A0A087XZY5_POEFO Loading...

5-taurinomethyluridine-[tRNA] synthase subunit GTPB3, mitochondrial

GTPase component of the GTPBP3-MTO1 complex that catalyzes the 5-taurinomethyluridine (taum(5)U) modification at the 34th wobble position (U34) of mitochondrial tRNAs (mt-tRNAs), which plays a role in mt-tRNA decoding and mitochondrial translation. Taum(5)U formation on mammalian mt-tRNA requires the presence of both GTPBP3-mediated GTPase activity and MTO1 catalytic activity.

AlphaFold DB , UniProt , Accession A0A087XZY5, Species POEFO (Poecilia formosa, Amazon molly), 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	40	Very low	33.2	Very low	247 Å²	247	131.8 Å²	131.8	100%	1.217	85%	0.846	S	S	*	*				0	107.6	0	-80.4	178.3	176.3	0	0	107.7
2	L	26.3	Very low	33.2	Very low	166 Å²	166	139.8 Å²	139.8	87%	0.869	85%	0.85	S	S	*	*			trans	-137.2	149.6	179.4	-90.2	161.6	0	0	0	107.7
3	P	30.8	Very low	33	Very low	107 Å²	107	148 Å²	148	70%	0.695	86%	0.856	S	S	*	*			trans	-82.5	149.7	-159.8	32.2	-33.8	0	0	0	113.8	S5	P3-S5 PolarHBondContact O-N 3.33Å
4	V	35.1	Very low	32.7	Very low	150 Å²	150	144.1 Å²	144.1	91%	0.909	85%	0.85	S	S	*	*	S	Bend	trans	-80.9	87.3	-180	-177.5	0	0	0	0	109.3
5	S	35.2	Very low	32.6	Very low	111 Å²	111	143.4 Å²	143.4	78%	0.776	85%	0.848	S	S	*	*			trans	-144.7	23.2	169.3	74.5	0	0	0	0	114.1	P3	P3-S5 PolarHBondContact O-N 3.33Å
6	A	33.3	Very low	32.5	Very low	93 Å²	93	144.9 Å²	144.9	77%	0.769	85%	0.849	S	S	*	*			trans	-136.3	59.2	-174.4	0	0	0	0	0	113.1
7	V	37	Very low	32.3	Very low	133 Å²	133	150.2 Å²	150.2	81%	0.806	85%	0.851	S	S	*	*	S	Bend	trans	-134.8	-15.9	171	-176.4	0	0	0	0	114.6
8	C	32.3	Very low	32.2	Very low	139 Å²	139	150 Å²	150	94%	0.939	85%	0.854	S	S	*	*	S	Bend	trans	-98	5.4	-176.2	-74.4	0	0	0	0	116.5
9	G	30.6	Very low	32.2	Very low	78 Å²	78	151.4 Å²	151.4	80%	0.804	86%	0.857	S	S	*	*	S	Bend	trans	-99.1	-1.8	-174.5	0	0	0	0	0	117
10	G	29.3	Very low	32	Very low	70 Å²	70	155.5 Å²	155.5	72%	0.722	86%	0.859	S	S	*	*	S	Bend	trans	-94.8	-12.7	-160.8	0	0	0	0	0	118
11	I	34.8	Very low	32	Very low	156 Å²	156	154.3 Å²	154.3	80%	0.8	86%	0.856	S	S	*	*	S	Bend	trans	-101.7	-14.6	-166.6	-59.7	176.8	0	0	0	113.2
12	Y	33.2	Very low	31.5	Very low	227 Å²	227	154.1 Å²	154.1	89%	0.89	84%	0.842	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	11.4	-170.9	-92	-82.3	0	0	0	116.9
13	R	30.7	Very low	31.7	Very low	247 Å²	247	154.3 Å²	154.3	93%	0.932	84%	0.843	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	6.4	-174.4	-107.1	-176	-179.2	-172.9	1.3	117.6
14	A	29.6	Very low	31.6	Very low	94 Å²	94	156.4 Å²	156.4	78%	0.777	85%	0.847	S	S	*	*	S	Bend	trans	-104.5	1.6	-173.9	0	0	0	0	0	116.5
15	T	30.7	Very low	31.3	Very low	133 Å²	133	154.9 Å²	154.9	82%	0.816	84%	0.84	S	S	*	*	S	Bend	trans	-115.4	19	-170.9	-20.9	0	0	0	0	115.4
16	I	31.6	Very low	31	Very low	167 Å²	167	157.1 Å²	157.1	86%	0.856	84%	0.843	S	S	*	*	S	Bend	trans	-115.8	41.5	174.8	-47	-177.8	0	0	0	111.1
17	R	29	Very low	30.7	Very low	235 Å²	235	160.8 Å²	160.8	89%	0.887	85%	0.849	S	S	*	*	S	Bend	trans	-154.6	54	175.5	-124.2	177.4	-167.3	-171.6	3.7	115.8
18	T	29.4	Very low	30.3	Very low	147 Å²	147	165 Å²	165	90%	0.902	85%	0.851	S	S	*	*			trans	-159.7	57.4	159	17.6	0	0	0	0	111.7
19	L	31.9	Very low	30	Very low	176 Å²	176	170.3 Å²	170.3	92%	0.921	85%	0.851	S	S	*	*			trans	-107.1	92.3	157.7	-84.4	165.8	0	0	0	107.9
20	R	28.5	Very low	30.1	Very low	234 Å²	234	174.9 Å²	174.9	88%	0.883	86%	0.856	S	S	*	*			trans	-157.6	124	154	-110.7	171.6	-170.8	-168	1.7	110.8
21	T	33.4	Very low	30	Very low	130 Å²	130	177.5 Å²	177.5	80%	0.798	86%	0.864	S	S	*	*			trans	69.9	107.6	156.3	61.6	0	0	0	0	118.3
22	R	27.7	Very low	29.7	Very low	244 Å²	244	176 Å²	176	92%	0.921	87%	0.867	S	S	*	*			trans	-159.2	103	132	-105.3	167.3	-169.2	-169.5	3	110.8
23	N	31.9	Very low	29.4	Very low	170 Å²	170	169.2 Å²	169.2	91%	0.909	87%	0.865	S	S	*	*			trans	-72.3	126.5	163	-87.4	-16.8	0	0	0	109.4
24	I	29.2	Very low	29.3	Very low	151 Å²	151	160.9 Å²	160.9	77%	0.774	86%	0.856	S	S	*	*			trans	-144.8	141	163.1	-62.5	-173	0	0	0	108.2
25	P	28.4	Very low	29.3	Very low	118 Å²	118	169 Å²	169	77%	0.766	87%	0.867	S	S	*	*			trans	-91.4	155.8	-147	35.3	-33.9	0	0	0	115.3	N27	P25-N27 PolarHBondContact O-N 2.98Å
26	L	28.8	Very low	29.4	Very low	157 Å²	157	168.2 Å²	168.2	82%	0.822	86%	0.862	S	S	*	*			trans	-62.7	124.2	169.6	-84.9	119.4	0	0	0	111.3
27	N	26.4	Very low	29.4	Very low	170 Å²	170	167.8 Å²	167.8	91%	0.909	86%	0.86	S	S	*	*			trans	-127.9	100.3	159.4	-125.7	-7.9	0	0	0	109.1	P25	P25-N27 PolarHBondContact O-N 2.98Å
28	R	29.7	Very low	29.5	Very low	223 Å²	223	162 Å²	162	84%	0.842	86%	0.863	S	S	*	*			trans	-80.5	120.6	174	-89.9	179.7	170.7	175.9	-2.5	109.2
29	R	24.9	Very low	29.6	Very low	250 Å²	250	158.2 Å²	158.2	94%	0.943	85%	0.853	S	S	*	*			trans	-112.9	122.3	151.3	-82.8	-171.5	177.9	-170	0.1	108.5
30	L	32.1	Very low	29.8	Very low	174 Å²	174	155.8 Å²	155.8	91%	0.911	84%	0.841	S	S	*	*			trans	-73.4	129.5	173.5	-75.1	143.9	0	0	0	109.5
31	S	27.1	Very low	30.3	Very low	125 Å²	125	149.7 Å²	149.7	87%	0.874	84%	0.84	S	S	*	*			trans	-146.4	142.2	148.9	62	0	0	0	0	110.2
32	S	30	Very low	30.8	Very low	125 Å²	125	151.2 Å²	151.2	87%	0.874	84%	0.843	S	S	*	*			trans	-87.8	143.9	-159.3	48.4	0	0	0	0	114.8
33	G	26.7	Very low	32.3	Very low	83 Å²	83	141.3 Å²	141.3	86%	0.856	81%	0.814	S	S	*	*			trans	142.8	107.3	151	0	0	0	0	0	115.6
34	G	28	Very low	34.9	Very low	72 Å²	72	137 Å²	137	74%	0.742	79%	0.791	S	S	*	*			trans	110.8	98.6	166.9	0	0	0	0	0	114.6	V36	G34-V36 VanDerWaalsContact C-N 3.34Å; G34-V36 PolarHBondContact O-N 3.39Å
35	R	29.2	Very low	38.1	Very low	265 Å²	265	129.8 Å²	129.8	100%	1	75%	0.754	S	S	*	*			trans	-68.9	89.3	169.8	-95.6	-179.2	171.4	174.6	-3	109.4
36	V	33.9	Very low	41.4	Very low	117 Å²	117	124.2 Å²	124.2	71%	0.709	72%	0.717	S	S	*	*			trans	-80.7	129.6	152.9	-179.3	0	0	0	0	106.1	G34 A38	G34-V36 VanDerWaalsContact C-N 3.34Å; G34-V36 PolarHBondContact O-N 3.39Å; V36-A38 PolarHBondContact O-N 2.89Å
37	L	31.7	Very low	44.6	Very low	157 Å²	157	117.1 Å²	117.1	82%	0.822	68%	0.68	S	S	*	*			trans	-48.7	117.5	172.5	-84.2	150.4	0	0	0	108.8	G39	L37-G39 PolarHBondContact O-N 3.37Å
38	A	30.6	Very low	48	Very low	114 Å²	114	109.3 Å²	109.3	94%	0.942	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	58	-171.9	0	0	0	0	0	112.5	V36	V36-A38 PolarHBondContact O-N 2.89Å
39	G	31.2	Very low	51.1	Low	68 Å²	68	99.4 Å²	99.4	70%	0.701	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.6	0.7	176.6	0	0	0	0	0	115	L37	L37-G39 PolarHBondContact O-N 3.37Å
40	L	37.3	Very low	54.3	Low	125 Å²	125	88.5 Å²	88.5	65%	0.654	57%	0.565	S	S	*	*	S	Bend	trans	-117.2	0.7	-174.3	-75.2	163.5	0	0	0	114.7	D42	L40-D42 PolarHBondContact O-N 2.98Å
41	A	37.6	Very low	57	Low	106 Å²	106	81.7 Å²	81.7	88%	0.876	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-1.2	-179.2	0	0	0	0	0	114.2
42	D	45.3	Very low	59.5	Low	161 Å²	161	78.7 Å²	78.7	86%	0.861	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.6	13.4	-175.9	-115.6	-0.4	0	0	0	112.9	L40 D44	L40-D42 PolarHBondContact O-N 2.98Å; D42-D44 PolarHBondContact O-N 3.3Å
43	A	58.5	Low	61.6	Low	36 Å²	36	79.9 Å²	79.9	30%	0.298	51%	0.512	S	S	.	.			trans	-79.1	110.8	178.4	0	0	0	0	0	110.6	T45	A43-T45 PolarHBondContact O-N 3.48Å
44	D	87.2	Confident	64.2	Low	80 Å²	80	78.1 Å²	78.1	43%	0.428	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-50.9	138.4	170.8	-68.2	-30.9	0	0	0	111.1	D42 R147 R157	D42-D44 PolarHBondContact O-N 3.3Å; D44-R147 HydrophobicContact CB-CG 4.01Å; D44-R147 WeakPolarHBondContact OD2-CD 3.4Å; D44-R147 IonicContact OD2-NE 3.28Å; D44-R147 PolarHBondContact OD2-NE 2.96Å; D44-R157 PolarHBondContact O-NH1 2.93Å; D44-R157 PolarHBondContact O-NH2 2.78Å
45	T	95.6	Very high	67.1	Low	0 Å²	0	85.5 Å²	85.5	0%	0	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	127.1	171.2	-62.4	0	0	0	0	109.5	A43 I63 S64 S66 A67 G145 M146 R147	A43-T45 PolarHBondContact O-N 3.48Å; T45-I63 HydrophobicContact CG2-CG2 3.7Å; T45-S64 CarbonylContact C-O 3.6Å; T45-S64 WeakPolarHBondContact CA-O 3.3Å; T45-S64 WeakPolarHBondContact CG2-O 3.49Å; T45-S66 PolarHBondContact OG1-N 3.02Å; T45-A67 HydrophobicContact CG2-CB 4.11Å; T45-A67 VanDerWaalsContact OG1-CB 3.29Å; T45-A67 WeakPolarHBondContact OG1-CB 3.15Å; T45-A67 PolarHBondContact OG1-N 3.34Å; T45-G145 WeakPolarHBondContact CB-O 3.06Å; T45-G145 PolarHBondContact N-O 3.44Å; T45-M146 HydrophobicContact CG2-CE 3.65Å; T45-M146 HydrophobicContact CG2-CG 4.26Å; T45-M146 CarbonylContact O-C 3.53Å; T45-M146 VanDerWaalsContact O-CA 3.22Å; T45-M146 WeakPolarHBondContact O-CA 3.5Å; T45-R147 PolarHBondContact O-N 3.17Å
46	I	96.9	Very high	70.1	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	150.6	-176.5	55.5	167.8	0	0	0	112.1	I63 S64 R147 A149 E153 F154	I46-I63 CarbonylContact O-C 3.59Å; I46-I63 VanDerWaalsContact O-CA 3.25Å; I46-I63 WeakPolarHBondContact O-CA 3.37Å; I46-S64 PolarHBondContact N-O 3.48Å; I46-S64 PolarHBondContact O-N 3.22Å; I46-R147 CarbonylContact C-O 3.59Å; I46-R147 VanDerWaalsContact CA-O 3.3Å; I46-R147 WeakPolarHBondContact CA-O 3.27Å; I46-R147 HydrophobicContact CG2-CG 4.18Å; I46-R147 VanDerWaalsContact CG2-NH1 3.34Å; I46-A149 HydrophobicContact CB-CB 3.93Å; I46-A149 HydrophobicContact CD1-CB 3.99Å; I46-A149 HydrophobicContact CG1-CB 4.45Å; I46-A149 HydrophobicContact CG2-CB 4.45Å; I46-E153 HydrophobicContact CD1-CB 4.12Å; I46-E153 HydrophobicContact CD1-CG 3.85Å; I46-F154 HydrophobicContact CD1-CD1 3.84Å; I46-F154 HydrophobicContact CD1-CD2 4.12Å; I46-F154 HydrophobicContact CD1-CE1 3.78Å; I46-F154 HydrophobicContact CD1-CE2 4.05Å; I46-F154 HydrophobicContact CD1-CG 4.01Å; I46-F154 HydrophobicContact CD1-CZ 3.9Å; I46-F154 HydrophobicContact CG1-CD1 4.4Å; I46-F154 HydrophobicContact CG1-CE1 3.91Å; I46-F154 HydrophobicContact CG1-CZ 4.03Å
47	F	97.3	Very high	72.9	Confident	9 Å²	9	72.8 Å²	72.8	4%	0.039	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	149.6	170.5	64.5	-93.7	0	0	0	112.1	R62 I63 L137 L140 M146 R147 P148 A149	F47-R62 CarbonylContact C-O 3.6Å; F47-R62 WeakPolarHBondContact CA-O 3.47Å; F47-I63 HydrophobicContact CB-CB 4.49Å; F47-I63 HydrophobicContact CB-CG1 3.86Å; F47-L137 HydrophobicContact CD2-CD2 3.64Å; F47-L137 HydrophobicContact CE2-CB 4.23Å; F47-L137 HydrophobicContact CE2-CD2 3.96Å; F47-L137 WeakPolarHBondContact CE2-O 3.41Å; F47-L140 HydrophobicContact CB-CD1 4.09Å; F47-L140 HydrophobicContact CD1-CB 3.93Å; F47-L140 HydrophobicContact CD2-CB 3.92Å; F47-L140 HydrophobicContact CD2-CD1 4.03Å; F47-L140 HydrophobicContact CE1-CB 3.97Å; F47-L140 HydrophobicContact CE2-CB 3.98Å; F47-L140 HydrophobicContact CG-CB 3.9Å; F47-L140 HydrophobicContact CG-CD1 4.08Å; F47-L140 HydrophobicContact CZ-CB 4Å; F47-M146 HydrophobicContact CD1-CB 4.06Å; F47-M146 HydrophobicContact CD1-CE 4.26Å; F47-M146 HydrophobicContact CE1-CB 4.02Å; F47-R147 WeakPolarHBondContact CD1-O 3.42Å; F47-R147 WeakPolarHBondContact CE1-O 3.21Å; F47-R147 PolarHBondContact N-O 2.9Å; F47-P148 HydrophobicContact CE2-CG 4.34Å; F47-P148 HydrophobicContact CZ-CG 4.05Å; F47-P148 WeakPolarHBondContact O-CA 3.39Å; F47-A149 PolarHBondContact O-N 3.39Å
48	A	96.3	Very high	76	Confident	5 Å²	5	69.5 Å²	69.5	4%	0.041	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	165.8	172.9	0	0	0	0	0	111.8	S50 V61 R62 A149 F154 I512	A48-S50 PolarHBondContact O-N 2.97Å; A48-V61 CarbonylContact O-C 3.21Å; A48-V61 WeakPolarHBondContact O-CA 3.27Å; A48-R62 PolarHBondContact N-O 3.32Å; A48-R62 PolarHBondContact O-N 3.48Å; A48-A149 HydrophobicContact CB-CB 3.98Å; A48-F154 HydrophobicContact CB-CE2 3.91Å; A48-F154 HydrophobicContact CB-CZ 4.44Å; A48-I512 HydrophobicContact CB-CG2 4.04Å
49	L	95.1	Very high	79.1	Confident	15 Å²	15	64.1 Å²	64.1	8%	0.079	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	117.2	164.6	-178.8	71.9	0	0	0	109.1	S51 A59 V61 I133 G513	L49-S51 VanDerWaalsContact CD1-OG 3.31Å; L49-S51 WeakPolarHBondContact CD1-OG 3.46Å; L49-A59 HydrophobicContact CD1-CB 3.85Å; L49-V61 HydrophobicContact CD1-CG2 4.35Å; L49-I133 HydrophobicContact CD1-CD1 4.12Å; L49-I133 HydrophobicContact CD1-CG1 4.34Å; L49-I133 HydrophobicContact CD1-CG2 4.13Å; L49-I133 HydrophobicContact CD2-CD1 4.34Å; L49-I133 HydrophobicContact CD2-CG2 4.37Å; L49-G513 WeakPolarHBondContact O-CA 3.38Å
50	S	92.6	Very high	82.3	Confident	22 Å²	22	62.3 Å²	62.3	15%	0.154	38%	0.382	C	S	.	.			trans	-97.8	-7.3	179.9	-67.4	0	0	0	0	114.2	A48 V60 R62 G513	A48-S50 PolarHBondContact O-N 2.97Å; S50-V60 PolarHBondContact N-O 3.39Å; S50-R62 WeakPolarHBondContact OG-CB 3.33Å; S50-G513 WeakPolarHBondContact CB-O 3.27Å; S50-G513 PolarHBondContact OG-O 3.02Å
51	S	88.8	Confident	85.1	Confident	30 Å²	30	56.3 Å²	56.3	21%	0.21	35%	0.351	C	S	.	.	S	Bend	trans	-90	163	170.4	54.7	0	0	0	0	111.7	L49 A59 V60	L49-S51 VanDerWaalsContact CD1-OG 3.31Å; L49-S51 WeakPolarHBondContact CD1-OG 3.46Å; S51-A59 WeakPolarHBondContact OG-CA 3.26Å; S51-V60 PolarHBondContact OG-N 3Å; S51-V60 VanDerWaalsContact OG-N 3.13Å
52	G	79.9	Confident	88	Confident	62 Å²	62	53.1 Å²	53.1	64%	0.639	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-56.8	152	174.6	0	0	0	0	0	113.1
53	H	74.4	Confident	90.5	Very high	150 Å²	150	45.5 Å²	45.5	69%	0.694	28%	0.275	S	S	*	.	S	Bend	trans	-76.6	139.8	177.7	-67.3	83.6	0	0	0	110.8
54	G	81.1	Confident	92.4	Very high	47 Å²	47	43.8 Å²	43.8	49%	0.485	26%	0.261	S	S	.	.	S	Bend	trans	133.6	-179.3	179	0	0	0	0	0	112.3
55	R	89.3	Confident	92.8	Very high	227 Å²	227	40 Å²	40	86%	0.857	24%	0.241	S	C	*	.	S	Bend	trans	-79	124.3	173.8	-64.5	-178.7	-176.8	-171.2	0.6	108.9
56	C	91.5	Very high	92.7	Very high	55 Å²	55	44.6 Å²	44.6	37%	0.372	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	165.8	177.2	59.8	0	0	0	0	111.6	V58 G128	C56-V58 PolarHBondContact SG-O 3.49Å; C56-G128 PolarHBondContact N-O 3.28Å; C56-G128 WeakPolarHBondContact O-CA 3.43Å; C56-G128 PolarHBondContact O-N 3.47Å
57	G	93.4	Very high	92.6	Very high	60 Å²	60	45.2 Å²	45.2	62%	0.619	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	-40.7	176.9	0	0	0	0	0	112.7
58	V	95.6	Very high	92.5	Very high	88 Å²	88	44.8 Å²	44.8	53%	0.533	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	131.6	-180	-178.6	0	0	0	0	109.9	C56 H125 I126	C56-V58 PolarHBondContact SG-O 3.49Å; V58-H125 HydrophobicContact CG1-CB 3.99Å; V58-I126 CarbonylContact C-O 3.43Å; V58-I126 WeakPolarHBondContact CA-O 3.38Å
59	A	96.4	Very high	92.4	Very high	0 Å²	0	45 Å²	45	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	140.2	170.7	0	0	0	0	0	109.7	L49 S51 H125 I126 I133	L49-A59 HydrophobicContact CD1-CB 3.85Å; S51-A59 WeakPolarHBondContact OG-CA 3.26Å; A59-H125 CarbonylContact O-C 3.56Å; A59-H125 WeakPolarHBondContact O-CA 3.27Å; A59-I126 HydrophobicContact CB-CG1 4.09Å; A59-I126 PolarHBondContact N-O 2.85Å; A59-I126 WeakPolarHBondContact O-CG1 3.36Å; A59-I126 PolarHBondContact O-N 3.39Å; A59-I133 HydrophobicContact CB-CD1 3.92Å; A59-I133 HydrophobicContact CB-CG1 4.09Å
60	V	97.3	Very high	92.3	Very high	30 Å²	30	47.2 Å²	47.2	18%	0.182	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	118.4	-179.8	-179.4	0	0	0	0	108.7	S50 S51 E123 F124	S50-V60 PolarHBondContact N-O 3.39Å; S51-V60 PolarHBondContact OG-N 3Å; S51-V60 VanDerWaalsContact OG-N 3.13Å; V60-E123 HydrophobicContact CG1-CB 4.19Å; V60-E123 HydrophobicContact CG1-CG 4.22Å; V60-F124 CarbonylContact C-O 3.53Å; V60-F124 WeakPolarHBondContact CA-O 3.3Å
61	V	97.6	Very high	92.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	119.8	169.7	178.8	0	0	0	0	108	A48 L49 E123 F124 I126 V136 L137 L140	A48-V61 CarbonylContact O-C 3.21Å; A48-V61 WeakPolarHBondContact O-CA 3.27Å; L49-V61 HydrophobicContact CD1-CG2 4.35Å; V61-E123 WeakPolarHBondContact O-CA 3.48Å; V61-F124 HydrophobicContact CB-CB 4.39Å; V61-F124 PolarHBondContact N-O 3.01Å; V61-F124 PolarHBondContact O-N 3.05Å; V61-I126 HydrophobicContact CG2-CD1 3.72Å; V61-I126 HydrophobicContact CG2-CG1 4.36Å; V61-V136 HydrophobicContact CG1-CG1 4.47Å; V61-V136 HydrophobicContact CG2-CG1 4.31Å; V61-L137 HydrophobicContact CG1-CD2 3.9Å; V61-L137 HydrophobicContact CG2-CD2 4.49Å; V61-L140 HydrophobicContact CG1-CD1 3.6Å
62	R	97.9	Very high	92.7	Very high	39 Å²	39	44.7 Å²	44.7	15%	0.147	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	142.4	180	-175.4	176.7	-74.3	172.7	-3.3	110.4	F47 A48 S50 V122 E123 F154	F47-R62 CarbonylContact C-O 3.6Å; F47-R62 WeakPolarHBondContact CA-O 3.47Å; A48-R62 PolarHBondContact N-O 3.32Å; A48-R62 PolarHBondContact O-N 3.48Å; S50-R62 WeakPolarHBondContact OG-CB 3.33Å; R62-V122 WeakPolarHBondContact CA-O 3.49Å; R62-E123 HydrophobicContact CB-CG 4.49Å; R62-E123 HydrophobicContact CG-CG 4.35Å; R62-E123 IonicContact CZ-OE1 3.58Å; R62-E123 IonicContact NE-OE1 3.99Å; R62-E123 PolarHBondContact NE-OE1 2.83Å; R62-E123 VanDerWaalsContact NE-OE1 3.08Å; R62-E123 IonicContact NH2-OE1 2.73Å; R62-E123 PolarHBondContact NH2-OE1 3.44Å; R62-F154 HydrophobicContact CB-CE1 4.26Å; R62-F154 HydrophobicContact CB-CZ 4.27Å; R62-F154 HydrophobicContact CG-CD1 4.23Å; R62-F154 HydrophobicContact CG-CE1 3.73Å; R62-F154 HydrophobicContact CG-CZ 4.24Å
