact CZ3-CD1 4.46Å
228	I	37.2	Very low	36.7	Very low	45 Å²	45	93.9 Å²	93.9	23%	0.231	47%	0.466	C	S	.	.	H	α-helix	trans	-65.2	-40.7	175	-68.2	-176	0	0	0	110.8	F224 L231 C232	F224-I228 HydrophobicContact CE1-CD1 4.08Å; F224-I228 HydrophobicContact CE2-CD1 4.26Å; F224-I228 HydrophobicContact CZ-CD1 3.85Å; F224-I228 PolarHBondContact O-N 2.75Å; I228-L231 PolarHBondContact O-N 3.38Å; I228-C232 PolarHBondContact O-N 3.29Å; I228-C232 VanDerWaalsContact O-N 3.14Å; I228-C232 PolarHBondContact O-SG 3.31Å
229	E	36.3	Very low	36.5	Very low	126 Å²	126	98.3 Å²	98.3	59%	0.589	48%	0.482	S	S	*	.	H	α-helix	trans	-62.9	-42.4	175.3	-126.7	-175.1	172.5	0	0	111.6	F225 E226 C232 I233	F225-E229 PolarHBondContact O-N 3.23Å; E226-E229 PolarHBondContact O-N 2.82Å; E229-C232 PolarHBondContact O-N 2.65Å; E229-I233 HydrophobicContact CG-CD1 4.16Å; E229-I233 WeakPolarHBondContact O-CB 3.35Å; E229-I233 VanDerWaalsContact O-CD1 3.28Å; E229-I233 WeakPolarHBondContact O-CD1 3.27Å; E229-I233 WeakPolarHBondContact O-CG1 3.23Å; E229-I233 PolarHBondContact O-N 3.04Å; E229-I233 VanDerWaalsContact O-N 3.13Å
230	Q	40.2	Very low	36.6	Very low	77 Å²	77	94.7 Å²	94.7	36%	0.36	47%	0.467	S	S	.	.	H	α-helix	trans	-68.2	-36.8	177.6	-71.6	-66	-27.2	0	0	112.6	Y222 E226 W227 C232 I233 S234	Y222-Q230 HydrophobicContact CD1-CG 4.21Å; Y222-Q230 HydrophobicContact CE1-CG 4Å; E226-Q230 WeakPolarHBondContact O-CB 3.11Å; E226-Q230 WeakPolarHBondContact O-CG 3.25Å; E226-Q230 PolarHBondContact O-N 3.35Å; W227-Q230 PolarHBondContact O-N 2.85Å; Q230-C232 VanDerWaalsContact C-N 3.29Å; Q230-C232 PolarHBondContact O-N 2.94Å; Q230-I233 PolarHBondContact O-N 3.16Å; Q230-S234 WeakPolarHBondContact O-CA 3.35Å; Q230-S234 WeakPolarHBondContact O-CB 3.12Å; Q230-S234 PolarHBondContact O-N 2.66Å
231	L	38.5	Very low	36.7	Very low	46 Å²	46	95.3 Å²	95.3	24%	0.241	47%	0.469	C	S	.	.	H	α-helix	trans	-64.4	-33.3	173.2	-86.6	165.1	0	0	0	112.8	W227 I228 I233 V236	W227-L231 HydrophobicContact CD2-CD1 3.84Å; W227-L231 HydrophobicContact CE3-CD1 3.8Å; W227-L231 HydrophobicContact CH2-CD1 3.46Å; W227-L231 VanDerWaalsContact CH2-CD1 3.46Å; W227-L231 HydrophobicContact CZ2-CD1 3.49Å; W227-L231 VanDerWaalsContact CZ2-CD1 3.49Å; W227-L231 HydrophobicContact CZ3-CD1 3.61Å; W227-L231 PolarHBondContact O-N 3.3Å; I228-L231 PolarHBondContact O-N 3.38Å; L231-I233 VanDerWaalsContact C-N 3.35Å; L231-V236 HydrophobicContact CD2-CG1 4.34Å; L231-V236 HydrophobicContact CD2-CG2 4.39Å
232	C	34.7	Very low	37	Very low	76 Å²	76	92.2 Å²	92.2	51%	0.514	46%	0.457	S	S	.	.	H	α-helix	trans	-74.7	-23.7	176.6	-66.2	0	0	0	0	113.4	I228 E229 Q230	I228-C232 PolarHBondContact O-N 3.29Å; I228-C232 VanDerWaalsContact O-N 3.14Å; I228-C232 PolarHBondContact O-SG 3.31Å; E229-C232 PolarHBondContact O-N 2.65Å; Q230-C232 VanDerWaalsContact C-N 3.29Å; Q230-C232 PolarHBondContact O-N 2.94Å
233	I	36.2	Very low	37.1	Very low	123 Å²	123	90.9 Å²	90.9	63%	0.631	46%	0.455	S	S	*	.	H	α-helix	trans	-108.1	-21.5	-172.4	-60.8	166.9	0	0	0	112.5	E229 Q230 L231	E229-I233 HydrophobicContact CG-CD1 4.16Å; E229-I233 WeakPolarHBondContact O-CB 3.35Å; E229-I233 VanDerWaalsContact O-CD1 3.28Å; E229-I233 WeakPolarHBondContact O-CD1 3.27Å; E229-I233 WeakPolarHBondContact O-CG1 3.23Å; E229-I233 PolarHBondContact O-N 3.04Å; E229-I233 VanDerWaalsContact O-N 3.13Å; Q230-I233 PolarHBondContact O-N 3.16Å; L231-I233 VanDerWaalsContact C-N 3.35Å
234	S	33.6	Very low	36.9	Very low	38 Å²	38	92.9 Å²	92.9	27%	0.266	46%	0.457	S	S	.	.	S	Bend	trans	-78.3	156.5	-171.2	173.5	0	0	0	0	114.4	Q230 V236 R237	Q230-S234 WeakPolarHBondContact O-CA 3.35Å; Q230-S234 WeakPolarHBondContact O-CB 3.12Å; Q230-S234 PolarHBondContact O-N 2.66Å; S234-V236 PolarHBondContact O-N 2.96Å; S234-R237 PolarHBondContact O-N 3.46Å
235	P	30	Very low	37.1	Very low	83 Å²	83	92.5 Å²	92.5	54%	0.539	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	-9	170.7	14.4	-30.6	0	0	0	116.7	R237 K238 F239	P235-R237 VanDerWaalsContact C-N 3.26Å; P235-R237 PolarHBondContact O-N 3.09Å; P235-K238 WeakPolarHBondContact O-CA 3.08Å; P235-K238 WeakPolarHBondContact O-CB 3.29Å; P235-K238 PolarHBondContact O-N 3.13Å; P235-F239 HydrophobicContact CB-CE2 4.22Å; P235-F239 WeakPolarHBondContact O-CD2 3.39Å; P235-F239 PolarHBondContact O-N 3.02Å
236	V	33.8	Very low	37.7	Very low	33 Å²	33	85.7 Å²	85.7	20%	0.2	43%	0.429	C	S	.	.	H	α-helix	trans	-52.7	-40.1	172.3	179.2	0	0	0	0	112.5	L231 S234 K238 F239 A240 M243	L231-V236 HydrophobicContact CD2-CG1 4.34Å; L231-V236 HydrophobicContact CD2-CG2 4.39Å; S234-V236 PolarHBondContact O-N 2.96Å; V236-K238 PolarHBondContact O-N 3.4Å; V236-F239 PolarHBondContact O-N 3.42Å; V236-A240 PolarHBondContact O-N 3.14Å; V236-M243 HydrophobicContact CG1-CE 4.27Å
237	R	35	Very low	37.6	Very low	190 Å²	190	87.9 Å²	87.9	72%	0.717	44%	0.44	S	S	*	.	H	α-helix	trans	-66.1	-19.8	176.4	-144.5	177.5	-170.2	174.2	3.1	113.3	S234 P235	S234-R237 PolarHBondContact O-N 3.46Å; P235-R237 VanDerWaalsContact C-N 3.26Å; P235-R237 PolarHBondContact O-N 3.09Å
238	K	35	Very low	37.6	Very low	184 Å²	184	88.1 Å²	88.1	80%	0.8	44%	0.442	S	S	*	.	H	α-helix	trans	-79.7	-22.4	176	-127.2	178.5	-174	-178.5	0	112.4	P235 V236	P235-K238 WeakPolarHBondContact O-CA 3.08Å; P235-K238 WeakPolarHBondContact O-CB 3.29Å; P235-K238 PolarHBondContact O-N 3.13Å; V236-K238 PolarHBondContact O-N 3.4Å
239	F	34.7	Very low	37.7	Very low	128 Å²	128	88.5 Å²	88.5	56%	0.561	45%	0.449	S	S	*	.	H	α-helix	trans	-102.1	-23.8	-176.5	-70.6	-74.7	0	0	0	113.8	P235 V236	P235-F239 HydrophobicContact CB-CE2 4.22Å; P235-F239 WeakPolarHBondContact O-CD2 3.39Å; P235-F239 PolarHBondContact O-N 3.02Å; V236-F239 PolarHBondContact O-N 3.42Å
240	A	39.2	Very low	37.8	Very low	25 Å²	25	86 Å²	86	21%	0.207	46%	0.457	C	S	.	.			trans	-140.2	77.4	178	0	0	0	0	0	111	V236 Q242 M243	V236-A240 PolarHBondContact O-N 3.14Å; A240-Q242 PolarHBondContact O-N 3.19Å; A240-M243 HydrophobicContact CB-CE 3.55Å; A240-M243 HydrophobicContact CB-CG 4.22Å; A240-M243 PolarHBondContact O-N 2.92Å
241	P	37.1	Very low	37.9	Very low	108 Å²	108	89.1 Å²	89.1	70%	0.701	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-1.3	-178	26.8	-33.8	0	0	0	114.1
242	Q	43	Very low	37.9	Very low	95 Å²	95	89.8 Å²	89.8	44%	0.444	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	8.3	-174.2	-44.7	-158.1	36.2	0	0	113.3	A240 E244	A240-Q242 PolarHBondContact O-N 3.19Å; Q242-E244 PolarHBondContact O-N 3.3Å
243	M	37.6	Very low	38.3	Very low	69 Å²	69	87.5 Å²	87.5	34%	0.34	45%	0.452	S	S	.	.			trans	-74.8	113.7	168.4	-94.4	-160.2	-90.3	0	0	109.1	L211 V236 A240 F255 L257	L211-M243 HydrophobicContact CD2-CE 4.46Å; V236-M243 HydrophobicContact CG1-CE 4.27Å; A240-M243 HydrophobicContact CB-CE 3.55Å; A240-M243 HydrophobicContact CB-CG 4.22Å; A240-M243 PolarHBondContact O-N 2.92Å; M243-F255 HydrophobicContact SD-CD1 4.06Å; M243-L257 HydrophobicContact CG-CD2 4.4Å
244	E	40.1	Very low	38.6	Very low	107 Å²	107	82.3 Å²	82.3	50%	0.5	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	115.4	168.4	-158.6	172.4	-155.1	0	0	108	Q242 L246	Q242-E244 PolarHBondContact O-N 3.3Å; E244-L246 PolarHBondContact O-N 3.06Å
245	L	42.7	Very low	39	Very low	85 Å²	85	82.2 Å²	82.2	45%	0.445	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	112.9	172.2	-176.9	76.1	0	0	0	107.8	E247 I253 F255	L245-E247 HydrophobicContact CD2-CB 4.49Å; L245-E247 PolarHBondContact O-N 3.18Å; L245-I253 HydrophobicContact CD1-CG2 3.92Å; L245-F255 HydrophobicContact CD1-CE1 4.04Å; L245-F255 HydrophobicContact CD1-CZ 4.34Å
246	L	45	Very low	39.5	Very low	25 Å²	25	78.6 Å²	78.6	13%	0.131	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	88.8	168.7	-67.9	168.5	0	0	0	107.4	E244 F248 L254	E244-L246 PolarHBondContact O-N 3.06Å; L246-F248 HydrophobicContact CB-CD2 3.88Å; L246-F248 HydrophobicContact CB-CE2 3.94Å; L246-F248 HydrophobicContact CD2-CE2 4.1Å; L246-F248 PolarHBondContact O-N 3.4Å; L246-L254 HydrophobicContact CB-CB 4.32Å; L246-L254 HydrophobicContact CD1-CD2 3.59Å; L246-L254 HydrophobicContact CD1-CG 4.12Å; L246-L254 PolarHBondContact N-O 3.47Å
247	E	39.4	Very low	39.9	Very low	147 Å²	147	80.7 Å²	80.7	69%	0.687	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	108.2	175	-168.1	178.1	-169.9	0	0	109.5	L245	L245-E247 HydrophobicContact CD2-CB 4.49Å; L245-E247 PolarHBondContact O-N 3.18Å
248	F	41.3	Very low	40.1	Very low	40 Å²	40	75.3 Å²	75.3	18%	0.175	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	96	179.9	-82.6	-88.7	0	0	0	111.2	L246 Q452 L497	L246-F248 HydrophobicContact CB-CD2 3.88Å; L246-F248 HydrophobicContact CB-CE2 3.94Å; L246-F248 HydrophobicContact CD2-CE2 4.1Å; L246-F248 PolarHBondContact O-N 3.4Å; F248-Q452 HydrophobicContact CB-CG 4.01Å; F248-Q452 HydrophobicContact CD1-CB 4.08Å; F248-Q452 HydrophobicContact CD1-CG 4.13Å; F248-Q452 VanDerWaalsContact CD1-OE1 3.3Å; F248-Q452 HydrophobicContact CG-CG 4.41Å; F248-L497 HydrophobicContact CE1-CD2 4.22Å; F248-L497 HydrophobicContact CZ-CD2 3.69Å
249	S	39.3	Very low	40.1	Very low	54 Å²	54	68.4 Å²	68.4	38%	0.378	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	37.2	102.1	166	71.8	0	0	0	0	117.3	K251	S249-K251 PolarHBondContact O-N 2.9Å
250	G	38.1	Very low	40.1	Very low	73 Å²	73	73.4 Å²	73.4	75%	0.753	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	43.1	-5.6	151.1	0	0	0	0	0	123
251	K	42.4	Very low	40	Very low	143 Å²	143	77.4 Å²	77.4	62%	0.622	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-138.4	-26.6	-167.3	-69.2	-175.7	-179.9	176.2	0	112.3	S249 K272 M273	S249-K251 PolarHBondContact O-N 2.9Å; K251-K272 CarbonylContact O-C 3.52Å; K251-K272 WeakPolarHBondContact O-CA 3.45Å; K251-M273 PolarHBondContact O-N 3.37Å
252	F	38.2	Very low	40	Very low	60 Å²	60	81.9 Å²	81.9	26%	0.263	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	143.1	177.9	-62.1	-85.5	0	0	0	113.4	V270 Y271 K272	F252-V270 HydrophobicContact CB-CG1 3.86Å; F252-V270 HydrophobicContact CD1-CG1 3.67Å; F252-V270 HydrophobicContact CG-CG1 4.17Å; F252-Y271 CarbonylContact C-O 3.56Å; F252-Y271 WeakPolarHBondContact CA-O 2.99Å; F252-Y271 WeakPolarHBondContact CD1-O 2.95Å; F252-K272 HydrophobicContact CD1-CB 3.88Å; F252-K272 HydrophobicContact CD1-CG 4.15Å; F252-K272 HydrophobicContact CE1-CB 3.51Å; F252-K272 HydrophobicContact CE1-CD 4.01Å; F252-K272 HydrophobicContact CE1-CG 3.5Å; F252-K272 HydrophobicContact CZ-CB 4.36Å; F252-K272 HydrophobicContact CZ-CD 4.12Å; F252-K272 HydrophobicContact CZ-CG 3.83Å
253	I	43.1	Very low	39.7	Very low	27 Å²	27	78.9 Å²	78.9	14%	0.138	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	122.6	170.9	-56.3	175.5	0	0	0	107.7	W227 L245 F255 V270 Y271 M273	W227-I253 HydrophobicContact CZ3-CD1 4.46Å; L245-I253 HydrophobicContact CD1-CG2 3.92Å; I253-F255 HydrophobicContact CB-CE2 4.28Å; I253-F255 HydrophobicContact CG2-CD2 4Å; I253-F255 HydrophobicContact CG2-CE2 3.44Å; I253-F255 VanDerWaalsContact CG2-CE2 3.44Å; I253-F255 HydrophobicContact CG2-CZ 3.76Å; I253-V270 VanDerWaalsContact O-CA 3.31Å; I253-V270 WeakPolarHBondContact O-CA 3.44Å; I253-Y271 PolarHBondContact N-O 3.44Å; I253-Y271 PolarHBondContact O-N 3.4Å; I253-M273 HydrophobicContact CD1-SD 4.17Å
254	L	41.3	Very low	39.6	Very low	14 Å²	14	79.2 Å²	79.2	7%	0.073	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.7	174.3	177.5	69.2	0	0	0	109	L246 Y268 V270 I446	L246-L254 HydrophobicContact CB-CB 4.32Å; L246-L254 HydrophobicContact CD1-CD2 3.59Å; L246-L254 HydrophobicContact CD1-CG 4.12Å; L246-L254 PolarHBondContact N-O 3.47Å; L254-Y268 HydrophobicContact CD1-CD1 3.95Å; L254-Y268 HydrophobicContact CD1-CG 4.41Å; L254-V270 HydrophobicContact CB-CG2 4.05Å; L254-V270 HydrophobicContact CD1-CG2 3.18Å; L254-V270 HydrophobicContact CG-CG2 4.17Å; L254-I446 HydrophobicContact CD2-CD1 4.17Å
255	F	43	Very low	39.4	Very low	36 Å²	36	78.4 Å²	78.4	16%	0.158	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	131.2	170.1	-68.1	-89.2	0	0	0	110	M243 L245 I253 T269 Y271	M243-F255 HydrophobicContact SD-CD1 4.06Å; L245-F255 HydrophobicContact CD1-CE1 4.04Å; L245-F255 HydrophobicContact CD1-CZ 4.34Å; I253-F255 HydrophobicContact CB-CE2 4.28Å; I253-F255 HydrophobicContact CG2-CD2 4Å; I253-F255 HydrophobicContact CG2-CE2 3.44Å; I253-F255 VanDerWaalsContact CG2-CE2 3.44Å; I253-F255 HydrophobicContact CG2-CZ 3.76Å; F255-T269 PolarHBondContact N-O 2.92Å; F255-T269 VanDerWaalsContact N-O 3.07Å; F255-Y271 AromaticContact CD2-CD2 3.66Å; F255-Y271 HydrophobicContact CD2-CD2 3.66Å; F255-Y271 AromaticContact CD2-CE2 3.47Å; F255-Y271 HydrophobicContact CD2-CE2 3.47Å; F255-Y271 VanDerWaalsContact CD2-CE2 3.47Å; F255-Y271 AromaticContact CE2-CD2 3.49Å; F255-Y271 HydrophobicContact CE2-CD2 3.49Å; F255-Y271 VanDerWaalsContact CE2-CD2 3.49Å; F255-Y271 AromaticContact CE2-CE2 3.42Å; F255-Y271 HydrophobicContact CE2-CE2 3.42Å; F255-Y271 VanDerWaalsContact CE2-CE2 3.42Å
256	D	40.8	Very low	39.3	Very low	7 Å²	7	76.2 Å²	76.2	4%	0.037	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	117.3	167.3	-165.1	-8.9	0	0	0	109.3	I258 V266	D256-I258 WeakPolarHBondContact OD1-CG1 3.26Å; D256-V266 WeakPolarHBondContact OD1-CG1 3.35Å
257	L	40.9	Very low	38.9	Very low	78 Å²	78	77.3 Å²	77.3	41%	0.408	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	91.5	170.3	-71.1	166.4	0	0	0	108.4	M243 S259 C267	M243-L257 HydrophobicContact CG-CD2 4.4Å; L257-S259 PolarHBondContact O-N 3.37Å; L257-C267 HydrophobicContact CB-CB 4.19Å; L257-C267 HydrophobicContact CD1-CB 4.04Å; L257-C267 PolarHBondContact N-O 3.35Å
258	I	39.4	Very low	38.8	Very low	77 Å²	77	71.1 Å²	71.1	40%	0.395	36%	0.364	S	S	.	.			trans	-78.2	121.1	175.2	-56.4	176.1	0	0	0	109.2	D256	D256-I258 WeakPolarHBondContact OD1-CG1 3.26Å
259	S	35.3	Very low	38.7	Very low	39 Å²	39	70 Å²	70	27%	0.273	36%	0.361	S	S	.	.			trans	-63.7	138.9	173.1	-174.9	0	0	0	0	111.6	L257 D261 R262 S263	L257-S259 PolarHBondContact O-N 3.37Å; S259-D261 VanDerWaalsContact CB-OD1 3.25Å; S259-D261 WeakPolarHBondContact CB-OD1 3.07Å; S259-D261 PolarHBondContact O-N 2.88Å; S259-D261 PolarHBondContact OG-OD1 3.08Å; S259-R262 PolarHBondContact O-N 3.04Å; S259-S263 PolarHBondContact OG-OG 3.03Å
260	R	34.8	Very low	38.6	Very low	233 Å²	233	68.3 Å²	68.3	88%	0.879	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-15.2	-176.4	-144.1	177.9	-173.1	177.2	2.6	113.7
261	D	36.9	Very low	38.7	Very low	108 Å²	108	68.2 Å²	68.2	58%	0.578	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	6.6	-176.1	65.8	-6.7	0	0	0	114.3	S259 S263	S259-D261 VanDerWaalsContact CB-OD1 3.25Å; S259-D261 WeakPolarHBondContact CB-OD1 3.07Å; S259-D261 PolarHBondContact O-N 2.88Å; S259-D261 PolarHBondContact OG-OD1 3.08Å; D261-S263 PolarHBondContact O-N 2.9Å; D261-S263 VanDerWaalsContact O-N 3.15Å; D261-S263 WeakPolarHBondContact OD1-CB 3.32Å; D261-S263 PolarHBondContact OD1-N 2.88Å; D261-S263 PolarHBondContact OD1-OG 2.83Å; D261-S263 PolarHBondContact OD2-OG 2.83Å
262	R	38.5	Very low	38.5	Very low	203 Å²	203	64.3 Å²	64.3	77%	0.766	31%	0.309	S	S	*	.			trans	56	22.6	-174.4	-53.5	-175.5	-174.2	178.5	2.1	113.7	S259	S259-R262 PolarHBondContact O-N 3.04Å
263	S	35.1	Very low	38.4	Very low	31 Å²	31	64.9 Å²	64.9	22%	0.217	31%	0.313	C	S	.	.			trans	-66.2	151.6	173	61.6	0	0	0	0	110.8	S259 D261 H265	S259-S263 PolarHBondContact OG-OG 3.03Å; D261-S263 PolarHBondContact O-N 2.9Å; D261-S263 VanDerWaalsContact O-N 3.15Å; D261-S263 WeakPolarHBondContact OD1-CB 3.32Å; D261-S263 PolarHBondContact OD1-N 2.88Å; D261-S263 PolarHBondContact OD1-OG 2.83Å; D261-S263 PolarHBondContact OD2-OG 2.83Å; S263-H265 PolarHBondContact O-N 3.43Å
264	P	35.9	Very low	38.3	Very low	76 Å²	76	66.2 Å²	66.2	49%	0.494	32%	0.322	S	S	.	.	S	Bend	trans	-71.8	4.8	-173.9	28.5	-34.6	0	0	0	114.8	V266 R390	P264-V266 PolarHBondContact O-N 2.97Å; P264-R390 PolarHBondContact O-NH2 3.15Å
265	H	36.8	Very low	38.3	Very low	91 Å²	91	71.9 Å²	71.9	42%	0.421	36%	0.363	S	S	.	.			trans	-84.4	98.1	178.7	-51.9	-78.5	0	0	0	108.8	S263	S263-H265 PolarHBondContact O-N 3.43Å
266	V	39.6	Very low	38	Very low	39 Å²	39	77.3 Å²	77.3	24%	0.236	39%	0.389	C	S	.	.			trans	-103.6	114.6	174.4	-171.9	0	0	0	0	107.8	D256 P264 Y268	D256-V266 WeakPolarHBondContact OD1-CG1 3.35Å; P264-V266 PolarHBondContact O-N 2.97Å; V266-Y268 HydrophobicContact CB-CE2 3.82Å; V266-Y268 HydrophobicContact CG1-CD1 4.18Å; V266-Y268 HydrophobicContact CG1-CD2 4.27Å; V266-Y268 HydrophobicContact CG1-CE1 3.56Å; V266-Y268 HydrophobicContact CG1-CE2 3.64Å; V266-Y268 VanDerWaalsContact CG1-OH 3.32Å; V266-Y268 WeakPolarHBondContact CG1-OH 3.29Å
267	C	36.2	Very low	37.7	Very low	47 Å²	47	86.4 Å²	86.4	32%	0.318	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	122.2	170.2	-78	0	0	0	0	108.5	L257	L257-C267 HydrophobicContact CB-CB 4.19Å; L257-C267 HydrophobicContact CD1-CB 4.04Å; L257-C267 PolarHBondContact N-O 3.35Å
268	Y	39	Very low	37.4	Very low	17 Å²	17	90 Å²	90	7%	0.067	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	139.7	169.2	-59.4	-76.6	0	0	0	109	L254 V266 W282 W382 L442	L254-Y268 HydrophobicContact CD1-CD1 3.95Å; L254-Y268 HydrophobicContact CD1-CG 4.41Å; V266-Y268 HydrophobicContact CB-CE2 3.82Å; V266-Y268 HydrophobicContact CG1-CD1 4.18Å; V266-Y268 HydrophobicContact CG1-CD2 4.27Å; V266-Y268 HydrophobicContact CG1-CE1 3.56Å; V266-Y268 HydrophobicContact CG1-CE2 3.64Å; V266-Y268 VanDerWaalsContact CG1-OH 3.32Å; V266-Y268 WeakPolarHBondContact CG1-OH 3.29Å; Y268-W282 WeakPolarHBondContact O-CZ3 3.33Å; Y268-W382 AromaticContact CD2-CH2 3.8Å; Y268-W382 HydrophobicContact CD2-CH2 3.8Å; Y268-W382 HydrophobicContact CD2-CZ3 4.08Å; Y268-W382 HydrophobicContact CE2-CH2 4.29Å; Y268-W382 HydrophobicContact CE2-CZ3 4.39Å; Y268-W382 HydrophobicContact CG-CH2 4.16Å; Y268-L442 HydrophobicContact CE1-CD2 4.07Å; Y268-L442 HydrophobicContact CE2-CD2 3.76Å; Y268-L442 WeakPolarHBondContact OH-CD2 3.31Å
269	T	37.7	Very low	37.1	Very low	17 Å²	17	90.7 Å²	90.7	10%	0.104	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	117.1	167	-50.8	0	0	0	0	106.2	F255 Y271	F255-T269 PolarHBondContact N-O 2.92Å; F255-T269 VanDerWaalsContact N-O 3.07Å; T269-Y271 HydrophobicContact CG2-CD2 4.09Å; T269-Y271 HydrophobicContact CG2-CE1 4.48Å; T269-Y271 HydrophobicContact CG2-CE2 3.37Å
270	V	39	Very low	37.1	Very low	18 Å²	18	93.5 Å²	93.5	11%	0.109	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	130.6	168.3	-177.8	0	0	0	0	109.7	F252 I253 L254 W282	F252-V270 HydrophobicContact CB-CG1 3.86Å; F252-V270 HydrophobicContact CD1-CG1 3.67Å; F252-V270 HydrophobicContact CG-CG1 4.17Å; I253-V270 VanDerWaalsContact O-CA 3.31Å; I253-V270 WeakPolarHBondContact O-CA 3.44Å; L254-V270 HydrophobicContact CB-CG2 4.05Å; L254-V270 HydrophobicContact CD1-CG2 3.18Å; L254-V270 HydrophobicContact CG-CG2 4.17Å; V270-W282 HydrophobicContact CB-CD2 4.4Å; V270-W282 HydrophobicContact CB-CH2 3.91Å; V270-W282 HydrophobicContact CB-CZ2 3.04Å; V270-W282 VanDerWaalsContact CB-NE1 3.33Å; V270-W282 HydrophobicContact CG1-CZ2 4.29Å; V270-W282 HydrophobicContact CG2-CH2 3.45Å; V270-W282 VanDerWaalsContact CG2-CH2 3.45Å; V270-W282 HydrophobicContact CG2-CZ2 2.99Å; V270-W282 VanDerWaalsContact N-CE2 3.33Å; V270-W282 PolarHBondContact O-NE1 3.25Å
271	Y	38.7	Very low	37	Very low	72 Å²	72	87.1 Å²	87.1	28%	0.282	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	133.1	170.9	-66.1	-90.6	0	0	0	108.3	F252 I253 F255 T269	F252-Y271 CarbonylContact C-O 3.56Å; F252-Y271 WeakPolarHBondContact CA-O 2.99Å; F252-Y271 WeakPolarHBondContact CD1-O 2.95Å; I253-Y271 PolarHBondContact N-O 3.44Å; I253-Y271 PolarHBondContact O-N 3.4Å; F255-Y271 AromaticContact CD2-CD2 3.66Å; F255-Y271 HydrophobicContact CD2-CD2 3.66Å; F255-Y271 AromaticContact CD2-CE2 3.47Å; F255-Y271 HydrophobicContact CD2-CE2 3.47Å; F255-Y271 VanDerWaalsContact CD2-CE2 3.47Å; F255-Y271 AromaticContact CE2-CD2 3.49Å; F255-Y271 HydrophobicContact CE2-CD2 3.49Å; F255-Y271 VanDerWaalsContact CE2-CD2 3.49Å; F255-Y271 AromaticContact CE2-CE2 3.42Å; F255-Y271 HydrophobicContact CE2-CE2 3.42Å; F255-Y271 VanDerWaalsContact CE2-CE2 3.42Å; T269-Y271 HydrophobicContact CG2-CD2 4.09Å; T269-Y271 HydrophobicContact CG2-CE1 4.48Å; T269-Y271 HydrophobicContact CG2-CE2 3.37Å
272	K	39.6	Very low	37	Very low	61 Å²	61	85.5 Å²	85.5	27%	0.265	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	123.2	163.6	-173.9	178	177.3	-171.1	0	108.2	K251 F252 T274 L280 L344	K251-K272 CarbonylContact O-C 3.52Å; K251-K272 WeakPolarHBondContact O-CA 3.45Å; F252-K272 HydrophobicContact CD1-CB 3.88Å; F252-K272 HydrophobicContact CD1-CG 4.15Å; F252-K272 HydrophobicContact CE1-CB 3.51Å; F252-K272 HydrophobicContact CE1-CD 4.01Å; F252-K272 HydrophobicContact CE1-CG 3.5Å; F252-K272 HydrophobicContact CZ-CB 4.36Å; F252-K272 HydrophobicContact CZ-CD 4.12Å; F252-K272 HydrophobicContact CZ-CG 3.83Å; K272-T274 HydrophobicContact CD-CG2 4.3Å; K272-T274 HydrophobicContact CG-CG2 4.37Å; K272-L280 HydrophobicContact CD-CD1 4.31Å; K272-L344 HydrophobicContact CD-CD1 3.81Å
273	M	35.7	Very low	36.7	Very low	71 Å²	71	78 Å²	78	35%	0.35	41%	0.412	S	S	.	.			trans	-88	109.1	168.3	-75.3	-167.6	63.2	0	0	109.2	F224 K251 I253	F224-M273 HydrophobicContact CD2-CE 3.72Å; F224-M273 HydrophobicContact CD2-SD 4.33Å; F224-M273 HydrophobicContact CE2-CE 3.4Å; F224-M273 VanDerWaalsContact CE2-CE 3.4Å; F224-M273 HydrophobicContact CE2-SD 3.46Å; F224-M273 WeakPolarHBondContact CE2-SD 3.13Å; F224-M273 HydrophobicContact CZ-CE 3.99Å; F224-M273 HydrophobicContact CZ-SD 3.91Å; K251-M273 PolarHBondContact O-N 3.37Å; I253-M273 HydrophobicContact CD1-SD 4.17Å
274	T	40.5	Very low	36.8	Very low	55 Å²	55	79.3 Å²	79.3	34%	0.337	42%	0.416	S	S	.	.			trans	-93.2	151.7	163.1	43.3	0	0	0	0	109.2	K272 E276	K272-T274 HydrophobicContact CD-CG2 4.3Å; K272-T274 HydrophobicContact CG-CG2 4.37Å; T274-E276 PolarHBondContact O-N 3.14Å; T274-E276 VanDerWaalsContact O-N 3.1Å; T274-E276 PolarHBondContact OG1-O 3.37Å
275	S	42.2	Very low	36.7	Very low	134 Å²	134	80.4 Å²	80.4	94%	0.937	41%	0.413	S	S	*	.	S	Bend	trans	-68	1.6	170.4	54.4	0	0	0	0	113.3
276	E	36.1	Very low	36.4	Very low	150 Å²	150	79.3 Å²	79.3	70%	0.701	42%	0.415	S	S	*	.	S	Bend	trans	-119.3	138.8	177.3	-65.7	176.7	171.9	0	0	107.4	T274 E278	T274-E276 PolarHBondContact O-N 3.14Å; T274-E276 VanDerWaalsContact O-N 3.1Å; T274-E276 PolarHBondContact OG1-O 3.37Å; E276-E278 PolarHBondContact O-N 3.5Å
277	E	34.6	Very low	36.1	Very low	198 Å²	198	81.9 Å²	81.9	93%	0.925	44%	0.435	S	S	*	.	S	Bend	trans	-65.7	28.9	-160.7	-59.6	-175.9	151	0	0	117.1	P279	E277-P279 VanDerWaalsContact O-CD 3.31Å; E277-P279 WeakPolarHBondContact O-CD 3.46Å
278	E	33.4	Very low	36.1	Very low	154 Å²	154	85.9 Å²	85.9	72%	0.72	45%	0.454	S	S	*	.			trans	-105.7	106.8	-179.6	-68.4	-158.6	162.3	0	0	113.4	E276 L280	E276-E278 PolarHBondContact O-N 3.5Å; E278-L280 PolarHBondContact O-N 3.04Å
279	P	34.6	Very low	36	Very low	91 Å²	91	91.4 Å²	91.4	59%	0.591	48%	0.484	S	S	*	.			trans	-74.1	106.4	170.3	28.4	-31	0	0	0	110.3	E277 H281	E277-P279 VanDerWaalsContact O-CD 3.31Å; E277-P279 WeakPolarHBondContact O-CD 3.46Å; P279-H281 PolarHBondContact O-N 3.5Å
280	L	34.1	Very low	36	Very low	98 Å²	98	97.4 Å²	97.4	51%	0.513	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	107.2	165	-82.8	158.5	0	0	0	109.1	K272 E278	K272-L280 HydrophobicContact CD-CD1 4.31Å; E278-L280 PolarHBondContact O-N 3.04Å
281	H	33.2	Very low	35.9	Very low	98 Å²	98	102.9 Å²	102.9	45%	0.454	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	126.1	174.2	-177.9	-89.3	0	0	0	109.9	P279	P279-H281 PolarHBondContact O-N 3.5Å
282	W	35.9	Very low	35.8	Very low	75 Å²	75	107 Å²	107	28%	0.284	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.1	132.6	159.1	59.4	-99	0	0	0	110.3	Y268 V270 L284 W382	Y268-W282 WeakPolarHBondContact O-CZ3 3.33Å; V270-W282 HydrophobicContact CB-CD2 4.4Å; V270-W282 HydrophobicContact CB-CH2 3.91Å; V270-W282 HydrophobicContact CB-CZ2 3.04Å; V270-W282 VanDerWaalsContact CB-NE1 3.33Å; V270-W282 HydrophobicContact CG1-CZ2 4.29Å; V270-W282 HydrophobicContact CG2-CH2 3.45Å; V270-W282 VanDerWaalsContact CG2-CH2 3.45Å; V270-W282 HydrophobicContact CG2-CZ2 2.99Å; V270-W282 VanDerWaalsContact N-CE2 3.33Å; V270-W282 PolarHBondContact O-NE1 3.25Å; W282-L284 HydrophobicContact CE3-CB 4.41Å; W282-L284 HydrophobicContact CE3-CD1 4.12Å; W282-L284 HydrophobicContact CZ3-CB 4.32Å; W282-L284 HydrophobicContact CZ3-CD1 3.94Å; W282-W382 AromaticContact CH2-CZ2 3.86Å; W282-W382 HydrophobicContact CH2-CZ2 3.86Å
283	S	33.7	Very low	35.8	Very low	46 Å²	46	114 Å²	114	32%	0.322	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.7	116.1	165.6	57.9	0	0	0	0	107.2	F285	S283-F285 PolarHBondContact O-N 2.9Å; S283-F285 WeakPolarHBondContact OG-CE2 3.43Å
284	L	35.5	Very low	35.9	Very low	58 Å²	58	115.4 Å²	115.4	30%	0.304	62%	0.616	S	S	.	*			trans	-86.8	103.1	170.6	-104.8	146.2	0	0	0	107.6	W282 W382	W282-L284 HydrophobicContact CE3-CB 4.41Å; W282-L284 HydrophobicContact CE3-CD1 4.12Å; W282-L284 HydrophobicContact CZ3-CB 4.32Å; W282-L284 HydrophobicContact CZ3-CD1 3.94Å; L284-W382 HydrophobicContact CD1-CB 3.87Å; L284-W382 HydrophobicContact CD1-CD2 3.75Å; L284-W382 HydrophobicContact CD1-CE3 4.36Å; L284-W382 HydrophobicContact CD1-CG 3.5Å
285	F	34.1	Very low	35.7	Very low	99 Å²	99	119.1 Å²	119.1	43%	0.434	63%	0.634	S	S	.	*			trans	-89.3	132.9	167.8	-63.9	-74.1	0	0	0	108.2	Y45 S283 S287	Y45-F285 HydrophobicContact CD1-CZ 4.33Å; Y45-F285 HydrophobicContact CE1-CE2 4.3Å; Y45-F285 AromaticContact CE1-CZ 3.82Å; Y45-F285 HydrophobicContact CE1-CZ 3.82Å; S283-F285 PolarHBondContact O-N 2.9Å; S283-F285 WeakPolarHBondContact OG-CE2 3.43Å; F285-S287 PolarHBondContact O-N 2.92Å
286	S	31.6	Very low	35.5	Very low	67 Å²	67	119.9 Å²	119.9	47%	0.469	63%	0.627	S	S	.	*			trans	-72.8	112.4	165.2	62.7	0	0	0	0	107.8	D288	S286-D288 PolarHBondContact O-N 2.93Å
287	S	33.7	Very low	35.4	Very low	93 Å²	93	119.2 Å²	119.2	65%	0.65	63%	0.628	S	S	*	*			trans	-76.6	110	169.3	51.4	0	0	0	0	109.1	F285 D289	F285-S287 PolarHBondContact O-N 2.92Å; S287-D289 PolarHBondContact O-N 2.85Å
288	D	34.8	Very low	35.4	Very low	132 Å²	132	112.7 Å²	112.7	71%	0.706	61%	0.614	S	S	*	*			trans	-78.6	102	157.7	-74.5	-28.1	0	0	0	107.1	S286 E290	S286-D288 PolarHBondContact O-N 2.93Å; D288-E290 PolarHBondContact O-N 2.84Å
289	D	37	Very low	35.7	Very low	133 Å²	133	114.9 Å²	114.9	71%	0.711	63%	0.625	S	S	*	*			trans	-74.8	100.8	166.5	-71.1	-42.2	0	0	0	108.2	S287	S287-D289 PolarHBondContact O-N 2.85Å
290	E	37.9	Very low	35.5	Very low	143 Å²	143	119.8 Å²	119.8	67%	0.668	64%	0.64	S	S	*	*			trans	-83.3	106.2	160.9	-75	-166.5	152.5	0	0	108.7	D288 D292	D288-E290 PolarHBondContact O-N 2.84Å; E290-D292 PolarHBondContact O-N 3.19Å; E290-D292 VanDerWaalsContact O-N 3.09Å
291	D	36.9	Very low	35.6	Very low	133 Å²	133	124.2 Å²	124.2	71%	0.711	66%	0.658	S	S	*	*			trans	-66.9	100.1	167.3	-73.9	-42.8	0	0	0	110	Y293	D291-Y293 HydrophobicContact CB-CD2 4.22Å; D291-Y293 HydrophobicContact CB-CE2 4.09Å; D291-Y293 PolarHBondContact O-N 3.42Å
292	D	37.5	Very low	35.5	Very low	159 Å²	159	124 Å²	124	85%	0.85	67%	0.667	S	S	*	*			trans	-68.7	91	167.6	-91.7	-33.3	0	0	0	110.4	E290 A294	E290-D292 PolarHBondContact O-N 3.19Å; E290-D292 VanDerWaalsContact O-N 3.09Å; D292-A294 PolarHBondContact O-N 3.14Å
293	Y	39.1	Very low	35.5	Very low	206 Å²	206	127.4 Å²	127.4	81%	0.808	69%	0.69	S	S	*	*			trans	-81.2	98.7	161.5	-78.5	-79.6	0	0	0	109.8	D291 N295	D291-Y293 HydrophobicContact CB-CD2 4.22Å; D291-Y293 HydrophobicContact CB-CE2 4.09Å; D291-Y293 PolarHBondContact O-N 3.42Å; Y293-N295 PolarHBondContact O-N 2.6Å; Y293-N295 VanDerWaalsContact O-N 3.16Å
294	A	38.1	Very low	35.5	Very low	102 Å²	102	131.7 Å²	131.7	84%	0.843	71%	0.705	S	S	*	*			trans	-62.1	110.4	164.5	0	0	0	0	0	109.9	D292	D292-A294 PolarHBondContact O-N 3.14Å
295	N	35.4	Very low	35.4	Very low	133 Å²	133	136.8 Å²	136.8	71%	0.711	73%	0.725	S	S	*	*			trans	-91.6	95.3	172.4	-163.9	17.5	0	0	0	108.7	Y293 N297	Y293-N295 PolarHBondContact O-N 2.6Å; Y293-N295 VanDerWaalsContact O-N 3.16Å; N295-N297 PolarHBondContact ND2-ND2 2.63Å
296	D	37.7	Very low	35.3	Very low	149 Å²	149	138.3 Å²	138.3	80%	0.797	74%	0.743	S	S	*	*			trans	-82.1	110	169.8	-171.8	17	0	0	0	109
297	N	34.7	Very low	35.3	Very low	136 Å²	136	138.1 Å²	138.1	73%	0.727	75%	0.751	S	S	*	*			trans	-111.1	108.2	169.6	-71.9	-62.6	0	0	0	107.6	N295	N295-N297 PolarHBondContact ND2-ND2 2.63Å
298	G	35	Very low	35.3	Very low	61 Å²	61	141.1 Å²	141.1	63%	0.629	76%	0.76	S	S	*	*			trans	-153.3	86.5	178	0	0	0	0	0	112.2
299	E	38.4	Very low	35	Very low	201 Å²	201	140.2 Å²	140.2	94%	0.939	76%	0.76	S	S	*	*			trans	73.3	125	143.3	-57.1	-179.4	177	0	0	120.6
300	E	30.3	Very low	34.9	Very low	194 Å²	194	141.2 Å²	141.2	91%	0.907	77%	0.765	S	S	*	*			trans	-65.4	140.7	171.1	-64.3	172.7	135.9	0	0	112
301	E	36.2	Very low	34.3	Very low	191 Å²	191	140.5 Å²	140.5	89%	0.893	77%	0.77	S	S	*	*				-169.2	134.8	120.7	-109	179.3	173.6	0	0	113
302	S	32.1	Very low	34	Very low	93 Å²	93	139.1 Å²	139.1	65%	0.65	77%	0.771	S	S	*	*			trans	-29.7	146.5	169.9	54.7	0	0	0	0	119.4
303	L	35.5	Very low	33.6	Very low	146 Å²	146	137 Å²	137	76%	0.764	77%	0.768	S	S	*	*				174.2	127.5	83.7	-131.1	119	0	0	0	113
304	E	33.7	Very low	33.3	Very low	137 Å²	137	133.2 Å²	133.2	64%	0.64	77%	0.767	S	S	*	*			trans	39.8	130.3	146.4	-60.7	-160.3	121.7	0	0	126
305	K	33.7	Very low	32.9	Very low	164 Å²	164	137.2 Å²	137.2	71%	0.713	77%	0.768	S	S	*	*				64.7	139.8	129.1	-76.6	177.2	177.9	140.2	0	118.3
306	T	32	Very low	32.4	Very low	132 Å²	132	136.4 Å²	136.4	81%	0.81	77%	0.768	S	S	*	*			cis	-172.2	140.6	21.1	27	0	0	0	0	104
307	G	30.7	Very low	31.9	Very low	63 Å²	63	136.7 Å²	136.7	65%	0.649	77%	0.768	S	S	*	*				129.6	136.8	74.6	0	0	0	0	0	110.1
308	D	33.9	Very low	31.5	Very low	155 Å²	155	135 Å²	135	83%	0.829	77%	0.768	S	S	*	*			trans	84.9	94.2	147.7	-50.8	-18.3	0	0	0	122
309	T	29.7	Very low	31.1	Very low	114 Å²	114	138.4 Å²	138.4	70%	0.699	78%	0.775	S	S	*	*				20.1	129.9	121.8	49.8	0	0	0	0	120.5
310	N	33.4	Very low	30.7	Very low	153 Å²	153	133.5 Å²	133.5	82%	0.818	76%	0.763	S	S	*	*				-178	136.9	104.4	-94.5	-26	0	0	0	114.4
311	T	27.3	Very low	30.7	Very low	128 Å²	128	129.7 Å²	129.7	79%	0.785	76%	0.758	S	S	*	*			trans	-68.1	149.6	164.9	48.4	0	0	0	0	112.4
312	S	29	Very low	30.7	Very low	104 Å²	104	125.4 Å²	125.4	73%	0.727	75%	0.747	S	S	*	*				164.7	145.3	115.9	78.8	0	0	0	0	114.2
313	S	29.9	Very low	30.6	Very low	114 Å²	114	128.2 Å²	128.2	80%	0.797	76%	0.755	S	S	*	*			trans	89.3	133.4	136.2	-46.3	0	0	0	0	122.8
314	V	31.9	Very low	30.4	Very low	128 Å²	128	127.9 Å²	127.9	78%	0.776	75%	0.754	S	S	*	*			trans	-78.9	153.2	177.9	171.8	0	0	0	0	112.6
315	E	31.3	Very low	30.2	Very low	186 Å²	186	124.8 Å²	124.8	87%	0.869	75%	0.747	S	S	*	*			trans	177.3	118.8	144.2	-100	171.5	-175	0	0	109.6
316	V	24.9	Very low	30.1	Very low	116 Å²	116	125.4 Å²	125.4	70%	0.703	75%	0.753	S	S	*	*				84.2	107.5	72.6	178.4	0	0	0	0	116
317	L	25.8	Very low	30	Very low	154 Å²	154	123.8 Å²	123.8	81%	0.806	75%	0.747	S	S	*	*			trans	58	123.4	140	-61.5	174.5	0	0	0	125.5
318	S	27.5	Very low	30.2	Very low	102 Å²	102	128.5 Å²	128.5	71%	0.713	76%	0.757	S	S	*	*				99.7	143.3	117.4	73.9	0	0	0	0	125
319	V	26.4	Very low	29.9	Very low	131 Å²	131	126.5 Å²	126.5	79%	0.794	76%	0.755	S	S	*	*			trans	73.4	140.5	156.5	-133.1	0	0	0	0	117.9
320	S	30.5	Very low	29.8	Very low	98 Å²	98	126.6 Å²	126.6	69%	0.685	76%	0.757	S	S	*	*			cis	-170.4	140.3	19.1	-14.2	0	0	0	0	112.5
321	S	29.8	Very low	29.7	Very low	114 Å²	114	125.8 Å²	125.8	80%	0.797	76%	0.758	S	S	*	*			trans	17.9	173.9	136.9	-59.7	0	0	0	0	124.8
322	P	36.7	Very low	29.8	Very low	102 Å²	102	127.2 Å²	127.2	66%	0.662	76%	0.76	S	S	*	*			cis	-145.4	-171.2	-42.4	41.3	-22.5	0	0	0	115.6
323	N	29.6	Very low	29.5	Very low	151 Å²	151	129.1 Å²	129.1	81%	0.807	76%	0.762	S	S	*	*			trans	81.9	140.6	156.7	-68.1	-5.5	0	0	0	118.8
324	N	30	Very low	29.4	Very low	139 Å²	139	129 Å²	129	74%	0.743	76%	0.762	S	S	*	*			cis	-162.9	143.7	10.8	-159.6	11.8	0	0	0	111.4
325	S	31.2	Very low	29.2	Very low	73 Å²	73	133.3 Å²	133.3	51%	0.51	77%	0.77	S	S	.	*			trans	37.1	122.5	143.2	66.5	0	0	0	0	122.8
326	H	30.3	Very low	29.1	Very low	177 Å²	177	128.4 Å²	128.4	82%	0.819	76%	0.756	S	S	*	*				175.6	146.4	96.4	-103.2	-76.5	0	0	0	113.3
327	S	31	Very low	29.5	Very low	98 Å²	98	132.5 Å²	132.5	69%	0.685	77%	0.768	S	S	*	*	S	Bend	trans	75.3	99.9	159.8	56.7	0	0	0	0	120.7
328	D	35.4	Very low	29.9	Very low	162 Å²	162	133.1 Å²	133.1	87%	0.866	77%	0.766	S	S	*	*			trans	71.3	86.4	135.2	-51.8	-20.6	0	0	0	119
329	S	26.6	Very low	30.1	Very low	112 Å²	112	135 Å²	135	78%	0.783	77%	0.769	S	S	*	*			trans	-63.2	144	-177	-48.4	0	0	0	0	115.2
330	P	27.7	Very low	30.5	Very low	116 Å²	116	135.4 Å²	135.4	75%	0.753	77%	0.766	S	S	*	*			trans	-76.4	124	163.8	32.1	-28.1	0	0	0	108.5	L332	P330-L332 VanDerWaalsContact C-N 3.32Å; P330-L332 PolarHBondContact O-N 2.87Å
331	T	30.1	Very low	30.9	Very low	137 Å²	137	137 Å²	137	84%	0.84	76%	0.763	S	S	*	*			trans	-69.5	93.9	173.9	-43.3	0	0	0	0	109.3	N333	T331-N333 PolarHBondContact O-N 3.17Å
332	L	30.1	Very low	31.5	Very low	157 Å²	157	139.8 Å²	139.8	82%	0.822	76%	0.763	S	S	*	*			trans	-55.2	112.4	151.4	-124.3	145.4	0	0	0	107.5	P330	P330-L332 VanDerWaalsContact C-N 3.32Å; P330-L332 PolarHBondContact O-N 2.87Å
333	N	24	Very low	32.3	Very low	145 Å²	145	138.8 Å²	138.8	78%	0.775	75%	0.748	S	S	*	*			trans	-170.9	144.8	150.4	-101	-2.7	0	0	0	110.6	T331	T331-N333 PolarHBondContact O-N 3.17Å
334	S	26.7	Very low	33.5	Very low	112 Å²	112	135.9 Å²	135.9	78%	0.783	73%	0.733	S	S	*	*			trans	66.8	75.9	174	73.3	0	0	0	0	116.8	S336	S334-S336 PolarHBondContact O-N 3.36Å
335	F	28.3	Very low	35.6	Very low	218 Å²	218	134.5 Å²	134.5	96%	0.956	73%	0.731	S	S	*	*			trans	-67	120.2	138.6	-91	-90	0	0	0	106.7
336	S	28.7	Very low	38	Very low	82 Å²	82	132.6 Å²	132.6	57%	0.573	72%	0.715	S	S	*	*			trans	-63.4	138.4	-169.8	35	0	0	0	0	113.2	S334 E338	S334-S336 PolarHBondContact O-N 3.36Å; S336-E338 PolarHBondContact O-N 2.96Å
337	E	32.8	Very low	40.5	Very low	202 Å²	202	130.3 Å²	130.3	94%	0.944	71%	0.708	S	S	*	*	S	Bend	trans	-71.6	59	169.7	-61.2	171.3	154.5	0	0	111
338	E	34.2	Very low	43.2	Very low	167 Å²	167	128.6 Å²	128.6	78%	0.78	69%	0.689	S	S	*	*			trans	-123	19.6	-169	-76.4	-170.9	-178.8	0	0	116.3	S336	S336-E338 PolarHBondContact O-N 2.96Å
339	D	31.2	Very low	45.9	Very low	143 Å²	143	123.6 Å²	123.6	77%	0.765	67%	0.665	S	S	*	*			trans	-123.4	25.2	179.1	-142	12.1	0	0	0	114.9	Q341	D339-Q341 VanDerWaalsContact C-N 3.34Å; D339-Q341 PolarHBondContact O-N 3.05Å; D339-Q341 VanDerWaalsContact O-N 3.15Å
340	D	34.7	Very low	49.2	Very low	138 Å²	138	118.5 Å²	118.5	74%	0.738	63%	0.628	S	S	*	*			trans	-79.2	87.2	161.2	-78.2	-25	0	0	0	108.1	H342	D340-H342 VanDerWaalsContact C-N 3.3Å; D340-H342 PolarHBondContact O-N 3.38Å
341	Q	40.5	Very low	52.5	Low	133 Å²	133	113.9 Å²	113.9	62%	0.621	60%	0.597	S	S	*	*			trans	-53.3	99	163.1	-77.8	-178.4	-3.7	0	0	108.1	D339 F343	D339-Q341 VanDerWaalsContact C-N 3.34Å; D339-Q341 PolarHBondContact O-N 3.05Å; D339-Q341 VanDerWaalsContact O-N 3.15Å; Q341-F343 VanDerWaalsContact C-N 3.3Å; Q341-F343 HydrophobicContact CB-CE2 4.49Å; Q341-F343 HydrophobicContact CB-CZ 4.35Å; Q341-F343 VanDerWaalsContact O-CD2 3.28Å; Q341-F343 WeakPolarHBondContact O-CD2 3.44Å; Q341-F343 PolarHBondContact O-N 3.11Å
342	H	42.8	Very low	55.6	Low	172 Å²	172	107.4 Å²	107.4	80%	0.796	56%	0.557	S	S	*	*			trans	-62.9	85.5	-176.5	-75.4	-45.9	0	0	0	111	D340 L344	D340-H342 VanDerWaalsContact C-N 3.3Å; D340-H342 PolarHBondContact O-N 3.38Å; H342-L344 PolarHBondContact O-N 2.87Å
343	F	53.2	Low	58.8	Low	80 Å²	80	101 Å²	101	35%	0.351	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-60.4	124.3	166.9	-60.2	-66.4	0	0	0	108.4	Q341 P345 D377 V379	Q341-F343 VanDerWaalsContact C-N 3.3Å; Q341-F343 HydrophobicContact CB-CE2 4.49Å; Q341-F343 HydrophobicContact CB-CZ 4.35Å; Q341-F343 VanDerWaalsContact O-CD2 3.28Å; Q341-F343 WeakPolarHBondContact O-CD2 3.44Å; Q341-F343 PolarHBondContact O-N 3.11Å; F343-P345 VanDerWaalsContact O-CD 3.27Å; F343-P345 WeakPolarHBondContact O-CD 3.47Å; F343-D377 HydrophobicContact CB-CB 4.07Å; F343-V379 HydrophobicContact CD1-CB 4.04Å; F343-V379 HydrophobicContact CD1-CG2 3.37Å; F343-V379 HydrophobicContact CE1-CB 4.23Å; F343-V379 HydrophobicContact CE1-CG1 4.27Å; F343-V379 HydrophobicContact CE1-CG2 3.62Å; F343-V379 HydrophobicContact CG-CG2 4.36Å
344	L	54.5	Low	62.2	Low	91 Å²	91	94.2 Å²	94.2	48%	0.476	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-64.3	117.1	-179.3	-68.8	171.8	0	0	0	109.2	K272 H342	K272-L344 HydrophobicContact CD-CD1 3.81Å; H342-L344 PolarHBondContact O-N 2.87Å
345	P	74.1	Confident	65.5	Low	109 Å²	109	88.9 Å²	88.9	71%	0.708	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	144.2	179.4	28.6	-34	0	0	0	110.2	F343	F343-P345 VanDerWaalsContact O-CD 3.27Å; F343-P345 WeakPolarHBondContact O-CD 3.47Å
346	L	80.6	Confident	68.5	Low	34 Å²	34	81.4 Å²	81.4	18%	0.178	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	155.9	170.4	-59.9	178.3	0	0	0	110.3	H348 I375 D376 L449	L346-H348 WeakPolarHBondContact CB-O 3.49Å; L346-H348 PolarHBondContact O-N 2.91Å; L346-I375 HydrophobicContact CD1-CG2 3.71Å; L346-D376 WeakPolarHBondContact CB-O 3.44Å; L346-D376 WeakPolarHBondContact CG-O 3.48Å; L346-D376 PolarHBondContact N-O 2.92Å; L346-L449 HydrophobicContact CD1-CB 4.3Å; L346-L449 HydrophobicContact CD1-CD2 4.24Å; L346-L449 HydrophobicContact CD1-CG 4.13Å
347	L	82.8	Confident	71.4	Confident	128 Å²	128	78.9 Å²	78.9	67%	0.67	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60	-34.6	178.7	179.3	64.2	0	0	0	112.7
348	H	87.8	Confident	73.8	Confident	63 Å²	63	71.8 Å²	71.8	29%	0.292	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	147.5	176	-58.7	89.3	0	0	0	108.5	L346 W350 K404	L346-H348 WeakPolarHBondContact CB-O 3.49Å; L346-H348 PolarHBondContact O-N 2.91Å; H348-W350 HydrophobicContact CB-CZ2 4.2Å; H348-W350 PolarHBondContact O-NE1 3.41Å; H348-K404 HydrophobicContact CB-CG 4.49Å
349	T	93.3	Very high	75.4	Confident	57 Å²	57	70.7 Å²	70.7	35%	0.35	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	131.9	163.6	-50.6	0	0	0	0	109	M374 D376 A405	T349-M374 HydrophobicContact CG2-CG 3.39Å; T349-M374 HydrophobicContact CG2-SD 3.72Å; T349-D376 HydrophobicContact CG2-CB 4.18Å; T349-A405 HydrophobicContact CG2-CB 3.92Å; T349-A405 WeakPolarHBondContact O-CB 3.28Å; T349-A405 PolarHBondContact O-N 2.95Å
350	W	95	Very high	77.4	Confident	5 Å²	5	72.3 Å²	72.3	2%	0.019	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	157.4	178.8	-58.1	85.6	0	0	0	110.6	H348 M374 I375 I402 F403 K404 V448 L449	H348-W350 HydrophobicContact CB-CZ2 4.2Å; H348-W350 PolarHBondContact O-NE1 3.41Å; W350-M374 CarbonylContact O-C 3.53Å; W350-M374 WeakPolarHBondContact O-CA 2.88Å; W350-I375 HydrophobicContact CB-CB 4.32Å; W350-I375 PolarHBondContact N-O 3.12Å; W350-I375 PolarHBondContact O-N 3.34Å; W350-I402 HydrophobicContact CB-CG2 3.79Å; W350-I402 HydrophobicContact CD2-CG2 4.26Å; W350-I402 HydrophobicContact CE3-CG2 3.97Å; W350-I402 HydrophobicContact CG-CG2 4.21Å; W350-F403 CarbonylContact C-O 3.53Å; W350-F403 VanDerWaalsContact CA-O 3.25Å; W350-F403 WeakPolarHBondContact CA-O 3.39Å; W350-K404 HydrophobicContact CE3-CG 4.13Å; W350-K404 HydrophobicContact CH2-CG 3.75Å; W350-K404 HydrophobicContact CZ2-CG 4.26Å; W350-K404 HydrophobicContact CZ3-CG 3.69Å; W350-V448 HydrophobicContact CH2-CG1 3.31Å; W350-V448 HydrophobicContact CZ2-CG1 3.52Å; W350-V448 HydrophobicContact CZ3-CG1 4.01Å; W350-L449 HydrophobicContact CD2-CD1 4.03Å; W350-L449 HydrophobicContact CG-CD1 4.12Å; W350-L449 HydrophobicContact CG-CG 4.33Å
351	I	96.5	Very high	78.9	Confident	18 Å²	18	66.7 Å²	66.7	9%	0.092	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	125.9	171.3	-61.6	172.5	0	0	0	107.4	W353 R371 T373 I402 F403 A405	I351-W353 HydrophobicContact CB-CZ2 4.34Å; I351-W353 HydrophobicContact CD1-CZ2 4.23Å; I351-W353 HydrophobicContact CG2-CD2 4.07Å; I351-W353 VanDerWaalsContact CG2-CE2 3.49Å; I351-W353 HydrophobicContact CG2-CG 4.3Å; I351-W353 HydrophobicContact CG2-CZ2 3.86Å; I351-W353 PolarHBondContact O-NE1 2.92Å; I351-R371 HydrophobicContact CG2-CB 4.28Å; I351-R371 HydrophobicContact CG2-CG 3.95Å; I351-T373 CarbonylContact C-O 3.6Å; I351-T373 WeakPolarHBondContact CA-O 3.48Å; I351-T373 WeakPolarHBondContact CG2-O 3.34Å; I351-I402 WeakPolarHBondContact O-CA 3.26Å; I351-F403 PolarHBondContact N-O 2.86Å; I351-F403 PolarHBondContact O-N 3.39Å; I351-A405 HydrophobicContact CD1-CB 4.1Å; I351-A405 HydrophobicContact CG1-CB 4.12Å
352	W	96.5	Very high	80.3	Confident	2 Å²	2	72.5 Å²	72.5	1%	0.008	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	123.5	169.8	-163.1	-35	0	0	0	108.6	V372 T373 I375 F384 Y385 L388 Y400 F401 I402 W441	W352-V372 HydrophobicContact CB-CB 4.32Å; W352-V372 HydrophobicContact CG-CB 4.47Å; W352-V372 WeakPolarHBondContact O-CA 3.32Å; W352-V372 WeakPolarHBondContact O-CB 3.25Å; W352-V372 PolarHBondContact O-N 3.48Å; W352-T373 HydrophobicContact CB-CG2 3.85Å; W352-T373 PolarHBondContact N-O 3.4Å; W352-T373 PolarHBondContact O-N 3.3Å; W352-I375 HydrophobicContact CB-CD1 4.24Å; W352-I375 HydrophobicContact CE3-CD1 4Å; W352-F384 HydrophobicContact CE3-CB 4.3Å; W352-F384 HydrophobicContact CZ3-CB 4.29Å; W352-Y385 HydrophobicContact CH2-CD2 4.09Å; W352-L388 HydrophobicContact CD2-CD1 3.83Å; W352-L388 HydrophobicContact CE3-CD1 3.87Å; W352-L388 HydrophobicContact CH2-CD1 3.69Å; W352-L388 HydrophobicContact CZ2-CD1 3.61Å; W352-L388 HydrophobicContact CZ3-CD1 3.82Å; W352-Y400 HydrophobicContact CZ2-CD2 4.07Å; W352-Y400 HydrophobicContact CZ2-CE2 4.09Å; W352-Y400 HydrophobicContact CZ2-CG 4.43Å; W352-Y400 AromaticContact NE1-CD1 3.25Å; W352-Y400 AromaticContact NE1-CD2 3.92Å; W352-Y400 AromaticContact NE1-CE1 3.66Å; W352-Y400 AromaticContact NE1-CG 3.41Å; W352-F401 CarbonylContact C-O 3.53Å; W352-F401 WeakPolarHBondContact CA-O 3.39Å; W352-I402 HydrophobicContact CB-CG1 4.19Å; W352-I402 HydrophobicContact CD2-CD1 3.98Å; W352-I402 HydrophobicContact CD2-CG1 4.03Å; W352-I402 HydrophobicContact CE3-CD1 4.09Å; W352-I402 HydrophobicContact CG-CD1 4.39Å; W352-I402 HydrophobicContact CG-CG1 3.89Å; W352-I402 HydrophobicContact CZ3-CD1 4.44Å; W352-W441 HydrophobicContact CZ2-CZ2 4.12Å