63	I	97.8	Very high	93.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	137.7	175.2	-57.6	150.3	0	0	0	107.9	T45 I46 F47 A68 A71 S121 V122 F124 L140 M146	T45-I63 HydrophobicContact CG2-CG2 3.7Å; I46-I63 CarbonylContact O-C 3.59Å; I46-I63 VanDerWaalsContact O-CA 3.25Å; I46-I63 WeakPolarHBondContact O-CA 3.37Å; F47-I63 HydrophobicContact CB-CB 4.49Å; F47-I63 HydrophobicContact CB-CG1 3.86Å; I63-A68 HydrophobicContact CG2-CB 3.84Å; I63-A71 HydrophobicContact CD1-CB 4.23Å; I63-S121 CarbonylContact O-C 3.48Å; I63-S121 WeakPolarHBondContact O-CA 3.46Å; I63-S121 WeakPolarHBondContact O-CB 3.29Å; I63-S121 PolarHBondContact O-OG 3.37Å; I63-V122 HydrophobicContact CB-CB 4.22Å; I63-V122 HydrophobicContact CD1-CB 4.08Å; I63-V122 HydrophobicContact CD1-CG1 4.15Å; I63-V122 PolarHBondContact N-O 2.9Å; I63-V122 PolarHBondContact O-N 3.31Å; I63-F124 HydrophobicContact CD1-CD2 4.17Å; I63-F124 HydrophobicContact CD1-CE2 3.7Å; I63-F124 HydrophobicContact CD1-CZ 3.93Å; I63-L140 HydrophobicContact CD1-CD1 4.11Å; I63-L140 HydrophobicContact CD1-CD2 3.45Å; I63-L140 VanDerWaalsContact CD1-CD2 3.45Å; I63-L140 HydrophobicContact CD1-CG 4.45Å; I63-L140 HydrophobicContact CG1-CD1 4.12Å; I63-L140 HydrophobicContact CG1-CD2 3.95Å; I63-M146 HydrophobicContact CB-CE 4.34Å; I63-M146 HydrophobicContact CG1-CE 4.23Å; I63-M146 HydrophobicContact CG2-CE 3.21Å
64	S	97.6	Very high	94.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	129.6	177.3	-173.8	0	0	0	0	111.5	T45 I46 T117 E119 D120	T45-S64 CarbonylContact C-O 3.6Å; T45-S64 WeakPolarHBondContact CA-O 3.3Å; T45-S64 WeakPolarHBondContact CG2-O 3.49Å; I46-S64 PolarHBondContact N-O 3.48Å; I46-S64 PolarHBondContact O-N 3.22Å; S64-T117 WeakPolarHBondContact OG-CB 3.32Å; S64-T117 WeakPolarHBondContact OG-CG2 3.23Å; S64-T117 PolarHBondContact OG-OG1 3.32Å; S64-E119 PolarHBondContact OG-OE2 2.96Å; S64-D120 WeakPolarHBondContact CA-O 3.45Å
65	G	96.1	Very high	94.8	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.01	22%	0.219	C	C	.	.	S	Bend	trans	136.1	-179.8	176.5	0	0	0	0	0	113.3	A67 A68 D120	G65-A67 PolarHBondContact O-N 3.46Å; G65-A67 VanDerWaalsContact O-N 3.16Å; G65-A68 WeakPolarHBondContact O-CB 3.42Å; G65-A68 PolarHBondContact O-N 2.82Å; G65-D120 PolarHBondContact N-O 3Å
66	S	93.9	Very high	95	Very high	97 Å²	97	28.5 Å²	28.5	68%	0.678	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-26.6	-173.5	59.2	0	0	0	0	114.8	T45	T45-S66 PolarHBondContact OG1-N 3.02Å
67	A	94.3	Very high	94.7	Very high	12 Å²	12	29 Å²	29	10%	0.099	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	1.9	178.1	0	0	0	0	0	113.7	T45 G65 A69 T70 A71 M146	T45-A67 HydrophobicContact CG2-CB 4.11Å; T45-A67 VanDerWaalsContact OG1-CB 3.29Å; T45-A67 WeakPolarHBondContact OG1-CB 3.15Å; T45-A67 PolarHBondContact OG1-N 3.34Å; G65-A67 PolarHBondContact O-N 3.46Å; G65-A67 VanDerWaalsContact O-N 3.16Å; A67-A69 VanDerWaalsContact C-N 3.32Å; A67-A69 PolarHBondContact O-N 3.32Å; A67-T70 WeakPolarHBondContact O-CA 3.46Å; A67-T70 VanDerWaalsContact O-CB 3.32Å; A67-T70 WeakPolarHBondContact O-CB 3.47Å; A67-T70 PolarHBondContact O-N 3.45Å; A67-A71 PolarHBondContact O-N 3.46Å; A67-M146 HydrophobicContact CB-CG 4.26Å
68	A	95.4	Very high	94.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-58.5	-43.3	-178.8	0	0	0	0	0	112.1	I63 G65 T70 A71 L72 W109 D120 V122	I63-A68 HydrophobicContact CG2-CB 3.84Å; G65-A68 WeakPolarHBondContact O-CB 3.42Å; G65-A68 PolarHBondContact O-N 2.82Å; A68-T70 VanDerWaalsContact C-N 3.29Å; A68-T70 PolarHBondContact O-N 2.89Å; A68-A71 PolarHBondContact O-N 2.89Å; A68-L72 PolarHBondContact O-N 2.74Å; A68-W109 HydrophobicContact CB-CZ3 4.19Å; A68-D120 HydrophobicContact CB-CB 4.34Å; A68-D120 WeakPolarHBondContact CB-O 3.43Å; A68-V122 HydrophobicContact CB-CG2 4.08Å; A68-V122 WeakPolarHBondContact O-CG2 3.33Å
69	A	94.3	Very high	93.3	Very high	10 Å²	10	26.3 Å²	26.3	8%	0.083	18%	0.177	C	C	.	.	H	α-helix	trans	-60.8	-37.6	174.6	0	0	0	0	0	112.7	A67 R73 L82 W109	A67-A69 VanDerWaalsContact C-N 3.32Å; A67-A69 PolarHBondContact O-N 3.32Å; A69-R73 WeakPolarHBondContact O-CG 3.32Å; A69-R73 PolarHBondContact O-N 2.86Å; A69-L82 HydrophobicContact CB-CD1 3.92Å; A69-L82 HydrophobicContact CB-CD2 4.15Å; A69-W109 HydrophobicContact CB-CH2 3.75Å; A69-W109 HydrophobicContact CB-CZ2 4.44Å; A69-W109 HydrophobicContact CB-CZ3 4.19Å
70	T	93.4	Very high	92.4	Very high	61 Å²	61	33.3 Å²	33.3	37%	0.374	22%	0.215	S	C	.	.	H	α-helix	trans	-65.2	-47.4	177.1	-57.3	0	0	0	0	110.8	A67 A68 L72 R73 C74 V143	A67-T70 WeakPolarHBondContact O-CA 3.46Å; A67-T70 VanDerWaalsContact O-CB 3.32Å; A67-T70 WeakPolarHBondContact O-CB 3.47Å; A67-T70 PolarHBondContact O-N 3.45Å; A68-T70 VanDerWaalsContact C-N 3.29Å; A68-T70 PolarHBondContact O-N 2.89Å; T70-L72 VanDerWaalsContact C-N 3.33Å; T70-L72 PolarHBondContact O-N 3.41Å; T70-R73 PolarHBondContact O-N 3.07Å; T70-C74 WeakPolarHBondContact O-CB 3.32Å; T70-C74 PolarHBondContact O-N 2.66Å; T70-C74 PolarHBondContact O-SG 3.49Å; T70-C74 VanDerWaalsContact O-SG 3.41Å; T70-V143 HydrophobicContact CG2-CG1 4.33Å
71	A	93.8	Very high	91.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-56.1	-47.9	176.4	0	0	0	0	0	111.6	I63 A67 A68 R73 C74 M75 L140 M146	I63-A71 HydrophobicContact CD1-CB 4.23Å; A67-A71 PolarHBondContact O-N 3.46Å; A68-A71 PolarHBondContact O-N 2.89Å; A71-R73 PolarHBondContact O-N 3.03Å; A71-C74 PolarHBondContact O-N 3.33Å; A71-M75 WeakPolarHBondContact O-CB 3.29Å; A71-M75 WeakPolarHBondContact O-CG 3.31Å; A71-M75 PolarHBondContact O-N 2.86Å; A71-L140 HydrophobicContact CB-CD2 4.02Å; A71-M146 HydrophobicContact CB-CE 3.64Å; A71-M146 HydrophobicContact CB-SD 3.64Å
72	L	95	Very high	91.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.2	-48.8	177.4	178.8	60.7	0	0	0	111.7	A68 T70 V76 L78 L82 P83 V107 W109 V122 F124	A68-L72 PolarHBondContact O-N 2.74Å; T70-L72 VanDerWaalsContact C-N 3.33Å; T70-L72 PolarHBondContact O-N 3.41Å; L72-V76 HydrophobicContact CD1-CB 4.39Å; L72-V76 HydrophobicContact CD1-CG2 3.78Å; L72-V76 WeakPolarHBondContact O-CB 3.41Å; L72-V76 WeakPolarHBondContact O-CG2 3.26Å; L72-V76 PolarHBondContact O-N 3.04Å; L72-V76 VanDerWaalsContact O-N 3.09Å; L72-L78 HydrophobicContact CD1-CD1 4.4Å; L72-L78 HydrophobicContact CD2-CD1 4.37Å; L72-L78 HydrophobicContact CG-CD1 4.02Å; L72-L82 HydrophobicContact CD2-CD2 4.14Å; L72-P83 HydrophobicContact CD2-CG 3.94Å; L72-V107 HydrophobicContact CD1-CB 4.18Å; L72-V107 HydrophobicContact CD1-CG2 4.17Å; L72-W109 HydrophobicContact CD2-CB 4.11Å; L72-W109 HydrophobicContact CD2-CD2 4.44Å; L72-W109 HydrophobicContact CD2-CE3 4.19Å; L72-W109 HydrophobicContact CD2-CG 4.45Å; L72-V122 HydrophobicContact CB-CG1 4.24Å; L72-V122 HydrophobicContact CB-CG2 3.8Å; L72-V122 HydrophobicContact CD1-CG1 4.02Å; L72-V122 HydrophobicContact CD2-CG2 4.17Å; L72-V122 HydrophobicContact CG-CG2 4.46Å; L72-F124 HydrophobicContact CD1-CE1 3.9Å
73	R	93.5	Very high	91	Very high	81 Å²	81	41.4 Å²	41.4	31%	0.306	26%	0.255	S	S	.	.	H	α-helix	trans	-61	-48.9	180	-73.3	172	179.2	154	-1	112.3	A69 T70 A71 G77 L78 N80 L82	A69-R73 WeakPolarHBondContact O-CG 3.32Å; A69-R73 PolarHBondContact O-N 2.86Å; T70-R73 PolarHBondContact O-N 3.07Å; A71-R73 PolarHBondContact O-N 3.03Å; R73-G77 WeakPolarHBondContact O-CA 3.49Å; R73-G77 PolarHBondContact O-N 3.46Å; R73-L78 HydrophobicContact CG-CB 4.41Å; R73-L78 PolarHBondContact O-N 3.36Å; R73-L78 VanDerWaalsContact O-N 3.14Å; R73-N80 PolarHBondContact NH2-O 3.27Å; R73-L82 HydrophobicContact CG-CD2 4Å
74	C	92.2	Very high	90.8	Very high	50 Å²	50	45.1 Å²	45.1	34%	0.338	28%	0.279	S	S	.	.	H	α-helix	trans	-69.4	-38	-173.4	-70.1	0	0	0	0	113.3	T70 A71 P96	T70-C74 WeakPolarHBondContact O-CB 3.32Å; T70-C74 PolarHBondContact O-N 2.66Å; T70-C74 PolarHBondContact O-SG 3.49Å; T70-C74 VanDerWaalsContact O-SG 3.41Å; A71-C74 PolarHBondContact O-N 3.33Å; C74-P96 HydrophobicContact CB-CB 4.41Å
75	M	94.9	Very high	90.7	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-85	-28.3	-176.9	-65.2	-176.1	73.1	0	0	113	A71 I93 T94 P96 L102 F124 V136 A139 L140	A71-M75 WeakPolarHBondContact O-CB 3.29Å; A71-M75 WeakPolarHBondContact O-CG 3.31Å; A71-M75 PolarHBondContact O-N 2.86Å; M75-I93 HydrophobicContact CB-CG2 4.39Å; M75-I93 HydrophobicContact CE-CG2 3.86Å; M75-T94 WeakPolarHBondContact CA-O 3.05Å; M75-T94 PolarHBondContact O-N 2.97Å; M75-T94 PolarHBondContact O-OG1 3.49Å; M75-P96 HydrophobicContact CG-CG 3.79Å; M75-L102 HydrophobicContact CE-CD1 4.21Å; M75-F124 HydrophobicContact CB-CZ 4.3Å; M75-F124 HydrophobicContact CE-CE2 4.1Å; M75-F124 HydrophobicContact SD-CE2 3.71Å; M75-F124 HydrophobicContact SD-CZ 4.24Å; M75-V136 HydrophobicContact CE-CG1 4.34Å; M75-A139 HydrophobicContact CE-CB 3.72Å; M75-L140 HydrophobicContact CE-CD2 4.48Å; M75-L140 HydrophobicContact CE-CG 4.22Å; M75-L140 HydrophobicContact SD-CD2 3.41Å; M75-L140 WeakPolarHBondContact SD-CD2 3.48Å; M75-L140 HydrophobicContact SD-CG 3.76Å
76	V	93.8	Very high	90.7	Very high	15 Å²	15	55.1 Å²	55.1	9%	0.091	33%	0.325	C	S	.	.	H	α-helix	trans	-97.7	-8.7	-178.6	177.8	0	0	0	0	112.7	L72 L78 R91 V107 F124	L72-V76 HydrophobicContact CD1-CB 4.39Å; L72-V76 HydrophobicContact CD1-CG2 3.78Å; L72-V76 WeakPolarHBondContact O-CB 3.41Å; L72-V76 WeakPolarHBondContact O-CG2 3.26Å; L72-V76 PolarHBondContact O-N 3.04Å; L72-V76 VanDerWaalsContact O-N 3.09Å; V76-L78 VanDerWaalsContact C-N 3.34Å; V76-L78 HydrophobicContact CB-CG 4.15Å; V76-L78 HydrophobicContact CG1-CD1 4.26Å; V76-L78 HydrophobicContact CG1-CD2 4.09Å; V76-L78 HydrophobicContact CG1-CG 3.81Å; V76-R91 HydrophobicContact CG1-CB 3.61Å; V76-R91 HydrophobicContact CG1-CG 3.4Å; V76-R91 VanDerWaalsContact CG1-CG 3.4Å; V76-V107 HydrophobicContact CG2-CG1 3.92Å; V76-V107 HydrophobicContact CG2-CG2 4.46Å; V76-F124 HydrophobicContact CG2-CE1 4.3Å
77	G	85.3	Confident	90.7	Very high	64 Å²	64	53.2 Å²	53.2	66%	0.66	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	33.3	-176.9	0	0	0	0	0	112.7	R73	R73-G77 WeakPolarHBondContact O-CA 3.49Å; R73-G77 PolarHBondContact O-N 3.46Å
78	L	81.8	Confident	90.8	Very high	38 Å²	38	55.3 Å²	55.3	20%	0.199	33%	0.327	C	S	.	.			trans	-79.6	145.4	174	-61	174.7	0	0	0	110.3	L72 R73 V76 P83	L72-L78 HydrophobicContact CD1-CD1 4.4Å; L72-L78 HydrophobicContact CD2-CD1 4.37Å; L72-L78 HydrophobicContact CG-CD1 4.02Å; R73-L78 HydrophobicContact CG-CB 4.41Å; R73-L78 PolarHBondContact O-N 3.36Å; R73-L78 VanDerWaalsContact O-N 3.14Å; V76-L78 VanDerWaalsContact C-N 3.34Å; V76-L78 HydrophobicContact CB-CG 4.15Å; V76-L78 HydrophobicContact CG1-CD1 4.26Å; V76-L78 HydrophobicContact CG1-CD2 4.09Å; V76-L78 HydrophobicContact CG1-CG 3.81Å; L78-P83 HydrophobicContact CD1-CG 4.47Å
79	G	77.4	Confident	90.8	Very high	54 Å²	54	57 Å²	57	56%	0.557	34%	0.336	S	S	*	.			trans	-71	-157.4	167.3	0	0	0	0	0	112.2	Q81	G79-Q81 PolarHBondContact O-N 3.48Å
80	N	77.3	Confident	90.9	Very high	147 Å²	147	60.9 Å²	60.9	79%	0.786	36%	0.355	S	S	*	.	S	Bend	trans	-66.3	-23.7	-177.7	-72.7	-12.4	0	0	0	113.8	R73	R73-N80 PolarHBondContact NH2-O 3.27Å
81	Q	84.4	Confident	91	Very high	174 Å²	174	62.3 Å²	62.3	81%	0.813	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-82.5	122.3	179.5	-69.7	-179	-8.8	0	0	111.2	G79	G79-Q81 PolarHBondContact O-N 3.48Å
82	L	89.1	Confident	91.1	Very high	54 Å²	54	64.9 Å²	64.9	28%	0.283	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-77.5	154.6	171.6	-67.8	172.6	0	0	0	110.2	A69 L72 R73 W109	A69-L82 HydrophobicContact CB-CD1 3.92Å; A69-L82 HydrophobicContact CB-CD2 4.15Å; L72-L82 HydrophobicContact CD2-CD2 4.14Å; R73-L82 HydrophobicContact CG-CD2 4Å; L82-W109 HydrophobicContact CD1-CH2 4.32Å; L82-W109 HydrophobicContact CD1-CZ2 3.7Å
83	P	89.8	Confident	91.2	Very high	11 Å²	11	64.9 Å²	64.9	7%	0.071	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-68.6	159.6	178.6	31.7	-35.7	0	0	0	111.3	L72 L78 L89 W109	L72-P83 HydrophobicContact CD2-CG 3.94Å; L78-P83 HydrophobicContact CD1-CG 4.47Å; P83-L89 HydrophobicContact CB-CD1 3.26Å; P83-L89 HydrophobicContact CB-CG 4.39Å; P83-L89 HydrophobicContact CG-CD1 4.19Å; P83-W109 HydrophobicContact CG-CB 3.76Å; P83-W109 HydrophobicContact CG-CG 4.43Å
84	P	93.4	Very high	91.4	Very high	78 Å²	78	62.1 Å²	62.1	51%	0.506	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-54.3	135.8	173.8	-24.8	34.4	0	0	0	111	R86 T87	P84-R86 PolarHBondContact O-N 2.99Å; P84-T87 WeakPolarHBondContact O-CB 3.49Å; P84-T87 PolarHBondContact O-N 2.88Å; P84-T87 PolarHBondContact O-OG1 2.99Å
85	P	96.1	Very high	91.6	Very high	69 Å²	69	61.2 Å²	61.2	45%	0.448	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	139.1	179.2	-29.3	37.4	0	0	0	112.3	T87 P111	P85-T87 PolarHBondContact O-N 3.27Å; P85-T87 VanDerWaalsContact O-N 3.14Å; P85-T87 PolarHBondContact O-OG1 2.98Å; P85-P111 HydrophobicContact CB-CG 3.88Å; P85-P111 HydrophobicContact CG-CG 3.75Å
86	R	94.8	Very high	91.5	Very high	142 Å²	142	62.1 Å²	62.1	54%	0.536	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	26.1	176.6	-51.2	-172.9	-177.1	94.7	4.5	115.2	P84 W109 F110 H114	P84-R86 PolarHBondContact O-N 2.99Å; R86-W109 PolarHBondContact N-O 3.09Å; R86-F110 HydrophobicContact CG-CD1 3.9Å; R86-F110 HydrophobicContact CG-CE1 4.01Å; R86-H114 PolarHBondContact NH2-O 2.99Å
87	T	95.4	Very high	91.4	Very high	57 Å²	57	67.8 Å²	67.8	35%	0.35	39%	0.386	S	S	.	.			trans	-103.6	123.8	174.4	-58.8	0	0	0	0	109.4	P84 P85 L89	P84-T87 WeakPolarHBondContact O-CB 3.49Å; P84-T87 PolarHBondContact O-N 2.88Å; P84-T87 PolarHBondContact O-OG1 2.99Å; P85-T87 PolarHBondContact O-N 3.27Å; P85-T87 VanDerWaalsContact O-N 3.14Å; P85-T87 PolarHBondContact O-OG1 2.98Å; T87-L89 HydrophobicContact CG2-CD2 4.1Å; T87-L89 PolarHBondContact O-N 3.3Å
88	A	95.7	Very high	91.8	Very high	57 Å²	57	68.2 Å²	68.2	47%	0.471	38%	0.379	S	S	.	.			trans	-75.1	124.1	176.3	0	0	0	0	0	110.2	L108	A88-L108 HydrophobicContact CB-CD1 4.44Å; A88-L108 HydrophobicContact CB-CG 4.45Å
89	L	94.7	Very high	92.4	Very high	34 Å²	34	72.1 Å²	72.1	18%	0.178	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	127.7	178.3	-62.8	-179.8	0	0	0	110.9	P83 T87 R91 L106 V107	P83-L89 HydrophobicContact CB-CD1 3.26Å; P83-L89 HydrophobicContact CB-CG 4.39Å; P83-L89 HydrophobicContact CG-CD1 4.19Å; T87-L89 HydrophobicContact CG2-CD2 4.1Å; T87-L89 PolarHBondContact O-N 3.3Å; L89-R91 HydrophobicContact CB-CG 4.32Å; L89-R91 PolarHBondContact O-N 2.82Å; L89-L106 CarbonylContact O-C 3.56Å; L89-L106 WeakPolarHBondContact O-CA 3.27Å; L89-V107 HydrophobicContact CB-CG2 4.01Å; L89-V107 PolarHBondContact N-O 2.79Å; L89-V107 VanDerWaalsContact N-O 3.07Å; L89-V107 PolarHBondContact O-N 2.93Å
90	L	96.6	Very high	93.3	Very high	92 Å²	92	75.7 Å²	75.7	48%	0.482	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	123.1	170.5	-176.8	65.9	0	0	0	110.1	R104 L106	L90-R104 HydrophobicContact CD1-CG 4.23Å; L90-L106 HydrophobicContact CB-CD2 4.17Å; L90-L106 HydrophobicContact CD1-CD2 4.39Å
91	R	95.6	Very high	94.2	Very high	92 Å²	92	72.7 Å²	72.7	35%	0.347	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	153.4	-176.3	-70.2	-68.3	-175.7	-84	3.3	112	V76 L89 R104 G105 V107	V76-R91 HydrophobicContact CG1-CB 3.61Å; V76-R91 HydrophobicContact CG1-CG 3.4Å; V76-R91 VanDerWaalsContact CG1-CG 3.4Å; L89-R91 HydrophobicContact CB-CG 4.32Å; L89-R91 PolarHBondContact O-N 2.82Å; R91-R104 WeakPolarHBondContact O-CA 3.5Å; R91-G105 PolarHBondContact N-O 2.76Å; R91-G105 PolarHBondContact O-N 3.37Å; R91-V107 HydrophobicContact CB-CG1 4.41Å; R91-V107 HydrophobicContact CB-CG2 4.37Å; R91-V107 HydrophobicContact CG-CG2 3.99Å
92	S	96.6	Very high	94.8	Very high	54 Å²	54	65.8 Å²	65.8	38%	0.378	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	126.6	163.2	-58.2	0	0	0	0	108.4
93	I	97.6	Very high	95.2	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	123	175.4	-61.9	161.1	0	0	0	106.2	M75 L102 D103 V107 F124 I126	M75-I93 HydrophobicContact CB-CG2 4.39Å; M75-I93 HydrophobicContact CE-CG2 3.86Å; I93-L102 PolarHBondContact O-N 2.94Å; I93-D103 PolarHBondContact N-O 3.19Å; I93-D103 PolarHBondContact O-N 3.29Å; I93-V107 HydrophobicContact CD1-CG1 4.25Å; I93-V107 HydrophobicContact CG1-CG1 4.2Å; I93-F124 HydrophobicContact CD1-CB 4.11Å; I93-F124 HydrophobicContact CD1-CG 4.26Å; I93-I126 HydrophobicContact CD1-CG2 3.51Å
94	T	97.4	Very high	95.6	Very high	22 Å²	22	71.4 Å²	71.4	14%	0.135	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	155.2	-171.6	60.5	0	0	0	0	111.5	M75 E100 V101	M75-T94 WeakPolarHBondContact CA-O 3.05Å; M75-T94 PolarHBondContact O-N 2.97Å; M75-T94 PolarHBondContact O-OG1 3.49Å; T94-E100 CarbonylContact C-O 3.5Å; T94-E100 WeakPolarHBondContact CA-O 3.27Å; T94-E100 WeakPolarHBondContact CB-O 3.4Å; T94-V101 HydrophobicContact CG2-CG2 4.09Å
95	D	96	Very high	95.7	Very high	31 Å²	31	68 Å²	68	17%	0.166	35%	0.348	C	S	.	.			trans	-63.3	130.4	170	-176.7	-91.2	0	0	0	110.2	H97 S98 K99 E100 L102	D95-H97 PolarHBondContact O-N 3.4Å; D95-H97 VanDerWaalsContact O-N 3.13Å; D95-H97 WeakPolarHBondContact OD1-CA 3.47Å; D95-H97 WeakPolarHBondContact OD1-CB 3.49Å; D95-H97 PolarHBondContact OD1-N 2.64Å; D95-S98 VanDerWaalsContact CB-OG 3.28Å; D95-S98 WeakPolarHBondContact CB-OG 3.2Å; D95-S98 PolarHBondContact OD1-N 3.35Å; D95-S98 PolarHBondContact OD1-OG 2.68Å; D95-K99 VanDerWaalsContact O-CA 3.32Å; D95-K99 WeakPolarHBondContact O-CA 3.37Å; D95-K99 PolarHBondContact O-N 2.85Å; D95-E100 PolarHBondContact N-O 2.91Å; D95-L102 HydrophobicContact CB-CD1 4.38Å; D95-L102 HydrophobicContact CB-CD2 4.25Å; D95-L102 HydrophobicContact CB-CG 4.42Å
96	P	92.6	Very high	95.8	Very high	19 Å²	19	68 Å²	68	12%	0.123	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-31.4	-179	-27.4	33.3	0	0	0	114.4	C74 M75 K99 V143	C74-P96 HydrophobicContact CB-CB 4.41Å; M75-P96 HydrophobicContact CG-CG 3.79Å; P96-K99 WeakPolarHBondContact O-CE 3.35Å; P96-K99 PolarHBondContact O-NZ 3.36Å; P96-V143 HydrophobicContact CB-CG2 4.42Å; P96-V143 HydrophobicContact CG-CG2 3.76Å
97	H	91.1	Very high	95.9	Very high	135 Å²	135	61.3 Å²	61.3	63%	0.625	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-57.8	-174.3	-62.3	-73	0	0	0	112.6	D95 K99 S142	D95-H97 PolarHBondContact O-N 3.4Å; D95-H97 VanDerWaalsContact O-N 3.13Å; D95-H97 WeakPolarHBondContact OD1-CA 3.47Å; D95-H97 WeakPolarHBondContact OD1-CB 3.49Å; D95-H97 PolarHBondContact OD1-N 2.64Å; H97-K99 VanDerWaalsContact C-N 3.31Å; H97-K99 PolarHBondContact O-N 2.99Å; H97-S142 PolarHBondContact CD2-OG 3.22Å; H97-S142 PolarHBondContact NE2-OG 3.44Å
98	S	94.1	Very high	96	Very high	72 Å²	72	59.8 Å²	59.8	50%	0.503	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-19.9	-175.1	74.9	0	0	0	0	113	D95 E100	D95-S98 VanDerWaalsContact CB-OG 3.28Å; D95-S98 WeakPolarHBondContact CB-OG 3.2Å; D95-S98 PolarHBondContact OD1-N 3.35Å; D95-S98 PolarHBondContact OD1-OG 2.68Å; S98-E100 PolarHBondContact O-N 2.74Å; S98-E100 VanDerWaalsContact OG-CB 3.27Å; S98-E100 WeakPolarHBondContact OG-CB 3.42Å; S98-E100 PolarHBondContact OG-N 3.33Å; S98-E100 VanDerWaalsContact OG-N 3.17Å
99	K	93.9	Very high	96	Very high	120 Å²	120	57.7 Å²	57.7	52%	0.522	29%	0.289	S	S	.	.			trans	60.5	14.1	-170.8	-53.8	-51.9	-170.1	-166.3	0	114.2	D95 P96 H97	D95-K99 VanDerWaalsContact O-CA 3.32Å; D95-K99 WeakPolarHBondContact O-CA 3.37Å; D95-K99 PolarHBondContact O-N 2.85Å; P96-K99 WeakPolarHBondContact O-CE 3.35Å; P96-K99 PolarHBondContact O-NZ 3.36Å; H97-K99 VanDerWaalsContact C-N 3.31Å; H97-K99 PolarHBondContact O-N 2.99Å
100	E	96.2	Very high	96.2	Very high	129 Å²	129	57.7 Å²	57.7	60%	0.603	29%	0.288	S	S	*	.			trans	-60.8	139.2	170.7	-177.8	178.6	-174.2	0	0	110.3	T94 D95 S98 L102	T94-E100 CarbonylContact C-O 3.5Å; T94-E100 WeakPolarHBondContact CA-O 3.27Å; T94-E100 WeakPolarHBondContact CB-O 3.4Å; D95-E100 PolarHBondContact N-O 2.91Å; S98-E100 PolarHBondContact O-N 2.74Å; S98-E100 VanDerWaalsContact OG-CB 3.27Å; S98-E100 WeakPolarHBondContact OG-CB 3.42Å; S98-E100 PolarHBondContact OG-N 3.33Å; S98-E100 VanDerWaalsContact OG-N 3.17Å; E100-L102 PolarHBondContact O-N 2.95Å
101	V	97.3	Very high	96.2	Very high	85 Å²	85	54.9 Å²	54.9	52%	0.515	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	112.7	175.4	-179	0	0	0	0	109.1	T94	T94-V101 HydrophobicContact CG2-CG2 4.09Å
102	L	97.1	Very high	96.1	Very high	29 Å²	29	52.8 Å²	52.8	15%	0.152	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	-40.2	178.4	-55.6	179.6	0	0	0	111.2	M75 I93 D95 E100 A135 V136 A139	M75-L102 HydrophobicContact CE-CD1 4.21Å; I93-L102 PolarHBondContact O-N 2.94Å; D95-L102 HydrophobicContact CB-CD1 4.38Å; D95-L102 HydrophobicContact CB-CD2 4.25Å; D95-L102 HydrophobicContact CB-CG 4.42Å; E100-L102 PolarHBondContact O-N 2.95Å; L102-A135 HydrophobicContact CD2-CB 4.18Å; L102-V136 HydrophobicContact CB-CG2 4.16Å; L102-V136 HydrophobicContact CD1-CG2 4.32Å; L102-A139 HydrophobicContact CD1-CB 3.52Å
103	D	97.8	Very high	96.1	Very high	21 Å²	21	53.7 Å²	53.7	11%	0.112	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	170.8	174.9	-161.9	16.8	0	0	0	111.6	I93 I126 H127 V132	I93-D103 PolarHBondContact N-O 3.19Å; I93-D103 PolarHBondContact O-N 3.29Å; D103-I126 HydrophobicContact CB-CB 4.5Å; D103-I126 HydrophobicContact CB-CG2 4.32Å; D103-I126 WeakPolarHBondContact OD2-CA 3.36Å; D103-I126 WeakPolarHBondContact OD2-CB 3.35Å; D103-H127 VanDerWaalsContact CG-ND1 3.34Å; D103-H127 IonicContact OD1-CE1 3.73Å; D103-H127 IonicContact OD1-CG 2.97Å; D103-H127 IonicContact OD1-ND1 2.84Å; D103-H127 PolarHBondContact OD1-ND1 3.35Å; D103-H127 IonicContact OD2-CG 3.81Å; D103-H127 PolarHBondContact OD2-N 2.92Å; D103-H127 IonicContact OD2-ND1 2.84Å; D103-H127 PolarHBondContact OD2-ND1 2.78Å; D103-H127 VanDerWaalsContact OD2-ND1 3.09Å; D103-V132 HydrophobicContact CB-CG1 3.77Å
104	R	97.1	Very high	95.9	Very high	161 Å²	161	59.3 Å²	59.3	61%	0.608	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	110.8	166.9	-172.3	177.3	177.6	-176.4	-1	109.5	L90 R91	L90-R104 HydrophobicContact CD1-CG 4.23Å; R91-R104 WeakPolarHBondContact O-CA 3.5Å
105	G	96.1	Very high	95.8	Very high	6 Å²	6	58.9 Å²	58.9	6%	0.062	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	-178	-169.4	0	0	0	0	0	113.8	R91 H125	R91-G105 PolarHBondContact N-O 2.76Å; R91-G105 PolarHBondContact O-N 3.37Å; G105-H125 VanDerWaalsContact CA-O 3.24Å; G105-H125 WeakPolarHBondContact CA-O 3.46Å
106	L	97.4	Very high	95.8	Very high	71 Å²	71	60.6 Å²	60.6	37%	0.372	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	140.8	173.4	-58.1	171.9	0	0	0	109.8	L89 L90 L108 H125	L89-L106 CarbonylContact O-C 3.56Å; L89-L106 WeakPolarHBondContact O-CA 3.27Å; L90-L106 HydrophobicContact CB-CD2 4.17Å; L90-L106 HydrophobicContact CD1-CD2 4.39Å; L106-L108 HydrophobicContact CB-CD1 4.49Å; L106-H125 HydrophobicContact CB-CB 4.04Å; L106-H125 PolarHBondContact N-O 2.96Å; L106-H125 VanDerWaalsContact N-O 3.08Å; L106-H125 PolarHBondContact O-N 3.41Å
107	V	97.1	Very high	95.9	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	138.7	173.5	-54	0	0	0	0	110.2	L72 V76 L89 R91 I93 E123 F124	L72-V107 HydrophobicContact CD1-CB 4.18Å; L72-V107 HydrophobicContact CD1-CG2 4.17Å; V76-V107 HydrophobicContact CG2-CG1 3.92Å; V76-V107 HydrophobicContact CG2-CG2 4.46Å; L89-V107 HydrophobicContact CB-CG2 4.01Å; L89-V107 PolarHBondContact N-O 2.79Å; L89-V107 VanDerWaalsContact N-O 3.07Å; L89-V107 PolarHBondContact O-N 2.93Å; R91-V107 HydrophobicContact CB-CG1 4.41Å; R91-V107 HydrophobicContact CB-CG2 4.37Å; R91-V107 HydrophobicContact CG-CG2 3.99Å; I93-V107 HydrophobicContact CD1-CG1 4.25Å; I93-V107 HydrophobicContact CG1-CG1 4.2Å; V107-E123 WeakPolarHBondContact CA-O 3.43Å; V107-F124 HydrophobicContact CB-CD1 4.13Å; V107-F124 HydrophobicContact CB-CE1 4.4Å; V107-F124 HydrophobicContact CG1-CD1 3.64Å; V107-F124 HydrophobicContact CG1-CE1 4.01Å
108	L	97.3	Very high	96.2	Very high	25 Å²	25	54 Å²	54	13%	0.131	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	143	178.5	-68.8	83.7	0	0	0	110.3	A88 L106 F110 V122 E123	A88-L108 HydrophobicContact CB-CD1 4.44Å; A88-L108 HydrophobicContact CB-CG 4.45Å; L106-L108 HydrophobicContact CB-CD1 4.49Å; L108-F110 HydrophobicContact CB-CD2 4.42Å; L108-F110 HydrophobicContact CB-CE2 3.57Å; L108-F110 HydrophobicContact CB-CZ 3.9Å; L108-F110 HydrophobicContact CD2-CE2 4.28Å; L108-F110 HydrophobicContact CD2-CZ 3.77Å; L108-V122 WeakPolarHBondContact O-CA 3.43Å; L108-E123 HydrophobicContact CB-CB 4.4Å; L108-E123 PolarHBondContact N-O 2.8Å; L108-E123 PolarHBondContact O-N 2.94Å
109	W	97.3	Very high	96.2	Very high	13 Å²	13	52.4 Å²	52.4	5%	0.049	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	129.8	177.1	172.9	-121.7	0	0	0	111	A68 A69 L72 L82 P83 R86 P111 D120 S121 V122	A68-W109 HydrophobicContact CB-CZ3 4.19Å; A69-W109 HydrophobicContact CB-CH2 3.75Å; A69-W109 HydrophobicContact CB-CZ2 4.44Å; A69-W109 HydrophobicContact CB-CZ3 4.19Å; L72-W109 HydrophobicContact CD2-CB 4.11Å; L72-W109 HydrophobicContact CD2-CD2 4.44Å; L72-W109 HydrophobicContact CD2-CE3 4.19Å; L72-W109 HydrophobicContact CD2-CG 4.45Å; L82-W109 HydrophobicContact CD1-CH2 4.32Å; L82-W109 HydrophobicContact CD1-CZ2 3.7Å; P83-W109 HydrophobicContact CG-CB 3.76Å; P83-W109 HydrophobicContact CG-CG 4.43Å; R86-W109 PolarHBondContact N-O 3.09Å; W109-P111 HydrophobicContact CZ2-CB 4.14Å; W109-D120 HydrophobicContact CH2-CB 3.54Å; W109-D120 VanDerWaalsContact CH2-CG 3.44Å; W109-D120 HydrophobicContact CZ2-CB 4.36Å; W109-D120 HydrophobicContact CZ3-CB 4.12Å; W109-S121 VanDerWaalsContact CE3-O 3.22Å; W109-V122 HydrophobicContact CE3-CG2 3.48Å; W109-V122 VanDerWaalsContact CE3-CG2 3.48Å; W109-V122 HydrophobicContact CZ3-CG2 3.65Å
110	F	97.6	Very high	96.4	Very high	35 Å²	35	49 Å²	49	15%	0.154	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	93.4	179.9	-57.4	-88.3	0	0	0	109.1	R86 L108 S121 E123	R86-F110 HydrophobicContact CG-CD1 3.9Å; R86-F110 HydrophobicContact CG-CE1 4.01Å; L108-F110 HydrophobicContact CB-CD2 4.42Å; L108-F110 HydrophobicContact CB-CE2 3.57Å; L108-F110 HydrophobicContact CB-CZ 3.9Å; L108-F110 HydrophobicContact CD2-CE2 4.28Å; L108-F110 HydrophobicContact CD2-CZ 3.77Å; F110-S121 PolarHBondContact N-O 2.98Å; F110-S121 PolarHBondContact O-N 3.05Å; F110-E123 HydrophobicContact CD2-CG 4.45Å; F110-E123 HydrophobicContact CE2-CB 4.2Å; F110-E123 HydrophobicContact CE2-CG 3.79Å
111	P	96.3	Very high	96.4	Very high	32 Å²	32	43 Å²	43	21%	0.208	23%	0.228	C	C	.	.			trans	-70.5	146.1	178.5	30.2	-35.4	0	0	0	111.6	P85 W109 H114 D120	P85-P111 HydrophobicContact CB-CG 3.88Å; P85-P111 HydrophobicContact CG-CG 3.75Å; W109-P111 HydrophobicContact CZ2-CB 4.14Å; P111-H114 PolarHBondContact O-N 3.32Å; P111-D120 WeakPolarHBondContact CA-OD1 3.27Å
112	A	95.2	Very high	96.5	Very high	48 Å²	48	39 Å²	39	40%	0.397	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	149.2	168.9	0	0	0	0	0	111.2	H114 G118 D120	A112-H114 VanDerWaalsContact C-N 3.27Å; A112-G118 WeakPolarHBondContact CB-O 3.38Å; A112-D120 WeakPolarHBondContact CB-OD1 3.39Å; A112-D120 PolarHBondContact N-OD1 3.27Å
113	P	94.9	Very high	96.5	Very high	74 Å²	74	38.7 Å²	38.7	48%	0.481	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	cis	-83.8	7.8	-4.5	35.4	-36.9	0	0	0	112.7	S115 G118 K163	P113-S115 PolarHBondContact O-N 3.46Å; P113-G118 WeakPolarHBondContact CA-O 2.91Å; P113-K163 WeakPolarHBondContact O-CE 3.5Å; P113-K163 PolarHBondContact O-NZ 2.58Å
114	H	95.1	Very high	96.5	Very high	117 Å²	117	37.7 Å²	37.7	54%	0.542	20%	0.196	S	C	.	.	S	Bend	trans	-98.9	48.8	-163.7	-51.8	-82.4	0	0	0	114	R86 P111 A112	R86-H114 PolarHBondContact NH2-O 2.99Å; P111-H114 PolarHBondContact O-N 3.32Å; A112-H114 VanDerWaalsContact C-N 3.27Å
115	S	95.5	Very high	96.5	Very high	13 Å²	13	32 Å²	32	9%	0.091	18%	0.176	C	C	.	.	S	Bend	trans	-117.4	177.7	171	71.1	0	0	0	0	110.9	P113 T117 G118 E119 K163	P113-S115 PolarHBondContact O-N 3.46Å; S115-T117 PolarHBondContact OG-OG1 3.36Å; S115-G118 PolarHBondContact O-N 2.75Å; S115-G118 WeakPolarHBondContact OG-CA 3.22Å; S115-G118 PolarHBondContact OG-N 2.99Å; S115-E119 WeakPolarHBondContact CB-O 3.4Å; S115-E119 PolarHBondContact OG-N 2.95Å; S115-E119 PolarHBondContact OG-O 3.37Å; S115-K163 WeakPolarHBondContact O-CE 3.4Å
116	F	94.7	Very high	96.6	Very high	67 Å²	67	31.9 Å²	31.9	29%	0.294	17%	0.174	S	C	.	.	S	Bend	trans	-60.9	-46	174.6	176.3	-103.8	0	0	0	112.3	G118 F154 T155 A158 L164 L172	F116-G118 VanDerWaalsContact C-N 3.35Å; F116-F154 HydrophobicContact CD1-CB 4.22Å; F116-F154 HydrophobicContact CE1-CB 3.97Å; F116-T155 HydrophobicContact CZ-CG2 4.45Å; F116-A158 HydrophobicContact CD1-CB 4.41Å; F116-A158 HydrophobicContact CE1-CB 4.17Å; F116-A158 HydrophobicContact CZ-CB 4.35Å; F116-A158 WeakPolarHBondContact O-CB 3.32Å; F116-L164 HydrophobicContact CE2-CD1 4.14Å; F116-L164 HydrophobicContact CZ-CD1 4.24Å; F116-L172 HydrophobicContact CE2-CD2 4.14Å; F116-L172 HydrophobicContact CZ-CD2 3.87Å
117	T	95.7	Very high	96.6	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.006	18%	0.179	C	C	.	.	S	Bend	trans	-81.9	-14.1	-179.1	55.1	0	0	0	0	113.3	S64 S115 E119 F154 R157 A161	S64-T117 WeakPolarHBondContact OG-CB 3.32Å; S64-T117 WeakPolarHBondContact OG-CG2 3.23Å; S64-T117 PolarHBondContact OG-OG1 3.32Å; S115-T117 PolarHBondContact OG-OG1 3.36Å; T117-E119 PolarHBondContact O-N 2.99Å; T117-E119 PolarHBondContact OG1-N 3Å; T117-F154 HydrophobicContact CG2-CB 4.02Å; T117-F154 HydrophobicContact CG2-CD1 3.79Å; T117-F154 HydrophobicContact CG2-CG 4.4Å; T117-F154 WeakPolarHBondContact CG2-O 3.48Å; T117-R157 HydrophobicContact CG2-CB 4.26Å; T117-A161 WeakPolarHBondContact O-CB 3.27Å
118	G	95.8	Very high	96.5	Very high	14 Å²	14	33.7 Å²	33.7	14%	0.144	18%	0.181	C	C	.	.	S	Bend	trans	82.5	-6.6	-169	0	0	0	0	0	114.2	A112 P113 S115 F116	A112-G118 WeakPolarHBondContact CB-O 3.38Å; P113-G118 WeakPolarHBondContact CA-O 2.91Å; S115-G118 PolarHBondContact O-N 2.75Å; S115-G118 WeakPolarHBondContact OG-CA 3.22Å; S115-G118 PolarHBondContact OG-N 2.99Å; F116-G118 VanDerWaalsContact C-N 3.35Å
119	E	96.1	Very high	96.4	Very high	40 Å²	40	33.7 Å²	33.7	19%	0.187	19%	0.187	C	C	.	.	S	Bend	trans	-96.1	174.5	176.1	-54	178.9	114.6	0	0	111.7	S64 S115 T117 S121 R157	S64-E119 PolarHBondContact OG-OE2 2.96Å; S115-E119 WeakPolarHBondContact CB-O 3.4Å; S115-E119 PolarHBondContact OG-N 2.95Å; S115-E119 PolarHBondContact OG-O 3.37Å; T117-E119 PolarHBondContact O-N 2.99Å; T117-E119 PolarHBondContact OG1-N 3Å; E119-S121 PolarHBondContact O-N 3.28Å; E119-R157 IonicContact OE1-NH1 3.09Å; E119-R157 PolarHBondContact OE1-NH1 3.02Å; E119-R157 VanDerWaalsContact OE2-CD 3.22Å; E119-R157 WeakPolarHBondContact OE2-CD 3.47Å; E119-R157 IonicContact OE2-CZ 2.79Å; E119-R157 IonicContact OE2-NE 3.86Å; E119-R157 IonicContact OE2-NH1 3.82Å; E119-R157 PolarHBondContact OE2-NH1 3.12Å
120	D	97.1	Very high	96.2	Very high	47 Å²	47	36.6 Å²	36.6	25%	0.251	21%	0.208	S	C	.	.			trans	-61.2	130.1	165.5	-83.7	-5.9	0	0	0	110	S64 G65 A68 W109 P111 A112	S64-D120 WeakPolarHBondContact CA-O 3.45Å; G65-D120 PolarHBondContact N-O 3Å; A68-D120 HydrophobicContact CB-CB 4.34Å; A68-D120 WeakPolarHBondContact CB-O 3.43Å; W109-D120 HydrophobicContact CH2-CB 3.54Å; W109-D120 VanDerWaalsContact CH2-CG 3.44Å; W109-D120 HydrophobicContact CZ2-CB 4.36Å; W109-D120 HydrophobicContact CZ3-CB 4.12Å; P111-D120 WeakPolarHBondContact CA-OD1 3.27Å; A112-D120 WeakPolarHBondContact CB-OD1 3.39Å; A112-D120 PolarHBondContact N-OD1 3.27Å
121	S	97.3	Very high	96.1	Very high	4 Å²	4	38.7 Å²	38.7	3%	0.028	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	146.9	-176.4	-175.9	0	0	0	0	112.8	I63 W109 F110 E119	I63-S121 CarbonylContact O-C 3.48Å; I63-S121 WeakPolarHBondContact O-CA 3.46Å; I63-S121 WeakPolarHBondContact O-CB 3.29Å; I63-S121 PolarHBondContact O-OG 3.37Å; W109-S121 VanDerWaalsContact CE3-O 3.22Å; F110-S121 PolarHBondContact N-O 2.98Å; F110-S121 PolarHBondContact O-N 3.05Å; E119-S121 PolarHBondContact O-N 3.28Å
122	V	97.4	Very high	96.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	142.7	177.6	177.1	0	0	0	0	108.4	R62 I63 A68 L72 L108 W109 F124	R62-V122 WeakPolarHBondContact CA-O 3.49Å; I63-V122 HydrophobicContact CB-CB 4.22Å; I63-V122 HydrophobicContact CD1-CB 4.08Å; I63-V122 HydrophobicContact CD1-CG1 4.15Å; I63-V122 PolarHBondContact N-O 2.9Å; I63-V122 PolarHBondContact O-N 3.31Å; A68-V122 HydrophobicContact CB-CG2 4.08Å; A68-V122 WeakPolarHBondContact O-CG2 3.33Å; L72-V122 HydrophobicContact CB-CG1 4.24Å; L72-V122 HydrophobicContact CB-CG2 3.8Å; L72-V122 HydrophobicContact CD1-CG1 4.02Å; L72-V122 HydrophobicContact CD2-CG2 4.17Å; L72-V122 HydrophobicContact CG-CG2 4.46Å; L108-V122 WeakPolarHBondContact O-CA 3.43Å; W109-V122 HydrophobicContact CE3-CG2 3.48Å; W109-V122 VanDerWaalsContact CE3-CG2 3.48Å; W109-V122 HydrophobicContact CZ3-CG2 3.65Å; V122-F124 HydrophobicContact CG1-CD1 3.75Å; V122-F124 HydrophobicContact CG1-CE1 3.36Å; V122-F124 HydrophobicContact CG1-CZ 4.02Å
123	E	98	Very high	96.2	Very high	23 Å²	23	37.4 Å²	37.4	11%	0.107	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	131.2	167.6	-66.3	-174.7	169.9	0	0	110.6	V60 V61 R62 V107 L108 F110 H125	V60-E123 HydrophobicContact CG1-CB 4.19Å; V60-E123 HydrophobicContact CG1-CG 4.22Å; V61-E123 WeakPolarHBondContact O-CA 3.48Å; R62-E123 HydrophobicContact CB-CG 4.49Å; R62-E123 HydrophobicContact CG-CG 4.35Å; R62-E123 IonicContact CZ-OE1 3.58Å; R62-E123 IonicContact NE-OE1 3.99Å; R62-E123 PolarHBondContact NE-OE1 2.83Å; R62-E123 VanDerWaalsContact NE-OE1 3.08Å; R62-E123 IonicContact NH2-OE1 2.73Å; R62-E123 PolarHBondContact NH2-OE1 3.44Å; V107-E123 WeakPolarHBondContact CA-O 3.43Å; L108-E123 HydrophobicContact CB-CB 4.4Å; L108-E123 PolarHBondContact N-O 2.8Å; L108-E123 PolarHBondContact O-N 2.94Å; F110-E123 HydrophobicContact CD2-CG 4.45Å; F110-E123 HydrophobicContact CE2-CB 4.2Å; F110-E123 HydrophobicContact CE2-CG 3.79Å; E123-H125 IonicContact OE2-CE1 3.92Å; E123-H125 IonicContact OE2-NE2 3.05Å; E123-H125 PolarHBondContact OE2-NE2 3.4Å
124	F	97.9	Very high	96.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	118.6	167.9	-60.3	-26.3	0	0	0	109	V60 V61 I63 L72 M75 V76 I93 V107 V122 I126 V136 L140	V60-F124 CarbonylContact C-O 3.53Å; V60-F124 WeakPolarHBondContact CA-O 3.3Å; V61-F124 HydrophobicContact CB-CB 4.39Å; V61-F124 PolarHBondContact N-O 3.01Å; V61-F124 PolarHBondContact O-N 3.05Å; I63-F124 HydrophobicContact CD1-CD2 4.17Å; I63-F124 HydrophobicContact CD1-CE2 3.7Å; I63-F124 HydrophobicContact CD1-CZ 3.93Å; L72-F124 HydrophobicContact CD1-CE1 3.9Å; M75-F124 HydrophobicContact CB-CZ 4.3Å; M75-F124 HydrophobicContact CE-CE2 4.1Å; M75-F124 HydrophobicContact SD-CE2 3.71Å; M75-F124 HydrophobicContact SD-CZ 4.24Å; V76-F124 HydrophobicContact CG2-CE1 4.3Å; I93-F124 HydrophobicContact CD1-CB 4.11Å; I93-F124 HydrophobicContact CD1-CG 4.26Å; V107-F124 HydrophobicContact CB-CD1 4.13Å; V107-F124 HydrophobicContact CB-CE1 4.4Å; V107-F124 HydrophobicContact CG1-CD1 3.64Å; V107-F124 HydrophobicContact CG1-CE1 4.01Å; V122-F124 HydrophobicContact CG1-CD1 3.75Å; V122-F124 HydrophobicContact CG1-CE1 3.36Å; V122-F124 HydrophobicContact CG1-CZ 4.02Å; F124-I126 HydrophobicContact CB-CG2 4.11Å; F124-V136 HydrophobicContact CD2-CG1 4.16Å; F124-L140 HydrophobicContact CE2-CD2 4.13Å