353	W	96.8	Very high	81.8	Confident	23 Å²	23	65.5 Å²	65.5	9%	0.087	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	149.3	176.7	-50.6	76.9	0	0	0	111.4	I351 L369 H370 R371 Y400 F401 T408 P409	I351-W353 HydrophobicContact CB-CZ2 4.34Å; I351-W353 HydrophobicContact CD1-CZ2 4.23Å; I351-W353 HydrophobicContact CG2-CD2 4.07Å; I351-W353 VanDerWaalsContact CG2-CE2 3.49Å; I351-W353 HydrophobicContact CG2-CG 4.3Å; I351-W353 HydrophobicContact CG2-CZ2 3.86Å; I351-W353 PolarHBondContact O-NE1 2.92Å; W353-L369 HydrophobicContact CB-CD1 3.94Å; W353-L369 HydrophobicContact CE3-CD1 4.31Å; W353-L369 HydrophobicContact CE3-CD2 3.92Å; W353-L369 HydrophobicContact CE3-CG 3.85Å; W353-L369 HydrophobicContact CZ3-CD2 4.19Å; W353-L369 HydrophobicContact CZ3-CG 4.42Å; W353-H370 CarbonylContact C-O 3.58Å; W353-H370 VanDerWaalsContact CA-O 3.26Å; W353-H370 WeakPolarHBondContact CA-O 3.43Å; W353-R371 HydrophobicContact CD2-CG 3.96Å; W353-R371 HydrophobicContact CE3-CB 4.41Å; W353-R371 HydrophobicContact CE3-CG 3.44Å; W353-R371 VanDerWaalsContact CE3-CG 3.44Å; W353-R371 HydrophobicContact CH2-CG 3.41Å; W353-R371 VanDerWaalsContact CH2-CG 3.41Å; W353-R371 HydrophobicContact CZ2-CG 3.91Å; W353-R371 HydrophobicContact CZ3-CB 4.47Å; W353-R371 HydrophobicContact CZ3-CG 3.16Å; W353-Y400 WeakPolarHBondContact O-CA 3.29Å; W353-F401 HydrophobicContact CB-CB 4.09Å; W353-F401 HydrophobicContact CB-CD2 4.37Å; W353-F401 PolarHBondContact N-O 2.78Å; W353-F401 PolarHBondContact O-N 2.99Å; W353-T408 HydrophobicContact CH2-CG2 4.01Å; W353-T408 HydrophobicContact CZ2-CG2 4.22Å; W353-P409 HydrophobicContact CB-CG 4.18Å; W353-P409 HydrophobicContact CD2-CG 3.91Å; W353-P409 HydrophobicContact CE3-CG 4.4Å; W353-P409 HydrophobicContact CG-CG 3.79Å
354	Y	95.7	Very high	83	Confident	1 Å²	1	65.5 Å²	65.5	0%	0.004	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	123.2	173.1	174.6	-122	0	0	0	109.3	L81 K356 H370 L394 A398 D399 Y400	L81-Y354 HydrophobicContact CD1-CD1 3.91Å; L81-Y354 HydrophobicContact CD1-CE1 4.47Å; L81-Y354 HydrophobicContact CD1-CG 4.01Å; L81-Y354 HydrophobicContact CD2-CD1 3.72Å; L81-Y354 HydrophobicContact CD2-CD2 3.59Å; L81-Y354 HydrophobicContact CD2-CE1 3.6Å; L81-Y354 HydrophobicContact CD2-CE2 3.45Å; L81-Y354 VanDerWaalsContact CD2-CE2 3.45Å; L81-Y354 HydrophobicContact CD2-CG 3.7Å; L81-Y354 VanDerWaalsContact CD2-CZ 3.47Å; L81-Y354 HydrophobicContact CG-CD1 4.02Å; L81-Y354 HydrophobicContact CG-CE1 4.07Å; L81-Y354 HydrophobicContact CG-CG 4.31Å; Y354-K356 HydrophobicContact CD1-CB 4.28Å; Y354-K356 HydrophobicContact CE1-CB 3.72Å; Y354-K356 HydrophobicContact CE1-CG 4.11Å; Y354-H370 PolarHBondContact N-O 3.13Å; Y354-H370 PolarHBondContact O-N 2.82Å; Y354-L394 HydrophobicContact CE2-CD2 4.36Å; Y354-A398 HydrophobicContact CE2-CB 3.91Å; Y354-D399 WeakPolarHBondContact CA-O 3.37Å; Y354-D399 WeakPolarHBondContact CD2-O 3.41Å; Y354-Y400 AromaticContact CD2-CD1 3.65Å; Y354-Y400 HydrophobicContact CD2-CD1 3.65Å; Y354-Y400 AromaticContact CD2-CE1 3.43Å; Y354-Y400 HydrophobicContact CD2-CE1 3.43Å; Y354-Y400 VanDerWaalsContact CD2-CE1 3.43Å; Y354-Y400 HydrophobicContact CE2-CE1 4.24Å; Y354-Y400 HydrophobicContact CG-CD1 4.3Å; Y354-Y400 AromaticContact CG-CE1 3.98Å; Y354-Y400 HydrophobicContact CG-CE1 3.98Å
355	H	94.8	Very high	84.5	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	116.1	166.4	-178.6	-97.4	0	0	0	108.9	W365 N368 L369 D399 F401	H355-W365 HydrophobicContact CB-CH2 4.45Å; H355-W365 HydrophobicContact CB-CZ2 3.79Å; H355-W365 AromaticContact CD2-CD1 3.89Å; H355-W365 AromaticContact CD2-CD2 3.71Å; H355-W365 AromaticContact CD2-CE2 3.19Å; H355-W365 AromaticContact CD2-CZ2 3.47Å; H355-W365 VanDerWaalsContact CD2-CZ2 3.47Å; H355-W365 WeakPolarHBondContact CD2-CZ2 3.11Å; H355-W365 AromaticContact CD2-NE1 3.32Å; H355-W365 PolarHBondContact CD2-NE1 2.8Å; H355-W365 VanDerWaalsContact CD2-NE1 3.32Å; H355-W365 AromaticContact CE1-CD1 3.52Å; H355-W365 AromaticContact CE1-CE2 3.89Å; H355-W365 AromaticContact CE1-NE1 3.16Å; H355-W365 PolarHBondContact CE1-NE1 3.26Å; H355-W365 AromaticContact CG-CE2 3.57Å; H355-W365 AromaticContact CG-CZ2 3.53Å; H355-W365 AromaticContact CG-NE1 3.59Å; H355-W365 AromaticContact ND1-CE2 3.97Å; H355-W365 AromaticContact ND1-NE1 3.48Å; H355-W365 PolarHBondContact ND1-NE1 2.8Å; H355-W365 AromaticContact NE2-CD1 3.23Å; H355-W365 AromaticContact NE2-CD2 3.79Å; H355-W365 AromaticContact NE2-CE2 3.44Å; H355-W365 AromaticContact NE2-CG 3.65Å; H355-W365 AromaticContact NE2-NE1 3.06Å; H355-W365 PolarHBondContact NE2-NE1 3.13Å; H355-W365 PolarHBondContact NE2-O 3.4Å; H355-N368 WeakPolarHBondContact CA-O 3.27Å; H355-N368 WeakPolarHBondContact NE2-CB 3.44Å; H355-L369 HydrophobicContact CB-CD1 4.25Å; H355-D399 HydrophobicContact CB-CB 3.96Å; H355-D399 PolarHBondContact N-O 2.74Å; H355-D399 IonicContact ND1-OD2 3.77Å; H355-D399 PolarHBondContact O-N 3.22Å; H355-F401 HydrophobicContact CB-CE2 4.18Å
356	K	92.1	Very high	85.1	Confident	61 Å²	61	59.2 Å²	59.2	27%	0.265	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-81.9	123.4	178.7	-176	176.4	-179	166.8	0	109.6	E80 Y354 N358 N368	E80-K356 VanDerWaalsContact CD-NZ 3.29Å; E80-K356 WeakPolarHBondContact OE1-CE 3.19Å; E80-K356 IonicContact OE1-NZ 2.75Å; E80-K356 PolarHBondContact OE1-NZ 3.25Å; E80-K356 IonicContact OE2-NZ 2.82Å; Y354-K356 HydrophobicContact CD1-CB 4.28Å; Y354-K356 HydrophobicContact CE1-CB 3.72Å; Y354-K356 HydrophobicContact CE1-CG 4.11Å; K356-N358 PolarHBondContact O-N 3.3Å; K356-N368 PolarHBondContact N-O 3.12Å; K356-N368 WeakPolarHBondContact O-CB 3.46Å
357	P	89.5	Confident	85.4	Confident	29 Å²	29	63.2 Å²	63.2	19%	0.188	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-65.1	129.1	172.4	25.2	-28.7	0	0	0	109.2	P395 I396 A398	P357-P395 HydrophobicContact CG-CB 4.04Å; P357-P395 HydrophobicContact CG-CG 3.76Å; P357-I396 WeakPolarHBondContact CB-O 3.12Å; P357-A398 HydrophobicContact CG-CB 4.18Å
358	N	83.2	Confident	85.8	Confident	54 Å²	54	58 Å²	58	29%	0.289	28%	0.28	S	S	.	.			trans	-136.7	103.9	-178.6	-172.4	-8.7	0	0	0	111.5	K356 Q360 S361 N368	K356-N358 PolarHBondContact O-N 3.3Å; N358-Q360 PolarHBondContact O-N 3.38Å; N358-Q360 PolarHBondContact OD1-N 3.09Å; N358-S361 PolarHBondContact O-N 3.18Å; N358-S361 PolarHBondContact OD1-N 3.28Å; N358-N368 PolarHBondContact ND2-OD1 2.94Å
359	R	68.3	Low	86	Confident	144 Å²	144	55.8 Å²	55.8	54%	0.543	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-19.5	179.5	-55.7	-169.3	171.9	-168.5	-15.1	114.2	E162 L165	E162-R359 IonicContact OE1-NH2 2.66Å; L165-R359 VanDerWaalsContact CD1-CD 3.43Å; L165-R359 HydrophobicContact CD1-CG 3.62Å; L165-R359 HydrophobicContact CD2-CB 3.85Å; L165-R359 HydrophobicContact CD2-CG 3.62Å; L165-R359 HydrophobicContact CG-CG 4.26Å
360	Q	71.6	Confident	86	Confident	176 Å²	176	56.6 Å²	56.6	82%	0.822	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	-5.4	-172.6	-64.6	169.4	7.7	0	0	112.3	N358 R362	N358-Q360 PolarHBondContact O-N 3.38Å; N358-Q360 PolarHBondContact OD1-N 3.09Å; Q360-R362 PolarHBondContact O-N 3.33Å
361	S	67.5	Low	86	Confident	20 Å²	20	65.1 Å²	65.1	14%	0.14	30%	0.302	C	S	.	.			trans	-73.6	108	-180	-177.8	0	0	0	0	109.7	N358 G363 N368	N358-S361 PolarHBondContact O-N 3.18Å; N358-S361 PolarHBondContact OD1-N 3.28Å; S361-G363 PolarHBondContact OG-N 3.14Å; S361-G363 PolarHBondContact OG-O 3.43Å; S361-N368 WeakPolarHBondContact CB-ND2 3.28Å; S361-N368 PolarHBondContact OG-ND2 3.45Å
362	R	70.3	Confident	85.8	Confident	255 Å²	255	65.1 Å²	65.1	96%	0.962	30%	0.303	S	S	*	.			trans	-84.1	-1.5	162.6	-65.1	-174.5	178	156.1	-0.3	112.8	Q360	Q360-R362 PolarHBondContact O-N 3.33Å
363	G	72.8	Confident	85.6	Confident	26 Å²	26	66 Å²	66	27%	0.268	31%	0.309	S	S	.	.	S	Bend	trans	-80	162.6	179.6	0	0	0	0	0	112.3	S361	S361-G363 PolarHBondContact OG-N 3.14Å; S361-G363 PolarHBondContact OG-O 3.43Å
364	P	80.1	Confident	85.5	Confident	79 Å²	79	70 Å²	70	51%	0.513	33%	0.329	S	S	.	.			trans	-56.6	142.5	176.3	23.9	-34.1	0	0	0	111.5	S366 E367	P364-S366 PolarHBondContact O-N 2.72Å; P364-E367 WeakPolarHBondContact CD-OE1 3.34Å; P364-E367 HydrophobicContact CG-CG 3.98Å; P364-E367 WeakPolarHBondContact O-CB 3.25Å; P364-E367 PolarHBondContact O-N 3.04Å
365	W	85.7	Confident	85.2	Confident	28 Å²	28	69.9 Å²	69.9	11%	0.106	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-41.9	-39.6	179	-179.6	92.5	0	0	0	113.6	Y171 H355 E367 N368 L369 F401	Y171-W365 HydrophobicContact CD1-CD2 4.07Å; Y171-W365 AromaticContact CD1-CE3 3.87Å; Y171-W365 HydrophobicContact CD1-CE3 3.87Å; Y171-W365 HydrophobicContact CD1-CH2 4.11Å; Y171-W365 HydrophobicContact CD1-CZ2 4.3Å; Y171-W365 AromaticContact CD1-CZ3 3.88Å; Y171-W365 HydrophobicContact CD1-CZ3 3.88Å; Y171-W365 HydrophobicContact CD2-CB 3.69Å; Y171-W365 AromaticContact CD2-CD1 3.98Å; Y171-W365 AromaticContact CD2-CD2 3.52Å; Y171-W365 HydrophobicContact CD2-CD2 3.52Å; Y171-W365 AromaticContact CD2-CE3 3.79Å; Y171-W365 HydrophobicContact CD2-CE3 3.79Å; Y171-W365 AromaticContact CD2-CG 3.44Å; Y171-W365 HydrophobicContact CD2-CG 3.44Å; Y171-W365 VanDerWaalsContact CD2-CG 3.44Å; Y171-W365 HydrophobicContact CE1-CD2 4.42Å; Y171-W365 AromaticContact CE1-CE3 3.82Å; Y171-W365 HydrophobicContact CE1-CE3 3.82Å; Y171-W365 HydrophobicContact CE1-CH2 4.48Å; Y171-W365 AromaticContact CE1-CZ3 3.85Å; Y171-W365 HydrophobicContact CE1-CZ3 3.85Å; Y171-W365 HydrophobicContact CE2-CB 3.91Å; Y171-W365 AromaticContact CE2-CD2 3.97Å; Y171-W365 HydrophobicContact CE2-CD2 3.97Å; Y171-W365 AromaticContact CE2-CE3 3.79Å; Y171-W365 HydrophobicContact CE2-CE3 3.79Å; Y171-W365 HydrophobicContact CE2-CG 4.02Å; Y171-W365 AromaticContact CG-CD2 3.55Å; Y171-W365 HydrophobicContact CG-CD2 3.55Å; Y171-W365 AromaticContact CG-CE2 3.76Å; Y171-W365 AromaticContact CG-CE3 3.81Å; Y171-W365 HydrophobicContact CG-CE3 3.81Å; Y171-W365 AromaticContact CG-CG 3.88Å; Y171-W365 HydrophobicContact CG-CG 3.88Å; Y171-W365 HydrophobicContact CG-CH2 4.44Å; Y171-W365 HydrophobicContact CG-CZ2 4.23Å; Y171-W365 HydrophobicContact CG-CZ3 4.24Å; Y171-W365 AromaticContact CZ-CE3 3.76Å; H355-W365 HydrophobicContact CB-CH2 4.45Å; H355-W365 HydrophobicContact CB-CZ2 3.79Å; H355-W365 AromaticContact CD2-CD1 3.89Å; H355-W365 AromaticContact CD2-CD2 3.71Å; H355-W365 AromaticContact CD2-CE2 3.19Å; H355-W365 AromaticContact CD2-CZ2 3.47Å; H355-W365 VanDerWaalsContact CD2-CZ2 3.47Å; H355-W365 WeakPolarHBondContact CD2-CZ2 3.11Å; H355-W365 AromaticContact CD2-NE1 3.32Å; H355-W365 PolarHBondContact CD2-NE1 2.8Å; H355-W365 VanDerWaalsContact CD2-NE1 3.32Å; H355-W365 AromaticContact CE1-CD1 3.52Å; H355-W365 AromaticContact CE1-CE2 3.89Å; H355-W365 AromaticContact CE1-NE1 3.16Å; H355-W365 PolarHBondContact CE1-NE1 3.26Å; H355-W365 AromaticContact CG-CE2 3.57Å; H355-W365 AromaticContact CG-CZ2 3.53Å; H355-W365 AromaticContact CG-NE1 3.59Å; H355-W365 AromaticContact ND1-CE2 3.97Å; H355-W365 AromaticContact ND1-NE1 3.48Å; H355-W365 PolarHBondContact ND1-NE1 2.8Å; H355-W365 AromaticContact NE2-CD1 3.23Å; H355-W365 AromaticContact NE2-CD2 3.79Å; H355-W365 AromaticContact NE2-CE2 3.44Å; H355-W365 AromaticContact NE2-CG 3.65Å; H355-W365 AromaticContact NE2-NE1 3.06Å; H355-W365 PolarHBondContact NE2-NE1 3.13Å; H355-W365 PolarHBondContact NE2-O 3.4Å; W365-E367 PolarHBondContact O-N 3.33Å; W365-E367 VanDerWaalsContact O-N 3.11Å; W365-N368 PolarHBondContact O-N 3.31Å; W365-N368 VanDerWaalsContact O-N 3.12Å; W365-L369 HydrophobicContact CH2-CB 4.5Å; W365-L369 HydrophobicContact CH2-CD1 3.84Å; W365-L369 HydrophobicContact CH2-CD2 4.3Å; W365-L369 HydrophobicContact CH2-CG 4.42Å; W365-L369 HydrophobicContact CZ3-CB 4.21Å; W365-L369 HydrophobicContact CZ3-CD1 4.24Å; W365-L369 HydrophobicContact CZ3-CD2 3.9Å; W365-L369 HydrophobicContact CZ3-CG 4.33Å; W365-F401 AromaticContact CH2-CE2 3.73Å; W365-F401 HydrophobicContact CH2-CE2 3.73Å; W365-F401 AromaticContact CH2-CZ 3.94Å; W365-F401 HydrophobicContact CH2-CZ 3.94Å; W365-F401 AromaticContact CZ2-CE2 3.84Å; W365-F401 HydrophobicContact CZ2-CE2 3.84Å; W365-F401 AromaticContact CZ2-CZ 3.94Å; W365-F401 HydrophobicContact CZ2-CZ 3.94Å
366	S	85.8	Confident	85	Confident	40 Å²	40	72.2 Å²	72.2	28%	0.28	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-63	-17.1	-179.5	64.6	0	0	0	0	116.1	P364 N368 L369 K410	P364-S366 PolarHBondContact O-N 2.72Å; S366-N368 VanDerWaalsContact C-N 3.32Å; S366-L369 PolarHBondContact O-N 3.05Å; S366-K410 VanDerWaalsContact CB-CE 3.49Å; S366-K410 VanDerWaalsContact CB-NZ 3.34Å
367	E	87.4	Confident	84.4	Confident	119 Å²	119	69.6 Å²	69.6	56%	0.556	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-71.3	-28.9	175.4	-76.1	176.5	-173.7	0	0	112.5	P364 W365 L369	P364-E367 WeakPolarHBondContact CD-OE1 3.34Å; P364-E367 HydrophobicContact CG-CG 3.98Å; P364-E367 WeakPolarHBondContact O-CB 3.25Å; P364-E367 PolarHBondContact O-N 3.04Å; W365-E367 PolarHBondContact O-N 3.33Å; W365-E367 VanDerWaalsContact O-N 3.11Å; E367-L369 VanDerWaalsContact C-N 3.31Å
368	N	90.4	Very high	83.8	Confident	18 Å²	18	70.4 Å²	70.4	10%	0.096	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-90.2	2	176.9	-62.3	-52.2	0	0	0	112.6	H355 K356 N358 S361 W365 S366 H370	H355-N368 WeakPolarHBondContact CA-O 3.27Å; H355-N368 WeakPolarHBondContact NE2-CB 3.44Å; K356-N368 PolarHBondContact N-O 3.12Å; K356-N368 WeakPolarHBondContact O-CB 3.46Å; N358-N368 PolarHBondContact ND2-OD1 2.94Å; S361-N368 WeakPolarHBondContact CB-ND2 3.28Å; S361-N368 PolarHBondContact OG-ND2 3.45Å; W365-N368 PolarHBondContact O-N 3.31Å; W365-N368 VanDerWaalsContact O-N 3.12Å; S366-N368 VanDerWaalsContact C-N 3.32Å; N368-H370 PolarHBondContact O-CD2 3.08Å; N368-H370 VanDerWaalsContact O-CD2 3.3Å; N368-H370 PolarHBondContact O-NE2 3.47Å
369	L	93.2	Very high	83.6	Confident	17 Å²	17	70.9 Å²	70.9	9%	0.089	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	115.2	176	-178.3	71.7	0	0	0	110.2	W353 H355 W365 S366 E367 F401 P409	W353-L369 HydrophobicContact CB-CD1 3.94Å; W353-L369 HydrophobicContact CE3-CD1 4.31Å; W353-L369 HydrophobicContact CE3-CD2 3.92Å; W353-L369 HydrophobicContact CE3-CG 3.85Å; W353-L369 HydrophobicContact CZ3-CD2 4.19Å; W353-L369 HydrophobicContact CZ3-CG 4.42Å; H355-L369 HydrophobicContact CB-CD1 4.25Å; W365-L369 HydrophobicContact CH2-CB 4.5Å; W365-L369 HydrophobicContact CH2-CD1 3.84Å; W365-L369 HydrophobicContact CH2-CD2 4.3Å; W365-L369 HydrophobicContact CH2-CG 4.42Å; W365-L369 HydrophobicContact CZ3-CB 4.21Å; W365-L369 HydrophobicContact CZ3-CD1 4.24Å; W365-L369 HydrophobicContact CZ3-CD2 3.9Å; W365-L369 HydrophobicContact CZ3-CG 4.33Å; S366-L369 PolarHBondContact O-N 3.05Å; E367-L369 VanDerWaalsContact C-N 3.31Å; L369-F401 HydrophobicContact CD1-CD2 4.07Å; L369-F401 HydrophobicContact CD1-CE2 4.2Å; L369-P409 HydrophobicContact CD1-CG 3.97Å; L369-P409 HydrophobicContact CD2-CG 3.65Å; L369-P409 HydrophobicContact CG-CG 4.38Å
370	H	93.4	Very high	84.2	Confident	74 Å²	74	64.3 Å²	64.3	34%	0.343	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	139.6	-176.7	-55.2	-61.4	0	0	0	111.7	W353 Y354 N368	W353-H370 CarbonylContact C-O 3.58Å; W353-H370 VanDerWaalsContact CA-O 3.26Å; W353-H370 WeakPolarHBondContact CA-O 3.43Å; Y354-H370 PolarHBondContact N-O 3.13Å; Y354-H370 PolarHBondContact O-N 2.82Å; N368-H370 PolarHBondContact O-CD2 3.08Å; N368-H370 VanDerWaalsContact O-CD2 3.3Å; N368-H370 PolarHBondContact O-NE2 3.47Å
371	R	94.4	Very high	84.8	Confident	183 Å²	183	56.4 Å²	56.4	69%	0.691	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.3	123.9	166.5	-66.7	-175.6	-66.4	-174.3	1.2	108.7	I351 W353	I351-R371 HydrophobicContact CG2-CB 4.28Å; I351-R371 HydrophobicContact CG2-CG 3.95Å; W353-R371 HydrophobicContact CD2-CG 3.96Å; W353-R371 HydrophobicContact CE3-CB 4.41Å; W353-R371 HydrophobicContact CE3-CG 3.44Å; W353-R371 VanDerWaalsContact CE3-CG 3.44Å; W353-R371 HydrophobicContact CH2-CG 3.41Å; W353-R371 VanDerWaalsContact CH2-CG 3.41Å; W353-R371 HydrophobicContact CZ2-CG 3.91Å; W353-R371 HydrophobicContact CZ3-CB 4.47Å; W353-R371 HydrophobicContact CZ3-CG 3.16Å
372	V	92.4	Very high	85.5	Confident	18 Å²	18	56.5 Å²	56.5	11%	0.109	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-54.2	175.8	-177.9	0	0	0	0	109.3	F77 L81 W352 F384 L388	F77-V372 HydrophobicContact CD1-CG1 4Å; F77-V372 HydrophobicContact CE1-CG1 3.83Å; L81-V372 HydrophobicContact CD1-CG2 4.07Å; W352-V372 HydrophobicContact CB-CB 4.32Å; W352-V372 HydrophobicContact CG-CB 4.47Å; W352-V372 WeakPolarHBondContact O-CA 3.32Å; W352-V372 WeakPolarHBondContact O-CB 3.25Å; W352-V372 PolarHBondContact O-N 3.48Å; V372-F384 HydrophobicContact CG1-CD1 4.18Å; V372-F384 HydrophobicContact CG1-CE1 4.24Å; V372-L388 HydrophobicContact CG1-CD1 4.15Å; V372-L388 HydrophobicContact CG1-CD2 4.2Å
373	T	92.2	Very high	85.9	Confident	22 Å²	22	47.2 Å²	47.2	14%	0.135	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	164.6	-177.9	-168.2	0	0	0	0	112.8	I351 W352 I375 F384	I351-T373 CarbonylContact C-O 3.6Å; I351-T373 WeakPolarHBondContact CA-O 3.48Å; I351-T373 WeakPolarHBondContact CG2-O 3.34Å; W352-T373 HydrophobicContact CB-CG2 3.85Å; W352-T373 PolarHBondContact N-O 3.4Å; W352-T373 PolarHBondContact O-N 3.3Å; T373-I375 HydrophobicContact CG2-CD1 4.42Å; T373-I375 HydrophobicContact CG2-CG1 3.93Å; T373-F384 HydrophobicContact CG2-CB 4.21Å; T373-F384 HydrophobicContact CG2-CD1 3.49Å; T373-F384 VanDerWaalsContact CG2-CD1 3.49Å; T373-F384 HydrophobicContact CG2-CD2 3.75Å; T373-F384 HydrophobicContact CG2-CE1 3.62Å; T373-F384 HydrophobicContact CG2-CE2 3.92Å; T373-F384 HydrophobicContact CG2-CG 3.54Å; T373-F384 HydrophobicContact CG2-CZ 3.88Å; T373-F384 WeakPolarHBondContact OG1-CE2 3.14Å; T373-F384 WeakPolarHBondContact OG1-CZ 3.41Å
374	M	93.8	Very high	86.5	Confident	105 Å²	105	46.2 Å²	46.2	52%	0.517	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	136.4	166.7	-176.4	176.6	65.4	0	0	108.5	T349 W350 T380	T349-M374 HydrophobicContact CG2-CG 3.39Å; T349-M374 HydrophobicContact CG2-SD 3.72Å; W350-M374 CarbonylContact O-C 3.53Å; W350-M374 WeakPolarHBondContact O-CA 2.88Å; M374-T380 VanDerWaalsContact O-CG2 3.29Å; M374-T380 WeakPolarHBondContact O-CG2 3.43Å
375	I	90.9	Very high	86.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	108.5	-176.7	-54.3	169.8	0	0	0	107.4	L346 W350 W352 T373 T380 F381 L449	L346-I375 HydrophobicContact CD1-CG2 3.71Å; W350-I375 HydrophobicContact CB-CB 4.32Å; W350-I375 PolarHBondContact N-O 3.12Å; W350-I375 PolarHBondContact O-N 3.34Å; W352-I375 HydrophobicContact CB-CD1 4.24Å; W352-I375 HydrophobicContact CE3-CD1 4Å; T373-I375 HydrophobicContact CG2-CD1 4.42Å; T373-I375 HydrophobicContact CG2-CG1 3.93Å; I375-T380 HydrophobicContact CG1-CG2 4.48Å; I375-F381 HydrophobicContact CG2-CB 3.72Å; I375-L449 HydrophobicContact CG2-CD2 4.23Å
376	D	89.3	Confident	86.5	Confident	48 Å²	48	46.1 Å²	46.1	26%	0.257	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	-16.3	176.6	56.1	-5.6	0	0	0	112.7	L346 T349	L346-D376 WeakPolarHBondContact CB-O 3.44Å; L346-D376 WeakPolarHBondContact CG-O 3.48Å; L346-D376 PolarHBondContact N-O 2.92Å; T349-D376 HydrophobicContact CG2-CB 4.18Å
377	D	80.4	Confident	86.3	Confident	6 Å²	6	46.8 Å²	46.8	3%	0.032	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	163.8	175	63.8	40.6	0	0	0	112.6	R70 F343 V379 T380 F381	R70-D377 IonicContact NH1-OD2 2.9Å; R70-D377 PolarHBondContact NH1-OD2 3.16Å; F343-D377 HydrophobicContact CB-CB 4.07Å; D377-V379 VanDerWaalsContact C-N 3.28Å; D377-V379 PolarHBondContact O-N 3.14Å; D377-V379 PolarHBondContact OD1-N 3.13Å; D377-T380 WeakPolarHBondContact OD1-CA 3.34Å; D377-T380 WeakPolarHBondContact OD1-CB 3.47Å; D377-T380 PolarHBondContact OD1-N 2.95Å; D377-T380 PolarHBondContact OD1-OG1 3.31Å; D377-F381 PolarHBondContact O-N 3.03Å
378	A	77.6	Confident	86.4	Confident	46 Å²	46	41.5 Å²	41.5	38%	0.38	21%	0.205	S	C	.	.	H	α-helix	trans	-67.5	-29	-179.2	0	0	0	0	0	112.8	F381 W382	A378-F381 WeakPolarHBondContact O-CB 3.47Å; A378-F381 PolarHBondContact O-N 3.24Å; A378-W382 PolarHBondContact O-N 3.37Å