125	H	97.9	Very high	96.3	Very high	43 Å²	43	33.2 Å²	33.2	20%	0.199	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	95.8	176	-62.6	-165.2	0	0	0	107.1	V58 A59 G105 L106 E123	V58-H125 HydrophobicContact CG1-CB 3.99Å; A59-H125 CarbonylContact O-C 3.56Å; A59-H125 WeakPolarHBondContact O-CA 3.27Å; G105-H125 VanDerWaalsContact CA-O 3.24Å; G105-H125 WeakPolarHBondContact CA-O 3.46Å; L106-H125 HydrophobicContact CB-CB 4.04Å; L106-H125 PolarHBondContact N-O 2.96Å; L106-H125 VanDerWaalsContact N-O 3.08Å; L106-H125 PolarHBondContact O-N 3.41Å; E123-H125 IonicContact OE2-CE1 3.92Å; E123-H125 IonicContact OE2-NE2 3.05Å; E123-H125 PolarHBondContact OE2-NE2 3.4Å
126	I	97.3	Very high	96.4	Very high	3 Å²	3	32.6 Å²	32.6	2%	0.015	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	168.5	-172.8	59.1	173.2	0	0	0	110.7	V58 A59 V61 I93 D103 F124 V132 I133 V136	V58-I126 CarbonylContact C-O 3.43Å; V58-I126 WeakPolarHBondContact CA-O 3.38Å; A59-I126 HydrophobicContact CB-CG1 4.09Å; A59-I126 PolarHBondContact N-O 2.85Å; A59-I126 WeakPolarHBondContact O-CG1 3.36Å; A59-I126 PolarHBondContact O-N 3.39Å; V61-I126 HydrophobicContact CG2-CD1 3.72Å; V61-I126 HydrophobicContact CG2-CG1 4.36Å; I93-I126 HydrophobicContact CD1-CG2 3.51Å; D103-I126 HydrophobicContact CB-CB 4.5Å; D103-I126 HydrophobicContact CB-CG2 4.32Å; D103-I126 WeakPolarHBondContact OD2-CA 3.36Å; D103-I126 WeakPolarHBondContact OD2-CB 3.35Å; F124-I126 HydrophobicContact CB-CG2 4.11Å; I126-V132 HydrophobicContact CB-CG1 4.42Å; I126-V132 HydrophobicContact CD1-CG1 4.28Å; I126-I133 HydrophobicContact CD1-CG1 4.09Å; I126-V136 HydrophobicContact CD1-CB 4.12Å; I126-V136 HydrophobicContact CD1-CG1 4.34Å; I126-V136 HydrophobicContact CD1-CG2 3.98Å; I126-V136 HydrophobicContact CG2-CG2 4.44Å
127	H	97.4	Very high	96.5	Very high	104 Å²	104	31.6 Å²	31.6	48%	0.481	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	137.6	171	-64	90.1	0	0	0	111.2	D103 G129	D103-H127 VanDerWaalsContact CG-ND1 3.34Å; D103-H127 IonicContact OD1-CE1 3.73Å; D103-H127 IonicContact OD1-CG 2.97Å; D103-H127 IonicContact OD1-ND1 2.84Å; D103-H127 PolarHBondContact OD1-ND1 3.35Å; D103-H127 IonicContact OD2-CG 3.81Å; D103-H127 PolarHBondContact OD2-N 2.92Å; D103-H127 IonicContact OD2-ND1 2.84Å; D103-H127 PolarHBondContact OD2-ND1 2.78Å; D103-H127 VanDerWaalsContact OD2-ND1 3.09Å; H127-G129 PolarHBondContact O-N 3.37Å
128	G	95	Very high	96.5	Very high	4 Å²	4	38.1 Å²	38.1	4%	0.041	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	36.6	-175.5	0	0	0	0	0	115.6	C56	C56-G128 PolarHBondContact N-O 3.28Å; C56-G128 WeakPolarHBondContact O-CA 3.43Å; C56-G128 PolarHBondContact O-N 3.47Å
129	G	95.1	Very high	96.6	Very high	25 Å²	25	37.5 Å²	37.5	26%	0.258	22%	0.219	S	C	.	.			trans	-84.2	132.1	173.5	0	0	0	0	0	110.9	H127 A131 V132 I133	H127-G129 PolarHBondContact O-N 3.37Å; G129-A131 PolarHBondContact O-N 2.83Å; G129-A131 VanDerWaalsContact O-N 3.14Å; G129-V132 PolarHBondContact O-N 2.89Å; G129-I133 WeakPolarHBondContact O-CG1 3.33Å; G129-I133 PolarHBondContact O-N 2.84Å
130	P	93.8	Very high	96.6	Very high	75 Å²	75	35.6 Å²	35.6	49%	0.487	21%	0.21	S	C	.	.	H	α-helix	trans	-54.6	-36.3	-179.7	-28.7	35.2	0	0	0	114.3	T134	P130-T134 WeakPolarHBondContact O-CB 3.14Å; P130-T134 PolarHBondContact O-N 3.32Å; P130-T134 PolarHBondContact O-OG1 3.09Å
131	A	95.3	Very high	96.5	Very high	78 Å²	78	35.4 Å²	35.4	65%	0.645	22%	0.22	S	C	*	.	H	α-helix	trans	-67.5	-42.5	176.3	0	0	0	0	0	112.4	G129 T134 A135	G129-A131 PolarHBondContact O-N 2.83Å; G129-A131 VanDerWaalsContact O-N 3.14Å; A131-T134 PolarHBondContact O-N 3Å; A131-A135 WeakPolarHBondContact O-CB 3.49Å; A131-A135 PolarHBondContact O-N 3.28Å
132	V	96.1	Very high	96.3	Very high	36 Å²	36	37.3 Å²	37.3	22%	0.218	23%	0.233	C	C	.	.	H	α-helix	trans	-63.8	-48.7	178.2	-176.5	0	0	0	0	110.2	D103 I126 G129 T134 A135 V136	D103-V132 HydrophobicContact CB-CG1 3.77Å; I126-V132 HydrophobicContact CB-CG1 4.42Å; I126-V132 HydrophobicContact CD1-CG1 4.28Å; G129-V132 PolarHBondContact O-N 2.89Å; V132-T134 VanDerWaalsContact C-N 3.34Å; V132-T134 PolarHBondContact O-N 3.39Å; V132-A135 PolarHBondContact O-N 3.3Å; V132-V136 WeakPolarHBondContact O-CG2 3.38Å; V132-V136 PolarHBondContact O-N 2.72Å
133	I	96.2	Very high	96	Very high	17 Å²	17	37.6 Å²	37.6	9%	0.087	24%	0.235	C	C	.	.	H	α-helix	trans	-57.7	-48.6	176.9	-64.6	166.5	0	0	0	110.3	L49 A59 I126 G129 A135 V136 L137	L49-I133 HydrophobicContact CD1-CD1 4.12Å; L49-I133 HydrophobicContact CD1-CG1 4.34Å; L49-I133 HydrophobicContact CD1-CG2 4.13Å; L49-I133 HydrophobicContact CD2-CD1 4.34Å; L49-I133 HydrophobicContact CD2-CG2 4.37Å; A59-I133 HydrophobicContact CB-CD1 3.92Å; A59-I133 HydrophobicContact CB-CG1 4.09Å; I126-I133 HydrophobicContact CD1-CG1 4.09Å; G129-I133 WeakPolarHBondContact O-CG1 3.33Å; G129-I133 PolarHBondContact O-N 2.84Å; I133-A135 PolarHBondContact O-N 3.32Å; I133-V136 PolarHBondContact O-N 3.11Å; I133-L137 HydrophobicContact CG2-CD1 3.8Å; I133-L137 HydrophobicContact CG2-CG 4.31Å; I133-L137 WeakPolarHBondContact O-CB 3.43Å; I133-L137 VanDerWaalsContact O-CG 3.27Å; I133-L137 WeakPolarHBondContact O-CG 3.37Å; I133-L137 PolarHBondContact O-N 3.02Å
134	T	95.9	Very high	95.7	Very high	71 Å²	71	41.9 Å²	41.9	44%	0.436	27%	0.265	S	S	.	.	H	α-helix	trans	-60.5	-45.3	-179.7	-58.3	0	0	0	0	111.6	P130 A131 V132 L137 Q138	P130-T134 WeakPolarHBondContact O-CB 3.14Å; P130-T134 PolarHBondContact O-N 3.32Å; P130-T134 PolarHBondContact O-OG1 3.09Å; A131-T134 PolarHBondContact O-N 3Å; V132-T134 VanDerWaalsContact C-N 3.34Å; V132-T134 PolarHBondContact O-N 3.39Å; T134-L137 PolarHBondContact O-N 3.42Å; T134-Q138 HydrophobicContact CG2-CG 4.41Å; T134-Q138 WeakPolarHBondContact O-CB 3.41Å; T134-Q138 VanDerWaalsContact O-CG 3.3Å; T134-Q138 WeakPolarHBondContact O-CG 3.32Å; T134-Q138 PolarHBondContact O-N 3.38Å
135	A	97.1	Very high	95.3	Very high	32 Å²	32	44.2 Å²	44.2	26%	0.264	29%	0.288	S	S	.	.	H	α-helix	trans	-63.4	-43.7	179.9	0	0	0	0	0	112	L102 A131 V132 I133 Q138 A139	L102-A135 HydrophobicContact CD2-CB 4.18Å; A131-A135 WeakPolarHBondContact O-CB 3.49Å; A131-A135 PolarHBondContact O-N 3.28Å; V132-A135 PolarHBondContact O-N 3.3Å; I133-A135 PolarHBondContact O-N 3.32Å; A135-Q138 PolarHBondContact O-N 3.48Å; A135-A139 WeakPolarHBondContact O-CB 3.19Å; A135-A139 PolarHBondContact O-N 3.07Å
136	V	97.5	Very high	95.1	Very high	0 Å²	0	43 Å²	43	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.1	-42.3	176.8	172	0	0	0	0	111.7	V61 M75 L102 F124 I126 V132 I133 A139 L140	V61-V136 HydrophobicContact CG1-CG1 4.47Å; V61-V136 HydrophobicContact CG2-CG1 4.31Å; M75-V136 HydrophobicContact CE-CG1 4.34Å; L102-V136 HydrophobicContact CB-CG2 4.16Å; L102-V136 HydrophobicContact CD1-CG2 4.32Å; F124-V136 HydrophobicContact CD2-CG1 4.16Å; I126-V136 HydrophobicContact CD1-CB 4.12Å; I126-V136 HydrophobicContact CD1-CG1 4.34Å; I126-V136 HydrophobicContact CD1-CG2 3.98Å; I126-V136 HydrophobicContact CG2-CG2 4.44Å; V132-V136 WeakPolarHBondContact O-CG2 3.38Å; V132-V136 PolarHBondContact O-N 2.72Å; I133-V136 PolarHBondContact O-N 3.11Å; V136-A139 PolarHBondContact O-N 2.97Å; V136-L140 HydrophobicContact CG1-CD1 4.14Å; V136-L140 WeakPolarHBondContact O-CG 3.34Å; V136-L140 PolarHBondContact O-N 3.42Å
137	L	96.8	Very high	95	Very high	46 Å²	46	46 Å²	46	24%	0.241	29%	0.294	C	S	.	.	H	α-helix	trans	-66.8	-38.3	177.5	-67.5	175.3	0	0	0	112.3	F47 V61 I133 T134 L140 G141	F47-L137 HydrophobicContact CD2-CD2 3.64Å; F47-L137 HydrophobicContact CE2-CB 4.23Å; F47-L137 HydrophobicContact CE2-CD2 3.96Å; F47-L137 WeakPolarHBondContact CE2-O 3.41Å; V61-L137 HydrophobicContact CG1-CD2 3.9Å; V61-L137 HydrophobicContact CG2-CD2 4.49Å; I133-L137 HydrophobicContact CG2-CD1 3.8Å; I133-L137 HydrophobicContact CG2-CG 4.31Å; I133-L137 WeakPolarHBondContact O-CB 3.43Å; I133-L137 VanDerWaalsContact O-CG 3.27Å; I133-L137 WeakPolarHBondContact O-CG 3.37Å; I133-L137 PolarHBondContact O-N 3.02Å; T134-L137 PolarHBondContact O-N 3.42Å; L137-L140 PolarHBondContact O-N 3.28Å; L137-G141 PolarHBondContact O-N 2.9Å
138	Q	96.6	Very high	94.9	Very high	138 Å²	138	45.2 Å²	45.2	65%	0.645	30%	0.298	S	S	*	.	H	α-helix	trans	-65.1	-44.5	174.6	-75.9	176.5	-12.7	0	0	111.6	T134 A135 L140 G141 S142	T134-Q138 HydrophobicContact CG2-CG 4.41Å; T134-Q138 WeakPolarHBondContact O-CB 3.41Å; T134-Q138 VanDerWaalsContact O-CG 3.3Å; T134-Q138 WeakPolarHBondContact O-CG 3.32Å; T134-Q138 PolarHBondContact O-N 3.38Å; A135-Q138 PolarHBondContact O-N 3.48Å; Q138-L140 VanDerWaalsContact C-N 3.33Å; Q138-L140 PolarHBondContact O-N 2.87Å; Q138-G141 PolarHBondContact O-N 2.6Å; Q138-G141 VanDerWaalsContact O-N 3.13Å; Q138-S142 PolarHBondContact O-N 3Å; Q138-S142 VanDerWaalsContact O-N 3.17Å
139	A	96.9	Very high	94.9	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.008	30%	0.299	C	S	.	.	H	α-helix	trans	-60	-42.8	175.7	0	0	0	0	0	111.8	M75 L102 A135 V136 G141 S142	M75-A139 HydrophobicContact CE-CB 3.72Å; L102-A139 HydrophobicContact CD1-CB 3.52Å; A135-A139 WeakPolarHBondContact O-CB 3.19Å; A135-A139 PolarHBondContact O-N 3.07Å; V136-A139 PolarHBondContact O-N 2.97Å; A139-G141 VanDerWaalsContact C-N 3.35Å; A139-G141 PolarHBondContact O-N 3.41Å; A139-S142 WeakPolarHBondContact O-CB 3.48Å; A139-S142 PolarHBondContact O-N 2.94Å; A139-S142 PolarHBondContact O-OG 2.94Å
140	L	96.6	Very high	94.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-61.5	-40.9	172.8	-75.8	167	0	0	0	112.5	F47 V61 I63 A71 M75 F124 V136 L137 Q138 S142 V143 M146	F47-L140 HydrophobicContact CB-CD1 4.09Å; F47-L140 HydrophobicContact CD1-CB 3.93Å; F47-L140 HydrophobicContact CD2-CB 3.92Å; F47-L140 HydrophobicContact CD2-CD1 4.03Å; F47-L140 HydrophobicContact CE1-CB 3.97Å; F47-L140 HydrophobicContact CE2-CB 3.98Å; F47-L140 HydrophobicContact CG-CB 3.9Å; F47-L140 HydrophobicContact CG-CD1 4.08Å; F47-L140 HydrophobicContact CZ-CB 4Å; V61-L140 HydrophobicContact CG1-CD1 3.6Å; I63-L140 HydrophobicContact CD1-CD1 4.11Å; I63-L140 HydrophobicContact CD1-CD2 3.45Å; I63-L140 VanDerWaalsContact CD1-CD2 3.45Å; I63-L140 HydrophobicContact CD1-CG 4.45Å; I63-L140 HydrophobicContact CG1-CD1 4.12Å; I63-L140 HydrophobicContact CG1-CD2 3.95Å; A71-L140 HydrophobicContact CB-CD2 4.02Å; M75-L140 HydrophobicContact CE-CD2 4.48Å; M75-L140 HydrophobicContact CE-CG 4.22Å; M75-L140 HydrophobicContact SD-CD2 3.41Å; M75-L140 WeakPolarHBondContact SD-CD2 3.48Å; M75-L140 HydrophobicContact SD-CG 3.76Å; F124-L140 HydrophobicContact CE2-CD2 4.13Å; V136-L140 HydrophobicContact CG1-CD1 4.14Å; V136-L140 WeakPolarHBondContact O-CG 3.34Å; V136-L140 PolarHBondContact O-N 3.42Å; L137-L140 PolarHBondContact O-N 3.28Å; Q138-L140 VanDerWaalsContact C-N 3.33Å; Q138-L140 PolarHBondContact O-N 2.87Å; L140-S142 PolarHBondContact O-N 3.41Å; L140-V143 WeakPolarHBondContact O-CB 3.49Å; L140-V143 PolarHBondContact O-N 2.77Å; L140-V143 VanDerWaalsContact O-N 3.12Å; L140-M146 HydrophobicContact CD2-CE 3.97Å; L140-M146 HydrophobicContact CD2-SD 4.28Å
141	G	94.6	Very high	94.4	Very high	44 Å²	44	46.7 Å²	46.7	45%	0.454	30%	0.301	S	S	.	.	H	α-helix	trans	-64.4	-17.7	176.2	0	0	0	0	0	114.7	L137 Q138 A139	L137-G141 PolarHBondContact O-N 2.9Å; Q138-G141 PolarHBondContact O-N 2.6Å; Q138-G141 VanDerWaalsContact O-N 3.13Å; A139-G141 VanDerWaalsContact C-N 3.35Å; A139-G141 PolarHBondContact O-N 3.41Å
142	S	93.5	Very high	94.1	Very high	43 Å²	43	43 Å²	43	30%	0.301	27%	0.27	S	S	.	.	H	α-helix	trans	-81.7	-17.8	174.8	77.8	0	0	0	0	113.7	H97 Q138 A139 L140	H97-S142 PolarHBondContact CD2-OG 3.22Å; H97-S142 PolarHBondContact NE2-OG 3.44Å; Q138-S142 PolarHBondContact O-N 3Å; Q138-S142 VanDerWaalsContact O-N 3.17Å; A139-S142 WeakPolarHBondContact O-CB 3.48Å; A139-S142 PolarHBondContact O-N 2.94Å; A139-S142 PolarHBondContact O-OG 2.94Å; L140-S142 PolarHBondContact O-N 3.41Å
143	V	91.8	Very high	93.9	Very high	7 Å²	7	41.4 Å²	41.4	4%	0.042	26%	0.261	C	S	.	.	S	Bend	trans	-76.8	129.6	-178.5	179.2	0	0	0	0	109.5	T70 P96 L140 G145 M146	T70-V143 HydrophobicContact CG2-CG1 4.33Å; P96-V143 HydrophobicContact CB-CG2 4.42Å; P96-V143 HydrophobicContact CG-CG2 3.76Å; L140-V143 WeakPolarHBondContact O-CB 3.49Å; L140-V143 PolarHBondContact O-N 2.77Å; L140-V143 VanDerWaalsContact O-N 3.12Å; V143-G145 PolarHBondContact O-N 3.08Å; V143-M146 HydrophobicContact CB-CG 4.04Å; V143-M146 HydrophobicContact CB-SD 3.46Å; V143-M146 WeakPolarHBondContact CB-SD 3.47Å; V143-M146 HydrophobicContact CG1-CG 4.04Å; V143-M146 HydrophobicContact CG1-SD 3.55Å; V143-M146 VanDerWaalsContact CG1-SD 3.55Å; V143-M146 HydrophobicContact CG2-SD 4.16Å; V143-M146 WeakPolarHBondContact O-CB 3.31Å; V143-M146 PolarHBondContact O-N 2.79Å
144	P	90.3	Very high	93.8	Very high	113 Å²	113	40.6 Å²	40.6	73%	0.734	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	137.3	-178.4	-25.7	34.3	0	0	0	113.3	M146	P144-M146 VanDerWaalsContact C-N 3.34Å
145	G	90.6	Very high	93.6	Very high	48 Å²	48	37.2 Å²	37.2	50%	0.495	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.5	14.1	178.4	0	0	0	0	0	114.6	T45 V143	T45-G145 WeakPolarHBondContact CB-O 3.06Å; T45-G145 PolarHBondContact N-O 3.44Å; V143-G145 PolarHBondContact O-N 3.08Å
146	M	93.8	Very high	93.3	Very high	19 Å²	19	39 Å²	39	9%	0.094	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	146.1	177.8	-56.4	-169.2	85.4	0	0	112.3	T45 F47 I63 A67 A71 L140 V143 P144	T45-M146 HydrophobicContact CG2-CE 3.65Å; T45-M146 HydrophobicContact CG2-CG 4.26Å; T45-M146 CarbonylContact O-C 3.53Å; T45-M146 VanDerWaalsContact O-CA 3.22Å; T45-M146 WeakPolarHBondContact O-CA 3.5Å; F47-M146 HydrophobicContact CD1-CB 4.06Å; F47-M146 HydrophobicContact CD1-CE 4.26Å; F47-M146 HydrophobicContact CE1-CB 4.02Å; I63-M146 HydrophobicContact CB-CE 4.34Å; I63-M146 HydrophobicContact CG1-CE 4.23Å; I63-M146 HydrophobicContact CG2-CE 3.21Å; A67-M146 HydrophobicContact CB-CG 4.26Å; A71-M146 HydrophobicContact CB-CE 3.64Å; A71-M146 HydrophobicContact CB-SD 3.64Å; L140-M146 HydrophobicContact CD2-CE 3.97Å; L140-M146 HydrophobicContact CD2-SD 4.28Å; V143-M146 HydrophobicContact CB-CG 4.04Å; V143-M146 HydrophobicContact CB-SD 3.46Å; V143-M146 WeakPolarHBondContact CB-SD 3.47Å; V143-M146 HydrophobicContact CG1-CG 4.04Å; V143-M146 HydrophobicContact CG1-SD 3.55Å; V143-M146 VanDerWaalsContact CG1-SD 3.55Å; V143-M146 HydrophobicContact CG2-SD 4.16Å; V143-M146 WeakPolarHBondContact O-CB 3.31Å; V143-M146 PolarHBondContact O-N 2.79Å; P144-M146 VanDerWaalsContact C-N 3.34Å
147	R	95.4	Very high	93.1	Very high	66 Å²	66	40.5 Å²	40.5	25%	0.249	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	161.4	171.3	65.7	169.6	174.6	74.3	2.1	112.2	D44 T45 I46 F47 E153	D44-R147 HydrophobicContact CB-CG 4.01Å; D44-R147 WeakPolarHBondContact OD2-CD 3.4Å; D44-R147 IonicContact OD2-NE 3.28Å; D44-R147 PolarHBondContact OD2-NE 2.96Å; T45-R147 PolarHBondContact O-N 3.17Å; I46-R147 CarbonylContact C-O 3.59Å; I46-R147 VanDerWaalsContact CA-O 3.3Å; I46-R147 WeakPolarHBondContact CA-O 3.27Å; I46-R147 HydrophobicContact CG2-CG 4.18Å; I46-R147 VanDerWaalsContact CG2-NH1 3.34Å; F47-R147 WeakPolarHBondContact CD1-O 3.42Å; F47-R147 WeakPolarHBondContact CE1-O 3.21Å; F47-R147 PolarHBondContact N-O 2.9Å; R147-E153 IonicContact CZ-OE1 3.07Å; R147-E153 IonicContact CZ-OE2 3.54Å; R147-E153 IonicContact NH1-OE1 3.34Å; R147-E153 IonicContact NH1-OE2 3.99Å; R147-E153 PolarHBondContact NH1-OE2 2.72Å; R147-E153 IonicContact NH2-OE1 3.08Å; R147-E153 PolarHBondContact NH2-OE1 3.38Å; R147-E153 IonicContact NH2-OE2 2.94Å; R147-E153 PolarHBondContact NH2-OE2 3.17Å
148	P	95.2	Very high	92.9	Very high	86 Å²	86	38.3 Å²	38.3	56%	0.558	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-57.3	143.4	167.2	-23.1	34.6	0	0	0	111.6	F47	F47-P148 HydrophobicContact CE2-CG 4.34Å; F47-P148 HydrophobicContact CZ-CG 4.05Å; F47-P148 WeakPolarHBondContact O-CA 3.39Å
149	A	94.3	Very high	92.7	Very high	7 Å²	7	33 Å²	33	6%	0.058	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-73.5	145.6	173.6	0	0	0	0	0	111.7	I46 F47 A48 E153 F154	I46-A149 HydrophobicContact CB-CB 3.93Å; I46-A149 HydrophobicContact CD1-CB 3.99Å; I46-A149 HydrophobicContact CG1-CB 4.45Å; I46-A149 HydrophobicContact CG2-CB 4.45Å; F47-A149 PolarHBondContact O-N 3.39Å; A48-A149 HydrophobicContact CB-CB 3.98Å; A149-E153 HydrophobicContact CB-CB 4.42Å; A149-F154 HydrophobicContact CB-CD2 4.2Å; A149-F154 HydrophobicContact CB-CE2 3.53Å; A149-F154 HydrophobicContact CB-CZ 4.17Å
150	D	91	Very high	92.5	Very high	91 Å²	91	38.9 Å²	38.9	49%	0.487	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-74.1	166.3	165	-63.4	-41.3	0	0	0	111.1	G152 E153	D150-G152 PolarHBondContact O-N 2.92Å; D150-E153 HydrophobicContact CB-CB 4.18Å; D150-E153 PolarHBondContact N-OE2 2.76Å; D150-E153 WeakPolarHBondContact O-CB 3.43Å; D150-E153 PolarHBondContact O-N 2.76Å
151	A	86.8	Confident	92.2	Very high	37 Å²	37	41.5 Å²	41.5	31%	0.306	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	130.8	171.7	0	0	0	0	0	111	E153 F507 F510 I512	A151-E153 PolarHBondContact O-N 3.5Å; A151-F507 CarbonylContact C-O 3.41Å; A151-F510 WeakPolarHBondContact CB-O 3.21Å; A151-I512 HydrophobicContact CB-CG1 4.33Å
152	G	88.5	Confident	92.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	-0.8	-179.5	0	0	0	0	0	115	D150 F154 T155 R156 F507 K514	D150-G152 PolarHBondContact O-N 2.92Å; G152-F154 PolarHBondContact O-N 3.33Å; G152-T155 PolarHBondContact O-N 2.94Å; G152-R156 WeakPolarHBondContact O-CB 3.48Å; G152-R156 PolarHBondContact O-N 2.82Å; G152-F507 WeakPolarHBondContact O-CD1 3.28Å; G152-K514 CarbonylContact C-O 3.17Å; G152-K514 VanDerWaalsContact C-O 3.3Å; G152-K514 WeakPolarHBondContact CA-O 3.46Å; G152-K514 PolarHBondContact N-O 3.49Å
153	E	92.3	Very high	92	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.019	27%	0.266	C	S	.	.	H	α-helix	trans	-67	-36.1	-164.6	-167.1	178.5	171.4	0	0	113.3	I46 R147 A149 D150 A151 T155 R156 R157	I46-E153 HydrophobicContact CD1-CB 4.12Å; I46-E153 HydrophobicContact CD1-CG 3.85Å; R147-E153 IonicContact CZ-OE1 3.07Å; R147-E153 IonicContact CZ-OE2 3.54Å; R147-E153 IonicContact NH1-OE1 3.34Å; R147-E153 IonicContact NH1-OE2 3.99Å; R147-E153 PolarHBondContact NH1-OE2 2.72Å; R147-E153 IonicContact NH2-OE1 3.08Å; R147-E153 PolarHBondContact NH2-OE1 3.38Å; R147-E153 IonicContact NH2-OE2 2.94Å; R147-E153 PolarHBondContact NH2-OE2 3.17Å; A149-E153 HydrophobicContact CB-CB 4.42Å; D150-E153 HydrophobicContact CB-CB 4.18Å; D150-E153 PolarHBondContact N-OE2 2.76Å; D150-E153 WeakPolarHBondContact O-CB 3.43Å; D150-E153 PolarHBondContact O-N 2.76Å; A151-E153 PolarHBondContact O-N 3.5Å; E153-T155 VanDerWaalsContact C-N 3.33Å; E153-T155 PolarHBondContact O-N 3.4Å; E153-R156 PolarHBondContact O-N 2.89Å; E153-R156 IonicContact OE1-NH2 3.2Å; E153-R157 WeakPolarHBondContact O-CG 3.39Å; E153-R157 PolarHBondContact O-N 2.79Å; E153-R157 IonicContact OE1-CZ 2.84Å; E153-R157 IonicContact OE1-NE 3.11Å; E153-R157 PolarHBondContact OE1-NE 3.16Å; E153-R157 IonicContact OE1-NH2 3.45Å; E153-R157 PolarHBondContact OE1-NH2 2.99Å
154	F	93.6	Very high	92.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-64	-42.9	176.7	-67.4	-89.3	0	0	0	110.7	I46 A48 R62 F116 T117 A149 G152 R157 A158 K514	I46-F154 HydrophobicContact CD1-CD1 3.84Å; I46-F154 HydrophobicContact CD1-CD2 4.12Å; I46-F154 HydrophobicContact CD1-CE1 3.78Å; I46-F154 HydrophobicContact CD1-CE2 4.05Å; I46-F154 HydrophobicContact CD1-CG 4.01Å; I46-F154 HydrophobicContact CD1-CZ 3.9Å; I46-F154 HydrophobicContact CG1-CD1 4.4Å; I46-F154 HydrophobicContact CG1-CE1 3.91Å; I46-F154 HydrophobicContact CG1-CZ 4.03Å; A48-F154 HydrophobicContact CB-CE2 3.91Å; A48-F154 HydrophobicContact CB-CZ 4.44Å; R62-F154 HydrophobicContact CB-CE1 4.26Å; R62-F154 HydrophobicContact CB-CZ 4.27Å; R62-F154 HydrophobicContact CG-CD1 4.23Å; R62-F154 HydrophobicContact CG-CE1 3.73Å; R62-F154 HydrophobicContact CG-CZ 4.24Å; F116-F154 HydrophobicContact CD1-CB 4.22Å; F116-F154 HydrophobicContact CE1-CB 3.97Å; T117-F154 HydrophobicContact CG2-CB 4.02Å; T117-F154 HydrophobicContact CG2-CD1 3.79Å; T117-F154 HydrophobicContact CG2-CG 4.4Å; T117-F154 WeakPolarHBondContact CG2-O 3.48Å; A149-F154 HydrophobicContact CB-CD2 4.2Å; A149-F154 HydrophobicContact CB-CE2 3.53Å; A149-F154 HydrophobicContact CB-CZ 4.17Å; G152-F154 PolarHBondContact O-N 3.33Å; F154-R157 PolarHBondContact O-N 2.97Å; F154-A158 PolarHBondContact O-N 3.19Å; F154-K514 WeakPolarHBondContact CB-OXT 3.34Å; F154-K514 PolarHBondContact N-OXT 3.21Å
155	T	92.8	Very high	92.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-69.3	-37.2	178.9	-52.8	0	0	0	0	110.9	F116 G152 E153 R157 A158 F159 L164 V169 L172 F507 K514	F116-T155 HydrophobicContact CZ-CG2 4.45Å; G152-T155 PolarHBondContact O-N 2.94Å; E153-T155 VanDerWaalsContact C-N 3.33Å; E153-T155 PolarHBondContact O-N 3.4Å; T155-R157 PolarHBondContact O-N 2.84Å; T155-A158 WeakPolarHBondContact O-CB 3.41Å; T155-A158 PolarHBondContact O-N 2.89Å; T155-F159 PolarHBondContact O-N 3.34Å; T155-L164 HydrophobicContact CG2-CD1 4.21Å; T155-V169 HydrophobicContact CG2-CB 4.38Å; T155-V169 HydrophobicContact CG2-CG1 3.87Å; T155-V169 HydrophobicContact CG2-CG2 3.94Å; T155-L172 HydrophobicContact CG2-CD2 3.99Å; T155-F507 HydrophobicContact CG2-CE1 3.76Å; T155-K514 VanDerWaalsContact CB-OXT 3.3Å; T155-K514 WeakPolarHBondContact CB-OXT 3.44Å; T155-K514 PolarHBondContact N-OXT 3.17Å; T155-K514 PolarHBondContact OG1-OXT 3.23Å
156	R	91.2	Very high	92.2	Very high	68 Å²	68	38.5 Å²	38.5	26%	0.257	22%	0.217	S	C	.	.	H	α-helix	trans	-58.8	-45.2	171.3	-174.1	171.9	67.1	-176	-2	111.9	G152 E153 F159 H160 F507	G152-R156 WeakPolarHBondContact O-CB 3.48Å; G152-R156 PolarHBondContact O-N 2.82Å; E153-R156 PolarHBondContact O-N 2.89Å; E153-R156 IonicContact OE1-NH2 3.2Å; R156-F159 PolarHBondContact O-N 3.26Å; R156-H160 PolarHBondContact O-CD2 3.25Å; R156-H160 PolarHBondContact O-N 2.67Å; R156-F507 HydrophobicContact CB-CD1 4.46Å; R156-F507 HydrophobicContact CB-CD2 3.76Å; R156-F507 HydrophobicContact CB-CE1 4.24Å; R156-F507 HydrophobicContact CB-CE2 3.46Å; R156-F507 VanDerWaalsContact CB-CE2 3.46Å; R156-F507 HydrophobicContact CB-CG 4.27Å; R156-F507 HydrophobicContact CB-CZ 3.77Å; R156-F507 HydrophobicContact CG-CD2 3.94Å; R156-F507 HydrophobicContact CG-CE2 3.59Å; R156-F507 HydrophobicContact CG-CZ 4.3Å
157	R	92.7	Very high	92.1	Very high	32 Å²	32	37.6 Å²	37.6	12%	0.121	21%	0.213	C	C	.	.	H	α-helix	trans	-64.7	-41.6	175.4	-69.2	-175.9	-171.3	-146.3	-1.1	112	D44 T117 E119 E153 F154 T155 F159 H160 A161	D44-R157 PolarHBondContact O-NH1 2.93Å; D44-R157 PolarHBondContact O-NH2 2.78Å; T117-R157 HydrophobicContact CG2-CB 4.26Å; E119-R157 IonicContact OE1-NH1 3.09Å; E119-R157 PolarHBondContact OE1-NH1 3.02Å; E119-R157 VanDerWaalsContact OE2-CD 3.22Å; E119-R157 WeakPolarHBondContact OE2-CD 3.47Å; E119-R157 IonicContact OE2-CZ 2.79Å; E119-R157 IonicContact OE2-NE 3.86Å; E119-R157 IonicContact OE2-NH1 3.82Å; E119-R157 PolarHBondContact OE2-NH1 3.12Å; E153-R157 WeakPolarHBondContact O-CG 3.39Å; E153-R157 PolarHBondContact O-N 2.79Å; E153-R157 IonicContact OE1-CZ 2.84Å; E153-R157 IonicContact OE1-NE 3.11Å; E153-R157 PolarHBondContact OE1-NE 3.16Å; E153-R157 IonicContact OE1-NH2 3.45Å; E153-R157 PolarHBondContact OE1-NH2 2.99Å; F154-R157 PolarHBondContact O-N 2.97Å; T155-R157 PolarHBondContact O-N 2.84Å; R157-F159 VanDerWaalsContact C-N 3.32Å; R157-F159 PolarHBondContact O-N 2.93Å; R157-H160 PolarHBondContact O-N 3.4Å; R157-A161 WeakPolarHBondContact O-CB 3.47Å; R157-A161 PolarHBondContact O-N 2.92Å
158	A	93.6	Very high	92.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.7	-44.4	174.3	0	0	0	0	0	111.9	F116 F154 T155 A161 G162 K163 L164	F116-A158 HydrophobicContact CD1-CB 4.41Å; F116-A158 HydrophobicContact CE1-CB 4.17Å; F116-A158 HydrophobicContact CZ-CB 4.35Å; F116-A158 WeakPolarHBondContact O-CB 3.32Å; F154-A158 PolarHBondContact O-N 3.19Å; T155-A158 WeakPolarHBondContact O-CB 3.41Å; T155-A158 PolarHBondContact O-N 2.89Å; A158-A161 PolarHBondContact O-N 3.14Å; A158-G162 PolarHBondContact O-N 3.2Å; A158-K163 HydrophobicContact CB-CB 4.09Å; A158-K163 VanDerWaalsContact O-CB 3.26Å; A158-K163 WeakPolarHBondContact O-CB 3.45Å; A158-K163 PolarHBondContact O-N 3.09Å; A158-L164 HydrophobicContact CB-CD1 4.09Å; A158-L164 HydrophobicContact CB-CG 4.44Å
159	F	92	Very high	92	Very high	26 Å²	26	32.2 Å²	32.2	11%	0.114	18%	0.183	C	C	.	.	H	α-helix	trans	-60.3	-50.7	174.9	173.5	-98.5	0	0	0	112.1	T155 R156 R157 A161 G162 L164 L166 V169 G495 A499 L503	T155-F159 PolarHBondContact O-N 3.34Å; R156-F159 PolarHBondContact O-N 3.26Å; R157-F159 VanDerWaalsContact C-N 3.32Å; R157-F159 PolarHBondContact O-N 2.93Å; F159-A161 VanDerWaalsContact C-N 3.26Å; F159-A161 PolarHBondContact O-N 3.19Å; F159-G162 PolarHBondContact O-N 3.49Å; F159-L164 WeakPolarHBondContact CA-O 3.44Å; F159-L164 WeakPolarHBondContact CD2-O 3.43Å; F159-L166 HydrophobicContact CE2-CB 4.1Å; F159-V169 HydrophobicContact CB-CG2 4.2Å; F159-V169 HydrophobicContact CD2-CG2 4.35Å; F159-G495 WeakPolarHBondContact CZ-O 3.35Å; F159-A499 HydrophobicContact CE1-CB 4.24Å; F159-A499 HydrophobicContact CZ-CB 3.97Å; F159-L503 HydrophobicContact CD1-CD1 3.95Å; F159-L503 HydrophobicContact CD1-CD2 3.96Å; F159-L503 HydrophobicContact CE1-CD1 3.68Å; F159-L503 HydrophobicContact CE1-CD2 3.98Å; F159-L503 HydrophobicContact CE1-CG 4.43Å; F159-L503 HydrophobicContact CG-CD2 4.33Å; F159-L503 HydrophobicContact CZ-CD2 4.34Å
160	H	91.1	Very high	91.8	Very high	126 Å²	126	32 Å²	32	58%	0.583	18%	0.181	S	C	*	.	H	α-helix	trans	-63.5	-30.8	178.3	-70.4	-56.1	0	0	0	113.5	R156 R157 G162	R156-H160 PolarHBondContact O-CD2 3.25Å; R156-H160 PolarHBondContact O-N 2.67Å; R157-H160 PolarHBondContact O-N 3.4Å; H160-G162 PolarHBondContact O-N 3.23Å
161	A	91.9	Very high	91.9	Very high	55 Å²	55	27.7 Å²	27.7	46%	0.455	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	1.4	173.8	0	0	0	0	0	113.6	T117 R157 A158 F159 K163	T117-A161 WeakPolarHBondContact O-CB 3.27Å; R157-A161 WeakPolarHBondContact O-CB 3.47Å; R157-A161 PolarHBondContact O-N 2.92Å; A158-A161 PolarHBondContact O-N 3.14Å; F159-A161 VanDerWaalsContact C-N 3.26Å; F159-A161 PolarHBondContact O-N 3.19Å; A161-K163 HydrophobicContact CB-CG 4.13Å; A161-K163 PolarHBondContact O-N 3.15Å
162	G	91.4	Very high	92.2	Very high	65 Å²	65	26.8 Å²	26.8	67%	0.67	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.5	22.2	-178	0	0	0	0	0	113.6	A158 F159 H160	A158-G162 PolarHBondContact O-N 3.2Å; F159-G162 PolarHBondContact O-N 3.49Å; H160-G162 PolarHBondContact O-N 3.23Å
163	K	92.7	Very high	92.2	Very high	80 Å²	80	27.1 Å²	27.1	35%	0.348	15%	0.151	S	C	.	.	S	Bend	trans	-77.4	-30.4	175.9	-65.5	-58	-158.6	178.9	0	112.9	P113 S115 A158 A161	P113-K163 WeakPolarHBondContact O-CE 3.5Å; P113-K163 PolarHBondContact O-NZ 2.58Å; S115-K163 WeakPolarHBondContact O-CE 3.4Å; A158-K163 HydrophobicContact CB-CB 4.09Å; A158-K163 VanDerWaalsContact O-CB 3.26Å; A158-K163 WeakPolarHBondContact O-CB 3.45Å; A158-K163 PolarHBondContact O-N 3.09Å; A161-K163 HydrophobicContact CB-CG 4.13Å; A161-K163 PolarHBondContact O-N 3.15Å
164	L	92.1	Very high	92.1	Very high	27 Å²	27	27.7 Å²	27.7	14%	0.141	15%	0.154	C	C	.	.	S	Bend	trans	-137.7	139.8	-179.9	-60.8	172.5	0	0	0	108.1	F116 T155 A158 F159 E168 V169 L172	F116-L164 HydrophobicContact CE2-CD1 4.14Å; F116-L164 HydrophobicContact CZ-CD1 4.24Å; T155-L164 HydrophobicContact CG2-CD1 4.21Å; A158-L164 HydrophobicContact CB-CD1 4.09Å; A158-L164 HydrophobicContact CB-CG 4.44Å; F159-L164 WeakPolarHBondContact CA-O 3.44Å; F159-L164 WeakPolarHBondContact CD2-O 3.43Å; L164-E168 VanDerWaalsContact CA-OE2 3.31Å; L164-E168 WeakPolarHBondContact CA-OE2 3.42Å; L164-E168 HydrophobicContact CB-CB 4.23Å; L164-E168 HydrophobicContact CD2-CB 4.04Å; L164-V169 HydrophobicContact CB-CG2 3.91Å; L164-V169 HydrophobicContact CD1-CG2 4.29Å; L164-L172 HydrophobicContact CD1-CD2 4.4Å
165	D	92.3	Very high	92	Very high	19 Å²	19	29.9 Å²	29.9	10%	0.102	17%	0.166	C	C	.	.			trans	-84.5	171.6	162.8	80.3	28.5	0	0	0	111.4	T167 E168 V169 G196	D165-T167 PolarHBondContact O-N 3Å; D165-T167 WeakPolarHBondContact OD1-CA 3.37Å; D165-T167 WeakPolarHBondContact OD1-CB 3.47Å; D165-T167 PolarHBondContact OD1-N 2.81Å; D165-T167 PolarHBondContact OD1-OG1 3.41Å; D165-E168 PolarHBondContact N-OE2 2.83Å; D165-E168 PolarHBondContact O-N 3.12Å; D165-E168 PolarHBondContact OD1-N 3.16Å; D165-V169 WeakPolarHBondContact O-CG2 3.42Å; D165-V169 PolarHBondContact O-N 3.25Å; D165-G196 WeakPolarHBondContact OD2-CA 3.46Å
166	L	91.8	Very high	91.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-64.3	-30.7	-175.3	-169.6	58.8	0	0	0	112.7	F159 E170 T494 I502 L503 I506	F159-L166 HydrophobicContact CE2-CB 4.1Å; L166-E170 VanDerWaalsContact O-CG 3.29Å; L166-E170 WeakPolarHBondContact O-CG 3.32Å; L166-E170 PolarHBondContact O-N 3.36Å; L166-E170 VanDerWaalsContact O-N 3.11Å; L166-T494 WeakPolarHBondContact CB-O 3.27Å; L166-T494 PolarHBondContact N-O 3.47Å; L166-I502 HydrophobicContact CD2-CG2 4.38Å; L166-L503 HydrophobicContact CD1-CD2 3.62Å; L166-I506 HydrophobicContact CD1-CD1 3.79Å; L166-I506 HydrophobicContact CG-CD1 4.42Å
167	T	92.6	Very high	91.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-71.4	-36.6	177.1	69.3	0	0	0	0	111.2	D165 E170 G171 Q190 L195 G196 Y199 I493	D165-T167 PolarHBondContact O-N 3Å; D165-T167 WeakPolarHBondContact OD1-CA 3.37Å; D165-T167 WeakPolarHBondContact OD1-CB 3.47Å; D165-T167 PolarHBondContact OD1-N 2.81Å; D165-T167 PolarHBondContact OD1-OG1 3.41Å; T167-E170 PolarHBondContact O-N 3.39Å; T167-G171 PolarHBondContact O-N 3.22Å; T167-Q190 VanDerWaalsContact O-CG 3.28Å; T167-Q190 WeakPolarHBondContact O-CG 3.28Å; T167-Q190 PolarHBondContact O-NE2 3.48Å; T167-L195 HydrophobicContact CG2-CD2 4.41Å; T167-G196 PolarHBondContact OG1-N 3.1Å; T167-Y199 HydrophobicContact CG2-CD2 4.33Å; T167-Y199 HydrophobicContact CG2-CE2 4.32Å; T167-I493 HydrophobicContact CG2-CG2 4.05Å
168	E	94.2	Very high	91.4	Very high	39 Å²	39	34.2 Å²	34.2	18%	0.182	20%	0.196	C	C	.	.	H	α-helix	trans	-69.6	-38.2	175.4	-66.4	172.2	136.9	0	0	111.8	L164 D165 E170 G171 L172 G193	L164-E168 VanDerWaalsContact CA-OE2 3.31Å; L164-E168 WeakPolarHBondContact CA-OE2 3.42Å; L164-E168 HydrophobicContact CB-CB 4.23Å; L164-E168 HydrophobicContact CD2-CB 4.04Å; D165-E168 PolarHBondContact N-OE2 2.83Å; D165-E168 PolarHBondContact O-N 3.12Å; D165-E168 PolarHBondContact OD1-N 3.16Å; E168-E170 VanDerWaalsContact C-N 3.35Å; E168-G171 PolarHBondContact O-N 3.26Å; E168-L172 WeakPolarHBondContact O-CB 3.42Å; E168-L172 PolarHBondContact O-N 3Å; E168-G193 WeakPolarHBondContact OE1-CA 3.12Å
169	V	92.3	Very high	91.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58.3	-47.9	172	170.1	0	0	0	0	110.5	T155 F159 L164 D165 G171 L172 G173 I506 F507 F510	T155-V169 HydrophobicContact CG2-CB 4.38Å; T155-V169 HydrophobicContact CG2-CG1 3.87Å; T155-V169 HydrophobicContact CG2-CG2 3.94Å; F159-V169 HydrophobicContact CB-CG2 4.2Å; F159-V169 HydrophobicContact CD2-CG2 4.35Å; L164-V169 HydrophobicContact CB-CG2 3.91Å; L164-V169 HydrophobicContact CD1-CG2 4.29Å; D165-V169 WeakPolarHBondContact O-CG2 3.42Å; D165-V169 PolarHBondContact O-N 3.25Å; V169-G171 VanDerWaalsContact C-N 3.35Å; V169-G171 PolarHBondContact O-N 3.16Å; V169-L172 WeakPolarHBondContact O-CB 3.36Å; V169-L172 PolarHBondContact O-N 3.38Å; V169-G173 PolarHBondContact O-N 2.9Å; V169-I506 HydrophobicContact CG1-CG2 3.92Å; V169-F507 HydrophobicContact CG1-CE1 3.62Å; V169-F507 HydrophobicContact CG1-CZ 4Å; V169-F510 HydrophobicContact CG1-CE2 4.34Å; V169-F510 HydrophobicContact CG1-CZ 4.22Å; V169-F510 WeakPolarHBondContact O-CZ 3.4Å
170	E	91.6	Very high	91.1	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.019	21%	0.207	C	C	.	.	H	α-helix	trans	-62.3	-42.4	176.1	-71.1	170	158.1	0	0	112.1	L166 T167 E168 L172 G173 D174 Q451 R453 H454 I506	L166-E170 VanDerWaalsContact O-CG 3.29Å; L166-E170 WeakPolarHBondContact O-CG 3.32Å; L166-E170 PolarHBondContact O-N 3.36Å; L166-E170 VanDerWaalsContact O-N 3.11Å; T167-E170 PolarHBondContact O-N 3.39Å; E168-E170 VanDerWaalsContact C-N 3.35Å; E170-L172 VanDerWaalsContact C-N 3.3Å; E170-L172 PolarHBondContact O-N 3.27Å; E170-G173 PolarHBondContact O-N 3.19Å; E170-G173 VanDerWaalsContact O-N 3.16Å; E170-D174 WeakPolarHBondContact O-CB 3.3Å; E170-D174 VanDerWaalsContact O-CG 3.26Å; E170-D174 PolarHBondContact O-N 3.27Å; E170-Q451 VanDerWaalsContact CG-NE2 3.31Å; E170-Q451 PolarHBondContact OE1-NE2 2.85Å; E170-R453 IonicContact OE1-CZ 2.7Å; E170-R453 IonicContact OE1-NE 3.01Å; E170-R453 PolarHBondContact OE1-NE 2.9Å; E170-R453 IonicContact OE1-NH2 2.89Å; E170-R453 PolarHBondContact OE1-NH2 3.13Å; E170-R453 IonicContact OE2-CZ 3.93Å; E170-R453 IonicContact OE2-NE 3.56Å; E170-R453 IonicContact OE2-NH2 2.71Å; E170-R453 PolarHBondContact OE2-NH2 2.75Å; E170-H454 IonicContact OE2-CD2 2.99Å; E170-H454 IonicContact OE2-CE1 2.69Å; E170-H454 PolarHBondContact OE2-CE1 2.95Å; E170-H454 IonicContact OE2-NE2 3.28Å; E170-H454 PolarHBondContact OE2-NE2 2.72Å; E170-I506 HydrophobicContact CG-CD1 3.82Å; E170-I506 WeakPolarHBondContact OE1-CD1 3.32Å
171	G	92.7	Very high	91.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.6	-36.6	175.6	0	0	0	0	0	112.8	T167 E168 V169 D174 L175	T167-G171 PolarHBondContact O-N 3.22Å; E168-G171 PolarHBondContact O-N 3.26Å; V169-G171 VanDerWaalsContact C-N 3.35Å; V169-G171 PolarHBondContact O-N 3.16Å; G171-D174 PolarHBondContact O-N 3.1Å; G171-L175 VanDerWaalsContact O-CB 3.31Å; G171-L175 WeakPolarHBondContact O-CB 3.46Å; G171-L175 PolarHBondContact O-N 3.38Å