379	V	78.1	Confident	86.5	Confident	64 Å²	64	42.1 Å²	42.1	39%	0.388	21%	0.207	S	C	.	.	H	α-helix	trans	-69.4	-43.8	-179	172.9	0	0	0	0	110.4	F343 D377 F381 W382 H383	F343-V379 HydrophobicContact CD1-CB 4.04Å; F343-V379 HydrophobicContact CD1-CG2 3.37Å; F343-V379 HydrophobicContact CE1-CB 4.23Å; F343-V379 HydrophobicContact CE1-CG1 4.27Å; F343-V379 HydrophobicContact CE1-CG2 3.62Å; F343-V379 HydrophobicContact CG-CG2 4.36Å; D377-V379 VanDerWaalsContact C-N 3.28Å; D377-V379 PolarHBondContact O-N 3.14Å; D377-V379 PolarHBondContact OD1-N 3.13Å; V379-F381 VanDerWaalsContact C-N 3.32Å; V379-F381 PolarHBondContact O-N 3Å; V379-W382 PolarHBondContact O-N 2.77Å; V379-H383 WeakPolarHBondContact O-CB 3.49Å; V379-H383 PolarHBondContact O-N 3.27Å
380	T	80.6	Confident	86.4	Confident	7 Å²	7	45.3 Å²	45.3	4%	0.043	22%	0.218	C	C	.	.	H	α-helix	trans	-60.6	-45	173.7	-60.3	0	0	0	0	110.5	F71 M374 I375 D377 W382 H383 F384	F71-T380 HydrophobicContact CE1-CG2 3.94Å; F71-T380 WeakPolarHBondContact CZ-OG1 3.17Å; M374-T380 VanDerWaalsContact O-CG2 3.29Å; M374-T380 WeakPolarHBondContact O-CG2 3.43Å; I375-T380 HydrophobicContact CG1-CG2 4.48Å; D377-T380 WeakPolarHBondContact OD1-CA 3.34Å; D377-T380 WeakPolarHBondContact OD1-CB 3.47Å; D377-T380 PolarHBondContact OD1-N 2.95Å; D377-T380 PolarHBondContact OD1-OG1 3.31Å; T380-W382 PolarHBondContact O-N 3.33Å; T380-H383 PolarHBondContact O-N 3.45Å; T380-F384 HydrophobicContact CG2-CD2 4.01Å; T380-F384 HydrophobicContact CG2-CE2 4.07Å; T380-F384 VanDerWaalsContact O-CD2 3.29Å; T380-F384 WeakPolarHBondContact O-CD2 3.46Å; T380-F384 PolarHBondContact O-N 3.03Å; T380-F384 VanDerWaalsContact O-N 3.14Å
381	F	84.1	Confident	86.4	Confident	9 Å²	9	41.8 Å²	41.8	4%	0.039	20%	0.202	C	C	.	.	H	α-helix	trans	-54.4	-54.9	173.9	164	-112.3	0	0	0	112.2	I375 D377 A378 V379 H383 F384 Y385 L442 I445 I446 L449	I375-F381 HydrophobicContact CG2-CB 3.72Å; D377-F381 PolarHBondContact O-N 3.03Å; A378-F381 WeakPolarHBondContact O-CB 3.47Å; A378-F381 PolarHBondContact O-N 3.24Å; V379-F381 VanDerWaalsContact C-N 3.32Å; V379-F381 PolarHBondContact O-N 3Å; F381-H383 PolarHBondContact O-N 3.47Å; F381-F384 PolarHBondContact O-N 3.39Å; F381-Y385 HydrophobicContact CE2-CD2 4.13Å; F381-Y385 HydrophobicContact CE2-CG 4.17Å; F381-Y385 HydrophobicContact CZ-CD2 4.14Å; F381-Y385 HydrophobicContact CZ-CG 4.02Å; F381-Y385 WeakPolarHBondContact O-CB 3.36Å; F381-Y385 PolarHBondContact O-N 3.26Å; F381-L442 HydrophobicContact CE1-CD1 4.46Å; F381-L442 HydrophobicContact CZ-CD1 3.83Å; F381-I445 HydrophobicContact CD2-CG2 3.87Å; F381-I445 HydrophobicContact CE1-CG2 4.49Å; F381-I445 HydrophobicContact CE2-CB 4.3Å; F381-I445 HydrophobicContact CE2-CD1 4.28Å; F381-I445 HydrophobicContact CE2-CG2 3.27Å; F381-I445 HydrophobicContact CZ-CB 4.4Å; F381-I445 HydrophobicContact CZ-CG2 3.63Å; F381-I446 HydrophobicContact CE1-CG1 4.5Å; F381-L449 HydrophobicContact CB-CD2 4.24Å; F381-L449 HydrophobicContact CD2-CD2 3.87Å; F381-L449 HydrophobicContact CG-CD2 3.99Å
382	W	81.9	Confident	86.4	Confident	22 Å²	22	34.3 Å²	34.3	8%	0.083	18%	0.177	C	C	.	.	H	α-helix	trans	-64.9	-40.2	-176.4	-76.6	118	0	0	0	112.5	Y268 W282 L284 A378 V379 T380 F384 Y385 H386 L442 I446	Y268-W382 AromaticContact CD2-CH2 3.8Å; Y268-W382 HydrophobicContact CD2-CH2 3.8Å; Y268-W382 HydrophobicContact CD2-CZ3 4.08Å; Y268-W382 HydrophobicContact CE2-CH2 4.29Å; Y268-W382 HydrophobicContact CE2-CZ3 4.39Å; Y268-W382 HydrophobicContact CG-CH2 4.16Å; W282-W382 AromaticContact CH2-CZ2 3.86Å; W282-W382 HydrophobicContact CH2-CZ2 3.86Å; L284-W382 HydrophobicContact CD1-CB 3.87Å; L284-W382 HydrophobicContact CD1-CD2 3.75Å; L284-W382 HydrophobicContact CD1-CE3 4.36Å; L284-W382 HydrophobicContact CD1-CG 3.5Å; A378-W382 PolarHBondContact O-N 3.37Å; V379-W382 PolarHBondContact O-N 2.77Å; T380-W382 PolarHBondContact O-N 3.33Å; W382-F384 VanDerWaalsContact C-N 3.33Å; W382-F384 PolarHBondContact O-N 3.38Å; W382-Y385 HydrophobicContact CE3-CD1 4.01Å; W382-Y385 AromaticContact CZ3-CD1 3.85Å; W382-Y385 HydrophobicContact CZ3-CD1 3.85Å; W382-Y385 HydrophobicContact CZ3-CE1 4.23Å; W382-Y385 PolarHBondContact O-N 3.21Å; W382-H386 AromaticContact CE3-NE2 3.41Å; W382-H386 PolarHBondContact O-CD2 3.15Å; W382-H386 PolarHBondContact O-N 3.07Å; W382-L442 HydrophobicContact CH2-CD1 4.16Å; W382-L442 HydrophobicContact CZ3-CD1 4.25Å; W382-I446 HydrophobicContact CH2-CD1 4.17Å; W382-I446 HydrophobicContact CZ2-CD1 4.3Å
383	H	79.5	Confident	86.4	Confident	60 Å²	60	36.6 Å²	36.6	28%	0.278	19%	0.187	S	C	.	.	H	α-helix	trans	-53.9	-50.4	175.1	176.8	86.5	0	0	0	111.2	F71 V379 T380 F381 N387	F71-H383 HydrophobicContact CD1-CB 4.27Å; F71-H383 AromaticContact CD1-CD2 3.36Å; F71-H383 WeakPolarHBondContact CD1-CD2 3.38Å; F71-H383 AromaticContact CD1-CG 3.71Å; F71-H383 AromaticContact CD1-NE2 3.77Å; F71-H383 HydrophobicContact CE1-CB 4.01Å; F71-H383 AromaticContact CE1-CD2 3.95Å; F71-H383 AromaticContact CE1-CG 3.96Å; F71-H383 AromaticContact CG-NE2 3.98Å; V379-H383 WeakPolarHBondContact O-CB 3.49Å; V379-H383 PolarHBondContact O-N 3.27Å; T380-H383 PolarHBondContact O-N 3.45Å; F381-H383 PolarHBondContact O-N 3.47Å; H383-N387 WeakPolarHBondContact O-CB 3.22Å; H383-N387 PolarHBondContact O-N 3.08Å; H383-N387 PolarHBondContact O-ND2 2.81Å
384	F	85.5	Confident	86.4	Confident	5 Å²	5	35.9 Å²	35.9	2%	0.022	18%	0.182	C	C	.	.	H	α-helix	trans	-71.8	-41	179.5	-81.8	-92.7	0	0	0	112.4	F71 F77 W352 V372 T373 T380 F381 W382 H386 N387 L388	F71-F384 HydrophobicContact CD1-CD2 4.44Å; F71-F384 AromaticContact CD1-CE2 3.8Å; F71-F384 HydrophobicContact CD1-CE2 3.8Å; F71-F384 HydrophobicContact CE1-CE2 4.14Å; F77-F384 HydrophobicContact CE1-CD1 4.39Å; F77-F384 AromaticContact CE1-CE1 3.62Å; F77-F384 HydrophobicContact CE1-CE1 3.62Å; F77-F384 HydrophobicContact CE2-CE1 4.12Å; F77-F384 AromaticContact CZ-CD1 3.92Å; F77-F384 HydrophobicContact CZ-CD1 3.92Å; F77-F384 AromaticContact CZ-CE1 3.17Å; F77-F384 HydrophobicContact CZ-CE1 3.17Å; F77-F384 AromaticContact CZ-CZ 3.94Å; F77-F384 HydrophobicContact CZ-CZ 3.94Å; W352-F384 HydrophobicContact CE3-CB 4.3Å; W352-F384 HydrophobicContact CZ3-CB 4.29Å; V372-F384 HydrophobicContact CG1-CD1 4.18Å; V372-F384 HydrophobicContact CG1-CE1 4.24Å; T373-F384 HydrophobicContact CG2-CB 4.21Å; T373-F384 HydrophobicContact CG2-CD1 3.49Å; T373-F384 VanDerWaalsContact CG2-CD1 3.49Å; T373-F384 HydrophobicContact CG2-CD2 3.75Å; T373-F384 HydrophobicContact CG2-CE1 3.62Å; T373-F384 HydrophobicContact CG2-CE2 3.92Å; T373-F384 HydrophobicContact CG2-CG 3.54Å; T373-F384 HydrophobicContact CG2-CZ 3.88Å; T373-F384 WeakPolarHBondContact OG1-CE2 3.14Å; T373-F384 WeakPolarHBondContact OG1-CZ 3.41Å; T380-F384 HydrophobicContact CG2-CD2 4.01Å; T380-F384 HydrophobicContact CG2-CE2 4.07Å; T380-F384 VanDerWaalsContact O-CD2 3.29Å; T380-F384 WeakPolarHBondContact O-CD2 3.46Å; T380-F384 PolarHBondContact O-N 3.03Å; T380-F384 VanDerWaalsContact O-N 3.14Å; F381-F384 PolarHBondContact O-N 3.39Å; W382-F384 VanDerWaalsContact C-N 3.33Å; W382-F384 PolarHBondContact O-N 3.38Å; F384-H386 VanDerWaalsContact C-N 3.3Å; F384-H386 PolarHBondContact O-N 2.92Å; F384-N387 PolarHBondContact O-N 3.01Å; F384-L388 HydrophobicContact CB-CD1 4.21Å; F384-L388 HydrophobicContact CD1-CD1 4.37Å; F384-L388 WeakPolarHBondContact O-CB 3.41Å; F384-L388 WeakPolarHBondContact O-CG 3.09Å; F384-L388 PolarHBondContact O-N 3.07Å
385	Y	85.9	Confident	86.4	Confident	25 Å²	25	33.2 Å²	33.2	10%	0.098	17%	0.172	C	C	.	.	H	α-helix	trans	-59.5	-40.2	-179.6	-179.3	-97.1	0	0	0	112.6	W352 F381 W382 L442 I445	W352-Y385 HydrophobicContact CH2-CD2 4.09Å; F381-Y385 HydrophobicContact CE2-CD2 4.13Å; F381-Y385 HydrophobicContact CE2-CG 4.17Å; F381-Y385 HydrophobicContact CZ-CD2 4.14Å; F381-Y385 HydrophobicContact CZ-CG 4.02Å; F381-Y385 WeakPolarHBondContact O-CB 3.36Å; F381-Y385 PolarHBondContact O-N 3.26Å; W382-Y385 HydrophobicContact CE3-CD1 4.01Å; W382-Y385 AromaticContact CZ3-CD1 3.85Å; W382-Y385 HydrophobicContact CZ3-CD1 3.85Å; W382-Y385 HydrophobicContact CZ3-CE1 4.23Å; W382-Y385 PolarHBondContact O-N 3.21Å; Y385-L442 HydrophobicContact CD1-CD1 4.34Å; Y385-L442 HydrophobicContact CD2-CD1 4.19Å; Y385-L442 HydrophobicContact CE1-CD1 3.94Å; Y385-L442 HydrophobicContact CE1-CD2 4.13Å; Y385-L442 HydrophobicContact CE2-CB 4.24Å; Y385-L442 HydrophobicContact CE2-CD1 3.79Å; Y385-L442 HydrophobicContact CE2-CG 4.48Å; Y385-L442 HydrophobicContact CG-CD1 4.47Å; Y385-I445 HydrophobicContact CD2-CD1 4.46Å
386	H	80.3	Confident	86.5	Confident	81 Å²	81	35.2 Å²	35.2	38%	0.375	18%	0.182	S	C	.	.	H	α-helix	trans	-73	-31.3	178.2	-73.1	-60.5	0	0	0	113.5	W382 F384	W382-H386 AromaticContact CE3-NE2 3.41Å; W382-H386 PolarHBondContact O-CD2 3.15Å; W382-H386 PolarHBondContact O-N 3.07Å; F384-H386 VanDerWaalsContact C-N 3.3Å; F384-H386 PolarHBondContact O-N 2.92Å
387	N	81.9	Confident	86.6	Confident	54 Å²	54	33 Å²	33	29%	0.289	17%	0.171	S	C	.	.	H	α-helix	trans	-92.5	-5.9	-177.5	-73	-68.9	0	0	0	113.7	F74 P83 H383 F384	F74-N387 HydrophobicContact CD2-CB 4.02Å; F74-N387 HydrophobicContact CE2-CB 4.45Å; F74-N387 WeakPolarHBondContact CE2-O 3.43Å; P83-N387 WeakPolarHBondContact CD-O 3.31Å; P83-N387 VanDerWaalsContact CG-O 3.25Å; P83-N387 WeakPolarHBondContact CG-O 3.26Å; H383-N387 WeakPolarHBondContact O-CB 3.22Å; H383-N387 PolarHBondContact O-N 3.08Å; H383-N387 PolarHBondContact O-ND2 2.81Å; F384-N387 PolarHBondContact O-N 3.01Å
388	L	89.2	Confident	87.3	Confident	8 Å²	8	32.7 Å²	32.7	4%	0.042	17%	0.17	C	C	.	.	S	Bend	trans	-100.1	148.7	176.5	-68.3	172.6	0	0	0	111	L81 W352 V372 F384	L81-L388 HydrophobicContact CB-CD2 3.96Å; L81-L388 HydrophobicContact CD1-CD2 4.07Å; W352-L388 HydrophobicContact CD2-CD1 3.83Å; W352-L388 HydrophobicContact CE3-CD1 3.87Å; W352-L388 HydrophobicContact CH2-CD1 3.69Å; W352-L388 HydrophobicContact CZ2-CD1 3.61Å; W352-L388 HydrophobicContact CZ3-CD1 3.82Å; V372-L388 HydrophobicContact CG1-CD1 4.15Å; V372-L388 HydrophobicContact CG1-CD2 4.2Å; F384-L388 HydrophobicContact CB-CD1 4.21Å; F384-L388 HydrophobicContact CD1-CD1 4.37Å; F384-L388 WeakPolarHBondContact O-CB 3.41Å; F384-L388 WeakPolarHBondContact O-CG 3.09Å; F384-L388 PolarHBondContact O-N 3.07Å
389	K	91.2	Very high	88.1	Confident	31 Å²	31	30.6 Å²	30.6	14%	0.135	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-55.7	143.5	170.9	-77.2	-170.8	-168.8	169.5	0	111.7	E80 L81 H82 E393 L394 Y400	E80-K389 WeakPolarHBondContact O-CD 3.47Å; E80-K389 WeakPolarHBondContact O-CE 3.25Å; E80-K389 PolarHBondContact O-NZ 3.35Å; L81-K389 PolarHBondContact O-N 2.91Å; L81-K389 VanDerWaalsContact O-N 3.17Å; H82-K389 WeakPolarHBondContact O-CE 3.4Å; H82-K389 VanDerWaalsContact O-CG 3.28Å; H82-K389 WeakPolarHBondContact O-CG 2.92Å; K389-E393 HydrophobicContact CB-CB 4.18Å; K389-E393 HydrophobicContact CD-CB 4.22Å; K389-E393 HydrophobicContact CG-CB 4.37Å; K389-L394 HydrophobicContact CB-CD2 3.91Å; K389-Y400 WeakPolarHBondContact O-CE2 3.35Å
390	R	91.8	Very high	89.1	Confident	83 Å²	83	27.6 Å²	27.6	31%	0.313	13%	0.134	S	C	.	.	P	Polyproline II helix	trans	-71	155.7	172	-63.7	179.3	179.6	176.3	-0.2	110.6	P264 S392 E393 L394	P264-R390 PolarHBondContact O-NH2 3.15Å; R390-S392 PolarHBondContact O-N 3.45Å; R390-S392 VanDerWaalsContact O-N 3.11Å; R390-E393 HydrophobicContact CB-CG 4.32Å; R390-E393 PolarHBondContact N-OE2 2.8Å; R390-E393 WeakPolarHBondContact O-CA 3.43Å; R390-E393 WeakPolarHBondContact O-CB 3.44Å; R390-E393 PolarHBondContact O-N 3.34Å; R390-L394 PolarHBondContact O-N 2.85Å
391	P	93.9	Very high	89.9	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.006	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-49.8	-39.2	177.2	-29.7	34.2	0	0	0	114.7	E393 L394 V437 N438 W441 V465 V467	P391-E393 PolarHBondContact O-N 2.91Å; P391-L394 PolarHBondContact O-N 3.38Å; P391-V437 HydrophobicContact CB-CG2 4.14Å; P391-N438 VanDerWaalsContact CD-OD1 3.26Å; P391-N438 WeakPolarHBondContact CD-OD1 3.24Å; P391-W441 HydrophobicContact CG-CB 3.77Å; P391-W441 VanDerWaalsContact CG-CD1 3.45Å; P391-W441 HydrophobicContact CG-CD2 4.38Å; P391-W441 HydrophobicContact CG-CG 3.59Å; P391-V465 HydrophobicContact CB-CG1 4.36Å; P391-V465 HydrophobicContact CB-CG2 3.79Å; P391-V465 HydrophobicContact CG-CG1 4.07Å; P391-V465 HydrophobicContact CG-CG2 4.19Å; P391-V467 WeakPolarHBondContact O-CG2 3Å
392	S	93.2	Very high	90.5	Very high	25 Å²	25	27.1 Å²	27.1	18%	0.175	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-65.2	-19.3	177.7	66.3	0	0	0	0	114.5	R390 N438	R390-S392 PolarHBondContact O-N 3.45Å; R390-S392 VanDerWaalsContact O-N 3.11Å; S392-N438 WeakPolarHBondContact CB-OD1 3.44Å; S392-N438 PolarHBondContact N-OD1 2.83Å; S392-N438 PolarHBondContact OG-ND2 2.81Å; S392-N438 PolarHBondContact OG-OD1 3.48Å
393	E	92.7	Very high	91.2	Very high	67 Å²	67	26.1 Å²	26.1	31%	0.313	13%	0.127	S	C	.	.	G	3₁₀ helix	trans	-101.8	-8.8	-174.1	-59	174.3	161.4	0	0	113.4	K389 R390 P391	K389-E393 HydrophobicContact CB-CB 4.18Å; K389-E393 HydrophobicContact CD-CB 4.22Å; K389-E393 HydrophobicContact CG-CB 4.37Å; R390-E393 HydrophobicContact CB-CG 4.32Å; R390-E393 PolarHBondContact N-OE2 2.8Å; R390-E393 WeakPolarHBondContact O-CA 3.43Å; R390-E393 WeakPolarHBondContact O-CB 3.44Å; R390-E393 PolarHBondContact O-N 3.34Å; P391-E393 PolarHBondContact O-N 2.91Å
394	L	93.6	Very high	92	Very high	7 Å²	7	24.1 Å²	24.1	4%	0.037	12%	0.118	C	C	.	.	S	Bend	trans	-69.3	151.9	176.6	-64.8	175.2	0	0	0	111.3	L81 Y354 K389 R390 P391 A398 Y400 V467	L81-L394 HydrophobicContact CD2-CD2 4.25Å; Y354-L394 HydrophobicContact CE2-CD2 4.36Å; K389-L394 HydrophobicContact CB-CD2 3.91Å; R390-L394 PolarHBondContact O-N 2.85Å; P391-L394 PolarHBondContact O-N 3.38Å; L394-A398 HydrophobicContact CB-CB 4.08Å; L394-A398 HydrophobicContact CD1-CB 4.49Å; L394-Y400 HydrophobicContact CD1-CD2 3.62Å; L394-Y400 HydrophobicContact CD1-CE2 3.6Å; L394-Y400 HydrophobicContact CD1-CG 4.21Å; L394-Y400 HydrophobicContact CD2-CE2 3.85Å; L394-Y400 HydrophobicContact CG-CE2 4.16Å; L394-V467 HydrophobicContact CB-CG2 4.02Å; L394-V467 HydrophobicContact CD1-CG2 4.08Å
395	P	93	Very high	92.4	Very high	48 Å²	48	26 Å²	26	31%	0.312	13%	0.134	S	C	.	.	P	Polyproline II helix	trans	-63.4	151.8	172.1	25.3	-30.3	0	0	0	111.3	P357 A398	P357-P395 HydrophobicContact CG-CB 4.04Å; P357-P395 HydrophobicContact CG-CG 3.76Å; P395-A398 HydrophobicContact CG-CB 4.11Å; P395-A398 WeakPolarHBondContact O-CB 3.43Å; P395-A398 PolarHBondContact O-N 3.44Å
396	I	92.3	Very high	92.8	Very high	42 Å²	42	30.9 Å²	30.9	22%	0.215	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	138.4	173.8	-56.4	172.2	0	0	0	109.1	E166 P357 A398 R428	E166-I396 HydrophobicContact CG-CG2 4.41Å; P357-I396 WeakPolarHBondContact CB-O 3.12Å; I396-A398 VanDerWaalsContact C-N 3.32Å; I396-R428 VanDerWaalsContact CD1-NH1 3.26Å
397	G	91.6	Very high	93.4	Very high	2 Å²	2	27.5 Å²	27.5	2%	0.021	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	-4.7	-175.4	0	0	0	0	0	114.3	V467	G397-V467 WeakPolarHBondContact CA-O 3.42Å; G397-V467 PolarHBondContact N-O 3.4Å
398	A	94.6	Very high	94	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.147	C	C	.	.			trans	-77.4	149.2	175	0	0	0	0	0	112.5	Y354 P357 L394 P395 I396 V467 R468	Y354-A398 HydrophobicContact CE2-CB 3.91Å; P357-A398 HydrophobicContact CG-CB 4.18Å; L394-A398 HydrophobicContact CB-CB 4.08Å; L394-A398 HydrophobicContact CD1-CB 4.49Å; P395-A398 HydrophobicContact CG-CB 4.11Å; P395-A398 WeakPolarHBondContact O-CB 3.43Å; P395-A398 PolarHBondContact O-N 3.44Å; I396-A398 VanDerWaalsContact C-N 3.32Å; A398-V467 PolarHBondContact O-N 2.91Å; A398-R468 PolarHBondContact O-NH1 3.22Å
399	D	96.1	Very high	94.2	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.011	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	143.2	169.9	-54.5	-53.1	0	0	0	111.2	Y354 H355 F401 V465 S466 R468	Y354-D399 WeakPolarHBondContact CA-O 3.37Å; Y354-D399 WeakPolarHBondContact CD2-O 3.41Å; H355-D399 HydrophobicContact CB-CB 3.96Å; H355-D399 PolarHBondContact N-O 2.74Å; H355-D399 IonicContact ND1-OD2 3.77Å; H355-D399 PolarHBondContact O-N 3.22Å; D399-F401 HydrophobicContact CB-CD2 4.22Å; D399-F401 HydrophobicContact CB-CE1 4.49Å; D399-F401 HydrophobicContact CB-CE2 3.38Å; D399-F401 HydrophobicContact CB-CZ 3.54Å; D399-V465 WeakPolarHBondContact CA-O 3.48Å; D399-S466 WeakPolarHBondContact OD1-CA 3.35Å; D399-S466 WeakPolarHBondContact OD1-CB 3.31Å; D399-S466 PolarHBondContact OD1-OG 3.32Å; D399-R468 VanDerWaalsContact CG-NH2 3.34Å; D399-R468 IonicContact OD1-CZ 2.7Å; D399-R468 VanDerWaalsContact OD1-CZ 3.26Å; D399-R468 IonicContact OD1-NH1 3.6Å; D399-R468 PolarHBondContact OD1-NH1 3.29Å; D399-R468 IonicContact OD1-NH2 3.91Å; D399-R468 PolarHBondContact OD1-NH2 3.3Å; D399-R468 IonicContact OD2-NH2 3.97Å; D399-R468 PolarHBondContact OD2-NH2 3.31Å
400	Y	97.6	Very high	94.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	143.5	159.9	-78.3	-37.8	0	0	0	110.4	L81 W352 W353 Y354 K389 L394 W441 F464 V465	L81-Y400 HydrophobicContact CD2-CE1 3.86Å; L81-Y400 VanDerWaalsContact CD2-OH 3.28Å; L81-Y400 WeakPolarHBondContact CD2-OH 3.35Å; W352-Y400 HydrophobicContact CZ2-CD2 4.07Å; W352-Y400 HydrophobicContact CZ2-CE2 4.09Å; W352-Y400 HydrophobicContact CZ2-CG 4.43Å; W352-Y400 AromaticContact NE1-CD1 3.25Å; W352-Y400 AromaticContact NE1-CD2 3.92Å; W352-Y400 AromaticContact NE1-CE1 3.66Å; W352-Y400 AromaticContact NE1-CG 3.41Å; W353-Y400 WeakPolarHBondContact O-CA 3.29Å; Y354-Y400 AromaticContact CD2-CD1 3.65Å; Y354-Y400 HydrophobicContact CD2-CD1 3.65Å; Y354-Y400 AromaticContact CD2-CE1 3.43Å; Y354-Y400 HydrophobicContact CD2-CE1 3.43Å; Y354-Y400 VanDerWaalsContact CD2-CE1 3.43Å; Y354-Y400 HydrophobicContact CE2-CE1 4.24Å; Y354-Y400 HydrophobicContact CG-CD1 4.3Å; Y354-Y400 AromaticContact CG-CE1 3.98Å; Y354-Y400 HydrophobicContact CG-CE1 3.98Å; K389-Y400 WeakPolarHBondContact O-CE2 3.35Å; L394-Y400 HydrophobicContact CD1-CD2 3.62Å; L394-Y400 HydrophobicContact CD1-CE2 3.6Å; L394-Y400 HydrophobicContact CD1-CG 4.21Å; L394-Y400 HydrophobicContact CD2-CE2 3.85Å; L394-Y400 HydrophobicContact CG-CE2 4.16Å; Y400-W441 HydrophobicContact CD2-CZ2 4.5Å; Y400-F464 CarbonylContact O-C 3.53Å; Y400-F464 VanDerWaalsContact O-CA 3.29Å; Y400-F464 WeakPolarHBondContact O-CA 3.35Å; Y400-V465 HydrophobicContact CD2-CG1 4.32Å; Y400-V465 PolarHBondContact N-O 3.37Å; Y400-V465 PolarHBondContact O-N 3.38Å
401	F	97.7	Very high	94.1	Very high	7 Å²	7	25.3 Å²	25.3	3%	0.031	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	145.1	172.3	-52.1	-89	0	0	0	110.2	W352 W353 H355 W365 L369 D399 F403 P409 I463 F464 W477	W352-F401 CarbonylContact C-O 3.53Å; W352-F401 WeakPolarHBondContact CA-O 3.39Å; W353-F401 HydrophobicContact CB-CB 4.09Å; W353-F401 HydrophobicContact CB-CD2 4.37Å; W353-F401 PolarHBondContact N-O 2.78Å; W353-F401 PolarHBondContact O-N 2.99Å; H355-F401 HydrophobicContact CB-CE2 4.18Å; W365-F401 AromaticContact CH2-CE2 3.73Å; W365-F401 HydrophobicContact CH2-CE2 3.73Å; W365-F401 AromaticContact CH2-CZ 3.94Å; W365-F401 HydrophobicContact CH2-CZ 3.94Å; W365-F401 AromaticContact CZ2-CE2 3.84Å; W365-F401 HydrophobicContact CZ2-CE2 3.84Å; W365-F401 AromaticContact CZ2-CZ 3.94Å; W365-F401 HydrophobicContact CZ2-CZ 3.94Å; L369-F401 HydrophobicContact CD1-CD2 4.07Å; L369-F401 HydrophobicContact CD1-CE2 4.2Å; D399-F401 HydrophobicContact CB-CD2 4.22Å; D399-F401 HydrophobicContact CB-CE1 4.49Å; D399-F401 HydrophobicContact CB-CE2 3.38Å; D399-F401 HydrophobicContact CB-CZ 3.54Å; F401-F403 HydrophobicContact CB-CD2 3.72Å; F401-F403 HydrophobicContact CB-CE2 3.73Å; F401-F403 AromaticContact CD1-CE2 3.85Å; F401-F403 HydrophobicContact CD1-CE2 3.85Å; F401-F403 HydrophobicContact CG-CE2 4.22Å; F401-P409 HydrophobicContact CB-CB 3.8Å; F401-P409 HydrophobicContact CB-CG 4.14Å; F401-P409 HydrophobicContact CD1-CB 3.81Å; F401-P409 HydrophobicContact CD2-CB 4.05Å; F401-P409 HydrophobicContact CD2-CG 4.16Å; F401-P409 HydrophobicContact CE1-CB 4.4Å; F401-P409 HydrophobicContact CG-CB 3.62Å; F401-P409 HydrophobicContact CG-CG 4.11Å; F401-I463 CarbonylContact C-O 3.24Å; F401-I463 VanDerWaalsContact CA-O 3.29Å; F401-I463 WeakPolarHBondContact CA-O 3.49Å; F401-F464 HydrophobicContact CD1-CB 3.45Å; F401-F464 VanDerWaalsContact CD1-CB 3.45Å; F401-F464 HydrophobicContact CE1-CB 3.74Å; F401-F464 HydrophobicContact CG-CB 4.45Å; F401-W477 HydrophobicContact CE1-CZ2 4.42Å
402	I	97.4	Very high	93.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	109.4	168.3	-66.5	166.8	0	0	0	107.2	W350 I351 W352 W441 I445 L449 G462 I463	W350-I402 HydrophobicContact CB-CG2 3.79Å; W350-I402 HydrophobicContact CD2-CG2 4.26Å; W350-I402 HydrophobicContact CE3-CG2 3.97Å; W350-I402 HydrophobicContact CG-CG2 4.21Å; I351-I402 WeakPolarHBondContact O-CA 3.26Å; W352-I402 HydrophobicContact CB-CG1 4.19Å; W352-I402 HydrophobicContact CD2-CD1 3.98Å; W352-I402 HydrophobicContact CD2-CG1 4.03Å; W352-I402 HydrophobicContact CE3-CD1 4.09Å; W352-I402 HydrophobicContact CG-CD1 4.39Å; W352-I402 HydrophobicContact CG-CG1 3.89Å; W352-I402 HydrophobicContact CZ3-CD1 4.44Å; I402-W441 HydrophobicContact CD1-CH2 3.87Å; I402-W441 HydrophobicContact CD1-CZ2 3.72Å; I402-W441 HydrophobicContact CG1-CH2 4.14Å; I402-W441 HydrophobicContact CG1-CZ2 4.29Å; I402-I445 HydrophobicContact CD1-CD1 3.79Å; I402-I445 HydrophobicContact CD1-CG1 3.76Å; I402-I445 HydrophobicContact CD1-CG2 4.27Å; I402-L449 HydrophobicContact CG2-CD1 4.17Å; I402-G462 CarbonylContact O-C 3.5Å; I402-G462 WeakPolarHBondContact O-CA 3.48Å; I402-I463 PolarHBondContact N-O 3.11Å; I402-I463 PolarHBondContact O-N 3.21Å
403	F	97.2	Very high	93.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	152.1	-172.6	-86.8	-115.6	0	0	0	110.9	W350 I351 F401 L407 P409 N461 W477	W350-F403 CarbonylContact C-O 3.53Å; W350-F403 VanDerWaalsContact CA-O 3.25Å; W350-F403 WeakPolarHBondContact CA-O 3.39Å; I351-F403 PolarHBondContact N-O 2.86Å; I351-F403 PolarHBondContact O-N 3.39Å; F401-F403 HydrophobicContact CB-CD2 3.72Å; F401-F403 HydrophobicContact CB-CE2 3.73Å; F401-F403 AromaticContact CD1-CE2 3.85Å; F401-F403 HydrophobicContact CD1-CE2 3.85Å; F401-F403 HydrophobicContact CG-CE2 4.22Å; F403-L407 HydrophobicContact CD1-CB 4.18Å; F403-P409 HydrophobicContact CD1-CB 4.36Å; F403-P409 HydrophobicContact CD2-CB 3.79Å; F403-P409 HydrophobicContact CE1-CB 4.19Å; F403-P409 HydrophobicContact CE2-CB 3.63Å; F403-P409 HydrophobicContact CG-CB 4.17Å; F403-P409 HydrophobicContact CZ-CB 3.81Å; F403-N461 HydrophobicContact CE1-CB 4.33Å; F403-W477 HydrophobicContact CE1-CB 4.24Å; F403-W477 HydrophobicContact CE1-CD2 4.09Å; F403-W477 AromaticContact CE1-CE3 3.69Å; F403-W477 HydrophobicContact CE1-CE3 3.69Å; F403-W477 HydrophobicContact CE1-CG 4.36Å; F403-W477 HydrophobicContact CE1-CZ3 4.32Å; F403-W477 HydrophobicContact CZ-CB 3.91Å; F403-W477 AromaticContact CZ-CD2 3.51Å; F403-W477 HydrophobicContact CZ-CD2 3.51Å; F403-W477 AromaticContact CZ-CE3 3.55Å; F403-W477 HydrophobicContact CZ-CE3 3.55Å; F403-W477 AromaticContact CZ-CG 3.69Å; F403-W477 HydrophobicContact CZ-CG 3.69Å; F403-W477 HydrophobicContact CZ-CZ3 4.2Å
404	K	95.7	Very high	93.3	Very high	19 Å²	19	31 Å²	31	8%	0.083	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	142.2	170.8	-69.4	174.6	172.9	161.4	0	109.5	H348 W350 N406 L407 C457 I460 N461	H348-K404 HydrophobicContact CB-CG 4.49Å; W350-K404 HydrophobicContact CE3-CG 4.13Å; W350-K404 HydrophobicContact CH2-CG 3.75Å; W350-K404 HydrophobicContact CZ2-CG 4.26Å; W350-K404 HydrophobicContact CZ3-CG 3.69Å; K404-N406 WeakPolarHBondContact CB-OD1 3.5Å; K404-N406 PolarHBondContact O-N 3.31Å; K404-L407 HydrophobicContact CB-CD1 4.14Å; K404-L407 HydrophobicContact CB-CG 4.23Å; K404-L407 HydrophobicContact CD-CD1 4.48Å; K404-L407 WeakPolarHBondContact O-CB 3.15Å; K404-L407 PolarHBondContact O-N 3.2Å; K404-C457 PolarHBondContact NZ-O 3.47Å; K404-C457 VanDerWaalsContact NZ-O 3.15Å; K404-I460 WeakPolarHBondContact CE-O 3.45Å; K404-I460 PolarHBondContact NZ-O 3.08Å; K404-N461 PolarHBondContact N-O 3.44Å; K404-N461 VanDerWaalsContact N-O 3.14Å
405	A	94.4	Very high	93.1	Very high	43 Å²	43	34.1 Å²	34.1	36%	0.355	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-25	-168.3	0	0	0	0	0	115.1	T349 I351 L407	T349-A405 HydrophobicContact CG2-CB 3.92Å; T349-A405 WeakPolarHBondContact O-CB 3.28Å; T349-A405 PolarHBondContact O-N 2.95Å; I351-A405 HydrophobicContact CD1-CB 4.1Å; I351-A405 HydrophobicContact CG1-CB 4.12Å; A405-L407 VanDerWaalsContact C-N 3.31Å
406	N	92.7	Very high	93.1	Very high	129 Å²	129	31.9 Å²	31.9	69%	0.69	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	-3.4	175.5	65.4	-47.8	0	0	0	113.9	K404	K404-N406 WeakPolarHBondContact CB-OD1 3.5Å; K404-N406 PolarHBondContact O-N 3.31Å
407	L	94.6	Very high	92.9	Very high	9 Å²	9	30.6 Å²	30.6	5%	0.047	17%	0.17	C	C	.	.			trans	-116.3	148.6	-176.2	-55.7	-177.2	0	0	0	110.9	F403 K404 A405 E415 N461	F403-L407 HydrophobicContact CD1-CB 4.18Å; K404-L407 HydrophobicContact CB-CD1 4.14Å; K404-L407 HydrophobicContact CB-CG 4.23Å; K404-L407 HydrophobicContact CD-CD1 4.48Å; K404-L407 WeakPolarHBondContact O-CB 3.15Å; K404-L407 PolarHBondContact O-N 3.2Å; A405-L407 VanDerWaalsContact C-N 3.31Å; L407-E415 HydrophobicContact CD2-CB 3.54Å; L407-E415 HydrophobicContact CD2-CG 3.51Å; L407-N461 HydrophobicContact CD1-CB 3.62Å
408	T	93.4	Very high	92.8	Very high	48 Å²	48	40.5 Å²	40.5	29%	0.294	21%	0.207	S	C	.	.			trans	-109.6	146.5	170.3	52.3	0	0	0	0	109.8	W353 K410 S413 N416	W353-T408 HydrophobicContact CH2-CG2 4.01Å; W353-T408 HydrophobicContact CZ2-CG2 4.22Å; T408-K410 PolarHBondContact O-N 3.33Å; T408-S413 PolarHBondContact OG1-OG 3.29Å; T408-N416 PolarHBondContact O-ND2 2.77Å
409	P	94.3	Very high	92.7	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.208	C	C	.	.	S	Bend	trans	-76.4	56.6	176.6	34.1	-36.9	0	0	0	110.8	W353 L369 F401 F403	W353-P409 HydrophobicContact CB-CG 4.18Å; W353-P409 HydrophobicContact CD2-CG 3.91Å; W353-P409 HydrophobicContact CE3-CG 4.4Å; W353-P409 HydrophobicContact CG-CG 3.79Å; L369-P409 HydrophobicContact CD1-CG 3.97Å; L369-P409 HydrophobicContact CD2-CG 3.65Å; L369-P409 HydrophobicContact CG-CG 4.38Å; F401-P409 HydrophobicContact CB-CB 3.8Å; F401-P409 HydrophobicContact CB-CG 4.14Å; F401-P409 HydrophobicContact CD1-CB 3.81Å; F401-P409 HydrophobicContact CD2-CB 4.05Å; F401-P409 HydrophobicContact CD2-CG 4.16Å; F401-P409 HydrophobicContact CE1-CB 4.4Å; F401-P409 HydrophobicContact CG-CB 3.62Å; F401-P409 HydrophobicContact CG-CG 4.11Å; F403-P409 HydrophobicContact CD1-CB 4.36Å; F403-P409 HydrophobicContact CD2-CB 3.79Å; F403-P409 HydrophobicContact CE1-CB 4.19Å; F403-P409 HydrophobicContact CE2-CB 3.63Å; F403-P409 HydrophobicContact CG-CB 4.17Å; F403-P409 HydrophobicContact CZ-CB 3.81Å
410	K	91.7	Very high	92.6	Very high	66 Å²	66	40.5 Å²	40.5	29%	0.287	21%	0.207	S	C	.	.			trans	-121.1	126.3	177.3	-66	-171.1	-176.1	-170.1	0	108	S366 T408 E412 S413 N416	S366-K410 VanDerWaalsContact CB-CE 3.49Å; S366-K410 VanDerWaalsContact CB-NZ 3.34Å; T408-K410 PolarHBondContact O-N 3.33Å; K410-E412 PolarHBondContact O-N 3.14Å; K410-S413 WeakPolarHBondContact O-CB 3.3Å; K410-S413 PolarHBondContact O-N 3.34Å; K410-S413 PolarHBondContact O-OG 3.01Å; K410-N416 WeakPolarHBondContact O-CB 3.45Å; K410-N416 PolarHBondContact O-ND2 3.38Å
411	W	88.3	Confident	92.4	Very high	16 Å²	16	41 Å²	41	6%	0.061	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-22.4	-176.4	67.4	-98.3	0	0	0	111.2	Y171 I172 Y175 S413 N416 A417 W477 H509 I510	Y171-W411 AromaticContact CD1-CD1 3.63Å; Y171-W411 AromaticContact CE1-CD1 3.25Å; Y171-W411 HydrophobicContact CE1-CG 4.25Å; Y171-W411 AromaticContact CE1-NE1 3.83Å; Y171-W411 AromaticContact CE2-NE1 3.94Å; Y171-W411 AromaticContact CZ-CD1 3.6Å; Y171-W411 AromaticContact CZ-NE1 3.68Å; I172-W411 HydrophobicContact CD1-CB 4.38Å; Y175-W411 AromaticContact CD1-CH2 3.95Å; Y175-W411 HydrophobicContact CD1-CH2 3.95Å; Y175-W411 AromaticContact CD1-CZ2 3.74Å; Y175-W411 HydrophobicContact CD1-CZ2 3.74Å; Y175-W411 AromaticContact CD2-CZ2 3.79Å; Y175-W411 HydrophobicContact CD2-CZ2 3.79Å; Y175-W411 AromaticContact CE1-CH2 3.63Å; Y175-W411 HydrophobicContact CE1-CH2 3.63Å; Y175-W411 AromaticContact CE1-CZ2 3.79Å; Y175-W411 HydrophobicContact CE1-CZ2 3.79Å; Y175-W411 HydrophobicContact CE2-CH2 4.3Å; Y175-W411 AromaticContact CE2-CZ2 3.85Å; Y175-W411 HydrophobicContact CE2-CZ2 3.85Å; Y175-W411 HydrophobicContact CG-CH2 4.4Å; Y175-W411 AromaticContact CG-CZ2 3.73Å; Y175-W411 HydrophobicContact CG-CZ2 3.73Å; Y175-W411 AromaticContact CZ-CH2 3.82Å; Y175-W411 AromaticContact CZ-CZ2 3.84Å; W411-S413 VanDerWaalsContact C-N 3.28Å; W411-S413 PolarHBondContact O-N 3.31Å; W411-N416 CarbonylContact O-C 3.57Å; W411-A417 WeakPolarHBondContact O-CA 3.42Å; W411-A417 VanDerWaalsContact O-CB 3.28Å; W411-A417 WeakPolarHBondContact O-CB 3.47Å; W411-A417 PolarHBondContact O-N 3.12Å; W411-W477 HydrophobicContact CB-CH2 4.03Å; W411-W477 HydrophobicContact CB-CZ3 4.18Å; W411-H509 HydrophobicContact CB-CB 4.24Å; W411-I510 HydrophobicContact CE3-CD1 4.45Å; W411-I510 HydrophobicContact CE3-CG1 3.97Å; W411-I510 HydrophobicContact CZ3-CD1 4.05Å; W411-I510 HydrophobicContact CZ3-CG1 3.72Å
412	E	88.4	Confident	92.3	Very high	92 Å²	92	40.7 Å²	40.7	43%	0.43	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-16.8	178.4	-48.1	86.7	155.9	0	0	112.8	Y171 K410	Y171-E412 VanDerWaalsContact CZ-OE1 3.28Å; Y171-E412 PolarHBondContact OH-OE1 3.05Å; Y171-E412 PolarHBondContact OH-OE2 3.05Å; K410-E412 PolarHBondContact O-N 3.14Å
413	S	87.9	Confident	92.2	Very high	18 Å²	18	41.3 Å²	41.3	13%	0.126	21%	0.213	C	C	.	.	S	Bend	trans	-57.3	136	175.2	-68	0	0	0	0	109.8	T408 K410 W411 E415 N416 A417	T408-S413 PolarHBondContact OG1-OG 3.29Å; K410-S413 WeakPolarHBondContact O-CB 3.3Å; K410-S413 PolarHBondContact O-N 3.34Å; K410-S413 PolarHBondContact O-OG 3.01Å; W411-S413 VanDerWaalsContact C-N 3.28Å; W411-S413 PolarHBondContact O-N 3.31Å; S413-E415 WeakPolarHBondContact CB-OE2 3.25Å; S413-E415 PolarHBondContact O-N 2.87Å; S413-N416 PolarHBondContact O-N 3.04Å; S413-A417 WeakPolarHBondContact O-CB 3.13Å; S413-A417 PolarHBondContact O-N 3.07Å
414	P	87.7	Confident	92.1	Very high	102 Å²	102	41.3 Å²	41.3	66%	0.662	21%	0.213	S	C	*	.	H	α-helix	trans	-50.5	-33.8	-176.8	-29	35.3	0	0	0	114.5
415	E	88.4	Confident	92	Very high	74 Å²	74	43.8 Å²	43.8	35%	0.346	23%	0.233	S	C	.	.	H	α-helix	trans	-76.7	-22.3	-177.9	-52.8	80.8	-171.6	0	0	113	L407 S413 N461 H479	L407-E415 HydrophobicContact CD2-CB 3.54Å; L407-E415 HydrophobicContact CD2-CG 3.51Å; S413-E415 WeakPolarHBondContact CB-OE2 3.25Å; S413-E415 PolarHBondContact O-N 2.87Å; E415-N461 PolarHBondContact O-ND2 3.26Å; E415-H479 PolarHBondContact O-CD2 2.99Å
416	N	92.2	Very high	91.9	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-104.6	-34.6	179.3	-64.4	-36.7	0	0	0	112.4	T408 K410 W411 S413 R418 G419 N461 W477 H509	T408-N416 PolarHBondContact O-ND2 2.77Å; K410-N416 WeakPolarHBondContact O-CB 3.45Å; K410-N416 PolarHBondContact O-ND2 3.38Å; W411-N416 CarbonylContact O-C 3.57Å; S413-N416 PolarHBondContact O-N 3.04Å; N416-R418 PolarHBondContact O-N 2.84Å; N416-R418 VanDerWaalsContact O-N 3.08Å; N416-G419 WeakPolarHBondContact O-CA 3.35Å; N416-G419 PolarHBondContact O-N 2.86Å; N416-N461 PolarHBondContact OD1-ND2 3.47Å; N416-W477 HydrophobicContact CB-CE3 4.07Å; N416-W477 HydrophobicContact CB-CZ3 4.01Å; N416-H509 PolarHBondContact O-CD2 3.15Å
417	A	89.1	Confident	91.8	Very high	16 Å²	16	40.2 Å²	40.2	13%	0.132	21%	0.207	C	C	.	.	H	α-helix	trans	-54.8	-37.4	-169.3	0	0	0	0	0	114.3	W411 S413 I510	W411-A417 WeakPolarHBondContact O-CA 3.42Å; W411-A417 VanDerWaalsContact O-CB 3.28Å; W411-A417 WeakPolarHBondContact O-CB 3.47Å; W411-A417 PolarHBondContact O-N 3.12Å; S413-A417 WeakPolarHBondContact O-CB 3.13Å; S413-A417 PolarHBondContact O-N 3.07Å; A417-I510 HydrophobicContact CB-CD1 4.07Å; A417-I510 VanDerWaalsContact O-CD1 3.31Å; A417-I510 WeakPolarHBondContact O-CD1 3.18Å; A417-I510 WeakPolarHBondContact O-CG1 3.28Å
418	R	89.5	Confident	91.4	Very high	209 Å²	209	43.7 Å²	43.7	79%	0.789	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.9	0.2	179.9	-64	-179.7	-176.7	177.5	1.6	113.6	N416 S480	N416-R418 PolarHBondContact O-N 2.84Å; N416-R418 VanDerWaalsContact O-N 3.08Å; R418-S480 WeakPolarHBondContact O-CA 3.27Å; R418-S480 VanDerWaalsContact O-CB 3.3Å; R418-S480 WeakPolarHBondContact O-CB 3.46Å
419	G	92.5	Very high	90.9	Very high	2 Å²	2	46.3 Å²	46.3	2%	0.021	24%	0.24	C	C	.	.			trans	-90.6	-154.2	178.5	0	0	0	0	0	112.9	N416 L478 H509	N416-G419 WeakPolarHBondContact O-CA 3.35Å; N416-G419 PolarHBondContact O-N 2.86Å; G419-L478 WeakPolarHBondContact CA-O 3.27Å; G419-H509 VanDerWaalsContact C-CD2 3.44Å; G419-H509 PolarHBondContact O-N 2.97Å
420	G	93.8	Very high	90.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.6	178	173.5	0	0	0	0	0	112	L478 K507 H509	G420-L478 PolarHBondContact N-O 3.29Å; G420-L478 VanDerWaalsContact N-O 3.15Å; G420-L478 PolarHBondContact O-N 3.48Å; G420-K507 CarbonylContact C-O 3.46Å; G420-K507 VanDerWaalsContact CA-O 3.25Å; G420-K507 WeakPolarHBondContact CA-O 3.31Å; G420-H509 WeakPolarHBondContact CA-CD2 3.2Å; G420-H509 PolarHBondContact N-CD2 3.31Å; G420-H509 VanDerWaalsContact N-CD2 3.27Å; G420-H509 PolarHBondContact O-NE2 3.4Å
421	R	94.4	Very high	90	Very high	12 Å²	12	51.5 Å²	51.5	5%	0.045	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	139.6	177.7	61.3	-176	-177.6	164.6	3.7	111.6	D170 I172 D173 F464 L476 W477 Y506 K507	D170-R421 IonicContact OD1-NH1 2.77Å; I172-R421 VanDerWaalsContact CG2-NH2 3.32Å; D173-R421 IonicContact OD1-CZ 3.62Å; D173-R421 IonicContact OD1-NH2 2.69Å; D173-R421 PolarHBondContact OD1-NH2 3.33Å; D173-R421 IonicContact OD2-CZ 2.96Å; D173-R421 IonicContact OD2-NH2 2.74Å; D173-R421 PolarHBondContact OD2-NH2 2.97Å; R421-F464 HydrophobicContact CB-CE1 4.06Å; R421-F464 HydrophobicContact CB-CZ 4.44Å; R421-L476 CarbonylContact C-O 3.52Å; R421-L476 VanDerWaalsContact CA-O 3.23Å; R421-L476 WeakPolarHBondContact CA-O 3.42Å; R421-W477 HydrophobicContact CB-CG 4.5Å; R421-Y506 CarbonylContact O-C 3.44Å; R421-Y506 VanDerWaalsContact O-CA 3.3Å; R421-Y506 WeakPolarHBondContact O-CA 3.44Å; R421-K507 HydrophobicContact CG-CB 4.43Å; R421-K507 PolarHBondContact N-O 2.77Å; R421-K507 PolarHBondContact O-N 2.78Å
422	V	94.7	Very high	89.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	125.7	165.2	-177.5	0	0	0	0	107.6	G475 L476 L478 F494 A504 F505 Y506	V422-G475 CarbonylContact O-C 3.51Å; V422-G475 WeakPolarHBondContact O-CA 3.35Å; V422-L476 PolarHBondContact N-O 3.35Å; V422-L476 PolarHBondContact O-N 2.93Å; V422-L478 HydrophobicContact CG2-CD1 3.52Å; V422-L478 HydrophobicContact CG2-CG 4.35Å; V422-F494 HydrophobicContact CB-CE2 4.18Å; V422-F494 HydrophobicContact CB-CZ 3.98Å; V422-F494 HydrophobicContact CG1-CD1 4.31Å; V422-F494 HydrophobicContact CG1-CD2 4.16Å; V422-F494 HydrophobicContact CG1-CE1 3.98Å; V422-F494 HydrophobicContact CG1-CE2 3.78Å; V422-F494 HydrophobicContact CG1-CG 4.38Å; V422-F494 HydrophobicContact CG1-CZ 3.7Å; V422-F494 VanDerWaalsContact O-CZ 3.27Å; V422-F494 WeakPolarHBondContact O-CZ 3.13Å; V422-A504 HydrophobicContact CG1-CB 3.78Å; V422-F505 WeakPolarHBondContact CA-O 3.15Å; V422-Y506 HydrophobicContact CG2-CD2 3.63Å; V422-Y506 HydrophobicContact CG2-CG 4.37Å
423	A	95.3	Very high	89.8	Confident	13 Å²	13	49.9 Å²	49.9	11%	0.107	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	152.9	-175.6	0	0	0	0	0	113.3	F464 V474 A504 F505	A423-F464 HydrophobicContact CB-CE1 4.28Å; A423-F464 HydrophobicContact CB-CZ 3.73Å; A423-V474 WeakPolarHBondContact CA-O 3.48Å; A423-A504 WeakPolarHBondContact O-CA 3.38Å; A423-F505 PolarHBondContact N-O 2.72Å; A423-F505 PolarHBondContact O-N 3.1Å
424	V	94.4	Very high	89.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	144.7	169.3	56.2	0	0	0	0	109.7	F426 F444 K473 V474 F494 V498 R502	V424-F426 HydrophobicContact CB-CE2 4.39Å; V424-F426 HydrophobicContact CG1-CE2 3.58Å; V424-F426 HydrophobicContact CG1-CZ 3.9Å; V424-F426 HydrophobicContact CG2-CE2 4.14Å; V424-F426 HydrophobicContact CG2-CZ 4.22Å; V424-F444 HydrophobicContact CG1-CE2 4.37Å; V424-K473 WeakPolarHBondContact O-CA 3.41Å; V424-V474 HydrophobicContact CG1-CB 4.32Å; V424-V474 WeakPolarHBondContact CG1-O 3.18Å; V424-V474 PolarHBondContact N-O 3.24Å; V424-V474 PolarHBondContact O-N 3.15Å; V424-F494 HydrophobicContact CB-CD1 4.29Å; V424-F494 HydrophobicContact CG1-CD1 4.24Å; V424-F494 HydrophobicContact CG1-CE1 4.32Å; V424-V498 HydrophobicContact CG1-CG1 4.35Å; V424-V498 HydrophobicContact CG1-CG2 4Å; V424-V498 HydrophobicContact CG2-CG1 4.03Å; V424-R502 HydrophobicContact CG2-CB 3.47Å; V424-R502 VanDerWaalsContact CG2-CB 3.47Å; V424-R502 HydrophobicContact CG2-CG 4.38Å
425	S	93.4	Very high	89.9	Confident	71 Å²	71	51.2 Å²	51.2	50%	0.497	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	146	179.7	-57	0	0	0	0	111.6	Y472	S425-Y472 CarbonylContact C-O 3.5Å; S425-Y472 VanDerWaalsContact CA-O 3.27Å; S425-Y472 WeakPolarHBondContact CA-O 3.48Å
426	F	92.9	Very high	90	Very high	5 Å²	5	48.3 Å²	48.3	2%	0.022	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.8	176.3	-56.5	-104.7	0	0	0	108.9	V424 G436 V437 S440 G471 Y472 V474 V498 R502	V424-F426 HydrophobicContact CB-CE2 4.39Å; V424-F426 HydrophobicContact CG1-CE2 3.58Å; V424-F426 HydrophobicContact CG1-CZ 3.9Å; V424-F426 HydrophobicContact CG2-CE2 4.14Å; V424-F426 HydrophobicContact CG2-CZ 4.22Å; F426-G436 VanDerWaalsContact CE1-C 3.48Å; F426-V437 HydrophobicContact CB-CB 4.34Å; F426-V437 HydrophobicContact CD1-CB 4.27Å; F426-V437 HydrophobicContact CD2-CB 4.05Å; F426-V437 HydrophobicContact CD2-CG2 4.17Å; F426-V437 HydrophobicContact CE2-CB 4.47Å; F426-V437 HydrophobicContact CG-CB 3.98Å; F426-S440 WeakPolarHBondContact CZ-OG 3.46Å; F426-G471 CarbonylContact O-C 3.5Å; F426-G471 WeakPolarHBondContact O-CA 3.28Å; F426-Y472 HydrophobicContact CB-CD2 4.15Å; F426-Y472 PolarHBondContact N-O 2.97Å; F426-Y472 PolarHBondContact O-N 3.07Å; F426-V474 HydrophobicContact CD2-CG2 4.39Å; F426-V474 HydrophobicContact CE2-CB 4.13Å; F426-V474 HydrophobicContact CE2-CG2 3.96Å; F426-V498 HydrophobicContact CE1-CG1 4.03Å; F426-V498 HydrophobicContact CZ-CG1 3.7Å; F426-R502 VanDerWaalsContact CD1-NH1 3.34Å
427	N	91.3	Very high	90	Very high	91 Å²	91	48.3 Å²	48.3	49%	0.487	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	143.9	174.4	-168	-52.8	0	0	0	110.2	S429 S433	N427-S429 WeakPolarHBondContact OD1-CB 3.23Å; N427-S429 PolarHBondContact OD1-N 3.21Å; N427-S429 PolarHBondContact OD1-OG 3.31Å; N427-S433 WeakPolarHBondContact O-CB 3.28Å
428	R	86.8	Confident	90.1	Very high	83 Å²	83	48.2 Å²	48.2	31%	0.313	26%	0.258	S	S	.	.	S	Bend	trans	-79.4	-27.3	-179.9	-167.7	167	-178.4	-117.2	2.2	114.3	I396 N430 Q434 S469 Y472	I396-R428 VanDerWaalsContact CD1-NH1 3.26Å; R428-N430 VanDerWaalsContact C-N 3.32Å; R428-N430 PolarHBondContact O-N 2.9Å; R428-Q434 PolarHBondContact O-NE2 3.07Å; R428-Q434 VanDerWaalsContact O-NE2 3.1Å; R428-S469 WeakPolarHBondContact CB-O 3.08Å; R428-S469 VanDerWaalsContact CD-O 3.26Å; R428-S469 WeakPolarHBondContact CD-O 3.36Å; R428-Y472 HydrophobicContact CB-CE2 4.22Å; R428-Y472 HydrophobicContact CG-CE2 4.05Å
429	S	82.4	Confident	90.1	Very high	103 Å²	103	40.8 Å²	40.8	72%	0.72	23%	0.233	S	C	*	.	S	Bend	trans	-65.8	-29.3	-168.3	64.7	0	0	0	0	114.3	N427	N427-S429 WeakPolarHBondContact OD1-CB 3.23Å; N427-S429 PolarHBondContact OD1-N 3.21Å; N427-S429 PolarHBondContact OD1-OG 3.31Å
430	N	82.1	Confident	90	Very high	82 Å²	82	41 Å²	41	44%	0.439	23%	0.234	S	C	.	.			trans	-103.5	130.5	-174.4	-168.7	-20	0	0	0	111.8	R428 S432 S433 Q434	R428-N430 VanDerWaalsContact C-N 3.32Å; R428-N430 PolarHBondContact O-N 2.9Å; N430-S432 PolarHBondContact ND2-OG 3.43Å; N430-S432 VanDerWaalsContact ND2-OG 3.13Å; N430-S432 PolarHBondContact O-N 3.23Å; N430-S432 PolarHBondContact OD1-N 2.89Å; N430-S432 PolarHBondContact OD1-OG 2.94Å; N430-S432 VanDerWaalsContact OD1-OG 3.05Å; N430-S433 WeakPolarHBondContact O-CA 3.3Å; N430-S433 WeakPolarHBondContact O-CB 3.33Å; N430-S433 PolarHBondContact O-N 2.84Å; N430-Q434 PolarHBondContact O-N 3.25Å; N430-Q434 VanDerWaalsContact O-N 3.09Å
431	V	85.1	Confident	90.1	Very high	93 Å²	93	41 Å²	41	56%	0.564	23%	0.234	S	C	*	.	H	α-helix	trans	-53.3	-37.4	173.2	179.5	0	0	0	0	111.9	S433 Q434 Q435	V431-S433 VanDerWaalsContact C-N 3.26Å; V431-S433 PolarHBondContact O-N 3.2Å; V431-Q434 WeakPolarHBondContact O-CB 3.24Å; V431-Q434 PolarHBondContact O-N 3.08Å; V431-Q435 PolarHBondContact O-N 3.08Å
432	S	86.2	Confident	90	Very high	61 Å²	61	40.6 Å²	40.6	43%	0.427	23%	0.233	S	C	.	.	H	α-helix	trans	-63.9	-32.7	176.4	69.9	0	0	0	0	112.5	N430 G436	N430-S432 PolarHBondContact ND2-OG 3.43Å; N430-S432 VanDerWaalsContact ND2-OG 3.13Å; N430-S432 PolarHBondContact O-N 3.23Å; N430-S432 PolarHBondContact OD1-N 2.89Å; N430-S432 PolarHBondContact OD1-OG 2.94Å; N430-S432 VanDerWaalsContact OD1-OG 3.05Å; S432-G436 PolarHBondContact O-N 3.38Å
433	S	86.1	Confident	89.6	Confident	12 Å²	12	42.7 Å²	42.7	8%	0.084	24%	0.241	C	C	.	.	H	α-helix	trans	-76.2	-33.6	176.7	-65.2	0	0	0	0	111.7	N427 N430 V431 G436 V437 R502	N427-S433 WeakPolarHBondContact O-CB 3.28Å; N430-S433 WeakPolarHBondContact O-CA 3.3Å; N430-S433 WeakPolarHBondContact O-CB 3.33Å; N430-S433 PolarHBondContact O-N 2.84Å; V431-S433 VanDerWaalsContact C-N 3.26Å; V431-S433 PolarHBondContact O-N 3.2Å; S433-G436 PolarHBondContact O-N 2.85Å; S433-V437 PolarHBondContact O-N 2.8Å; S433-R502 PolarHBondContact OG-NH2 3.34Å