172	L	91.9	Very high	91.2	Very high	17 Å²	17	31.3 Å²	31.3	9%	0.089	18%	0.176	C	C	.	.	H	α-helix	trans	-65.2	-43.1	173.3	178.1	62.5	0	0	0	111.6	F116 T155 L164 E168 V169 E170 L175 I176 M191 F510	F116-L172 HydrophobicContact CE2-CD2 4.14Å; F116-L172 HydrophobicContact CZ-CD2 3.87Å; T155-L172 HydrophobicContact CG2-CD2 3.99Å; L164-L172 HydrophobicContact CD1-CD2 4.4Å; E168-L172 WeakPolarHBondContact O-CB 3.42Å; E168-L172 PolarHBondContact O-N 3Å; V169-L172 WeakPolarHBondContact O-CB 3.36Å; V169-L172 PolarHBondContact O-N 3.38Å; E170-L172 VanDerWaalsContact C-N 3.3Å; E170-L172 PolarHBondContact O-N 3.27Å; L172-L175 PolarHBondContact O-N 3.48Å; L172-I176 HydrophobicContact CD1-CD1 4.32Å; L172-I176 HydrophobicContact CG-CD1 4.22Å; L172-I176 WeakPolarHBondContact O-CD1 3.48Å; L172-I176 VanDerWaalsContact O-CG1 3.31Å; L172-I176 WeakPolarHBondContact O-CG1 3.35Å; L172-I176 PolarHBondContact O-N 3.27Å; L172-I176 VanDerWaalsContact O-N 3.14Å; L172-M191 HydrophobicContact CB-CG 4.31Å; L172-M191 HydrophobicContact CD1-SD 3.96Å; L172-F510 HydrophobicContact CG-CE1 4.34Å
173	G	89.1	Confident	91.3	Very high	7 Å²	7	29.3 Å²	29.3	7%	0.072	15%	0.149	C	C	.	.	H	α-helix	trans	-59.5	-49.3	174.6	0	0	0	0	0	111.4	V169 E170 L175 I176 H177 F510	V169-G173 PolarHBondContact O-N 2.9Å; E170-G173 PolarHBondContact O-N 3.19Å; E170-G173 VanDerWaalsContact O-N 3.16Å; G173-L175 VanDerWaalsContact C-N 3.27Å; G173-L175 PolarHBondContact O-N 3.3Å; G173-I176 PolarHBondContact O-N 3.45Å; G173-H177 PolarHBondContact O-N 2.84Å; G173-H177 VanDerWaalsContact O-N 3.16Å; G173-H177 PolarHBondContact O-ND1 3.44Å; G173-F510 VanDerWaalsContact CA-CZ 3.43Å
174	D	90.6	Very high	91.4	Very high	17 Å²	17	30.1 Å²	30.1	9%	0.091	15%	0.15	C	C	.	.	H	α-helix	trans	-62.6	-34.1	178.4	-67.7	-10.7	0	0	0	112	E170 G171 H177 A178 A187 R258	E170-D174 WeakPolarHBondContact O-CB 3.3Å; E170-D174 VanDerWaalsContact O-CG 3.26Å; E170-D174 PolarHBondContact O-N 3.27Å; G171-D174 PolarHBondContact O-N 3.1Å; D174-H177 CarbonylContact O-C 3.5Å; D174-H177 PolarHBondContact O-N 2.97Å; D174-A178 WeakPolarHBondContact O-CA 3.45Å; D174-A178 WeakPolarHBondContact O-CB 3.46Å; D174-A178 PolarHBondContact O-N 3.19Å; D174-A187 HydrophobicContact CB-CB 3.86Å; D174-R258 IonicContact OD1-CZ 3.17Å; D174-R258 IonicContact OD1-NE 2.97Å; D174-R258 PolarHBondContact OD1-NE 2.93Å; D174-R258 IonicContact OD1-NH2 3.36Å; D174-R258 PolarHBondContact OD1-NH2 3.44Å; D174-R258 WeakPolarHBondContact OD2-CD 3.5Å; D174-R258 IonicContact OD2-NE 2.71Å; D174-R258 PolarHBondContact OD2-NE 2.93Å
175	L	91.6	Very high	91.5	Very high	45 Å²	45	33.3 Å²	33.3	24%	0.236	16%	0.16	C	C	.	.	H	α-helix	trans	-69.3	-37.1	177.9	-177.7	60	0	0	0	112.2	G171 L172 G173 H177 R184 A187 L188 M191	G171-L175 VanDerWaalsContact O-CB 3.31Å; G171-L175 WeakPolarHBondContact O-CB 3.46Å; G171-L175 PolarHBondContact O-N 3.38Å; L172-L175 PolarHBondContact O-N 3.48Å; G173-L175 VanDerWaalsContact C-N 3.27Å; G173-L175 PolarHBondContact O-N 3.3Å; L175-H177 VanDerWaalsContact C-N 3.31Å; L175-R184 HydrophobicContact CD1-CG 3.8Å; L175-A187 HydrophobicContact CB-CB 3.81Å; L175-A187 HydrophobicContact CD1-CB 4.24Å; L175-L188 HydrophobicContact CD1-CD1 4.5Å; L175-L188 HydrophobicContact CD1-CD2 4.13Å; L175-L188 HydrophobicContact CD1-CG 3.8Å; L175-L188 HydrophobicContact CD2-CD2 3.62Å; L175-L188 HydrophobicContact CD2-CG 4.2Å; L175-M191 HydrophobicContact CD2-SD 3.7Å
176	I	87.9	Confident	91.6	Very high	69 Å²	69	32.9 Å²	32.9	35%	0.354	16%	0.157	S	C	.	.	H	α-helix	trans	-67.8	-36.5	177.4	-68.4	162.2	0	0	0	110.6	L172 G173 F510 K514	L172-I176 HydrophobicContact CD1-CD1 4.32Å; L172-I176 HydrophobicContact CG-CD1 4.22Å; L172-I176 WeakPolarHBondContact O-CD1 3.48Å; L172-I176 VanDerWaalsContact O-CG1 3.31Å; L172-I176 WeakPolarHBondContact O-CG1 3.35Å; L172-I176 PolarHBondContact O-N 3.27Å; L172-I176 VanDerWaalsContact O-N 3.14Å; G173-I176 PolarHBondContact O-N 3.45Å; I176-F510 HydrophobicContact CD1-CD1 4.28Å; I176-F510 HydrophobicContact CD1-CE1 4.15Å; I176-K514 HydrophobicContact CD1-CD 3.56Å; I176-K514 HydrophobicContact CG1-CD 4.5Å
177	H	85.3	Confident	91.6	Very high	93 Å²	93	33 Å²	33	43%	0.431	16%	0.158	S	C	.	.	S	Bend	trans	-92.8	1	-178.6	-64.5	80.5	0	0	0	113.4	G173 D174 L175 E179	G173-H177 PolarHBondContact O-N 2.84Å; G173-H177 VanDerWaalsContact O-N 3.16Å; G173-H177 PolarHBondContact O-ND1 3.44Å; D174-H177 CarbonylContact O-C 3.5Å; D174-H177 PolarHBondContact O-N 2.97Å; L175-H177 VanDerWaalsContact C-N 3.31Å; H177-E179 PolarHBondContact O-N 3.16Å
178	A	89.8	Confident	91.7	Very high	29 Å²	29	36 Å²	36	24%	0.24	17%	0.174	C	C	.	.			trans	-64.9	122.9	-178.3	0	0	0	0	0	110.8	D174 Q183 R184	D174-A178 WeakPolarHBondContact O-CA 3.45Å; D174-A178 WeakPolarHBondContact O-CB 3.46Å; D174-A178 PolarHBondContact O-N 3.19Å; A178-Q183 HydrophobicContact CB-CB 3.85Å; A178-R184 HydrophobicContact CB-CB 4.18Å
179	E	88.4	Confident	91.6	Very high	67 Å²	67	36 Å²	36	31%	0.313	17%	0.172	S	C	.	.			trans	-105.2	-21	-176.2	-82.9	-168.3	152.5	0	0	112.3	H177 V288 S289	H177-E179 PolarHBondContact O-N 3.16Å; E179-V288 HydrophobicContact CB-CB 3.83Å; E179-V288 HydrophobicContact CB-CG1 3.49Å; E179-V288 VanDerWaalsContact CB-CG1 3.49Å; E179-V288 HydrophobicContact CB-CG2 4.08Å; E179-V288 VanDerWaalsContact CD-CB 3.44Å; E179-V288 HydrophobicContact CG-CB 3.88Å; E179-V288 HydrophobicContact CG-CG1 3.56Å; E179-V288 WeakPolarHBondContact OE2-CB 3.46Å; E179-S289 PolarHBondContact OE1-N 3.08Å
180	T	91.3	Very high	91.6	Very high	5 Å²	5	36.2 Å²	36.2	3%	0.031	17%	0.173	C	C	.	.	S	Bend	trans	-123.4	157.1	179.8	63.3	0	0	0	0	111.9	A182 Q183 R184 D304 G307 P309	T180-A182 VanDerWaalsContact C-N 3.28Å; T180-A182 PolarHBondContact O-N 3.38Å; T180-Q183 WeakPolarHBondContact O-CB 3.43Å; T180-Q183 PolarHBondContact O-N 2.93Å; T180-Q183 WeakPolarHBondContact OG1-CG 3.31Å; T180-Q183 PolarHBondContact OG1-N 3.44Å; T180-Q183 PolarHBondContact OG1-OE1 3.35Å; T180-R184 PolarHBondContact O-N 2.99Å; T180-D304 HydrophobicContact CG2-CB 3.85Å; T180-G307 WeakPolarHBondContact CB-O 3.2Å; T180-P309 HydrophobicContact CG2-CB 3.94Å; T180-P309 WeakPolarHBondContact OG1-CD 3.46Å
181	E	92.2	Very high	91.6	Very high	69 Å²	69	39.1 Å²	39.1	32%	0.322	19%	0.188	S	C	.	.	H	α-helix	trans	-61.3	-35.2	-179.4	173.3	60.4	-172.4	0	0	112.6	R184 R185	E181-R184 VanDerWaalsContact CD-NH2 3.26Å; E181-R184 PolarHBondContact O-N 3.38Å; E181-R184 IonicContact OE1-CZ 2.75Å; E181-R184 IonicContact OE1-NE 2.79Å; E181-R184 IonicContact OE1-NH2 2.63Å; E181-R184 PolarHBondContact OE1-NH2 3.42Å; E181-R184 IonicContact OE2-CZ 3.42Å; E181-R184 IonicContact OE2-NE 2.78Å; E181-R184 PolarHBondContact OE2-NE 3.25Å; E181-R184 IonicContact OE2-NH2 3.2Å; E181-R184 PolarHBondContact OE2-NH2 3.22Å; E181-R184 VanDerWaalsContact OE2-NH2 3.12Å; E181-R185 WeakPolarHBondContact O-CG 3.46Å; E181-R185 PolarHBondContact O-N 2.93Å; E181-R185 VanDerWaalsContact O-N 3.07Å; E181-R185 IonicContact OE1-CZ 3.31Å; E181-R185 VanDerWaalsContact OE1-CZ 3.23Å; E181-R185 IonicContact OE1-NE 3.03Å; E181-R185 PolarHBondContact OE1-NE 3.31Å; E181-R185 IonicContact OE1-NH2 3.92Å; E181-R185 PolarHBondContact OE1-NH2 3.17Å
182	A	93.3	Very high	91.5	Very high	6 Å²	6	41.5 Å²	41.5	5%	0.05	20%	0.204	C	C	.	.	H	α-helix	trans	-69.9	-39.5	176.6	0	0	0	0	0	112.1	T180 R185 Q186 L257 G307 F308 P442	T180-A182 VanDerWaalsContact C-N 3.28Å; T180-A182 PolarHBondContact O-N 3.38Å; A182-R185 PolarHBondContact O-N 3.18Å; A182-Q186 PolarHBondContact O-N 3.09Å; A182-L257 HydrophobicContact CB-CD1 3.52Å; A182-L257 HydrophobicContact CB-CD2 4.24Å; A182-G307 WeakPolarHBondContact CB-O 3.35Å; A182-G307 PolarHBondContact N-O 3.06Å; A182-F308 HydrophobicContact CB-CD1 3.87Å; A182-F308 HydrophobicContact CB-CE1 3.91Å; A182-F308 HydrophobicContact CB-CG 4.42Å; A182-F308 HydrophobicContact CB-CZ 4.49Å; A182-P442 HydrophobicContact CB-CG 4.18Å
183	Q	93.8	Very high	91.5	Very high	23 Å²	23	40.8 Å²	40.8	11%	0.107	20%	0.201	C	C	.	.	H	α-helix	trans	-58.9	-47.7	171.4	-81.1	169	-44.6	0	0	111.3	A178 T180 R185 Q186 A187 L257 R258 P309	A178-Q183 HydrophobicContact CB-CB 3.85Å; T180-Q183 WeakPolarHBondContact O-CB 3.43Å; T180-Q183 PolarHBondContact O-N 2.93Å; T180-Q183 WeakPolarHBondContact OG1-CG 3.31Å; T180-Q183 PolarHBondContact OG1-N 3.44Å; T180-Q183 PolarHBondContact OG1-OE1 3.35Å; Q183-R185 VanDerWaalsContact C-N 3.32Å; Q183-R185 PolarHBondContact O-N 2.83Å; Q183-Q186 PolarHBondContact O-N 2.77Å; Q183-A187 VanDerWaalsContact O-CB 3.32Å; Q183-A187 WeakPolarHBondContact O-CB 3.5Å; Q183-A187 PolarHBondContact O-N 3.22Å; Q183-L257 HydrophobicContact CG-CD1 4.48Å; Q183-L257 WeakPolarHBondContact CG-O 3.34Å; Q183-R258 PolarHBondContact NE2-O 2.83Å; Q183-P309 HydrophobicContact CG-CB 4.32Å; Q183-P309 HydrophobicContact CG-CG 3.78Å
184	R	94.6	Very high	91.7	Very high	97 Å²	97	43.3 Å²	43.3	37%	0.366	21%	0.211	S	C	.	.	H	α-helix	trans	-57.3	-44.8	178.8	-172.9	-166.4	67.3	79.3	0.8	111.7	L175 A178 T180 E181 L188	L175-R184 HydrophobicContact CD1-CG 3.8Å; A178-R184 HydrophobicContact CB-CB 4.18Å; T180-R184 PolarHBondContact O-N 2.99Å; E181-R184 VanDerWaalsContact CD-NH2 3.26Å; E181-R184 PolarHBondContact O-N 3.38Å; E181-R184 IonicContact OE1-CZ 2.75Å; E181-R184 IonicContact OE1-NE 2.79Å; E181-R184 IonicContact OE1-NH2 2.63Å; E181-R184 PolarHBondContact OE1-NH2 3.42Å; E181-R184 IonicContact OE2-CZ 3.42Å; E181-R184 IonicContact OE2-NE 2.78Å; E181-R184 PolarHBondContact OE2-NE 3.25Å; E181-R184 IonicContact OE2-NH2 3.2Å; E181-R184 PolarHBondContact OE2-NH2 3.22Å; E181-R184 VanDerWaalsContact OE2-NH2 3.12Å; R184-L188 HydrophobicContact CG-CD1 4.21Å; R184-L188 WeakPolarHBondContact O-CB 3.46Å; R184-L188 WeakPolarHBondContact O-CG 3.41Å; R184-L188 PolarHBondContact O-N 2.98Å
185	R	94.2	Very high	91.7	Very high	93 Å²	93	42.6 Å²	42.6	35%	0.351	21%	0.207	S	C	.	.	H	α-helix	trans	-63.6	-46.4	178	-73.5	173.6	-172.8	-179.1	8.9	112.3	E181 A182 Q183 L188 R189 P442 L443	E181-R185 WeakPolarHBondContact O-CG 3.46Å; E181-R185 PolarHBondContact O-N 2.93Å; E181-R185 VanDerWaalsContact O-N 3.07Å; E181-R185 IonicContact OE1-CZ 3.31Å; E181-R185 VanDerWaalsContact OE1-CZ 3.23Å; E181-R185 IonicContact OE1-NE 3.03Å; E181-R185 PolarHBondContact OE1-NE 3.31Å; E181-R185 IonicContact OE1-NH2 3.92Å; E181-R185 PolarHBondContact OE1-NH2 3.17Å; A182-R185 PolarHBondContact O-N 3.18Å; Q183-R185 VanDerWaalsContact C-N 3.32Å; Q183-R185 PolarHBondContact O-N 2.83Å; R185-L188 PolarHBondContact O-N 3.43Å; R185-R189 PolarHBondContact O-N 3.01Å; R185-P442 HydrophobicContact CB-CB 4.34Å; R185-P442 HydrophobicContact CB-CG 4.11Å; R185-L443 HydrophobicContact CB-CD2 4.12Å; R185-L443 HydrophobicContact CG-CD2 4.34Å
186	Q	93.9	Very high	91.8	Very high	10 Å²	10	40.5 Å²	40.5	5%	0.047	20%	0.196	C	C	.	.	H	α-helix	trans	-60.5	-50.2	177	178.2	174.8	-80.5	0	0	111.1	A182 Q183 L188 R189 Q190 G254 L257 P442 T450	A182-Q186 PolarHBondContact O-N 3.09Å; Q183-Q186 PolarHBondContact O-N 2.77Å; Q186-L188 VanDerWaalsContact C-N 3.31Å; Q186-L188 PolarHBondContact O-N 3.45Å; Q186-R189 PolarHBondContact O-N 3.16Å; Q186-Q190 PolarHBondContact O-N 2.96Å; Q186-G254 PolarHBondContact NE2-O 3.06Å; Q186-G254 PolarHBondContact OE1-O 2.85Å; Q186-L257 HydrophobicContact CB-CD2 4.02Å; Q186-L257 HydrophobicContact CB-CG 4.49Å; Q186-P442 HydrophobicContact CB-CB 4.1Å; Q186-T450 HydrophobicContact CG-CG2 3.95Å
187	A	93.3	Very high	92	Very high	2 Å²	2	44 Å²	44	2%	0.017	21%	0.205	C	C	.	.	H	α-helix	trans	-61.6	-38.6	-178.6	0	0	0	0	0	112.1	D174 L175 Q183 Q190 M191	D174-A187 HydrophobicContact CB-CB 3.86Å; L175-A187 HydrophobicContact CB-CB 3.81Å; L175-A187 HydrophobicContact CD1-CB 4.24Å; Q183-A187 VanDerWaalsContact O-CB 3.32Å; Q183-A187 WeakPolarHBondContact O-CB 3.5Å; Q183-A187 PolarHBondContact O-N 3.22Å; A187-Q190 PolarHBondContact O-N 3.42Å; A187-M191 VanDerWaalsContact O-CB 3.29Å; A187-M191 WeakPolarHBondContact O-CB 3.4Å; A187-M191 PolarHBondContact O-N 2.93Å
188	L	93.4	Very high	92.5	Very high	63 Å²	63	41.4 Å²	41.4	33%	0.33	19%	0.194	S	C	.	.	H	α-helix	trans	-64	-40.8	174.8	-80.8	169.7	0	0	0	113.5	L175 R184 R185 Q186 Q190 M191 S192	L175-L188 HydrophobicContact CD1-CD1 4.5Å; L175-L188 HydrophobicContact CD1-CD2 4.13Å; L175-L188 HydrophobicContact CD1-CG 3.8Å; L175-L188 HydrophobicContact CD2-CD2 3.62Å; L175-L188 HydrophobicContact CD2-CG 4.2Å; R184-L188 HydrophobicContact CG-CD1 4.21Å; R184-L188 WeakPolarHBondContact O-CB 3.46Å; R184-L188 WeakPolarHBondContact O-CG 3.41Å; R184-L188 PolarHBondContact O-N 2.98Å; R185-L188 PolarHBondContact O-N 3.43Å; Q186-L188 VanDerWaalsContact C-N 3.31Å; Q186-L188 PolarHBondContact O-N 3.45Å; L188-Q190 VanDerWaalsContact C-N 3.31Å; L188-M191 PolarHBondContact O-N 3.46Å; L188-S192 WeakPolarHBondContact O-CB 3.35Å; L188-S192 PolarHBondContact O-N 2.82Å
189	R	92.3	Very high	92.7	Very high	39 Å²	39	40.1 Å²	40.1	15%	0.147	18%	0.183	C	C	.	.	H	α-helix	trans	-64.9	-37.3	175.1	-72.5	-177	70	-173.4	1.8	111.8	R185 Q186 S192 E194 P442 G445	R185-R189 PolarHBondContact O-N 3.01Å; Q186-R189 PolarHBondContact O-N 3.16Å; R189-S192 PolarHBondContact O-OG 2.86Å; R189-E194 IonicContact CZ-OE2 3.28Å; R189-E194 IonicContact NE-OE1 2.9Å; R189-E194 PolarHBondContact NE-OE1 3.48Å; R189-E194 IonicContact NE-OE2 3.28Å; R189-E194 PolarHBondContact NE-OE2 3.3Å; R189-E194 IonicContact NH2-OE2 2.83Å; R189-E194 PolarHBondContact NH2-OE2 2.73Å; R189-E194 WeakPolarHBondContact O-CB 3.46Å; R189-E194 PolarHBondContact O-N 3.05Å; R189-P442 WeakPolarHBondContact CD-O 3.47Å; R189-P442 PolarHBondContact NH1-O 3.39Å; R189-G445 PolarHBondContact NH2-O 2.89Å
190	Q	92.3	Very high	93	Very high	6 Å²	6	40 Å²	40	3%	0.028	18%	0.182	C	C	.	.	H	α-helix	trans	-70	-45.6	176	-176	172.4	-19.6	0	0	111.4	T167 Q186 A187 L188 S192 G193 T450	T167-Q190 VanDerWaalsContact O-CG 3.28Å; T167-Q190 WeakPolarHBondContact O-CG 3.28Å; T167-Q190 PolarHBondContact O-NE2 3.48Å; Q186-Q190 PolarHBondContact O-N 2.96Å; A187-Q190 PolarHBondContact O-N 3.42Å; L188-Q190 VanDerWaalsContact C-N 3.31Å; Q190-S192 PolarHBondContact O-N 2.78Å; Q190-G193 PolarHBondContact O-N 3.47Å; Q190-T450 PolarHBondContact NE2-OG1 2.74Å; Q190-T450 PolarHBondContact OE1-OG1 2.76Å
191	M	92.1	Very high	93.2	Very high	65 Å²	65	44.7 Å²	44.7	32%	0.32	21%	0.207	S	C	.	.	H	α-helix	trans	-62.9	-28.3	176.6	-166.5	-162.7	89.8	0	0	112.5	L172 L175 A187 L188 G193	L172-M191 HydrophobicContact CB-CG 4.31Å; L172-M191 HydrophobicContact CD1-SD 3.96Å; L175-M191 HydrophobicContact CD2-SD 3.7Å; A187-M191 VanDerWaalsContact O-CB 3.29Å; A187-M191 WeakPolarHBondContact O-CB 3.4Å; A187-M191 PolarHBondContact O-N 2.93Å; L188-M191 PolarHBondContact O-N 3.46Å; M191-G193 PolarHBondContact O-N 3.34Å
192	S	90.9	Very high	93.4	Very high	49 Å²	49	41.8 Å²	41.8	34%	0.343	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-5.7	174.6	79.5	0	0	0	0	113.2	L188 R189 Q190 R197	L188-S192 WeakPolarHBondContact O-CB 3.35Å; L188-S192 PolarHBondContact O-N 2.82Å; R189-S192 PolarHBondContact O-OG 2.86Å; Q190-S192 PolarHBondContact O-N 2.78Å; S192-R197 PolarHBondContact O-NH2 2.98Å
193	G	92.1	Very high	93.5	Very high	3 Å²	3	42 Å²	42	3%	0.031	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.9	15.9	175.1	0	0	0	0	0	114.6	E168 Q190 M191 L195 G196 R197	E168-G193 WeakPolarHBondContact OE1-CA 3.12Å; Q190-G193 PolarHBondContact O-N 3.47Å; M191-G193 PolarHBondContact O-N 3.34Å; G193-L195 VanDerWaalsContact C-N 3.34Å; G193-L195 PolarHBondContact O-N 3.35Å; G193-G196 PolarHBondContact O-N 3.42Å; G193-R197 WeakPolarHBondContact O-CB 3.16Å; G193-R197 VanDerWaalsContact O-CG 3.27Å; G193-R197 WeakPolarHBondContact O-CG 3.49Å; G193-R197 PolarHBondContact O-N 3.2Å
194	E	92.7	Very high	93.6	Very high	59 Å²	59	47 Å²	47	28%	0.276	22%	0.218	S	C	.	.	H	α-helix	trans	-58.4	-45.1	178.2	-74.7	-179.4	-143.5	0	0	112.3	R189 R197 L198 P447	R189-E194 IonicContact CZ-OE2 3.28Å; R189-E194 IonicContact NE-OE1 2.9Å; R189-E194 PolarHBondContact NE-OE1 3.48Å; R189-E194 IonicContact NE-OE2 3.28Å; R189-E194 PolarHBondContact NE-OE2 3.3Å; R189-E194 IonicContact NH2-OE2 2.83Å; R189-E194 PolarHBondContact NH2-OE2 2.73Å; R189-E194 WeakPolarHBondContact O-CB 3.46Å; R189-E194 PolarHBondContact O-N 3.05Å; E194-R197 PolarHBondContact O-N 3.24Å; E194-L198 PolarHBondContact O-N 3.07Å; E194-L198 VanDerWaalsContact O-N 3.14Å; E194-P447 HydrophobicContact CB-CB 4.34Å
195	L	91.4	Very high	93.7	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-67.4	-43	178.5	-167.4	68.1	0	0	0	111.4	T167 G193 R197 L198 Y199 P447	T167-L195 HydrophobicContact CG2-CD2 4.41Å; G193-L195 VanDerWaalsContact C-N 3.34Å; G193-L195 PolarHBondContact O-N 3.35Å; L195-R197 PolarHBondContact O-N 3.02Å; L195-L198 WeakPolarHBondContact O-CB 2.99Å; L195-L198 PolarHBondContact O-N 2.76Å; L195-Y199 HydrophobicContact CD1-CE1 4.14Å; L195-Y199 HydrophobicContact CD1-CE2 3.94Å; L195-Y199 WeakPolarHBondContact CD1-OH 3.28Å; L195-Y199 HydrophobicContact CD2-CE2 3.86Å; L195-Y199 HydrophobicContact CG-CD2 4.21Å; L195-Y199 HydrophobicContact CG-CE2 3.48Å; L195-Y199 VanDerWaalsContact CG-CE2 3.48Å; L195-Y199 WeakPolarHBondContact O-CD2 3.41Å; L195-Y199 PolarHBondContact O-N 3.44Å; L195-Y199 VanDerWaalsContact O-N 3.14Å; L195-P447 HydrophobicContact CB-CB 4.3Å; L195-P447 HydrophobicContact CD1-CB 3.93Å; L195-P447 HydrophobicContact CD1-CG 4.02Å
196	G	92.3	Very high	93.8	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-56.5	-46.8	173.8	0	0	0	0	0	112.3	D165 T167 G193 L198 Y199 Q200	D165-G196 WeakPolarHBondContact OD2-CA 3.46Å; T167-G196 PolarHBondContact OG1-N 3.1Å; G193-G196 PolarHBondContact O-N 3.42Å; G196-L198 PolarHBondContact O-N 3.08Å; G196-Y199 PolarHBondContact O-N 3.32Å; G196-Q200 WeakPolarHBondContact O-CB 3.32Å; G196-Q200 WeakPolarHBondContact O-CG 3.48Å; G196-Q200 PolarHBondContact O-N 2.84Å