434	Q	89.1	Confident	89.5	Confident	60 Å²	60	42 Å²	42	28%	0.28	24%	0.236	S	C	.	.	H	α-helix	trans	-64.6	-40.6	170.4	-65.3	-178	16.8	0	0	112.4	R428 N430 V431 V437 N438 Y472	R428-Q434 PolarHBondContact O-NE2 3.07Å; R428-Q434 VanDerWaalsContact O-NE2 3.1Å; N430-Q434 PolarHBondContact O-N 3.25Å; N430-Q434 VanDerWaalsContact O-N 3.09Å; V431-Q434 WeakPolarHBondContact O-CB 3.24Å; V431-Q434 PolarHBondContact O-N 3.08Å; Q434-V437 WeakPolarHBondContact O-CG1 3.3Å; Q434-N438 VanDerWaalsContact O-CG 3.25Å; Q434-N438 PolarHBondContact O-N 3.18Å; Q434-N438 PolarHBondContact O-ND2 3.31Å; Q434-Y472 HydrophobicContact CG-CE2 4.08Å
435	Q	89.1	Confident	89.4	Confident	89 Å²	89	42 Å²	42	42%	0.416	24%	0.236	S	C	.	.	H	α-helix	trans	-66.5	-41.7	171.3	-70.7	-179.2	-24.5	0	0	111.1	V431 V437 N438 M439	V431-Q435 PolarHBondContact O-N 3.08Å; Q435-V437 PolarHBondContact O-N 3.45Å; Q435-N438 PolarHBondContact O-N 3.15Å; Q435-M439 WeakPolarHBondContact O-CG 3.25Å; Q435-M439 PolarHBondContact O-N 3.01Å
436	G	89	Confident	89.1	Confident	13 Å²	13	39.9 Å²	39.9	13%	0.134	22%	0.219	C	C	.	.	H	α-helix	trans	-58.6	-43.6	177.6	0	0	0	0	0	113.7	F426 S432 S433 S440	F426-G436 VanDerWaalsContact CE1-C 3.48Å; S432-G436 PolarHBondContact O-N 3.38Å; S433-G436 PolarHBondContact O-N 2.85Å; G436-S440 VanDerWaalsContact O-CB 3.27Å; G436-S440 WeakPolarHBondContact O-CB 3.3Å; G436-S440 PolarHBondContact O-N 3.46Å; G436-S440 PolarHBondContact O-OG 3.37Å
437	V	92.7	Very high	88.7	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.2	-43.4	177	63.4	0	0	0	0	111.3	P391 F426 S433 Q434 Q435 M439 S440 W441 V465 Y472 V474	P391-V437 HydrophobicContact CB-CG2 4.14Å; F426-V437 HydrophobicContact CB-CB 4.34Å; F426-V437 HydrophobicContact CD1-CB 4.27Å; F426-V437 HydrophobicContact CD2-CB 4.05Å; F426-V437 HydrophobicContact CD2-CG2 4.17Å; F426-V437 HydrophobicContact CE2-CB 4.47Å; F426-V437 HydrophobicContact CG-CB 3.98Å; S433-V437 PolarHBondContact O-N 2.8Å; Q434-V437 WeakPolarHBondContact O-CG1 3.3Å; Q435-V437 PolarHBondContact O-N 3.45Å; V437-M439 PolarHBondContact O-N 2.88Å; V437-S440 PolarHBondContact O-N 2.93Å; V437-W441 VanDerWaalsContact O-CB 3.32Å; V437-W441 WeakPolarHBondContact O-CB 3.49Å; V437-W441 PolarHBondContact O-N 3.06Å; V437-V465 HydrophobicContact CG2-CG2 4.12Å; V437-Y472 HydrophobicContact CB-CD2 4.17Å; V437-Y472 HydrophobicContact CB-CG 4.03Å; V437-Y472 HydrophobicContact CG1-CD1 4.13Å; V437-Y472 HydrophobicContact CG1-CD2 3.82Å; V437-Y472 HydrophobicContact CG1-CE1 4.35Å; V437-Y472 HydrophobicContact CG1-CE2 4.05Å; V437-Y472 HydrophobicContact CG1-CG 3.87Å; V437-Y472 VanDerWaalsContact CG2-CB 3.44Å; V437-Y472 HydrophobicContact CG2-CD1 4.09Å; V437-Y472 HydrophobicContact CG2-CD2 4.37Å; V437-Y472 HydrophobicContact CG2-CG 3.73Å; V437-V474 HydrophobicContact CG2-CG2 3.41Å; V437-V474 VanDerWaalsContact CG2-CG2 3.41Å
438	N	91.9	Very high	88.6	Confident	14 Å²	14	35.5 Å²	35.5	8%	0.075	20%	0.196	C	C	.	.	H	α-helix	trans	-62.7	-45.7	179.5	-67.5	-19.5	0	0	0	111.5	P391 S392 Q434 Q435 W441 L442	P391-N438 VanDerWaalsContact CD-OD1 3.26Å; P391-N438 WeakPolarHBondContact CD-OD1 3.24Å; S392-N438 WeakPolarHBondContact CB-OD1 3.44Å; S392-N438 PolarHBondContact N-OD1 2.83Å; S392-N438 PolarHBondContact OG-ND2 2.81Å; S392-N438 PolarHBondContact OG-OD1 3.48Å; Q434-N438 VanDerWaalsContact O-CG 3.25Å; Q434-N438 PolarHBondContact O-N 3.18Å; Q434-N438 PolarHBondContact O-ND2 3.31Å; Q435-N438 PolarHBondContact O-N 3.15Å; N438-W441 PolarHBondContact O-N 3.47Å; N438-L442 PolarHBondContact O-N 2.77Å; N438-L442 VanDerWaalsContact O-N 3.14Å
439	M	89.4	Confident	88.7	Confident	53 Å²	53	32 Å²	32	26%	0.261	18%	0.183	S	C	.	.	H	α-helix	trans	-65.3	-42.6	177	-69.9	-53.9	-65.5	0	0	111.7	Q435 V437 L442 K443	Q435-M439 WeakPolarHBondContact O-CG 3.25Å; Q435-M439 PolarHBondContact O-N 3.01Å; V437-M439 PolarHBondContact O-N 2.88Å; M439-L442 PolarHBondContact O-N 3.39Å; M439-K443 WeakPolarHBondContact O-CB 3.34Å; M439-K443 VanDerWaalsContact O-CG 3.29Å; M439-K443 WeakPolarHBondContact O-CG 3.45Å; M439-K443 PolarHBondContact O-N 2.81Å
440	S	91	Very high	88.5	Confident	5 Å²	5	29.4 Å²	29.4	4%	0.035	17%	0.165	C	C	.	.	H	α-helix	trans	-64.2	-44.1	179.3	-58.5	0	0	0	0	111.1	F426 G436 V437 L442 K443 F444	F426-S440 WeakPolarHBondContact CZ-OG 3.46Å; G436-S440 VanDerWaalsContact O-CB 3.27Å; G436-S440 WeakPolarHBondContact O-CB 3.3Å; G436-S440 PolarHBondContact O-N 3.46Å; G436-S440 PolarHBondContact O-OG 3.37Å; V437-S440 PolarHBondContact O-N 2.93Å; S440-L442 PolarHBondContact O-N 2.88Å; S440-K443 PolarHBondContact O-N 2.89Å; S440-F444 WeakPolarHBondContact O-CD2 3.28Å; S440-F444 PolarHBondContact O-N 3.4Å
441	W	94.4	Very high	88.3	Confident	2 Å²	2	26.6 Å²	26.6	1%	0.008	16%	0.155	C	C	.	.	H	α-helix	trans	-53.6	-51.8	174.5	173.9	-119.4	0	0	0	111.6	W352 P391 Y400 I402 V437 N438 K443 F444 I445 I463 V465 V474	W352-W441 HydrophobicContact CZ2-CZ2 4.12Å; P391-W441 HydrophobicContact CG-CB 3.77Å; P391-W441 VanDerWaalsContact CG-CD1 3.45Å; P391-W441 HydrophobicContact CG-CD2 4.38Å; P391-W441 HydrophobicContact CG-CG 3.59Å; Y400-W441 HydrophobicContact CD2-CZ2 4.5Å; I402-W441 HydrophobicContact CD1-CH2 3.87Å; I402-W441 HydrophobicContact CD1-CZ2 3.72Å; I402-W441 HydrophobicContact CG1-CH2 4.14Å; I402-W441 HydrophobicContact CG1-CZ2 4.29Å; V437-W441 VanDerWaalsContact O-CB 3.32Å; V437-W441 WeakPolarHBondContact O-CB 3.49Å; V437-W441 PolarHBondContact O-N 3.06Å; N438-W441 PolarHBondContact O-N 3.47Å; W441-K443 PolarHBondContact O-N 2.87Å; W441-F444 PolarHBondContact O-N 3.11Å; W441-I445 HydrophobicContact CD2-CD1 3.73Å; W441-I445 HydrophobicContact CD2-CG1 4.21Å; W441-I445 HydrophobicContact CE3-CD1 4.4Å; W441-I445 HydrophobicContact CE3-CG1 4.41Å; W441-I445 HydrophobicContact CG-CD1 4.07Å; W441-I445 HydrophobicContact CH2-CD1 4.29Å; W441-I445 HydrophobicContact CH2-CG1 4.36Å; W441-I445 HydrophobicContact CZ2-CD1 3.6Å; W441-I445 HydrophobicContact CZ2-CG1 4.16Å; W441-I445 HydrophobicContact CZ3-CG1 4.49Å; W441-I445 VanDerWaalsContact NE1-CD1 3.32Å; W441-I445 VanDerWaalsContact O-CG1 3.26Å; W441-I445 WeakPolarHBondContact O-CG1 3.27Å; W441-I445 PolarHBondContact O-N 3.14Å; W441-I463 HydrophobicContact CE3-CG2 4.14Å; W441-I463 HydrophobicContact CH2-CG2 4.39Å; W441-I463 HydrophobicContact CZ3-CB 4.14Å; W441-I463 HydrophobicContact CZ3-CG2 3.57Å; W441-V465 HydrophobicContact CD2-CB 4.16Å; W441-V465 HydrophobicContact CD2-CG1 3.66Å; W441-V465 HydrophobicContact CE3-CB 3.72Å; W441-V465 HydrophobicContact CE3-CG1 3.59Å; W441-V465 HydrophobicContact CG-CG1 4.31Å; W441-V465 HydrophobicContact CH2-CG1 4.03Å; W441-V465 HydrophobicContact CZ2-CG1 4.08Å; W441-V465 HydrophobicContact CZ3-CB 4.05Å; W441-V465 HydrophobicContact CZ3-CG1 3.78Å; W441-V474 HydrophobicContact CE3-CG1 4.29Å
442	L	92	Very high	87.6	Confident	3 Å²	3	23.3 Å²	23.3	2%	0.016	13%	0.134	C	C	.	.	H	α-helix	trans	-61.9	-45.6	177.5	179.8	59.1	0	0	0	112.6	Y268 F381 W382 Y385 N438 M439 S440 F444 I445 I446	Y268-L442 HydrophobicContact CE1-CD2 4.07Å; Y268-L442 HydrophobicContact CE2-CD2 3.76Å; Y268-L442 WeakPolarHBondContact OH-CD2 3.31Å; F381-L442 HydrophobicContact CE1-CD1 4.46Å; F381-L442 HydrophobicContact CZ-CD1 3.83Å; W382-L442 HydrophobicContact CH2-CD1 4.16Å; W382-L442 HydrophobicContact CZ3-CD1 4.25Å; Y385-L442 HydrophobicContact CD1-CD1 4.34Å; Y385-L442 HydrophobicContact CD2-CD1 4.19Å; Y385-L442 HydrophobicContact CE1-CD1 3.94Å; Y385-L442 HydrophobicContact CE1-CD2 4.13Å; Y385-L442 HydrophobicContact CE2-CB 4.24Å; Y385-L442 HydrophobicContact CE2-CD1 3.79Å; Y385-L442 HydrophobicContact CE2-CG 4.48Å; Y385-L442 HydrophobicContact CG-CD1 4.47Å; N438-L442 PolarHBondContact O-N 2.77Å; N438-L442 VanDerWaalsContact O-N 3.14Å; M439-L442 PolarHBondContact O-N 3.39Å; S440-L442 PolarHBondContact O-N 2.88Å; L442-F444 VanDerWaalsContact C-N 3.32Å; L442-F444 PolarHBondContact O-N 3Å; L442-I445 PolarHBondContact O-N 2.84Å; L442-I445 VanDerWaalsContact O-N 3.15Å; L442-I446 HydrophobicContact CD1-CD1 3.72Å; L442-I446 HydrophobicContact CD1-CG1 3.92Å; L442-I446 HydrophobicContact CD2-CD1 4.37Å; L442-I446 HydrophobicContact CG-CD1 3.76Å; L442-I446 HydrophobicContact CG-CG1 4.34Å; L442-I446 WeakPolarHBondContact O-CG1 3.11Å; L442-I446 PolarHBondContact O-N 2.77Å
443	K	88.1	Confident	87.3	Confident	43 Å²	43	21 Å²	21	19%	0.187	12%	0.117	C	C	.	.	H	α-helix	trans	-57.9	-43.4	178.7	-77.3	-178.6	179.9	-170.7	0	111.7	M439 S440 W441 A447 L497	M439-K443 WeakPolarHBondContact O-CB 3.34Å; M439-K443 VanDerWaalsContact O-CG 3.29Å; M439-K443 WeakPolarHBondContact O-CG 3.45Å; M439-K443 PolarHBondContact O-N 2.81Å; S440-K443 PolarHBondContact O-N 2.89Å; W441-K443 PolarHBondContact O-N 2.87Å; K443-A447 VanDerWaalsContact O-CB 3.26Å; K443-A447 WeakPolarHBondContact O-CB 3.34Å; K443-A447 PolarHBondContact O-N 2.96Å; K443-L497 HydrophobicContact CB-CD2 4.29Å; K443-L497 WeakPolarHBondContact CD-O 3.36Å; K443-L497 PolarHBondContact NZ-O 3.28Å
444	F	91.2	Very high	86.8	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.1	-44.5	174.8	-80	-67	0	0	0	112.2	V424 S440 W441 L442 A447 V448 I463 V474 L476 F494 L497 V498	V424-F444 HydrophobicContact CG1-CE2 4.37Å; S440-F444 WeakPolarHBondContact O-CD2 3.28Å; S440-F444 PolarHBondContact O-N 3.4Å; W441-F444 PolarHBondContact O-N 3.11Å; L442-F444 VanDerWaalsContact C-N 3.32Å; L442-F444 PolarHBondContact O-N 3Å; F444-A447 PolarHBondContact O-N 3.01Å; F444-V448 WeakPolarHBondContact O-CB 3.44Å; F444-V448 VanDerWaalsContact O-CG2 3.27Å; F444-V448 WeakPolarHBondContact O-CG2 3.09Å; F444-V448 PolarHBondContact O-N 2.93Å; F444-V448 VanDerWaalsContact O-N 3.08Å; F444-I463 HydrophobicContact CB-CG2 3.88Å; F444-V474 HydrophobicContact CD2-CG1 3.56Å; F444-V474 HydrophobicContact CE2-CG1 4Å; F444-L476 HydrophobicContact CD1-CD1 4.47Å; F444-L476 HydrophobicContact CD1-CD2 4.1Å; F444-L476 HydrophobicContact CD1-CG 4.22Å; F444-L476 HydrophobicContact CE1-CG 4.44Å; F444-F494 HydrophobicContact CD1-CE2 4.5Å; F444-F494 HydrophobicContact CE1-CD1 4.09Å; F444-F494 AromaticContact CE1-CD2 3.67Å; F444-F494 HydrophobicContact CE1-CD2 3.67Å; F444-F494 AromaticContact CE1-CE1 3.85Å; F444-F494 HydrophobicContact CE1-CE1 3.85Å; F444-F494 AromaticContact CE1-CE2 3.44Å; F444-F494 HydrophobicContact CE1-CE2 3.44Å; F444-F494 VanDerWaalsContact CE1-CE2 3.44Å; F444-F494 HydrophobicContact CE1-CG 4.03Å; F444-F494 AromaticContact CE1-CZ 3.53Å; F444-F494 HydrophobicContact CE1-CZ 3.53Å; F444-F494 HydrophobicContact CE2-CD1 4.37Å; F444-F494 HydrophobicContact CE2-CE1 4.16Å; F444-F494 AromaticContact CZ-CD1 3.44Å; F444-F494 HydrophobicContact CZ-CD1 3.44Å; F444-F494 VanDerWaalsContact CZ-CD1 3.44Å; F444-F494 AromaticContact CZ-CD2 3.86Å; F444-F494 HydrophobicContact CZ-CD2 3.86Å; F444-F494 AromaticContact CZ-CE1 3.37Å; F444-F494 HydrophobicContact CZ-CE1 3.37Å; F444-F494 AromaticContact CZ-CE2 3.83Å; F444-F494 HydrophobicContact CZ-CE2 3.83Å; F444-F494 AromaticContact CZ-CG 3.7Å; F444-F494 HydrophobicContact CZ-CG 3.7Å; F444-F494 AromaticContact CZ-CZ 3.59Å; F444-F494 HydrophobicContact CZ-CZ 3.59Å; F444-L497 HydrophobicContact CD1-CD1 3.63Å; F444-L497 HydrophobicContact CE1-CD1 3.53Å; F444-L497 HydrophobicContact CG-CD1 4.32Å; F444-L497 HydrophobicContact CZ-CB 4.47Å; F444-L497 HydrophobicContact CZ-CD1 4.15Å; F444-V498 HydrophobicContact CE2-CG2 3.69Å; F444-V498 HydrophobicContact CZ-CG2 3.91Å
445	I	92.5	Very high	86.7	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-58.4	-52.6	178.2	-65	164.6	0	0	0	111	F381 Y385 I402 W441 L442 A447 V448 L449 I463	F381-I445 HydrophobicContact CD2-CG2 3.87Å; F381-I445 HydrophobicContact CE1-CG2 4.49Å; F381-I445 HydrophobicContact CE2-CB 4.3Å; F381-I445 HydrophobicContact CE2-CD1 4.28Å; F381-I445 HydrophobicContact CE2-CG2 3.27Å; F381-I445 HydrophobicContact CZ-CB 4.4Å; F381-I445 HydrophobicContact CZ-CG2 3.63Å; Y385-I445 HydrophobicContact CD2-CD1 4.46Å; I402-I445 HydrophobicContact CD1-CD1 3.79Å; I402-I445 HydrophobicContact CD1-CG1 3.76Å; I402-I445 HydrophobicContact CD1-CG2 4.27Å; W441-I445 HydrophobicContact CD2-CD1 3.73Å; W441-I445 HydrophobicContact CD2-CG1 4.21Å; W441-I445 HydrophobicContact CE3-CD1 4.4Å; W441-I445 HydrophobicContact CE3-CG1 4.41Å; W441-I445 HydrophobicContact CG-CD1 4.07Å; W441-I445 HydrophobicContact CH2-CD1 4.29Å; W441-I445 HydrophobicContact CH2-CG1 4.36Å; W441-I445 HydrophobicContact CZ2-CD1 3.6Å; W441-I445 HydrophobicContact CZ2-CG1 4.16Å; W441-I445 HydrophobicContact CZ3-CG1 4.49Å; W441-I445 VanDerWaalsContact NE1-CD1 3.32Å; W441-I445 VanDerWaalsContact O-CG1 3.26Å; W441-I445 WeakPolarHBondContact O-CG1 3.27Å; W441-I445 PolarHBondContact O-N 3.14Å; L442-I445 PolarHBondContact O-N 2.84Å; L442-I445 VanDerWaalsContact O-N 3.15Å; I445-A447 PolarHBondContact O-N 3Å; I445-V448 PolarHBondContact O-N 3.13Å; I445-L449 HydrophobicContact CG2-CD1 4.02Å; I445-L449 HydrophobicContact CG2-CD2 3.61Å; I445-L449 HydrophobicContact CG2-CG 4.3Å; I445-L449 WeakPolarHBondContact O-CB 3.08Å; I445-L449 WeakPolarHBondContact O-CD1 3.44Å; I445-L449 PolarHBondContact O-N 3.46Å; I445-I463 HydrophobicContact CB-CD1 4.38Å; I445-I463 HydrophobicContact CG1-CD1 4.18Å
446	I	87.5	Confident	86.7	Confident	25 Å²	25	24.6 Å²	24.6	13%	0.128	13%	0.131	C	C	.	.	H	α-helix	trans	-58.3	-52.1	-179.4	-67.3	172.7	0	0	0	109.8	L254 F381 W382 L442 V448 L449 S450	L254-I446 HydrophobicContact CD2-CD1 4.17Å; F381-I446 HydrophobicContact CE1-CG1 4.5Å; W382-I446 HydrophobicContact CH2-CD1 4.17Å; W382-I446 HydrophobicContact CZ2-CD1 4.3Å; L442-I446 HydrophobicContact CD1-CD1 3.72Å; L442-I446 HydrophobicContact CD1-CG1 3.92Å; L442-I446 HydrophobicContact CD2-CD1 4.37Å; L442-I446 HydrophobicContact CG-CD1 3.76Å; L442-I446 HydrophobicContact CG-CG1 4.34Å; L442-I446 WeakPolarHBondContact O-CG1 3.11Å; L442-I446 PolarHBondContact O-N 2.77Å; I446-V448 PolarHBondContact O-N 3.48Å; I446-L449 PolarHBondContact O-N 2.93Å; I446-S450 VanDerWaalsContact O-CB 3.26Å; I446-S450 WeakPolarHBondContact O-CB 3.36Å; I446-S450 PolarHBondContact O-N 2.77Å; I446-S450 PolarHBondContact O-OG 3.34Å
447	A	85.3	Confident	86.6	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-56.7	-37.4	-177	0	0	0	0	0	113.2	K443 F444 I445 Q452 L453 L497	K443-A447 VanDerWaalsContact O-CB 3.26Å; K443-A447 WeakPolarHBondContact O-CB 3.34Å; K443-A447 PolarHBondContact O-N 2.96Å; F444-A447 PolarHBondContact O-N 3.01Å; I445-A447 PolarHBondContact O-N 3Å; A447-Q452 PolarHBondContact O-N 3.39Å; A447-Q452 VanDerWaalsContact O-N 3.08Å; A447-L453 HydrophobicContact CB-CD2 4.22Å; A447-L453 HydrophobicContact CB-CG 4.29Å; A447-L497 HydrophobicContact CB-CD1 4.27Å; A447-L497 HydrophobicContact CB-CD2 4.48Å
448	V	89.2	Confident	86.5	Confident	5 Å²	5	29.5 Å²	29.5	3%	0.03	15%	0.154	C	C	.	.	H	α-helix	trans	-81.2	-49.6	-179.1	173.6	0	0	0	0	111.9	W350 F444 I445 I446 S450 G451 L453 I460 I463 L476	W350-V448 HydrophobicContact CH2-CG1 3.31Å; W350-V448 HydrophobicContact CZ2-CG1 3.52Å; W350-V448 HydrophobicContact CZ3-CG1 4.01Å; F444-V448 WeakPolarHBondContact O-CB 3.44Å; F444-V448 VanDerWaalsContact O-CG2 3.27Å; F444-V448 WeakPolarHBondContact O-CG2 3.09Å; F444-V448 PolarHBondContact O-N 2.93Å; F444-V448 VanDerWaalsContact O-N 3.08Å; I445-V448 PolarHBondContact O-N 3.13Å; I446-V448 PolarHBondContact O-N 3.48Å; V448-S450 PolarHBondContact O-N 3.16Å; V448-G451 PolarHBondContact O-N 2.87Å; V448-L453 HydrophobicContact CG2-CD1 3.96Å; V448-I460 HydrophobicContact CG1-CG2 4.18Å; V448-I460 HydrophobicContact CG2-CD1 3.89Å; V448-I463 HydrophobicContact CB-CD1 3.61Å; V448-I463 HydrophobicContact CB-CG1 4.21Å; V448-I463 HydrophobicContact CG1-CD1 3.89Å; V448-I463 HydrophobicContact CG1-CG1 4.13Å; V448-I463 HydrophobicContact CG2-CD1 3.83Å; V448-I463 HydrophobicContact CG2-CG1 4.09Å; V448-L476 HydrophobicContact CG2-CD2 3.89Å
449	L	87.6	Confident	86.6	Confident	9 Å²	9	30.9 Å²	30.9	5%	0.047	16%	0.158	C	C	.	.	H	α-helix	trans	-67.6	-37.1	-175.4	-88.2	54.2	0	0	0	111.7	L346 W350 I375 F381 I402 I445 I446 G451 I463	L346-L449 HydrophobicContact CD1-CB 4.3Å; L346-L449 HydrophobicContact CD1-CD2 4.24Å; L346-L449 HydrophobicContact CD1-CG 4.13Å; W350-L449 HydrophobicContact CD2-CD1 4.03Å; W350-L449 HydrophobicContact CG-CD1 4.12Å; W350-L449 HydrophobicContact CG-CG 4.33Å; I375-L449 HydrophobicContact CG2-CD2 4.23Å; F381-L449 HydrophobicContact CB-CD2 4.24Å; F381-L449 HydrophobicContact CD2-CD2 3.87Å; F381-L449 HydrophobicContact CG-CD2 3.99Å; I402-L449 HydrophobicContact CG2-CD1 4.17Å; I445-L449 HydrophobicContact CG2-CD1 4.02Å; I445-L449 HydrophobicContact CG2-CD2 3.61Å; I445-L449 HydrophobicContact CG2-CG 4.3Å; I445-L449 WeakPolarHBondContact O-CB 3.08Å; I445-L449 WeakPolarHBondContact O-CD1 3.44Å; I445-L449 PolarHBondContact O-N 3.46Å; I446-L449 PolarHBondContact O-N 2.93Å; L449-G451 PolarHBondContact O-N 3.46Å; L449-I463 HydrophobicContact CD1-CD1 4.16Å
450	S	79.4	Confident	86.9	Confident	48 Å²	48	28.4 Å²	28.4	34%	0.336	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-6.9	178	75.3	0	0	0	0	113.5	I446 V448 Q452	I446-S450 VanDerWaalsContact O-CB 3.26Å; I446-S450 WeakPolarHBondContact O-CB 3.36Å; I446-S450 PolarHBondContact O-N 2.77Å; I446-S450 PolarHBondContact O-OG 3.34Å; V448-S450 PolarHBondContact O-N 3.16Å; S450-Q452 VanDerWaalsContact C-N 3.33Å; S450-Q452 PolarHBondContact O-N 3.48Å; S450-Q452 WeakPolarHBondContact OG-CG 3.48Å
451	G	78	Confident	87.1	Confident	23 Å²	23	28.4 Å²	28.4	24%	0.237	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	23.3	-176.9	0	0	0	0	0	114.5	V448 L449 L453 E454	V448-G451 PolarHBondContact O-N 2.87Å; L449-G451 PolarHBondContact O-N 3.46Å; G451-L453 PolarHBondContact O-N 3.45Å; G451-E454 PolarHBondContact O-N 3.46Å
452	Q	70.1	Confident	87.3	Confident	25 Å²	25	28.3 Å²	28.3	12%	0.117	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-18.2	-177.4	-85.8	166.6	3.3	0	0	113.7	F248 A447 S450 E454	F248-Q452 HydrophobicContact CB-CG 4.01Å; F248-Q452 HydrophobicContact CD1-CB 4.08Å; F248-Q452 HydrophobicContact CD1-CG 4.13Å; F248-Q452 VanDerWaalsContact CD1-OE1 3.3Å; F248-Q452 HydrophobicContact CG-CG 4.41Å; A447-Q452 PolarHBondContact O-N 3.39Å; A447-Q452 VanDerWaalsContact O-N 3.08Å; S450-Q452 VanDerWaalsContact C-N 3.33Å; S450-Q452 PolarHBondContact O-N 3.48Å; S450-Q452 WeakPolarHBondContact OG-CG 3.48Å; Q452-E454 PolarHBondContact O-N 2.88Å
453	L	78.8	Confident	87.5	Confident	13 Å²	13	28.1 Å²	28.1	7%	0.068	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	10.4	178.8	-52.9	177.9	0	0	0	112.8	A447 V448 G451 F455 L456 I460 V493	A447-L453 HydrophobicContact CB-CD2 4.22Å; A447-L453 HydrophobicContact CB-CG 4.29Å; V448-L453 HydrophobicContact CG2-CD1 3.96Å; G451-L453 PolarHBondContact O-N 3.45Å; L453-F455 PolarHBondContact O-N 3.01Å; L453-L456 HydrophobicContact CB-CB 4.13Å; L453-L456 VanDerWaalsContact O-CB 3.28Å; L453-L456 WeakPolarHBondContact O-CB 3.01Å; L453-L456 PolarHBondContact O-N 3.38Å; L453-I460 HydrophobicContact CD1-CD1 3.52Å; L453-V493 HydrophobicContact CD2-CG1 3.61Å; L453-V493 HydrophobicContact CD2-CG2 4.12Å
454	E	77.2	Confident	88	Confident	124 Å²	124	26.1 Å²	26.1	58%	0.579	14%	0.136	S	C	*	.	G	3₁₀ helix	trans	48.2	-120	174.6	-59.2	-176.5	173.6	0	0	112.6	G451 Q452 L456 C457	G451-E454 PolarHBondContact O-N 3.46Å; Q452-E454 PolarHBondContact O-N 2.88Å; E454-L456 PolarHBondContact O-N 3.49Å; E454-C457 WeakPolarHBondContact O-CB 3.5Å; E454-C457 PolarHBondContact O-N 3.29Å
455	F	86.2	Confident	88.2	Confident	102 Å²	102	26.1 Å²	26.1	45%	0.447	14%	0.136	S	C	.	.	G	3₁₀ helix	trans	-67.5	-21.6	-178.7	65.8	-87.2	0	0	0	113.2	L453 C457 I458	L453-F455 PolarHBondContact O-N 3.01Å; F455-C457 VanDerWaalsContact C-N 3.27Å; F455-C457 PolarHBondContact O-N 3.32Å; F455-I458 WeakPolarHBondContact O-CD1 3.46Å; F455-I458 VanDerWaalsContact O-CG1 3.24Å; F455-I458 WeakPolarHBondContact O-CG1 3.25Å
456	L	89.2	Confident	88.4	Confident	9 Å²	9	26.3 Å²	26.3	5%	0.047	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-69.6	-25.7	177.4	-65.2	173.9	0	0	0	112.3	L453 E454 I458 Y459 D486 Q489 F490 V493	L453-L456 HydrophobicContact CB-CB 4.13Å; L453-L456 VanDerWaalsContact O-CB 3.28Å; L453-L456 WeakPolarHBondContact O-CB 3.01Å; L453-L456 PolarHBondContact O-N 3.38Å; E454-L456 PolarHBondContact O-N 3.49Å; L456-I458 PolarHBondContact O-N 3.48Å; L456-I458 VanDerWaalsContact O-N 3.08Å; L456-Y459 PolarHBondContact O-N 2.87Å; L456-D486 HydrophobicContact CD2-CB 4.39Å; L456-Q489 HydrophobicContact CD1-CB 4.12Å; L456-Q489 HydrophobicContact CD2-CB 4.23Å; L456-F490 HydrophobicContact CB-CE1 3.93Å; L456-F490 HydrophobicContact CB-CE2 4.43Å; L456-F490 HydrophobicContact CB-CZ 3.75Å; L456-F490 HydrophobicContact CD1-CD1 4.44Å; L456-F490 HydrophobicContact CD1-CE1 4.38Å; L456-F490 HydrophobicContact CD2-CD2 4.33Å; L456-F490 HydrophobicContact CD2-CE2 3.95Å; L456-F490 HydrophobicContact CD2-CZ 4.12Å; L456-F490 HydrophobicContact CG-CZ 4.4Å; L456-V493 HydrophobicContact CD1-CG2 4.03Å