197	R	93.7	Very high	94	Very high	144 Å²	144	45.3 Å²	45.3	54%	0.543	21%	0.214	S	C	.	.	H	α-helix	trans	-61.4	-41.3	177.2	-71.3	175.9	-136.2	165.3	2.6	112.7	S192 G193 E194 L195 Q200 N201	S192-R197 PolarHBondContact O-NH2 2.98Å; G193-R197 WeakPolarHBondContact O-CB 3.16Å; G193-R197 VanDerWaalsContact O-CG 3.27Å; G193-R197 WeakPolarHBondContact O-CG 3.49Å; G193-R197 PolarHBondContact O-N 3.2Å; E194-R197 PolarHBondContact O-N 3.24Å; L195-R197 PolarHBondContact O-N 3.02Å; R197-Q200 PolarHBondContact O-N 3.48Å; R197-N201 VanDerWaalsContact O-CG 3.22Å; R197-N201 PolarHBondContact O-N 2.96Å; R197-N201 PolarHBondContact O-ND2 3.29Å
198	L	94.6	Very high	94.1	Very high	38 Å²	38	51.7 Å²	51.7	20%	0.199	24%	0.237	C	C	.	.	H	α-helix	trans	-57.2	-51.2	175.5	177.7	64.7	0	0	0	110.9	E194 L195 G196 Q200 N201 W202 P447	E194-L198 PolarHBondContact O-N 3.07Å; E194-L198 VanDerWaalsContact O-N 3.14Å; L195-L198 WeakPolarHBondContact O-CB 2.99Å; L195-L198 PolarHBondContact O-N 2.76Å; G196-L198 PolarHBondContact O-N 3.08Å; L198-Q200 VanDerWaalsContact C-N 3.34Å; L198-Q200 PolarHBondContact O-N 2.85Å; L198-N201 WeakPolarHBondContact O-CB 3.39Å; L198-N201 PolarHBondContact O-N 3.13Å; L198-W202 HydrophobicContact CD1-CH2 4.45Å; L198-W202 HydrophobicContact CD1-CZ2 3.85Å; L198-W202 HydrophobicContact CD2-CH2 3.93Å; L198-W202 HydrophobicContact CD2-CZ2 4.12Å; L198-W202 HydrophobicContact CD2-CZ3 4.47Å; L198-W202 HydrophobicContact CG-CD2 4.49Å; L198-W202 HydrophobicContact CG-CH2 4.11Å; L198-W202 HydrophobicContact CG-CZ2 3.99Å; L198-W202 HydrophobicContact CG-CZ3 4.43Å; L198-W202 PolarHBondContact O-N 2.88Å; L198-W202 VanDerWaalsContact O-N 3.17Å; L198-P447 HydrophobicContact CB-CG 4.39Å; L198-P447 HydrophobicContact CD2-CG 3.93Å
199	Y	95.1	Very high	94.2	Very high	1 Å²	1	48.8 Å²	48.8	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-69.1	-32.2	-179.5	-59.2	-26.6	0	0	0	113.1	T167 L195 G196 W202 S203 H247 L449 L458 I493 T494	T167-Y199 HydrophobicContact CG2-CD2 4.33Å; T167-Y199 HydrophobicContact CG2-CE2 4.32Å; L195-Y199 HydrophobicContact CD1-CE1 4.14Å; L195-Y199 HydrophobicContact CD1-CE2 3.94Å; L195-Y199 WeakPolarHBondContact CD1-OH 3.28Å; L195-Y199 HydrophobicContact CD2-CE2 3.86Å; L195-Y199 HydrophobicContact CG-CD2 4.21Å; L195-Y199 HydrophobicContact CG-CE2 3.48Å; L195-Y199 VanDerWaalsContact CG-CE2 3.48Å; L195-Y199 WeakPolarHBondContact O-CD2 3.41Å; L195-Y199 PolarHBondContact O-N 3.44Å; L195-Y199 VanDerWaalsContact O-N 3.14Å; G196-Y199 PolarHBondContact O-N 3.32Å; Y199-W202 AromaticContact CD1-CE3 3.62Å; Y199-W202 HydrophobicContact CD1-CE3 3.62Å; Y199-W202 HydrophobicContact CD1-CH2 4.49Å; Y199-W202 AromaticContact CD1-CZ3 3.52Å; Y199-W202 HydrophobicContact CD1-CZ3 3.52Å; Y199-W202 HydrophobicContact CE1-CE3 4.16Å; Y199-W202 HydrophobicContact CE1-CH2 4.35Å; Y199-W202 AromaticContact CE1-CZ3 3.56Å; Y199-W202 HydrophobicContact CE1-CZ3 3.56Å; Y199-W202 PolarHBondContact O-N 2.86Å; Y199-S203 VanDerWaalsContact O-CB 3.3Å; Y199-S203 WeakPolarHBondContact O-CB 3.02Å; Y199-S203 PolarHBondContact O-N 2.83Å; Y199-H247 AromaticContact CE1-NE2 3.93Å; Y199-L449 WeakPolarHBondContact OH-CD2 3.38Å; Y199-L458 HydrophobicContact CE1-CD1 4.23Å; Y199-L458 HydrophobicContact CE1-CD2 4.31Å; Y199-I493 HydrophobicContact CD2-CB 4.28Å; Y199-I493 HydrophobicContact CD2-CG2 3.54Å; Y199-I493 HydrophobicContact CE2-CB 4.37Å; Y199-I493 HydrophobicContact CE2-CG2 3.29Å; Y199-T494 HydrophobicContact CD2-CG2 4.35Å
200	Q	93.1	Very high	94.4	Very high	65 Å²	65	47.8 Å²	47.8	30%	0.304	22%	0.22	S	C	.	.	H	α-helix	trans	-65.9	-38.3	173.5	-72.8	177.7	26.8	0	0	111.8	G196 R197 L198 S203 H204	G196-Q200 WeakPolarHBondContact O-CB 3.32Å; G196-Q200 WeakPolarHBondContact O-CG 3.48Å; G196-Q200 PolarHBondContact O-N 2.84Å; R197-Q200 PolarHBondContact O-N 3.48Å; L198-Q200 VanDerWaalsContact C-N 3.34Å; L198-Q200 PolarHBondContact O-N 2.85Å; Q200-S203 PolarHBondContact O-N 2.8Å; Q200-H204 WeakPolarHBondContact O-CB 3.2Å; Q200-H204 PolarHBondContact O-N 2.92Å
201	N	95.8	Very high	94.5	Very high	103 Å²	103	50 Å²	50	55%	0.551	24%	0.24	S	C	*	.	H	α-helix	trans	-63	-45	174.5	-70.7	-21.5	0	0	0	111.6	R197 L198 H204 R205	R197-N201 VanDerWaalsContact O-CG 3.22Å; R197-N201 PolarHBondContact O-N 2.96Å; R197-N201 PolarHBondContact O-ND2 3.29Å; L198-N201 WeakPolarHBondContact O-CB 3.39Å; L198-N201 PolarHBondContact O-N 3.13Å; N201-H204 PolarHBondContact O-N 2.99Å; N201-R205 PolarHBondContact O-N 3.45Å; N201-R205 VanDerWaalsContact O-N 3.11Å
202	W	97.1	Very high	94.5	Very high	8 Å²	8	50.2 Å²	50.2	3%	0.03	24%	0.24	C	C	.	.	H	α-helix	trans	-63	-42.9	173.5	-66.6	-22.6	0	0	0	112.3	L198 Y199 H204 R205 L206 L240 E243 I244 H247 L458 L490	L198-W202 HydrophobicContact CD1-CH2 4.45Å; L198-W202 HydrophobicContact CD1-CZ2 3.85Å; L198-W202 HydrophobicContact CD2-CH2 3.93Å; L198-W202 HydrophobicContact CD2-CZ2 4.12Å; L198-W202 HydrophobicContact CD2-CZ3 4.47Å; L198-W202 HydrophobicContact CG-CD2 4.49Å; L198-W202 HydrophobicContact CG-CH2 4.11Å; L198-W202 HydrophobicContact CG-CZ2 3.99Å; L198-W202 HydrophobicContact CG-CZ3 4.43Å; L198-W202 PolarHBondContact O-N 2.88Å; L198-W202 VanDerWaalsContact O-N 3.17Å; Y199-W202 AromaticContact CD1-CE3 3.62Å; Y199-W202 HydrophobicContact CD1-CE3 3.62Å; Y199-W202 HydrophobicContact CD1-CH2 4.49Å; Y199-W202 AromaticContact CD1-CZ3 3.52Å; Y199-W202 HydrophobicContact CD1-CZ3 3.52Å; Y199-W202 HydrophobicContact CE1-CE3 4.16Å; Y199-W202 HydrophobicContact CE1-CH2 4.35Å; Y199-W202 AromaticContact CE1-CZ3 3.56Å; Y199-W202 HydrophobicContact CE1-CZ3 3.56Å; Y199-W202 PolarHBondContact O-N 2.86Å; W202-H204 VanDerWaalsContact C-N 3.32Å; W202-H204 PolarHBondContact O-N 3.47Å; W202-R205 PolarHBondContact O-N 3.01Å; W202-L206 PolarHBondContact O-N 3.44Å; W202-L240 HydrophobicContact CB-CD2 4.11Å; W202-L240 VanDerWaalsContact CD1-CD2 3.44Å; W202-L240 HydrophobicContact CG-CD2 3.94Å; W202-E243 HydrophobicContact CZ2-CB 4.35Å; W202-E243 PolarHBondContact NE1-OE2 3.19Å; W202-I244 HydrophobicContact CD2-CG1 4.07Å; W202-I244 HydrophobicContact CE3-CD1 4.41Å; W202-I244 HydrophobicContact CE3-CG1 3.85Å; W202-I244 HydrophobicContact CH2-CG1 4.05Å; W202-I244 HydrophobicContact CZ2-CG1 4.23Å; W202-I244 HydrophobicContact CZ3-CG1 3.84Å; W202-H247 HydrophobicContact CH2-CB 3.85Å; W202-H247 AromaticContact CH2-CD2 3.83Å; W202-H247 AromaticContact CH2-CG 3.82Å; W202-H247 HydrophobicContact CZ2-CB 4.46Å; W202-L458 HydrophobicContact CE3-CD2 4.37Å; W202-L458 HydrophobicContact CZ3-CD2 3.89Å; W202-L490 HydrophobicContact CB-CD1 3.75Å; W202-L490 HydrophobicContact CE3-CD2 4.26Å
203	S	96.1	Very high	94.6	Very high	11 Å²	11	47.9 Å²	47.9	8%	0.077	22%	0.223	C	C	.	.	H	α-helix	trans	-59.3	-41.6	175.6	179.8	0	0	0	0	112	Y199 Q200 L206 K207 L487	Y199-S203 VanDerWaalsContact O-CB 3.3Å; Y199-S203 WeakPolarHBondContact O-CB 3.02Å; Y199-S203 PolarHBondContact O-N 2.83Å; Q200-S203 PolarHBondContact O-N 2.8Å; S203-L206 PolarHBondContact O-N 3.1Å; S203-K207 WeakPolarHBondContact O-CG 3.38Å; S203-K207 PolarHBondContact O-N 2.99Å; S203-L487 WeakPolarHBondContact OG-CD1 3.46Å
204	H	96.2	Very high	94.6	Very high	128 Å²	128	50.6 Å²	50.6	59%	0.593	24%	0.235	S	C	*	.	H	α-helix	trans	-63.5	-43.2	176.7	-175.1	-78.3	0	0	0	111.8	Q200 N201 W202 K207 R208	Q200-H204 WeakPolarHBondContact O-CB 3.2Å; Q200-H204 PolarHBondContact O-N 2.92Å; N201-H204 PolarHBondContact O-N 2.99Å; W202-H204 VanDerWaalsContact C-N 3.32Å; W202-H204 PolarHBondContact O-N 3.47Å; H204-K207 PolarHBondContact O-N 3.27Å; H204-R208 PolarHBondContact O-N 3.27Å; H204-R208 VanDerWaalsContact O-N 3.08Å
205	R	96.7	Very high	94.5	Very high	57 Å²	57	49.7 Å²	49.7	22%	0.215	24%	0.237	C	C	.	.	H	α-helix	trans	-61.8	-47.6	175.7	-72.1	167.7	63.8	-178.5	1.9	111.3	N201 W202 K207 R208 T209 L240 E243	N201-R205 PolarHBondContact O-N 3.45Å; N201-R205 VanDerWaalsContact O-N 3.11Å; W202-R205 PolarHBondContact O-N 3.01Å; R205-K207 VanDerWaalsContact C-N 3.33Å; R205-K207 PolarHBondContact O-N 3.12Å; R205-R208 PolarHBondContact O-N 2.9Å; R205-R208 VanDerWaalsContact O-N 3.15Å; R205-T209 PolarHBondContact O-N 3.5Å; R205-T209 PolarHBondContact O-OG1 2.99Å; R205-L240 HydrophobicContact CB-CD1 3.77Å; R205-L240 HydrophobicContact CB-CD2 4.18Å; R205-L240 HydrophobicContact CB-CG 4.32Å; R205-E243 IonicContact CZ-OE1 2.79Å; R205-E243 VanDerWaalsContact CZ-OE1 3.28Å; R205-E243 IonicContact CZ-OE2 3.32Å; R205-E243 IonicContact NH1-OE1 3.56Å; R205-E243 PolarHBondContact NH1-OE1 2.95Å; R205-E243 IonicContact NH1-OE2 2.9Å; R205-E243 PolarHBondContact NH1-OE2 2.83Å; R205-E243 IonicContact NH2-OE1 2.74Å; R205-E243 PolarHBondContact NH2-OE1 3.48Å
206	L	96.3	Very high	94.4	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-60.8	-38.5	176.5	-70.8	-179.4	0	0	0	113.2	W202 S203 R208 T209 L210 L240 L465 V483 A486 L487 L490	W202-L206 PolarHBondContact O-N 3.44Å; S203-L206 PolarHBondContact O-N 3.1Å; L206-R208 VanDerWaalsContact C-N 3.34Å; L206-T209 WeakPolarHBondContact O-CB 3.46Å; L206-T209 PolarHBondContact O-N 3.49Å; L206-L210 VanDerWaalsContact O-CB 3.32Å; L206-L210 WeakPolarHBondContact O-CB 3.4Å; L206-L210 PolarHBondContact O-N 3.25Å; L206-L240 HydrophobicContact CD2-CD1 3.5Å; L206-L240 VanDerWaalsContact CD2-CD1 3.5Å; L206-L240 HydrophobicContact CG-CD1 3.84Å; L206-L465 HydrophobicContact CD2-CD2 3.68Å; L206-V483 HydrophobicContact CB-CG1 4.47Å; L206-V483 HydrophobicContact CD2-CG1 4.28Å; L206-A486 HydrophobicContact CD1-CB 3.92Å; L206-L487 HydrophobicContact CB-CD1 4.37Å; L206-L490 HydrophobicContact CD1-CD1 3.65Å; L206-L490 HydrophobicContact CD1-CG 4.47Å
207	K	96.4	Very high	94.3	Very high	107 Å²	107	55.4 Å²	55.4	47%	0.465	27%	0.265	S	S	.	.	H	α-helix	trans	-62.7	-41.9	175.1	-76.3	177.1	-177.1	-171	0	111.9	S203 H204 R205 L210 A211 L487	S203-K207 WeakPolarHBondContact O-CG 3.38Å; S203-K207 PolarHBondContact O-N 2.99Å; H204-K207 PolarHBondContact O-N 3.27Å; R205-K207 VanDerWaalsContact C-N 3.33Å; R205-K207 PolarHBondContact O-N 3.12Å; K207-L210 PolarHBondContact O-N 2.89Å; K207-A211 WeakPolarHBondContact O-CB 3.41Å; K207-A211 PolarHBondContact O-N 3.17Å; K207-L487 HydrophobicContact CG-CD1 3.92Å; K207-L487 HydrophobicContact CG-CD2 3.69Å; K207-L487 HydrophobicContact CG-CG 4.49Å
208	R	96.1	Very high	93.9	Very high	135 Å²	135	54.1 Å²	54.1	51%	0.509	27%	0.268	S	S	.	.	H	α-helix	trans	-65	-46.3	176.3	-173.4	177.9	67.5	171.5	5.1	111.1	H204 R205 L206 L210 A211 H212	H204-R208 PolarHBondContact O-N 3.27Å; H204-R208 VanDerWaalsContact O-N 3.08Å; R205-R208 PolarHBondContact O-N 2.9Å; R205-R208 VanDerWaalsContact O-N 3.15Å; L206-R208 VanDerWaalsContact C-N 3.34Å; R208-L210 VanDerWaalsContact C-N 3.33Å; R208-L210 PolarHBondContact O-N 2.58Å; R208-A211 PolarHBondContact O-N 2.9Å; R208-H212 WeakPolarHBondContact CG-NE2 3.29Å; R208-H212 PolarHBondContact O-CD2 3Å; R208-H212 PolarHBondContact O-N 3.17Å
209	T	95.1	Very high	93.4	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.012	28%	0.278	C	S	.	.	H	α-helix	trans	-54.1	-49.2	173.2	-60.9	0	0	0	0	111.1	R205 L206 H212 V213 V233 V237 V483	R205-T209 PolarHBondContact O-N 3.5Å; R205-T209 PolarHBondContact O-OG1 2.99Å; L206-T209 WeakPolarHBondContact O-CB 3.46Å; L206-T209 PolarHBondContact O-N 3.49Å; T209-H212 PolarHBondContact O-N 2.95Å; T209-V213 WeakPolarHBondContact O-CG2 3.23Å; T209-V213 PolarHBondContact O-N 3.35Å; T209-V213 VanDerWaalsContact O-N 3.12Å; T209-V233 HydrophobicContact CG2-CB 4.41Å; T209-V233 HydrophobicContact CG2-CG1 3.39Å; T209-V237 HydrophobicContact CG2-CG2 3.52Å; T209-V483 HydrophobicContact CG2-CG1 4.19Å; T209-V483 HydrophobicContact CG2-CG2 4.27Å
210	L	96.1	Very high	92.4	Very high	19 Å²	19	59.2 Å²	59.2	10%	0.099	30%	0.296	C	S	.	.	H	α-helix	trans	-61.4	-46.3	178.7	-178.5	62	0	0	0	111.8	L206 K207 R208 H212 V213 E214 A480 V483 R484 L487	L206-L210 VanDerWaalsContact O-CB 3.32Å; L206-L210 WeakPolarHBondContact O-CB 3.4Å; L206-L210 PolarHBondContact O-N 3.25Å; K207-L210 PolarHBondContact O-N 2.89Å; R208-L210 VanDerWaalsContact C-N 3.33Å; R208-L210 PolarHBondContact O-N 2.58Å; L210-H212 VanDerWaalsContact C-N 3.29Å; L210-H212 PolarHBondContact O-N 3.48Å; L210-V213 PolarHBondContact O-N 3.48Å; L210-E214 HydrophobicContact CD1-CG 3.99Å; L210-E214 HydrophobicContact CG-CG 4.24Å; L210-E214 WeakPolarHBondContact O-CB 3.4Å; L210-E214 WeakPolarHBondContact O-CG 3.4Å; L210-E214 PolarHBondContact O-N 2.91Å; L210-A480 HydrophobicContact CD1-CB 4.28Å; L210-V483 HydrophobicContact CB-CG1 3.82Å; L210-V483 HydrophobicContact CD1-CB 4.23Å; L210-V483 HydrophobicContact CD1-CG1 4.38Å; L210-R484 HydrophobicContact CD1-CG 3.73Å; L210-R484 HydrophobicContact CD2-CG 3.72Å; L210-R484 HydrophobicContact CG-CG 4.4Å; L210-L487 HydrophobicContact CD2-CD2 4.47Å
211	A	94.1	Very high	91.2	Very high	53 Å²	53	65 Å²	65	44%	0.438	32%	0.323	S	S	.	.	H	α-helix	trans	-59.8	-39.1	179	0	0	0	0	0	112.3	K207 R208 A215	K207-A211 WeakPolarHBondContact O-CB 3.41Å; K207-A211 PolarHBondContact O-N 3.17Å; R208-A211 PolarHBondContact O-N 2.9Å; A211-A215 WeakPolarHBondContact O-CB 3.26Å; A211-A215 PolarHBondContact O-N 3.43Å
212	H	93.3	Very high	89.6	Confident	69 Å²	69	67.4 Å²	67.4	32%	0.319	34%	0.336	S	S	.	.	H	α-helix	trans	-67.6	-40.3	176	-72.3	-53.2	0	0	0	112.8	R208 T209 L210 F216 V229 V233	R208-H212 WeakPolarHBondContact CG-NE2 3.29Å; R208-H212 PolarHBondContact O-CD2 3Å; R208-H212 PolarHBondContact O-N 3.17Å; T209-H212 PolarHBondContact O-N 2.95Å; L210-H212 VanDerWaalsContact C-N 3.29Å; L210-H212 PolarHBondContact O-N 3.48Å; H212-F216 WeakPolarHBondContact O-CB 3.44Å; H212-F216 PolarHBondContact O-N 2.91Å; H212-V229 HydrophobicContact CB-CG1 3.81Å; H212-V233 HydrophobicContact CB-CG2 3.54Å
213	V	93	Very high	87.9	Confident	0 Å²	0	73 Å²	73	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-67.2	-45.5	176.5	178.5	0	0	0	0	110.7	T209 L210 F216 I217 L230 V233 Y468 A480	T209-V213 WeakPolarHBondContact O-CG2 3.23Å; T209-V213 PolarHBondContact O-N 3.35Å; T209-V213 VanDerWaalsContact O-N 3.12Å; L210-V213 PolarHBondContact O-N 3.48Å; V213-F216 PolarHBondContact O-N 3.01Å; V213-I217 HydrophobicContact CG1-CD1 3.99Å; V213-I217 WeakPolarHBondContact O-CG1 3.47Å; V213-I217 PolarHBondContact O-N 2.84Å; V213-L230 HydrophobicContact CG2-CD2 4.5Å; V213-V233 HydrophobicContact CG2-CB 4.41Å; V213-V233 HydrophobicContact CG2-CG1 3.43Å; V213-V233 VanDerWaalsContact CG2-CG1 3.43Å; V213-V233 HydrophobicContact CG2-CG2 4.25Å; V213-Y468 HydrophobicContact CG2-CE2 3.98Å; V213-A480 HydrophobicContact CG1-CB 3.77Å
214	E	91.9	Very high	86.3	Confident	60 Å²	60	81.1 Å²	81.1	28%	0.28	40%	0.404	S	S	.	.	H	α-helix	trans	-63	-45.1	178.3	-72.7	-178.4	162.6	0	0	111.3	L210 F216 I217 D218 R484	L210-E214 HydrophobicContact CD1-CG 3.99Å; L210-E214 HydrophobicContact CG-CG 4.24Å; L210-E214 WeakPolarHBondContact O-CB 3.4Å; L210-E214 WeakPolarHBondContact O-CG 3.4Å; L210-E214 PolarHBondContact O-N 2.91Å; E214-F216 VanDerWaalsContact C-N 3.28Å; E214-F216 PolarHBondContact O-N 3.47Å; E214-I217 PolarHBondContact O-N 3.32Å; E214-I217 VanDerWaalsContact O-N 3.12Å; E214-D218 PolarHBondContact O-N 2.87Å; E214-R484 IonicContact OE1-CZ 2.88Å; E214-R484 VanDerWaalsContact OE1-CZ 3.31Å; E214-R484 IonicContact OE1-NE 3.35Å; E214-R484 PolarHBondContact OE1-NE 3.03Å; E214-R484 IonicContact OE1-NH2 2.95Å; E214-R484 PolarHBondContact OE1-NH2 3.43Å
215	A	90	Very high	84.9	Confident	39 Å²	39	77.4 Å²	77.4	32%	0.322	39%	0.388	S	S	.	.	H	α-helix	trans	-60.4	-38.3	174.9	0	0	0	0	0	112.4	A211 D218 F219	A211-A215 WeakPolarHBondContact O-CB 3.26Å; A211-A215 PolarHBondContact O-N 3.43Å; A215-D218 PolarHBondContact O-N 3.23Å; A215-F219 HydrophobicContact CB-CD2 4.32Å; A215-F219 WeakPolarHBondContact O-CB 3.5Å; A215-F219 WeakPolarHBondContact O-CD2 3.41Å; A215-F219 PolarHBondContact O-N 3.46Å
216	F	89.9	Confident	83.6	Confident	60 Å²	60	81.8 Å²	81.8	26%	0.263	41%	0.411	S	S	.	.	H	α-helix	trans	-65.3	-39.8	175.3	-168.3	-83.2	0	0	0	112.3	H212 V213 E214 S220 I225 L230 L476	H212-F216 WeakPolarHBondContact O-CB 3.44Å; H212-F216 PolarHBondContact O-N 2.91Å; V213-F216 PolarHBondContact O-N 3.01Å; E214-F216 VanDerWaalsContact C-N 3.28Å; E214-F216 PolarHBondContact O-N 3.47Å; F216-S220 WeakPolarHBondContact O-CB 3.4Å; F216-S220 PolarHBondContact O-N 3.43Å; F216-S220 PolarHBondContact O-OG 2.9Å; F216-I225 HydrophobicContact CB-CD1 4.42Å; F216-I225 HydrophobicContact CD2-CD1 4.04Å; F216-I225 HydrophobicContact CD2-CG2 4.21Å; F216-I225 HydrophobicContact CG-CD1 4.44Å; F216-L230 HydrophobicContact CB-CD2 4.02Å; F216-L230 HydrophobicContact CD1-CD1 3.8Å; F216-L230 HydrophobicContact CD1-CD2 4.33Å; F216-L230 HydrophobicContact CD1-CG 4.32Å; F216-L230 HydrophobicContact CD2-CD1 4.05Å; F216-L230 HydrophobicContact CD2-CD2 4.3Å; F216-L230 HydrophobicContact CD2-CG 3.91Å; F216-L230 HydrophobicContact CE1-CD1 3.7Å; F216-L230 HydrophobicContact CE2-CD1 3.96Å; F216-L230 HydrophobicContact CE2-CG 4.17Å; F216-L230 HydrophobicContact CG-CD1 3.98Å; F216-L230 HydrophobicContact CG-CD2 3.95Å; F216-L230 HydrophobicContact CG-CG 3.99Å; F216-L230 HydrophobicContact CZ-CD1 3.78Å; F216-L230 HydrophobicContact CZ-CG 4.49Å; F216-L476 HydrophobicContact CD1-CD1 3.61Å; F216-L476 HydrophobicContact CE1-CD1 3.78Å