457	C	87.4	Confident	88.7	Confident	10 Å²	10	25.1 Å²	25.1	7%	0.068	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-56.3	-27.3	180	-74.2	0	0	0	0	113.4	K404 E454 F455 Y459 I460	K404-C457 PolarHBondContact NZ-O 3.47Å; K404-C457 VanDerWaalsContact NZ-O 3.15Å; E454-C457 WeakPolarHBondContact O-CB 3.5Å; E454-C457 PolarHBondContact O-N 3.29Å; F455-C457 VanDerWaalsContact C-N 3.27Å; F455-C457 PolarHBondContact O-N 3.32Å; C457-Y459 VanDerWaalsContact C-N 3.27Å; C457-Y459 PolarHBondContact O-N 2.9Å; C457-I460 PolarHBondContact O-N 3.02Å
458	I	90.9	Very high	89.1	Confident	106 Å²	106	25.8 Å²	25.8	54%	0.544	13%	0.133	S	C	.	.	G	3₁₀ helix	trans	-65.3	-34	179.3	75.4	-169.6	0	0	0	111.5	F455 L456 I460	F455-I458 WeakPolarHBondContact O-CD1 3.46Å; F455-I458 VanDerWaalsContact O-CG1 3.24Å; F455-I458 WeakPolarHBondContact O-CG1 3.25Å; L456-I458 PolarHBondContact O-N 3.48Å; L456-I458 VanDerWaalsContact O-N 3.08Å; I458-I460 VanDerWaalsContact C-N 3.35Å
459	Y	94.3	Very high	89.1	Confident	44 Å²	44	27 Å²	27	17%	0.173	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-84.8	-7.5	-178.2	-56.8	-61.9	0	0	0	113.3	L456 C457 L478 H479 D481 C482 D486	L456-Y459 PolarHBondContact O-N 2.87Å; C457-Y459 VanDerWaalsContact C-N 3.27Å; C457-Y459 PolarHBondContact O-N 2.9Å; Y459-L478 CarbonylContact O-C 3.44Å; Y459-L478 VanDerWaalsContact O-CA 3.24Å; Y459-L478 WeakPolarHBondContact O-CA 3.19Å; Y459-H479 PolarHBondContact O-N 2.8Å; Y459-D481 HydrophobicContact CD1-CB 4.33Å; Y459-D481 HydrophobicContact CE1-CB 4.11Å; Y459-C482 HydrophobicContact CD1-CB 4.33Å; Y459-C482 HydrophobicContact CG-CB 4.3Å; Y459-D486 HydrophobicContact CD2-CB 4.36Å; Y459-D486 HydrophobicContact CE2-CB 4.25Å
460	I	95.2	Very high	89.2	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	119.4	-178.6	-56.9	174.2	0	0	0	109.1	K404 V448 L453 C457 I458 L476 L478 F490	K404-I460 WeakPolarHBondContact CE-O 3.45Å; K404-I460 PolarHBondContact NZ-O 3.08Å; V448-I460 HydrophobicContact CG1-CG2 4.18Å; V448-I460 HydrophobicContact CG2-CD1 3.89Å; L453-I460 HydrophobicContact CD1-CD1 3.52Å; C457-I460 PolarHBondContact O-N 3.02Å; I458-I460 VanDerWaalsContact C-N 3.35Å; I460-L476 HydrophobicContact CD1-CD1 4.09Å; I460-L476 HydrophobicContact CG1-CD1 4.43Å; I460-L476 HydrophobicContact CG2-CD2 4.39Å; I460-L478 HydrophobicContact CG1-CD2 4.24Å; I460-F490 HydrophobicContact CD1-CE1 3.88Å; I460-F490 HydrophobicContact CD1-CZ 4.29Å; I460-F490 HydrophobicContact CG1-CE1 3.78Å; I460-F490 HydrophobicContact CG1-CZ 3.76Å
461	N	95.8	Very high	89.8	Confident	5 Å²	5	33 Å²	33	3%	0.027	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	-39.5	172.2	-73	-3.5	0	0	0	111.1	F403 K404 L407 E415 N416 W477	F403-N461 HydrophobicContact CE1-CB 4.33Å; K404-N461 PolarHBondContact N-O 3.44Å; K404-N461 VanDerWaalsContact N-O 3.14Å; L407-N461 HydrophobicContact CD1-CB 3.62Å; E415-N461 PolarHBondContact O-ND2 3.26Å; N416-N461 PolarHBondContact OD1-ND2 3.47Å; N461-W477 HydrophobicContact CB-CB 4.41Å; N461-W477 PolarHBondContact N-O 3.35Å
462	G	96.7	Very high	90.6	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.2	173.5	-179.5	0	0	0	0	0	114.5	I402 L476 W477	I402-G462 CarbonylContact O-C 3.5Å; I402-G462 WeakPolarHBondContact O-CA 3.48Å; G462-L476 CarbonylContact O-C 3.53Å; G462-L476 WeakPolarHBondContact O-CA 3.33Å; G462-W477 PolarHBondContact N-O 3.2Å; G462-W477 PolarHBondContact O-N 3.48Å
463	I	97.3	Very high	91.8	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	145.8	177.6	-38.7	175.9	0	0	0	107.2	F401 I402 W441 F444 I445 V448 L449 G475 L476	F401-I463 CarbonylContact C-O 3.24Å; F401-I463 VanDerWaalsContact CA-O 3.29Å; F401-I463 WeakPolarHBondContact CA-O 3.49Å; I402-I463 PolarHBondContact N-O 3.11Å; I402-I463 PolarHBondContact O-N 3.21Å; W441-I463 HydrophobicContact CE3-CG2 4.14Å; W441-I463 HydrophobicContact CH2-CG2 4.39Å; W441-I463 HydrophobicContact CZ3-CB 4.14Å; W441-I463 HydrophobicContact CZ3-CG2 3.57Å; F444-I463 HydrophobicContact CB-CG2 3.88Å; I445-I463 HydrophobicContact CB-CD1 4.38Å; I445-I463 HydrophobicContact CG1-CD1 4.18Å; V448-I463 HydrophobicContact CB-CD1 3.61Å; V448-I463 HydrophobicContact CB-CG1 4.21Å; V448-I463 HydrophobicContact CG1-CD1 3.89Å; V448-I463 HydrophobicContact CG1-CG1 4.13Å; V448-I463 HydrophobicContact CG2-CD1 3.83Å; V448-I463 HydrophobicContact CG2-CG1 4.09Å; L449-I463 HydrophobicContact CD1-CD1 4.16Å; I463-G475 WeakPolarHBondContact CA-O 3.24Å; I463-G475 WeakPolarHBondContact CG2-O 3.38Å; I463-L476 HydrophobicContact CB-CD2 4.24Å; I463-L476 HydrophobicContact CG1-CD2 3.94Å; I463-L476 HydrophobicContact CG2-CD2 3.98Å
464	F	97.5	Very high	92.6	Very high	1 Å²	1	32.4 Å²	32.4	0%	0.004	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	153.8	175.8	78.9	-78.3	0	0	0	112.7	Y400 F401 R421 A423 K473 V474 G475 W477	Y400-F464 CarbonylContact O-C 3.53Å; Y400-F464 VanDerWaalsContact O-CA 3.29Å; Y400-F464 WeakPolarHBondContact O-CA 3.35Å; F401-F464 HydrophobicContact CD1-CB 3.45Å; F401-F464 VanDerWaalsContact CD1-CB 3.45Å; F401-F464 HydrophobicContact CE1-CB 3.74Å; F401-F464 HydrophobicContact CG-CB 4.45Å; R421-F464 HydrophobicContact CB-CE1 4.06Å; R421-F464 HydrophobicContact CB-CZ 4.44Å; A423-F464 HydrophobicContact CB-CE1 4.28Å; A423-F464 HydrophobicContact CB-CZ 3.73Å; F464-K473 HydrophobicContact CE2-CB 4.27Å; F464-V474 WeakPolarHBondContact O-CA 3.46Å; F464-G475 VanDerWaalsContact CD1-C 3.47Å; F464-G475 WeakPolarHBondContact CD1-O 3.29Å; F464-G475 PolarHBondContact N-O 3.15Å; F464-G475 PolarHBondContact O-N 3.08Å; F464-W477 AromaticContact CD1-CD1 3.36Å; F464-W477 AromaticContact CD1-NE1 3.5Å; F464-W477 AromaticContact CE1-CD1 3.7Å; F464-W477 AromaticContact CE1-NE1 3.83Å; F464-W477 AromaticContact CG-NE1 3.87Å
465	V	97	Very high	93.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	131.8	162.9	56.5	0	0	0	0	109.7	P391 D399 Y400 V437 W441 K473 V474	P391-V465 HydrophobicContact CB-CG1 4.36Å; P391-V465 HydrophobicContact CB-CG2 3.79Å; P391-V465 HydrophobicContact CG-CG1 4.07Å; P391-V465 HydrophobicContact CG-CG2 4.19Å; D399-V465 WeakPolarHBondContact CA-O 3.48Å; Y400-V465 HydrophobicContact CD2-CG1 4.32Å; Y400-V465 PolarHBondContact N-O 3.37Å; Y400-V465 PolarHBondContact O-N 3.38Å; V437-V465 HydrophobicContact CG2-CG2 4.12Å; W441-V465 HydrophobicContact CD2-CB 4.16Å; W441-V465 HydrophobicContact CD2-CG1 3.66Å; W441-V465 HydrophobicContact CE3-CB 3.72Å; W441-V465 HydrophobicContact CE3-CG1 3.59Å; W441-V465 HydrophobicContact CG-CG1 4.31Å; W441-V465 HydrophobicContact CH2-CG1 4.03Å; W441-V465 HydrophobicContact CZ2-CG1 4.08Å; W441-V465 HydrophobicContact CZ3-CB 4.05Å; W441-V465 HydrophobicContact CZ3-CG1 3.78Å; V465-K473 CarbonylContact C-O 3.58Å; V465-K473 VanDerWaalsContact CA-O 3.25Å; V465-K473 WeakPolarHBondContact CA-O 3.41Å; V465-V474 HydrophobicContact CB-CG2 4.02Å; V465-V474 HydrophobicContact CG2-CG2 3.59Å
466	S	95.8	Very high	94	Very high	3 Å²	3	21.7 Å²	21.7	2%	0.021	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	128.1	-178.3	-70.1	0	0	0	0	110.4	D399 Y472 K473	D399-S466 WeakPolarHBondContact OD1-CA 3.35Å; D399-S466 WeakPolarHBondContact OD1-CB 3.31Å; D399-S466 PolarHBondContact OD1-OG 3.32Å; S466-Y472 CarbonylContact O-C 3.54Å; S466-Y472 VanDerWaalsContact O-CA 3.28Å; S466-Y472 WeakPolarHBondContact O-CA 3.48Å; S466-K473 PolarHBondContact N-O 3.36Å; S466-K473 PolarHBondContact O-N 3Å
467	V	94.8	Very high	94.4	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	116	178.9	-173	0	0	0	0	109.2	P391 L394 G397 A398 Y472	P391-V467 WeakPolarHBondContact O-CG2 3Å; L394-V467 HydrophobicContact CB-CG2 4.02Å; L394-V467 HydrophobicContact CD1-CG2 4.08Å; G397-V467 WeakPolarHBondContact CA-O 3.42Å; G397-V467 PolarHBondContact N-O 3.4Å; A398-V467 PolarHBondContact O-N 2.91Å; V467-Y472 HydrophobicContact CB-CD1 4.31Å; V467-Y472 HydrophobicContact CB-CE1 4.42Å; V467-Y472 HydrophobicContact CG1-CD1 4.02Å; V467-Y472 HydrophobicContact CG1-CE1 3.71Å; V467-Y472 HydrophobicContact CG2-CD1 3.96Å; V467-Y472 HydrophobicContact CG2-CE1 4.15Å
468	R	92.6	Very high	94.8	Very high	15 Å²	15	21 Å²	21	6%	0.057	10%	0.101	C	C	.	.			trans	-126.2	170.7	176.2	-58	-63.3	175.5	-76.9	1	109.1	N169 A398 D399 G471	N169-R468 PolarHBondContact O-NH2 3.35Å; A398-R468 PolarHBondContact O-NH1 3.22Å; D399-R468 VanDerWaalsContact CG-NH2 3.34Å; D399-R468 IonicContact OD1-CZ 2.7Å; D399-R468 VanDerWaalsContact OD1-CZ 3.26Å; D399-R468 IonicContact OD1-NH1 3.6Å; D399-R468 PolarHBondContact OD1-NH1 3.29Å; D399-R468 IonicContact OD1-NH2 3.91Å; D399-R468 PolarHBondContact OD1-NH2 3.3Å; D399-R468 IonicContact OD2-NH2 3.97Å; D399-R468 PolarHBondContact OD2-NH2 3.31Å; R468-G471 CarbonylContact C-O 3.5Å; R468-G471 WeakPolarHBondContact CA-O 3.36Å; R468-G471 PolarHBondContact N-O 2.92Å; R468-G471 PolarHBondContact O-N 2.6Å
469	S	89.4	Confident	94.9	Very high	29 Å²	29	18.2 Å²	18.2	20%	0.203	9%	0.086	C	C	.	.	S	Bend	trans	-70.1	-42.2	-178	79.4	0	0	0	0	111.1	E166 R428 G471	E166-S469 WeakPolarHBondContact OE1-CB 3.26Å; E166-S469 PolarHBondContact OE1-OG 3.5Å; E166-S469 WeakPolarHBondContact OE2-CB 3.37Å; E166-S469 PolarHBondContact OE2-N 2.98Å; E166-S469 PolarHBondContact OE2-OG 3.28Å; R428-S469 WeakPolarHBondContact CB-O 3.08Å; R428-S469 VanDerWaalsContact CD-O 3.26Å; R428-S469 WeakPolarHBondContact CD-O 3.36Å; S469-G471 PolarHBondContact O-N 3.43Å
470	K	90	Very high	94.7	Very high	172 Å²	172	18.4 Å²	18.4	75%	0.748	9%	0.093	S	C	*	.	S	Bend	trans	-60.3	-29.3	177.7	-64.4	-177.2	-178.8	174	0	112.3
471	G	93	Very high	94.5	Very high	11 Å²	11	23 Å²	23	11%	0.113	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.2	-171	-176.8	0	0	0	0	0	115.4	F426 R468 S469	F426-G471 CarbonylContact O-C 3.5Å; F426-G471 WeakPolarHBondContact O-CA 3.28Å; R468-G471 CarbonylContact C-O 3.5Å; R468-G471 WeakPolarHBondContact CA-O 3.36Å; R468-G471 PolarHBondContact N-O 2.92Å; R468-G471 PolarHBondContact O-N 2.6Å; S469-G471 PolarHBondContact O-N 3.43Å
472	Y	94.5	Very high	94.3	Very high	2 Å²	2	23 Å²	23	1%	0.008	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	142.8	174.5	-49.2	-90.4	0	0	0	109.9	S425 F426 R428 Q434 V437 S466 V467	S425-Y472 CarbonylContact C-O 3.5Å; S425-Y472 VanDerWaalsContact CA-O 3.27Å; S425-Y472 WeakPolarHBondContact CA-O 3.48Å; F426-Y472 HydrophobicContact CB-CD2 4.15Å; F426-Y472 PolarHBondContact N-O 2.97Å; F426-Y472 PolarHBondContact O-N 3.07Å; R428-Y472 HydrophobicContact CB-CE2 4.22Å; R428-Y472 HydrophobicContact CG-CE2 4.05Å; Q434-Y472 HydrophobicContact CG-CE2 4.08Å; V437-Y472 HydrophobicContact CB-CD2 4.17Å; V437-Y472 HydrophobicContact CB-CG 4.03Å; V437-Y472 HydrophobicContact CG1-CD1 4.13Å; V437-Y472 HydrophobicContact CG1-CD2 3.82Å; V437-Y472 HydrophobicContact CG1-CE1 4.35Å; V437-Y472 HydrophobicContact CG1-CE2 4.05Å; V437-Y472 HydrophobicContact CG1-CG 3.87Å; V437-Y472 VanDerWaalsContact CG2-CB 3.44Å; V437-Y472 HydrophobicContact CG2-CD1 4.09Å; V437-Y472 HydrophobicContact CG2-CD2 4.37Å; V437-Y472 HydrophobicContact CG2-CG 3.73Å; S466-Y472 CarbonylContact O-C 3.54Å; S466-Y472 VanDerWaalsContact O-CA 3.28Å; S466-Y472 WeakPolarHBondContact O-CA 3.48Å; V467-Y472 HydrophobicContact CB-CD1 4.31Å; V467-Y472 HydrophobicContact CB-CE1 4.42Å; V467-Y472 HydrophobicContact CG1-CD1 4.02Å; V467-Y472 HydrophobicContact CG1-CE1 3.71Å; V467-Y472 HydrophobicContact CG2-CD1 3.96Å; V467-Y472 HydrophobicContact CG2-CE1 4.15Å
473	K	95.2	Very high	94	Very high	48 Å²	48	27.9 Å²	27.9	21%	0.209	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	129	166.2	-64	173.3	-175	161.9	0	108.1	D170 D173 V424 F464 V465 S466	D170-K473 IonicContact OD2-NZ 3.77Å; D170-K473 PolarHBondContact OD2-NZ 3.42Å; D173-K473 IonicContact OD2-NZ 3.95Å; D173-K473 PolarHBondContact OD2-NZ 3.03Å; V424-K473 WeakPolarHBondContact O-CA 3.41Å; F464-K473 HydrophobicContact CE2-CB 4.27Å; V465-K473 CarbonylContact C-O 3.58Å; V465-K473 VanDerWaalsContact CA-O 3.25Å; V465-K473 WeakPolarHBondContact CA-O 3.41Å; S466-K473 PolarHBondContact N-O 3.36Å; S466-K473 PolarHBondContact O-N 3Å
474	V	95.8	Very high	93.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	136.2	174.2	-178.4	0	0	0	0	108.3	A423 V424 F426 V437 W441 F444 F464 V465	A423-V474 WeakPolarHBondContact CA-O 3.48Å; V424-V474 HydrophobicContact CG1-CB 4.32Å; V424-V474 WeakPolarHBondContact CG1-O 3.18Å; V424-V474 PolarHBondContact N-O 3.24Å; V424-V474 PolarHBondContact O-N 3.15Å; F426-V474 HydrophobicContact CD2-CG2 4.39Å; F426-V474 HydrophobicContact CE2-CB 4.13Å; F426-V474 HydrophobicContact CE2-CG2 3.96Å; V437-V474 HydrophobicContact CG2-CG2 3.41Å; V437-V474 VanDerWaalsContact CG2-CG2 3.41Å; W441-V474 HydrophobicContact CE3-CG1 4.29Å; F444-V474 HydrophobicContact CD2-CG1 3.56Å; F444-V474 HydrophobicContact CE2-CG1 4Å; F464-V474 WeakPolarHBondContact O-CA 3.46Å; V465-V474 HydrophobicContact CB-CG2 4.02Å; V465-V474 HydrophobicContact CG2-CG2 3.59Å
475	G	95.9	Very high	93.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.2	-167.6	-178.3	0	0	0	0	0	115.9	V422 I463 F464	V422-G475 CarbonylContact O-C 3.51Å; V422-G475 WeakPolarHBondContact O-CA 3.35Å; I463-G475 WeakPolarHBondContact CA-O 3.24Å; I463-G475 WeakPolarHBondContact CG2-O 3.38Å; F464-G475 VanDerWaalsContact CD1-C 3.47Å; F464-G475 WeakPolarHBondContact CD1-O 3.29Å; F464-G475 PolarHBondContact N-O 3.15Å; F464-G475 PolarHBondContact O-N 3.08Å
476	L	96.8	Very high	93.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	142.7	-178.8	-57.8	178.9	0	0	0	109.9	R421 V422 F444 V448 I460 G462 I463 L478 F490 F494	R421-L476 CarbonylContact C-O 3.52Å; R421-L476 VanDerWaalsContact CA-O 3.23Å; R421-L476 WeakPolarHBondContact CA-O 3.42Å; V422-L476 PolarHBondContact N-O 3.35Å; V422-L476 PolarHBondContact O-N 2.93Å; F444-L476 HydrophobicContact CD1-CD1 4.47Å; F444-L476 HydrophobicContact CD1-CD2 4.1Å; F444-L476 HydrophobicContact CD1-CG 4.22Å; F444-L476 HydrophobicContact CE1-CG 4.44Å; V448-L476 HydrophobicContact CG2-CD2 3.89Å; I460-L476 HydrophobicContact CD1-CD1 4.09Å; I460-L476 HydrophobicContact CG1-CD1 4.43Å; I460-L476 HydrophobicContact CG2-CD2 4.39Å; G462-L476 CarbonylContact O-C 3.53Å; G462-L476 WeakPolarHBondContact O-CA 3.33Å; I463-L476 HydrophobicContact CB-CD2 4.24Å; I463-L476 HydrophobicContact CG1-CD2 3.94Å; I463-L476 HydrophobicContact CG2-CD2 3.98Å; L476-L478 HydrophobicContact CB-CD2 4.07Å; L476-F490 HydrophobicContact CD1-CD1 3.94Å; L476-F490 HydrophobicContact CD1-CE1 3.93Å; L476-F494 HydrophobicContact CB-CZ 4.46Å; L476-F494 HydrophobicContact CD1-CE2 3.85Å; L476-F494 HydrophobicContact CD1-CZ 4.38Å; L476-F494 HydrophobicContact CG-CE2 4.01Å; L476-F494 HydrophobicContact CG-CZ 4.03Å
477	W	96.3	Very high	93.2	Very high	5 Å²	5	40.2 Å²	40.2	2%	0.019	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	130.4	163.9	-76.7	33.6	0	0	0	108.8	F401 F403 W411 N416 R421 N461 G462 F464 H509	F401-W477 HydrophobicContact CE1-CZ2 4.42Å; F403-W477 HydrophobicContact CE1-CB 4.24Å; F403-W477 HydrophobicContact CE1-CD2 4.09Å; F403-W477 AromaticContact CE1-CE3 3.69Å; F403-W477 HydrophobicContact CE1-CE3 3.69Å; F403-W477 HydrophobicContact CE1-CG 4.36Å; F403-W477 HydrophobicContact CE1-CZ3 4.32Å; F403-W477 HydrophobicContact CZ-CB 3.91Å; F403-W477 AromaticContact CZ-CD2 3.51Å; F403-W477 HydrophobicContact CZ-CD2 3.51Å; F403-W477 AromaticContact CZ-CE3 3.55Å; F403-W477 HydrophobicContact CZ-CE3 3.55Å; F403-W477 AromaticContact CZ-CG 3.69Å; F403-W477 HydrophobicContact CZ-CG 3.69Å; F403-W477 HydrophobicContact CZ-CZ3 4.2Å; W411-W477 HydrophobicContact CB-CH2 4.03Å; W411-W477 HydrophobicContact CB-CZ3 4.18Å; N416-W477 HydrophobicContact CB-CE3 4.07Å; N416-W477 HydrophobicContact CB-CZ3 4.01Å; R421-W477 HydrophobicContact CB-CG 4.5Å; N461-W477 HydrophobicContact CB-CB 4.41Å; N461-W477 PolarHBondContact N-O 3.35Å; G462-W477 PolarHBondContact N-O 3.2Å; G462-W477 PolarHBondContact O-N 3.48Å; F464-W477 AromaticContact CD1-CD1 3.36Å; F464-W477 AromaticContact CD1-NE1 3.5Å; F464-W477 AromaticContact CE1-CD1 3.7Å; F464-W477 AromaticContact CE1-NE1 3.83Å; F464-W477 AromaticContact CG-NE1 3.87Å; W477-H509 AromaticContact CD2-CE1 3.32Å; W477-H509 AromaticContact CD2-NE2 3.5Å; W477-H509 AromaticContact CE2-CE1 3.51Å; W477-H509 AromaticContact CE3-CE1 3.54Å; W477-H509 AromaticContact CE3-NE2 3.47Å; W477-H509 AromaticContact CG-CE1 3.83Å; W477-H509 AromaticContact CG-NE2 3.82Å; W477-H509 AromaticContact CZ2-CE1 3.9Å; W477-H509 AromaticContact CZ3-CE1 3.93Å; W477-H509 AromaticContact NE1-CE1 4Å
478	L	95.7	Very high	93.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	140.2	-173	-55.3	-175.8	0	0	0	110.6	G419 G420 V422 Y459 I460 L476 C482 F490 Y506	G419-L478 WeakPolarHBondContact CA-O 3.27Å; G420-L478 PolarHBondContact N-O 3.29Å; G420-L478 VanDerWaalsContact N-O 3.15Å; G420-L478 PolarHBondContact O-N 3.48Å; V422-L478 HydrophobicContact CG2-CD1 3.52Å; V422-L478 HydrophobicContact CG2-CG 4.35Å; Y459-L478 CarbonylContact O-C 3.44Å; Y459-L478 VanDerWaalsContact O-CA 3.24Å; Y459-L478 WeakPolarHBondContact O-CA 3.19Å; I460-L478 HydrophobicContact CG1-CD2 4.24Å; L476-L478 HydrophobicContact CB-CD2 4.07Å; L478-C482 HydrophobicContact CB-CB 4.34Å; L478-F490 HydrophobicContact CD1-CD2 3.6Å; L478-F490 HydrophobicContact CD1-CE2 3.83Å; L478-F490 HydrophobicContact CD1-CG 4.15Å; L478-F490 HydrophobicContact CD2-CD1 4.35Å; L478-F490 HydrophobicContact CD2-CD2 4.1Å; L478-F490 HydrophobicContact CD2-CE1 3.93Å; L478-F490 HydrophobicContact CD2-CE2 3.67Å; L478-F490 HydrophobicContact CD2-CG 4.43Å; L478-F490 HydrophobicContact CD2-CZ 3.57Å; L478-F490 HydrophobicContact CG-CE2 4.38Å; L478-Y506 HydrophobicContact CD1-CD2 4.4Å; L478-Y506 HydrophobicContact CD1-CE2 4.33Å
479	H	93.7	Very high	93	Very high	47 Å²	47	46.8 Å²	46.8	22%	0.218	23%	0.232	C	C	.	.			trans	-63.8	158.6	174.2	-165.8	-102.9	0	0	0	111.8	E415 Y459 D481 C482	E415-H479 PolarHBondContact O-CD2 2.99Å; Y459-H479 PolarHBondContact O-N 2.8Å; H479-D481 IonicContact CE1-OD1 3.74Å; H479-D481 IonicContact CE1-OD2 3.07Å; H479-D481 PolarHBondContact CE1-OD2 3.22Å; H479-D481 VanDerWaalsContact ND1-CG 3.25Å; H479-D481 PolarHBondContact ND1-N 3.48Å; H479-D481 IonicContact ND1-OD1 3.74Å; H479-D481 IonicContact ND1-OD2 3Å; H479-D481 PolarHBondContact ND1-OD2 2.95Å; H479-D481 PolarHBondContact O-N 3.02Å; H479-C482 VanDerWaalsContact O-CB 3.3Å; H479-C482 WeakPolarHBondContact O-CB 3.26Å; H479-C482 PolarHBondContact O-N 2.84Å
480	S	90	Very high	93.2	Very high	48 Å²	48	45.4 Å²	45.4	34%	0.336	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-24.5	-179.7	57	0	0	0	0	114.6	R418 C482	R418-S480 WeakPolarHBondContact O-CA 3.27Å; R418-S480 VanDerWaalsContact O-CB 3.3Å; R418-S480 WeakPolarHBondContact O-CB 3.46Å; S480-C482 PolarHBondContact O-N 3.06Å
481	D	90.9	Very high	93.3	Very high	97 Å²	97	41 Å²	41	52%	0.519	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-3.2	-177	-56.1	-21	0	0	0	112.7	Y459 H479 N483	Y459-D481 HydrophobicContact CD1-CB 4.33Å; Y459-D481 HydrophobicContact CE1-CB 4.11Å; H479-D481 IonicContact CE1-OD1 3.74Å; H479-D481 IonicContact CE1-OD2 3.07Å; H479-D481 PolarHBondContact CE1-OD2 3.22Å; H479-D481 VanDerWaalsContact ND1-CG 3.25Å; H479-D481 PolarHBondContact ND1-N 3.48Å; H479-D481 IonicContact ND1-OD1 3.74Å; H479-D481 IonicContact ND1-OD2 3Å; H479-D481 PolarHBondContact ND1-OD2 2.95Å; H479-D481 PolarHBondContact O-N 3.02Å; D481-N483 PolarHBondContact O-N 2.84Å
482	C	91.1	Very high	93.1	Very high	5 Å²	5	44.5 Å²	44.5	3%	0.034	21%	0.214	C	C	.	.			trans	-71.1	109.3	177	-172.3	0	0	0	0	110.3	Y459 L478 H479 S480 D486 K487	Y459-C482 HydrophobicContact CD1-CB 4.33Å; Y459-C482 HydrophobicContact CG-CB 4.3Å; L478-C482 HydrophobicContact CB-CB 4.34Å; H479-C482 VanDerWaalsContact O-CB 3.3Å; H479-C482 WeakPolarHBondContact O-CB 3.26Å; H479-C482 PolarHBondContact O-N 2.84Å; S480-C482 PolarHBondContact O-N 3.06Å; C482-D486 VanDerWaalsContact SG-CB 3.53Å; C482-K487 WeakPolarHBondContact O-CE 3.48Å
483	N	92	Very high	92.8	Very high	103 Å²	103	45.4 Å²	45.4	55%	0.551	22%	0.22	S	C	*	.			trans	-78.5	171.1	-179.3	-62.7	-46	0	0	0	111.6	D481 E485 D486 K487	D481-N483 PolarHBondContact O-N 2.84Å; N483-E485 PolarHBondContact O-N 3.21Å; N483-D486 WeakPolarHBondContact CB-OD2 3.45Å; N483-D486 PolarHBondContact N-OD2 2.76Å; N483-D486 PolarHBondContact O-N 3.19Å; N483-D486 VanDerWaalsContact O-N 3.15Å; N483-K487 WeakPolarHBondContact O-CG 3.13Å; N483-K487 PolarHBondContact O-N 2.7Å
484	E	92	Very high	92.7	Very high	123 Å²	123	43.2 Å²	43.2	58%	0.575	21%	0.211	S	C	*	.	H	α-helix	trans	-61.1	-30.4	179.1	-69.3	-54	130.9	0	0	113.7	K487 K488	E484-K487 WeakPolarHBondContact OE1-CD 3.4Å; E484-K487 IonicContact OE1-NZ 2.72Å; E484-K487 PolarHBondContact OE1-NZ 2.81Å; E484-K488 PolarHBondContact O-N 3.06Å
485	E	92.9	Very high	92.4	Very high	103 Å²	103	47 Å²	47	48%	0.481	23%	0.227	S	C	.	.	H	α-helix	trans	-71.2	-41.9	175	-168.1	59.1	-150.1	0	0	111.5	N483 K487 K488 Q489	N483-E485 PolarHBondContact O-N 3.21Å; E485-K487 VanDerWaalsContact C-N 3.33Å; E485-K487 PolarHBondContact O-N 2.71Å; E485-K488 WeakPolarHBondContact O-CB 3.47Å; E485-K488 PolarHBondContact O-N 3.14Å; E485-K488 VanDerWaalsContact O-N 3.12Å; E485-K488 IonicContact OE1-NZ 3.56Å; E485-Q489 WeakPolarHBondContact O-CG 3.44Å; E485-Q489 PolarHBondContact O-N 2.59Å
486	D	92.7	Very high	91.9	Very high	16 Å²	16	52.9 Å²	52.9	9%	0.086	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-42.6	175.2	-54.9	-51	0	0	0	110.4	L456 Y459 C482 N483 K488 Q489 F490	L456-D486 HydrophobicContact CD2-CB 4.39Å; Y459-D486 HydrophobicContact CD2-CB 4.36Å; Y459-D486 HydrophobicContact CE2-CB 4.25Å; C482-D486 VanDerWaalsContact SG-CB 3.53Å; N483-D486 WeakPolarHBondContact CB-OD2 3.45Å; N483-D486 PolarHBondContact N-OD2 2.76Å; N483-D486 PolarHBondContact O-N 3.19Å; N483-D486 VanDerWaalsContact O-N 3.15Å; D486-K488 VanDerWaalsContact C-N 3.27Å; D486-K488 PolarHBondContact O-N 3.08Å; D486-Q489 WeakPolarHBondContact O-CB 3.4Å; D486-Q489 PolarHBondContact O-N 3.06Å; D486-Q489 VanDerWaalsContact O-N 3.14Å; D486-F490 WeakPolarHBondContact O-CD2 3.45Å; D486-F490 PolarHBondContact O-N 3.43Å
487	K	92.1	Very high	91.3	Very high	20 Å²	20	53.2 Å²	53.2	9%	0.087	26%	0.259	C	S	.	.	H	α-helix	trans	-60	-36.2	174.1	-67.5	174.9	-162.7	173.6	0	112.2	C482 N483 E484 E485 F490 R491 Y506	C482-K487 WeakPolarHBondContact O-CE 3.48Å; N483-K487 WeakPolarHBondContact O-CG 3.13Å; N483-K487 PolarHBondContact O-N 2.7Å; E484-K487 WeakPolarHBondContact OE1-CD 3.4Å; E484-K487 IonicContact OE1-NZ 2.72Å; E484-K487 PolarHBondContact OE1-NZ 2.81Å; E485-K487 VanDerWaalsContact C-N 3.33Å; E485-K487 PolarHBondContact O-N 2.71Å; K487-F490 PolarHBondContact O-N 3.29Å; K487-R491 WeakPolarHBondContact O-CG 3.1Å; K487-R491 PolarHBondContact O-N 2.99Å; K487-R491 VanDerWaalsContact O-N 3.08Å; K487-R491 PolarHBondContact O-NH1 2.87Å; K487-Y506 HydrophobicContact CD-CD1 4.13Å; K487-Y506 HydrophobicContact CD-CD2 3.99Å; K487-Y506 HydrophobicContact CD-CE1 4.11Å; K487-Y506 HydrophobicContact CD-CE2 3.97Å; K487-Y506 HydrophobicContact CD-CG 4.06Å; K487-Y506 HydrophobicContact CG-CD2 4.25Å; K487-Y506 HydrophobicContact CG-CE2 4.35Å
488	K	92.3	Very high	90.9	Very high	95 Å²	95	54 Å²	54	41%	0.413	26%	0.264	S	S	.	.	H	α-helix	trans	-66.4	-42.2	175.5	-176.1	-175.7	168.1	-160.5	0	111.2	E484 E485 D486 R491 E492	E484-K488 PolarHBondContact O-N 3.06Å; E485-K488 WeakPolarHBondContact O-CB 3.47Å; E485-K488 PolarHBondContact O-N 3.14Å; E485-K488 VanDerWaalsContact O-N 3.12Å; E485-K488 IonicContact OE1-NZ 3.56Å; D486-K488 VanDerWaalsContact C-N 3.27Å; D486-K488 PolarHBondContact O-N 3.08Å; K488-R491 WeakPolarHBondContact O-CB 3.39Å; K488-R491 PolarHBondContact O-N 3.33Å; K488-R491 VanDerWaalsContact O-N 3.16Å; K488-E492 PolarHBondContact O-N 2.83Å; K488-E492 VanDerWaalsContact O-N 3.13Å
489	Q	91.8	Very high	90.2	Very high	59 Å²	59	55.4 Å²	55.4	28%	0.276	28%	0.279	S	S	.	.	H	α-helix	trans	-64.8	-40.3	175.1	-64.8	176.4	8.3	0	0	112	L456 E485 D486 R491 E492 V493	L456-Q489 HydrophobicContact CD1-CB 4.12Å; L456-Q489 HydrophobicContact CD2-CB 4.23Å; E485-Q489 WeakPolarHBondContact O-CG 3.44Å; E485-Q489 PolarHBondContact O-N 2.59Å; D486-Q489 WeakPolarHBondContact O-CB 3.4Å; D486-Q489 PolarHBondContact O-N 3.06Å; D486-Q489 VanDerWaalsContact O-N 3.14Å; Q489-R491 VanDerWaalsContact C-N 3.28Å; Q489-R491 PolarHBondContact O-N 3.09Å; Q489-E492 PolarHBondContact O-N 3.23Å; Q489-V493 WeakPolarHBondContact O-CG2 3.43Å; Q489-V493 PolarHBondContact O-N 3.17Å
490	F	92.9	Very high	89.4	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-56.9	-41.3	170.8	-80.4	-64.3	0	0	0	112.1	L456 I460 L476 L478 D486 K487 E492 V493 F494	L456-F490 HydrophobicContact CB-CE1 3.93Å; L456-F490 HydrophobicContact CB-CE2 4.43Å; L456-F490 HydrophobicContact CB-CZ 3.75Å; L456-F490 HydrophobicContact CD1-CD1 4.44Å; L456-F490 HydrophobicContact CD1-CE1 4.38Å; L456-F490 HydrophobicContact CD2-CD2 4.33Å; L456-F490 HydrophobicContact CD2-CE2 3.95Å; L456-F490 HydrophobicContact CD2-CZ 4.12Å; L456-F490 HydrophobicContact CG-CZ 4.4Å; I460-F490 HydrophobicContact CD1-CE1 3.88Å; I460-F490 HydrophobicContact CD1-CZ 4.29Å; I460-F490 HydrophobicContact CG1-CE1 3.78Å; I460-F490 HydrophobicContact CG1-CZ 3.76Å; L476-F490 HydrophobicContact CD1-CD1 3.94Å; L476-F490 HydrophobicContact CD1-CE1 3.93Å; L478-F490 HydrophobicContact CD1-CD2 3.6Å; L478-F490 HydrophobicContact CD1-CE2 3.83Å; L478-F490 HydrophobicContact CD1-CG 4.15Å; L478-F490 HydrophobicContact CD2-CD1 4.35Å; L478-F490 HydrophobicContact CD2-CD2 4.1Å; L478-F490 HydrophobicContact CD2-CE1 3.93Å; L478-F490 HydrophobicContact CD2-CE2 3.67Å; L478-F490 HydrophobicContact CD2-CG 4.43Å; L478-F490 HydrophobicContact CD2-CZ 3.57Å; L478-F490 HydrophobicContact CG-CE2 4.38Å; D486-F490 WeakPolarHBondContact O-CD2 3.45Å; D486-F490 PolarHBondContact O-N 3.43Å; K487-F490 PolarHBondContact O-N 3.29Å; F490-E492 VanDerWaalsContact C-N 3.31Å; F490-E492 PolarHBondContact O-N 3.13Å; F490-V493 WeakPolarHBondContact O-CB 3.29Å; F490-V493 PolarHBondContact O-N 3.32Å; F490-F494 WeakPolarHBondContact O-CD2 3.24Å; F490-F494 PolarHBondContact O-N 3.44Å
491	R	91.3	Very high	89	Confident	79 Å²	79	68.6 Å²	68.6	30%	0.298	33%	0.332	S	S	.	.	H	α-helix	trans	-62.3	-37.1	174.9	-70.1	-173.6	-62.6	-90.8	6.2	112.6	K487 K488 Q489 F494 K495	K487-R491 WeakPolarHBondContact O-CG 3.1Å; K487-R491 PolarHBondContact O-N 2.99Å; K487-R491 VanDerWaalsContact O-N 3.08Å; K487-R491 PolarHBondContact O-NH1 2.87Å; K488-R491 WeakPolarHBondContact O-CB 3.39Å; K488-R491 PolarHBondContact O-N 3.33Å; K488-R491 VanDerWaalsContact O-N 3.16Å; Q489-R491 VanDerWaalsContact C-N 3.28Å; Q489-R491 PolarHBondContact O-N 3.09Å; R491-F494 PolarHBondContact O-N 3.16Å; R491-K495 WeakPolarHBondContact O-CG 3.48Å; R491-K495 PolarHBondContact O-N 2.99Å; R491-K495 VanDerWaalsContact O-N 3.14Å
492	E	89.6	Confident	88.7	Confident	84 Å²	84	67.3 Å²	67.3	39%	0.393	32%	0.32	S	S	.	.	H	α-helix	trans	-67.2	-41.7	174.1	-61	-49.1	136.5	0	0	112	K488 Q489 F490 F494 K495 I496	K488-E492 PolarHBondContact O-N 2.83Å; K488-E492 VanDerWaalsContact O-N 3.13Å; Q489-E492 PolarHBondContact O-N 3.23Å; F490-E492 VanDerWaalsContact C-N 3.31Å; F490-E492 PolarHBondContact O-N 3.13Å; E492-F494 VanDerWaalsContact C-N 3.29Å; E492-F494 PolarHBondContact O-N 3.23Å; E492-K495 WeakPolarHBondContact O-CB 3.31Å; E492-K495 PolarHBondContact O-N 2.79Å; E492-K495 VanDerWaalsContact O-N 3.13Å; E492-K495 IonicContact OE1-NZ 3.96Å; E492-K495 PolarHBondContact OE1-NZ 2.79Å; E492-K495 WeakPolarHBondContact OE2-CD 3.46Å; E492-K495 IonicContact OE2-NZ 3.87Å; E492-K495 PolarHBondContact OE2-NZ 3.28Å; E492-I496 WeakPolarHBondContact O-CG1 3.46Å; E492-I496 PolarHBondContact O-N 2.99Å; E492-I496 VanDerWaalsContact O-N 3.09Å
493	V	88.8	Confident	88.4	Confident	22 Å²	22	70.6 Å²	70.6	13%	0.133	34%	0.341	C	S	.	.	H	α-helix	trans	-56.3	-45.3	172.9	170.5	0	0	0	0	110.7	L453 L456 Q489 F490 K495 I496 L497	L453-V493 HydrophobicContact CD2-CG1 3.61Å; L453-V493 HydrophobicContact CD2-CG2 4.12Å; L456-V493 HydrophobicContact CD1-CG2 4.03Å; Q489-V493 WeakPolarHBondContact O-CG2 3.43Å; Q489-V493 PolarHBondContact O-N 3.17Å; F490-V493 WeakPolarHBondContact O-CB 3.29Å; F490-V493 PolarHBondContact O-N 3.32Å; V493-K495 VanDerWaalsContact C-N 3.33Å; V493-K495 PolarHBondContact O-N 3.21Å; V493-I496 PolarHBondContact O-N 2.9Å; V493-I496 VanDerWaalsContact O-N 3.13Å; V493-L497 HydrophobicContact CG1-CD1 3.7Å; V493-L497 HydrophobicContact CG1-CG 4.17Å; V493-L497 WeakPolarHBondContact O-CG 3.03Å; V493-L497 PolarHBondContact O-N 3.11Å
494	F	91.6	Very high	88.4	Confident	1 Å²	1	66.2 Å²	66.2	0%	0.004	32%	0.319	C	S	.	.	H	α-helix	trans	-61.7	-39.5	177.8	-86.6	-119.5	0	0	0	112.4	V422 V424 F444 L476 F490 R491 E492 I496 L497 V498 A504	V422-F494 HydrophobicContact CB-CE2 4.18Å; V422-F494 HydrophobicContact CB-CZ 3.98Å; V422-F494 HydrophobicContact CG1-CD1 4.31Å; V422-F494 HydrophobicContact CG1-CD2 4.16Å; V422-F494 HydrophobicContact CG1-CE1 3.98Å; V422-F494 HydrophobicContact CG1-CE2 3.78Å; V422-F494 HydrophobicContact CG1-CG 4.38Å; V422-F494 HydrophobicContact CG1-CZ 3.7Å; V422-F494 VanDerWaalsContact O-CZ 3.27Å; V422-F494 WeakPolarHBondContact O-CZ 3.13Å; V424-F494 HydrophobicContact CB-CD1 4.29Å; V424-F494 HydrophobicContact CG1-CD1 4.24Å; V424-F494 HydrophobicContact CG1-CE1 4.32Å; F444-F494 HydrophobicContact CD1-CE2 4.5Å; F444-F494 HydrophobicContact CE1-CD1 4.09Å; F444-F494 AromaticContact CE1-CD2 3.67Å; F444-F494 HydrophobicContact CE1-CD2 3.67Å; F444-F494 AromaticContact CE1-CE1 3.85Å; F444-F494 HydrophobicContact CE1-CE1 3.85Å; F444-F494 AromaticContact CE1-CE2 3.44Å; F444-F494 HydrophobicContact CE1-CE2 3.44Å; F444-F494 VanDerWaalsContact CE1-CE2 3.44Å; F444-F494 HydrophobicContact CE1-CG 4.03Å; F444-F494 AromaticContact CE1-CZ 3.53Å; F444-F494 HydrophobicContact CE1-CZ 3.53Å; F444-F494 HydrophobicContact CE2-CD1 4.37Å; F444-F494 HydrophobicContact CE2-CE1 4.16Å; F444-F494 AromaticContact CZ-CD1 3.44Å; F444-F494 HydrophobicContact CZ-CD1 3.44Å; F444-F494 VanDerWaalsContact CZ-CD1 3.44Å; F444-F494 AromaticContact CZ-CD2 3.86Å; F444-F494 HydrophobicContact CZ-CD2 3.86Å; F444-F494 AromaticContact CZ-CE1 3.37Å; F444-F494 HydrophobicContact CZ-CE1 3.37Å; F444-F494 AromaticContact CZ-CE2 3.83Å; F444-F494 HydrophobicContact CZ-CE2 3.83Å; F444-F494 AromaticContact CZ-CG 3.7Å; F444-F494 HydrophobicContact CZ-CG 3.7Å; F444-F494 AromaticContact CZ-CZ 3.59Å; F444-F494 HydrophobicContact CZ-CZ 3.59Å; L476-F494 HydrophobicContact CB-CZ 4.46Å; L476-F494 HydrophobicContact CD1-CE2 3.85Å; L476-F494 HydrophobicContact CD1-CZ 4.38Å; L476-F494 HydrophobicContact CG-CE2 4.01Å; L476-F494 HydrophobicContact CG-CZ 4.03Å; F490-F494 WeakPolarHBondContact O-CD2 3.24Å; F490-F494 PolarHBondContact O-N 3.44Å; R491-F494 PolarHBondContact O-N 3.16Å; E492-F494 VanDerWaalsContact C-N 3.29Å; E492-F494 PolarHBondContact O-N 3.23Å; F494-I496 VanDerWaalsContact C-N 3.27Å; F494-I496 PolarHBondContact O-N 2.75Å; F494-L497 PolarHBondContact O-N 3.31Å; F494-V498 WeakPolarHBondContact O-CB 3.49Å; F494-V498 PolarHBondContact O-N 2.69Å; F494-A504 HydrophobicContact CB-CB 3.59Å; F494-A504 HydrophobicContact CD1-CB 3.3Å; F494-A504 HydrophobicContact CD2-CB 4.49Å; F494-A504 HydrophobicContact CE1-CB 4.08Å; F494-A504 HydrophobicContact CG-CB 3.55Å
495	K	89.2	Confident	88.3	Confident	80 Å²	80	66.4 Å²	66.4	35%	0.348	32%	0.319	S	S	.	.	H	α-helix	trans	-63	-34.7	175.5	-68.1	176.5	-159.5	165.5	0	112.3	R491 E492 V493 G499	R491-K495 WeakPolarHBondContact O-CG 3.48Å; R491-K495 PolarHBondContact O-N 2.99Å; R491-K495 VanDerWaalsContact O-N 3.14Å; E492-K495 WeakPolarHBondContact O-CB 3.31Å; E492-K495 PolarHBondContact O-N 2.79Å; E492-K495 VanDerWaalsContact O-N 3.13Å; E492-K495 IonicContact OE1-NZ 3.96Å; E492-K495 PolarHBondContact OE1-NZ 2.79Å; E492-K495 WeakPolarHBondContact OE2-CD 3.46Å; E492-K495 IonicContact OE2-NZ 3.87Å; E492-K495 PolarHBondContact OE2-NZ 3.28Å; V493-K495 VanDerWaalsContact C-N 3.33Å; V493-K495 PolarHBondContact O-N 3.21Å; K495-G499 CarbonylContact O-C 3.59Å; K495-G499 VanDerWaalsContact O-C 3.24Å; K495-G499 WeakPolarHBondContact O-CA 3.47Å; K495-G499 PolarHBondContact O-N 3.28Å
496	I	86.8	Confident	88.3	Confident	124 Å²	124	64.2 Å²	64.2	64%	0.636	31%	0.306	S	S	*	.	H	α-helix	trans	-71.3	-47.7	176.5	-65	166.7	0	0	0	110.2	E492 V493 F494	E492-I496 WeakPolarHBondContact O-CG1 3.46Å; E492-I496 PolarHBondContact O-N 2.99Å; E492-I496 VanDerWaalsContact O-N 3.09Å; V493-I496 PolarHBondContact O-N 2.9Å; V493-I496 VanDerWaalsContact O-N 3.13Å; F494-I496 VanDerWaalsContact C-N 3.27Å; F494-I496 PolarHBondContact O-N 2.75Å
497	L	84.3	Confident	88.2	Confident	6 Å²	6	68.6 Å²	68.6	3%	0.031	33%	0.325	C	S	.	.	H	α-helix	trans	-72	-39.3	-174.4	-64.9	178.3	0	0	0	113	F248 K443 F444 A447 V493 F494	F248-L497 HydrophobicContact CE1-CD2 4.22Å; F248-L497 HydrophobicContact CZ-CD2 3.69Å; K443-L497 HydrophobicContact CB-CD2 4.29Å; K443-L497 WeakPolarHBondContact CD-O 3.36Å; K443-L497 PolarHBondContact NZ-O 3.28Å; F444-L497 HydrophobicContact CD1-CD1 3.63Å; F444-L497 HydrophobicContact CE1-CD1 3.53Å; F444-L497 HydrophobicContact CG-CD1 4.32Å; F444-L497 HydrophobicContact CZ-CB 4.47Å; F444-L497 HydrophobicContact CZ-CD1 4.15Å; A447-L497 HydrophobicContact CB-CD1 4.27Å; A447-L497 HydrophobicContact CB-CD2 4.48Å; V493-L497 HydrophobicContact CG1-CD1 3.7Å; V493-L497 HydrophobicContact CG1-CG 4.17Å; V493-L497 WeakPolarHBondContact O-CG 3.03Å; V493-L497 PolarHBondContact O-N 3.11Å; F494-L497 PolarHBondContact O-N 3.31Å
498	V	87	Confident	88.2	Confident	22 Å²	22	70.8 Å²	70.8	13%	0.133	34%	0.341	C	S	.	.	H	α-helix	trans	-107.8	-20.7	-170.6	-172	0	0	0	0	112.7	V424 F426 F444 F494 R502	V424-V498 HydrophobicContact CG1-CG1 4.35Å; V424-V498 HydrophobicContact CG1-CG2 4Å; V424-V498 HydrophobicContact CG2-CG1 4.03Å; F426-V498 HydrophobicContact CE1-CG1 4.03Å; F426-V498 HydrophobicContact CZ-CG1 3.7Å; F444-V498 HydrophobicContact CE2-CG2 3.69Å; F444-V498 HydrophobicContact CZ-CG2 3.91Å; F494-V498 WeakPolarHBondContact O-CB 3.49Å; F494-V498 PolarHBondContact O-N 2.69Å; V498-R502 HydrophobicContact CG1-CB 4.16Å
499	G	80.8	Confident	88.1	Confident	29 Å²	29	66.3 Å²	66.3	30%	0.299	32%	0.321	S	S	.	.			trans	101	157.5	-172.4	0	0	0	0	0	112.8	K495 E501	K495-G499 CarbonylContact O-C 3.59Å; K495-G499 VanDerWaalsContact O-C 3.24Å; K495-G499 WeakPolarHBondContact O-CA 3.47Å; K495-G499 PolarHBondContact O-N 3.28Å; G499-E501 VanDerWaalsContact C-N 3.26Å; G499-E501 PolarHBondContact O-N 2.75Å
500	K	77.8	Confident	87.7	Confident	186 Å²	186	66.6 Å²	66.6	81%	0.809	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-21.5	-174.1	-66	179.8	-179	176.5	0	114.3	R502	K500-R502 PolarHBondContact O-N 3.06Å
501	E	81	Confident	86.7	Confident	186 Å²	186	72.1 Å²	72.1	87%	0.869	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-17.8	-174.3	-61.2	-177	175.9	0	0	113.2	G499 P503	G499-E501 VanDerWaalsContact C-N 3.26Å; G499-E501 PolarHBondContact O-N 2.75Å; E501-P503 WeakPolarHBondContact O-CD 3.21Å
502	R	83.8	Confident	85.1	Confident	70 Å²	70	75.8 Å²	75.8	26%	0.264	37%	0.373	S	S	.	.	S	Bend	trans	-115.9	93.5	-177.1	-62.1	-168	174.6	124.4	-5.7	110.5	V424 F426 S433 V498 K500	V424-R502 HydrophobicContact CG2-CB 3.47Å; V424-R502 VanDerWaalsContact CG2-CB 3.47Å; V424-R502 HydrophobicContact CG2-CG 4.38Å; F426-R502 VanDerWaalsContact CD1-NH1 3.34Å; S433-R502 PolarHBondContact OG-NH2 3.34Å; V498-R502 HydrophobicContact CG1-CB 4.16Å; K500-R502 PolarHBondContact O-N 3.06Å
503	P	86.2	Confident	82.8	Confident	74 Å²	74	80 Å²	80	48%	0.481	40%	0.397	S	S	.	.			trans	-64.8	141.2	179.9	26.5	-33.3	0	0	0	111	E501 F505	E501-P503 WeakPolarHBondContact O-CD 3.21Å; P503-F505 HydrophobicContact CB-CE2 4.25Å; P503-F505 HydrophobicContact CB-CZ 4.1Å; P503-F505 HydrophobicContact CG-CE2 3.87Å; P503-F505 HydrophobicContact CG-CZ 3.74Å; P503-F505 WeakPolarHBondContact O-CE2 3.47Å
504	A	91.2	Very high	80.1	Confident	11 Å²	11	93.8 Å²	93.8	9%	0.091	45%	0.447	C	S	.	.			trans	-94.4	133.3	174.7	0	0	0	0	0	110.6	V422 A423 F494	V422-A504 HydrophobicContact CG1-CB 3.78Å; A423-A504 WeakPolarHBondContact O-CA 3.38Å; F494-A504 HydrophobicContact CB-CB 3.59Å; F494-A504 HydrophobicContact CD1-CB 3.3Å; F494-A504 HydrophobicContact CD2-CB 4.49Å; F494-A504 HydrophobicContact CE1-CB 4.08Å; F494-A504 HydrophobicContact CG-CB 3.55Å
505	F	90.2	Very high	79.6	Confident	127 Å²	127	98.4 Å²	98.4	56%	0.557	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.4	131.1	-177.8	-60.5	-83.2	0	0	0	110.7	V422 A423 P503	V422-F505 WeakPolarHBondContact CA-O 3.15Å; A423-F505 PolarHBondContact N-O 2.72Å; A423-F505 PolarHBondContact O-N 3.1Å; P503-F505 HydrophobicContact CB-CE2 4.25Å; P503-F505 HydrophobicContact CB-CZ 4.1Å; P503-F505 HydrophobicContact CG-CE2 3.87Å; P503-F505 HydrophobicContact CG-CZ 3.74Å; P503-F505 WeakPolarHBondContact O-CE2 3.47Å
506	Y	92.6	Very high	79.1	Confident	58 Å²	58	99.4 Å²	99.4	23%	0.227	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	131.4	169.6	179.2	-94.7	0	0	0	109.7	R421 V422 L478 K487 P508	R421-Y506 CarbonylContact O-C 3.44Å; R421-Y506 VanDerWaalsContact O-CA 3.3Å; R421-Y506 WeakPolarHBondContact O-CA 3.44Å; V422-Y506 HydrophobicContact CG2-CD2 3.63Å; V422-Y506 HydrophobicContact CG2-CG 4.37Å; L478-Y506 HydrophobicContact CD1-CD2 4.4Å; L478-Y506 HydrophobicContact CD1-CE2 4.33Å; K487-Y506 HydrophobicContact CD-CD1 4.13Å; K487-Y506 HydrophobicContact CD-CD2 3.99Å; K487-Y506 HydrophobicContact CD-CE1 4.11Å; K487-Y506 HydrophobicContact CD-CE2 3.97Å; K487-Y506 HydrophobicContact CD-CG 4.06Å; K487-Y506 HydrophobicContact CG-CD2 4.25Å; K487-Y506 HydrophobicContact CG-CE2 4.35Å; Y506-P508 HydrophobicContact CE1-CB 4.36Å
507	K	91.7	Very high	78.6	Confident	108 Å²	108	98 Å²	98	47%	0.47	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	124.5	170.1	-68.8	-173.2	176.8	-173.8	0	109.1	G420 R421	G420-K507 CarbonylContact C-O 3.46Å; G420-K507 VanDerWaalsContact CA-O 3.25Å; G420-K507 WeakPolarHBondContact CA-O 3.31Å; R421-K507 HydrophobicContact CG-CB 4.43Å; R421-K507 PolarHBondContact N-O 2.77Å; R421-K507 PolarHBondContact O-N 2.78Å
508	P	91.9	Very high	78.3	Confident	66 Å²	66	103.4 Å²	103.4	43%	0.429	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	149.3	172.9	28.8	-34.3	0	0	0	110	Y506	Y506-P508 HydrophobicContact CE1-CB 4.36Å
509	H	89.3	Confident	77.8	Confident	0 Å²	0	108.5 Å²	108.5	0%	0	51%	0.514	C	S	.	.	S	Bend	trans	-68.8	-42.2	-179.2	-75.1	-54.8	0	0	0	111.9	I172 F176 W411 N416 G419 G420 W477	I172-H509 HydrophobicContact CD1-CB 4.02Å; I172-H509 WeakPolarHBondContact CD1-ND1 3.47Å; F176-H509 WeakPolarHBondContact CE2-O 3.27Å; W411-H509 HydrophobicContact CB-CB 4.24Å; N416-H509 PolarHBondContact O-CD2 3.15Å; G419-H509 VanDerWaalsContact C-CD2 3.44Å; G419-H509 PolarHBondContact O-N 2.97Å; G420-H509 WeakPolarHBondContact CA-CD2 3.2Å; G420-H509 PolarHBondContact N-CD2 3.31Å; G420-H509 VanDerWaalsContact N-CD2 3.27Å; G420-H509 PolarHBondContact O-NE2 3.4Å; W477-H509 AromaticContact CD2-CE1 3.32Å; W477-H509 AromaticContact CD2-NE2 3.5Å; W477-H509 AromaticContact CE2-CE1 3.51Å; W477-H509 AromaticContact CE3-CE1 3.54Å; W477-H509 AromaticContact CE3-NE2 3.47Å; W477-H509 AromaticContact CG-CE1 3.83Å; W477-H509 AromaticContact CG-NE2 3.82Å; W477-H509 AromaticContact CZ2-CE1 3.9Å; W477-H509 AromaticContact CZ3-CE1 3.93Å; W477-H509 AromaticContact NE1-CE1 4Å
510	I	84.6	Confident	77.6	Confident	65 Å²	65	113.8 Å²	113.8	33%	0.333	53%	0.528	S	S	.	.	S	Bend	trans	-101.9	119.3	172.5	-62.6	173.8	0	0	0	107.7	F176 W411 A417 L512	F176-I510 HydrophobicContact CZ-CB 4.43Å; F176-I510 HydrophobicContact CZ-CG1 4.49Å; F176-I510 HydrophobicContact CZ-CG2 4.42Å; W411-I510 HydrophobicContact CE3-CD1 4.45Å; W411-I510 HydrophobicContact CE3-CG1 3.97Å; W411-I510 HydrophobicContact CZ3-CD1 4.05Å; W411-I510 HydrophobicContact CZ3-CG1 3.72Å; A417-I510 HydrophobicContact CB-CD1 4.07Å; A417-I510 VanDerWaalsContact O-CD1 3.31Å; A417-I510 WeakPolarHBondContact O-CD1 3.18Å; A417-I510 WeakPolarHBondContact O-CG1 3.28Å; I510-L512 PolarHBondContact O-N 3.46Å; I510-L512 VanDerWaalsContact O-N 3.08Å
511	K	70.3	Confident	77.5	Confident	117 Å²	117	108.6 Å²	108.6	51%	0.509	51%	0.508	S	S	.	.			trans	-65.6	109.8	163.6	-68.9	-176.2	-171.7	167.8	0	106.5	F176 L513	F176-K511 HydrophobicContact CB-CD 3.99Å; F176-K511 HydrophobicContact CB-CG 4.45Å; F176-K511 HydrophobicContact CD1-CB 4.06Å; F176-K511 HydrophobicContact CD1-CD 4.32Å; F176-K511 HydrophobicContact CD1-CG 4.21Å; F176-K511 HydrophobicContact CE1-CB 4.28Å; F176-K511 HydrophobicContact CG-CD 4.32Å; F176-K511 HydrophobicContact CG-CG 4.3Å; F176-K511 PolarHBondContact O-NZ 2.99Å; K511-L513 VanDerWaalsContact C-N 3.33Å; K511-L513 PolarHBondContact O-N 3.36Å
512	L	57.9	Low	77.3	Confident	155 Å²	155	102.7 Å²	102.7	81%	0.812	48%	0.481	S	S	*	.			trans	-60.6	102.4	167.3	-72	171.7	0	0	0	106.8	I510 R514	I510-L512 PolarHBondContact O-N 3.46Å; I510-L512 VanDerWaalsContact O-N 3.08Å; L512-R514 PolarHBondContact O-N 2.87Å
513	L	42.4	Very low	76.7	Confident	172 Å²	172	105.4 Å²	105.4	90%	0.901	50%	0.499	S	S	*	.			trans	-57.1	111.1	166	-67.7	169.8	0	0	0	106	K511	K511-L513 VanDerWaalsContact C-N 3.33Å; K511-L513 PolarHBondContact O-N 3.36Å
514	R	32.5	Very low	75.9	Confident	312 Å²	312	108.3 Å²	108.3	100%	1.177	50%	0.5	S	S	*	.			trans	-85.1	0	172.2	-90.4	-170.4	178	169.8	1.1	110.6	L512	L512-R514 PolarHBondContact O-N 2.87Å

Retrieved 514 of 514 residues in 357.9 ms (Link to these results)

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