217	I	88.9	Confident	82.5	Confident	64 Å²	64	91.1 Å²	91.1	33%	0.328	45%	0.454	S	S	.	.	H	α-helix	trans	-64.6	-44.5	176.5	-67.2	164.4	0	0	0	110.8	V213 E214 L476 A480	V213-I217 HydrophobicContact CG1-CD1 3.99Å; V213-I217 WeakPolarHBondContact O-CG1 3.47Å; V213-I217 PolarHBondContact O-N 2.84Å; E214-I217 PolarHBondContact O-N 3.32Å; E214-I217 VanDerWaalsContact O-N 3.12Å; I217-L476 HydrophobicContact CD1-CB 4.1Å; I217-L476 HydrophobicContact CG1-CB 3.92Å; I217-A480 HydrophobicContact CD1-CB 4.14Å
218	D	87.1	Confident	81.9	Confident	116 Å²	116	87.4 Å²	87.4	62%	0.62	45%	0.447	S	S	*	.	H	α-helix	trans	-81.4	-27.7	-171.1	-68.7	-21.2	0	0	0	113.6	E214 A215	E214-D218 PolarHBondContact O-N 2.87Å; A215-D218 PolarHBondContact O-N 3.23Å
219	F	83.4	Confident	81.5	Confident	93 Å²	93	81.7 Å²	81.7	41%	0.408	43%	0.427	S	S	.	.	H	α-helix	trans	-126.9	3.1	-168.1	-55.4	-73.1	0	0	0	115.6	A215 E221 D222 E223 I225	A215-F219 HydrophobicContact CB-CD2 4.32Å; A215-F219 WeakPolarHBondContact O-CB 3.5Å; A215-F219 WeakPolarHBondContact O-CD2 3.41Å; A215-F219 PolarHBondContact O-N 3.46Å; F219-E221 PolarHBondContact O-N 3.37Å; F219-D222 PolarHBondContact O-N 2.96Å; F219-E223 HydrophobicContact CB-CB 4.3Å; F219-E223 HydrophobicContact CB-CG 4.36Å; F219-E223 PolarHBondContact O-N 3.35Å; F219-I225 HydrophobicContact CB-CD1 4.29Å
220	S	74.4	Confident	81.3	Confident	54 Å²	54	82.3 Å²	82.3	38%	0.378	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-19.2	-175.3	50	0	0	0	0	115.3	F216	F216-S220 WeakPolarHBondContact O-CB 3.4Å; F216-S220 PolarHBondContact O-N 3.43Å; F216-S220 PolarHBondContact O-OG 2.9Å
221	E	67	Low	81.1	Confident	186 Å²	186	86 Å²	86	87%	0.869	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-25.6	179.5	-62.4	-172.4	172.8	0	0	113.3	F219	F219-E221 PolarHBondContact O-N 3.37Å
222	D	62.9	Low	81	Confident	154 Å²	154	88.8 Å²	88.8	82%	0.824	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	-19.8	-168.8	-73	-38	0	0	0	114.6	F219	F219-D222 PolarHBondContact O-N 2.96Å
223	E	60.8	Low	81	Confident	124 Å²	124	85.6 Å²	85.6	58%	0.579	44%	0.439	S	S	*	.	S	Bend	trans	-119.9	148.7	-178.2	-66	-169.4	164.4	0	0	113.3	F219 I225	F219-E223 HydrophobicContact CB-CB 4.3Å; F219-E223 HydrophobicContact CB-CG 4.36Å; F219-E223 PolarHBondContact O-N 3.35Å; E223-I225 PolarHBondContact O-N 2.9Å
224	L	62.6	Low	81.1	Confident	183 Å²	183	87.7 Å²	87.7	96%	0.958	45%	0.45	S	S	*	.			trans	-70.6	75	169.9	-72.3	163.7	0	0	0	109.8	E226	L224-E226 PolarHBondContact O-N 3.37Å
225	I	66.9	Low	81.3	Confident	49 Å²	49	89.8 Å²	89.8	25%	0.251	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-64.2	133.3	169.6	-54.7	-173.8	0	0	0	108.3	F216 F219 E223 E227 V229	F216-I225 HydrophobicContact CB-CD1 4.42Å; F216-I225 HydrophobicContact CD2-CD1 4.04Å; F216-I225 HydrophobicContact CD2-CG2 4.21Å; F216-I225 HydrophobicContact CG-CD1 4.44Å; F219-I225 HydrophobicContact CB-CD1 4.29Å; E223-I225 PolarHBondContact O-N 2.9Å; I225-E227 PolarHBondContact O-N 3.4Å; I225-V229 HydrophobicContact CG2-CB 4.33Å; I225-V229 HydrophobicContact CG2-CG2 4.02Å
226	E	70.1	Confident	81.6	Confident	149 Å²	149	88.5 Å²	88.5	70%	0.696	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-52.7	132.1	176	-80	-176.8	161.1	0	0	111.2	L224 G228 V229	L224-E226 PolarHBondContact O-N 3.37Å; E226-G228 PolarHBondContact O-N 2.93Å; E226-V229 HydrophobicContact CB-CG2 3.93Å; E226-V229 VanDerWaalsContact O-CG2 3.23Å; E226-V229 WeakPolarHBondContact O-CG2 3.47Å; E226-V229 PolarHBondContact O-N 3.47Å
227	E	72.4	Confident	81.9	Confident	197 Å²	197	85.6 Å²	85.6	92%	0.921	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	135.4	174.4	-73.1	-175.9	167.8	0	0	110.4	I225	I225-E227 PolarHBondContact O-N 3.4Å
228	G	82.9	Confident	82.2	Confident	30 Å²	30	84.8 Å²	84.8	31%	0.309	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	6.2	176.8	0	0	0	0	0	115.8	E226 L230 D231 Q232	E226-G228 PolarHBondContact O-N 2.93Å; G228-L230 VanDerWaalsContact C-N 3.29Å; G228-L230 PolarHBondContact O-N 3.33Å; G228-D231 WeakPolarHBondContact O-CB 3.29Å; G228-D231 PolarHBondContact O-N 3.05Å; G228-D231 VanDerWaalsContact O-N 3.1Å; G228-Q232 WeakPolarHBondContact O-CG 3.39Å; G228-Q232 PolarHBondContact O-N 3.24Å
229	V	88.3	Confident	82.7	Confident	14 Å²	14	83 Å²	83	9%	0.085	43%	0.428	C	S	.	.	H	α-helix	trans	-54.3	-45.2	174.5	166.9	0	0	0	0	111.6	H212 I225 E226 D231 Q232 V233	H212-V229 HydrophobicContact CB-CG1 3.81Å; I225-V229 HydrophobicContact CG2-CB 4.33Å; I225-V229 HydrophobicContact CG2-CG2 4.02Å; E226-V229 HydrophobicContact CB-CG2 3.93Å; E226-V229 VanDerWaalsContact O-CG2 3.23Å; E226-V229 WeakPolarHBondContact O-CG2 3.47Å; E226-V229 PolarHBondContact O-N 3.47Å; V229-D231 VanDerWaalsContact C-N 3.32Å; V229-D231 PolarHBondContact O-N 3.38Å; V229-Q232 WeakPolarHBondContact O-CB 3.36Å; V229-Q232 PolarHBondContact O-N 3.43Å; V229-V233 WeakPolarHBondContact O-CG2 3.4Å; V229-V233 PolarHBondContact O-N 3.08Å; V229-V233 VanDerWaalsContact O-N 3.08Å
230	L	90.3	Very high	83.4	Confident	16 Å²	16	78.6 Å²	78.6	8%	0.084	41%	0.409	C	S	.	.	H	α-helix	trans	-68.7	-30.3	178.9	-63.8	179.5	0	0	0	113	V213 F216 G228 Q232 V233 D234 L476	V213-L230 HydrophobicContact CG2-CD2 4.5Å; F216-L230 HydrophobicContact CB-CD2 4.02Å; F216-L230 HydrophobicContact CD1-CD1 3.8Å; F216-L230 HydrophobicContact CD1-CD2 4.33Å; F216-L230 HydrophobicContact CD1-CG 4.32Å; F216-L230 HydrophobicContact CD2-CD1 4.05Å; F216-L230 HydrophobicContact CD2-CD2 4.3Å; F216-L230 HydrophobicContact CD2-CG 3.91Å; F216-L230 HydrophobicContact CE1-CD1 3.7Å; F216-L230 HydrophobicContact CE2-CD1 3.96Å; F216-L230 HydrophobicContact CE2-CG 4.17Å; F216-L230 HydrophobicContact CG-CD1 3.98Å; F216-L230 HydrophobicContact CG-CD2 3.95Å; F216-L230 HydrophobicContact CG-CG 3.99Å; F216-L230 HydrophobicContact CZ-CD1 3.78Å; F216-L230 HydrophobicContact CZ-CG 4.49Å; G228-L230 VanDerWaalsContact C-N 3.29Å; G228-L230 PolarHBondContact O-N 3.33Å; L230-Q232 VanDerWaalsContact C-N 3.33Å; L230-V233 WeakPolarHBondContact O-CB 3.17Å; L230-V233 PolarHBondContact O-N 3.05Å; L230-D234 PolarHBondContact O-N 2.95Å; L230-D234 VanDerWaalsContact O-OD2 3.14Å; L230-L476 HydrophobicContact CD1-CD1 4.12Å; L230-L476 HydrophobicContact CD1-CD2 4.32Å
231	D	92	Very high	84.4	Confident	96 Å²	96	76.9 Å²	76.9	51%	0.513	40%	0.395	S	S	.	.	H	α-helix	trans	-67.4	-37.5	174.6	-59.5	-36.2	0	0	0	110.8	G228 V229 V233 D234 I235	G228-D231 WeakPolarHBondContact O-CB 3.29Å; G228-D231 PolarHBondContact O-N 3.05Å; G228-D231 VanDerWaalsContact O-N 3.1Å; V229-D231 VanDerWaalsContact C-N 3.32Å; V229-D231 PolarHBondContact O-N 3.38Å; D231-V233 VanDerWaalsContact C-N 3.32Å; D231-V233 PolarHBondContact O-N 3.38Å; D231-D234 PolarHBondContact O-N 3.33Å; D231-I235 WeakPolarHBondContact O-CG1 3.42Å; D231-I235 PolarHBondContact O-N 3.04Å
232	Q	91.9	Very high	85.9	Confident	112 Å²	112	70.8 Å²	70.8	52%	0.523	37%	0.371	S	S	.	.	H	α-helix	trans	-64.1	-38.6	172.8	-64	177.4	21.3	0	0	111.9	G228 V229 L230 S236	G228-Q232 WeakPolarHBondContact O-CG 3.39Å; G228-Q232 PolarHBondContact O-N 3.24Å; V229-Q232 WeakPolarHBondContact O-CB 3.36Å; V229-Q232 PolarHBondContact O-N 3.43Å; L230-Q232 VanDerWaalsContact C-N 3.33Å; Q232-S236 WeakPolarHBondContact O-CB 3.45Å; Q232-S236 PolarHBondContact O-N 3.37Å
233	V	94.5	Very high	87.4	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.012	35%	0.346	C	S	.	.	H	α-helix	trans	-62.2	-45.5	173.6	174.1	0	0	0	0	110	T209 H212 V213 V229 L230 D231 I235 S236 V237 Y468	T209-V233 HydrophobicContact CG2-CB 4.41Å; T209-V233 HydrophobicContact CG2-CG1 3.39Å; H212-V233 HydrophobicContact CB-CG2 3.54Å; V213-V233 HydrophobicContact CG2-CB 4.41Å; V213-V233 HydrophobicContact CG2-CG1 3.43Å; V213-V233 VanDerWaalsContact CG2-CG1 3.43Å; V213-V233 HydrophobicContact CG2-CG2 4.25Å; V229-V233 WeakPolarHBondContact O-CG2 3.4Å; V229-V233 PolarHBondContact O-N 3.08Å; V229-V233 VanDerWaalsContact O-N 3.08Å; L230-V233 WeakPolarHBondContact O-CB 3.17Å; L230-V233 PolarHBondContact O-N 3.05Å; D231-V233 VanDerWaalsContact C-N 3.32Å; D231-V233 PolarHBondContact O-N 3.38Å; V233-I235 PolarHBondContact O-N 2.93Å; V233-S236 PolarHBondContact O-N 3.05Å; V233-S236 VanDerWaalsContact O-N 3.17Å; V233-V237 WeakPolarHBondContact O-CG2 3.3Å; V233-V237 PolarHBondContact O-N 2.92Å; V233-Y468 HydrophobicContact CG1-CE2 3.95Å; V233-Y468 WeakPolarHBondContact CG1-OH 3.38Å
234	D	95.4	Very high	89.1	Confident	43 Å²	43	60.7 Å²	60.7	23%	0.23	32%	0.318	C	S	.	.	H	α-helix	trans	-60.5	-45.2	179.4	-67.1	-29.9	0	0	0	112.2	L230 D231 V237 C238 Y468 R472	L230-D234 PolarHBondContact O-N 2.95Å; L230-D234 VanDerWaalsContact O-OD2 3.14Å; D231-D234 PolarHBondContact O-N 3.33Å; D234-V237 PolarHBondContact O-N 2.87Å; D234-C238 WeakPolarHBondContact O-CB 3.49Å; D234-C238 PolarHBondContact O-N 3.12Å; D234-Y468 WeakPolarHBondContact OD1-CE1 3.24Å; D234-Y468 VanDerWaalsContact OD1-CZ 3.28Å; D234-Y468 PolarHBondContact OD1-OH 3.35Å; D234-R472 VanDerWaalsContact OD1-CD 3.27Å; D234-R472 WeakPolarHBondContact OD1-CD 3.48Å; D234-R472 WeakPolarHBondContact OD1-CG 3.38Å; D234-R472 IonicContact OD1-NE 2.78Å; D234-R472 PolarHBondContact OD1-NE 3.14Å; D234-R472 IonicContact OD2-CZ 3.65Å; D234-R472 VanDerWaalsContact OD2-CZ 3.32Å; D234-R472 IonicContact OD2-NE 3.98Å; D234-R472 PolarHBondContact OD2-NE 2.9Å; D234-R472 IonicContact OD2-NH2 3.68Å; D234-R472 PolarHBondContact OD2-NH2 3.13Å
235	I	95.5	Very high	90.7	Very high	104 Å²	104	55 Å²	55	53%	0.533	29%	0.287	S	S	.	.	H	α-helix	trans	-59.3	-49.5	173.5	-66.8	163.9	0	0	0	109.9	D231 V233 V237 C238 D239	D231-I235 WeakPolarHBondContact O-CG1 3.42Å; D231-I235 PolarHBondContact O-N 3.04Å; V233-I235 PolarHBondContact O-N 2.93Å; I235-V237 VanDerWaalsContact C-N 3.33Å; I235-V237 PolarHBondContact O-N 2.69Å; I235-C238 PolarHBondContact O-N 3.02Å; I235-C238 VanDerWaalsContact O-N 3.17Å; I235-D239 VanDerWaalsContact O-CG 3.31Å; I235-D239 PolarHBondContact O-N 3.35Å
236	S	95.8	Very high	92	Very high	12 Å²	12	58.7 Å²	58.7	8%	0.084	30%	0.303	C	S	.	.	H	α-helix	trans	-62.6	-39.1	-176.5	-159.7	0	0	0	0	113	Q232 V233 L240	Q232-S236 WeakPolarHBondContact O-CB 3.45Å; Q232-S236 PolarHBondContact O-N 3.37Å; V233-S236 PolarHBondContact O-N 3.05Å; V233-S236 VanDerWaalsContact O-N 3.17Å; S236-L240 WeakPolarHBondContact O-CB 3.43Å; S236-L240 WeakPolarHBondContact O-CG 3.4Å; S236-L240 PolarHBondContact O-N 3.37Å
237	V	96.4	Very high	93.2	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-66.4	-44.3	175	170.2	0	0	0	0	111	T209 V233 D234 I235 L240 Q241 L465 Y468 R469	T209-V237 HydrophobicContact CG2-CG2 3.52Å; V233-V237 WeakPolarHBondContact O-CG2 3.3Å; V233-V237 PolarHBondContact O-N 2.92Å; D234-V237 PolarHBondContact O-N 2.87Å; I235-V237 VanDerWaalsContact C-N 3.33Å; I235-V237 PolarHBondContact O-N 2.69Å; V237-L240 PolarHBondContact O-N 3.3Å; V237-Q241 VanDerWaalsContact O-CB 3.29Å; V237-Q241 WeakPolarHBondContact O-CB 3.33Å; V237-Q241 PolarHBondContact O-N 3.01Å; V237-L465 HydrophobicContact CG1-CB 4.14Å; V237-L465 HydrophobicContact CG1-CD2 4.12Å; V237-Y468 HydrophobicContact CB-CD1 4.06Å; V237-Y468 HydrophobicContact CB-CE1 4.09Å; V237-Y468 HydrophobicContact CG1-CD1 3.7Å; V237-Y468 HydrophobicContact CG1-CE1 4.22Å; V237-Y468 HydrophobicContact CG1-CG 4.42Å; V237-Y468 HydrophobicContact CG2-CD1 3.88Å; V237-Y468 HydrophobicContact CG2-CE1 3.86Å; V237-Y468 HydrophobicContact CG2-CG 4.35Å; V237-R469 HydrophobicContact CG1-CG 4.43Å
238	C	96.4	Very high	94.2	Very high	47 Å²	47	44.6 Å²	44.6	32%	0.318	24%	0.238	S	C	.	.	H	α-helix	trans	-62.5	-44.2	179.1	-169.9	0	0	0	0	112	D234 I235 Q241 T242	D234-C238 WeakPolarHBondContact O-CB 3.49Å; D234-C238 PolarHBondContact O-N 3.12Å; I235-C238 PolarHBondContact O-N 3.02Å; I235-C238 VanDerWaalsContact O-N 3.17Å; C238-Q241 PolarHBondContact O-N 3.04Å; C238-T242 WeakPolarHBondContact O-CB 3.48Å; C238-T242 PolarHBondContact O-N 2.88Å; C238-T242 PolarHBondContact O-OG1 2.84Å
239	D	96.9	Very high	94.6	Very high	78 Å²	78	50.7 Å²	50.7	42%	0.417	26%	0.256	S	S	.	.	H	α-helix	trans	-63	-48.4	177.3	-69.7	-15.6	0	0	0	111.1	I235 Q241 T242 E243	I235-D239 VanDerWaalsContact O-CG 3.31Å; I235-D239 PolarHBondContact O-N 3.35Å; D239-Q241 PolarHBondContact O-N 3.31Å; D239-T242 PolarHBondContact O-N 3.18Å; D239-E243 WeakPolarHBondContact O-CG 3.44Å; D239-E243 PolarHBondContact O-N 3.08Å
240	L	96.9	Very high	94.6	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-44.3	177.7	-82.7	175.6	0	0	0	112.3	W202 R205 L206 S236 V237 T242 E243 I244 L465	W202-L240 HydrophobicContact CB-CD2 4.11Å; W202-L240 VanDerWaalsContact CD1-CD2 3.44Å; W202-L240 HydrophobicContact CG-CD2 3.94Å; R205-L240 HydrophobicContact CB-CD1 3.77Å; R205-L240 HydrophobicContact CB-CD2 4.18Å; R205-L240 HydrophobicContact CB-CG 4.32Å; L206-L240 HydrophobicContact CD2-CD1 3.5Å; L206-L240 VanDerWaalsContact CD2-CD1 3.5Å; L206-L240 HydrophobicContact CG-CD1 3.84Å; S236-L240 WeakPolarHBondContact O-CB 3.43Å; S236-L240 WeakPolarHBondContact O-CG 3.4Å; S236-L240 PolarHBondContact O-N 3.37Å; V237-L240 PolarHBondContact O-N 3.3Å; L240-T242 VanDerWaalsContact C-N 3.28Å; L240-T242 PolarHBondContact O-N 2.88Å; L240-E243 PolarHBondContact O-N 3.02Å; L240-I244 VanDerWaalsContact O-CG1 3.23Å; L240-I244 WeakPolarHBondContact O-CG1 3.49Å; L240-I244 PolarHBondContact O-N 2.79Å; L240-L465 HydrophobicContact CB-CD1 4.41Å
241	Q	97	Very high	94.4	Very high	19 Å²	19	56.2 Å²	56.2	9%	0.089	28%	0.281	C	S	.	.	H	α-helix	trans	-58.4	-45.9	177.2	-175.2	-176.3	-12.1	0	0	110.1	V237 C238 D239 I244 E245 V462 L465	V237-Q241 VanDerWaalsContact O-CB 3.29Å; V237-Q241 WeakPolarHBondContact O-CB 3.33Å; V237-Q241 PolarHBondContact O-N 3.01Å; C238-Q241 PolarHBondContact O-N 3.04Å; D239-Q241 PolarHBondContact O-N 3.31Å; Q241-I244 PolarHBondContact O-N 2.92Å; Q241-E245 HydrophobicContact CG-CG 4.47Å; Q241-E245 WeakPolarHBondContact CG-OE1 3.47Å; Q241-E245 PolarHBondContact NE2-OE1 2.92Å; Q241-E245 WeakPolarHBondContact O-CB 3.43Å; Q241-E245 VanDerWaalsContact O-CG 3.27Å; Q241-E245 WeakPolarHBondContact O-CG 3.5Å; Q241-E245 PolarHBondContact O-N 3.17Å; Q241-V462 HydrophobicContact CG-CG1 4.23Å; Q241-L465 HydrophobicContact CB-CB 4.45Å; Q241-L465 HydrophobicContact CB-CD1 4.06Å
242	T	96.8	Very high	94.2	Very high	58 Å²	58	57.7 Å²	57.7	36%	0.356	28%	0.279	S	S	.	.	H	α-helix	trans	-63.2	-44.5	179.2	-55.9	0	0	0	0	111.9	C238 D239 L240 E245 Q246	C238-T242 WeakPolarHBondContact O-CB 3.48Å; C238-T242 PolarHBondContact O-N 2.88Å; C238-T242 PolarHBondContact O-OG1 2.84Å; D239-T242 PolarHBondContact O-N 3.18Å; L240-T242 VanDerWaalsContact C-N 3.28Å; L240-T242 PolarHBondContact O-N 2.88Å; T242-E245 PolarHBondContact O-N 3.36Å; T242-Q246 WeakPolarHBondContact O-CB 3.35Å; T242-Q246 VanDerWaalsContact O-CG 3.26Å; T242-Q246 WeakPolarHBondContact O-CG 3.43Å; T242-Q246 PolarHBondContact O-N 3.43Å
243	E	96.3	Very high	94.2	Very high	65 Å²	65	57 Å²	57	30%	0.304	27%	0.272	S	S	.	.	H	α-helix	trans	-60.7	-45.2	176.5	-75.1	172.2	-138.3	0	0	112.1	W202 R205 D239 L240 Q246 H247	W202-E243 HydrophobicContact CZ2-CB 4.35Å; W202-E243 PolarHBondContact NE1-OE2 3.19Å; R205-E243 IonicContact CZ-OE1 2.79Å; R205-E243 VanDerWaalsContact CZ-OE1 3.28Å; R205-E243 IonicContact CZ-OE2 3.32Å; R205-E243 IonicContact NH1-OE1 3.56Å; R205-E243 PolarHBondContact NH1-OE1 2.95Å; R205-E243 IonicContact NH1-OE2 2.9Å; R205-E243 PolarHBondContact NH1-OE2 2.83Å; R205-E243 IonicContact NH2-OE1 2.74Å; R205-E243 PolarHBondContact NH2-OE1 3.48Å; D239-E243 WeakPolarHBondContact O-CG 3.44Å; D239-E243 PolarHBondContact O-N 3.08Å; L240-E243 PolarHBondContact O-N 3.02Å; E243-Q246 PolarHBondContact O-N 3.3Å; E243-H247 WeakPolarHBondContact O-CB 3.29Å; E243-H247 PolarHBondContact O-N 3.47Å
244	I	96.2	Very high	94	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.9	-42.3	179.3	-64.6	166.3	0	0	0	110.4	W202 L240 Q241 Q246 H247 L248 L458 V462 L465	W202-I244 HydrophobicContact CD2-CG1 4.07Å; W202-I244 HydrophobicContact CE3-CD1 4.41Å; W202-I244 HydrophobicContact CE3-CG1 3.85Å; W202-I244 HydrophobicContact CH2-CG1 4.05Å; W202-I244 HydrophobicContact CZ2-CG1 4.23Å; W202-I244 HydrophobicContact CZ3-CG1 3.84Å; L240-I244 VanDerWaalsContact O-CG1 3.23Å; L240-I244 WeakPolarHBondContact O-CG1 3.49Å; L240-I244 PolarHBondContact O-N 2.79Å; Q241-I244 PolarHBondContact O-N 2.92Å; I244-Q246 VanDerWaalsContact C-N 3.33Å; I244-Q246 PolarHBondContact O-N 3.49Å; I244-H247 PolarHBondContact O-N 2.97Å; I244-L248 HydrophobicContact CG2-CD1 4.12Å; I244-L248 HydrophobicContact CG2-CG 4.47Å; I244-L248 WeakPolarHBondContact O-CB 3.37Å; I244-L248 WeakPolarHBondContact O-CG 3.25Å; I244-L248 PolarHBondContact O-N 2.89Å; I244-L458 HydrophobicContact CG2-CB 4.04Å; I244-L458 HydrophobicContact CG2-CD2 4.03Å; I244-L458 HydrophobicContact CG2-CG 4.46Å; I244-V462 HydrophobicContact CB-CG2 4.07Å; I244-V462 HydrophobicContact CG2-CG2 3.52Å; I244-L465 HydrophobicContact CD1-CD1 4.19Å
245	E	95.9	Very high	93.9	Very high	64 Å²	64	55.5 Å²	55.5	30%	0.299	26%	0.264	S	S	.	.	H	α-helix	trans	-63.1	-38.1	175.8	-76.3	175.8	-174.6	0	0	112.3	Q241 T242 L248 K249 V462	Q241-E245 HydrophobicContact CG-CG 4.47Å; Q241-E245 WeakPolarHBondContact CG-OE1 3.47Å; Q241-E245 PolarHBondContact NE2-OE1 2.92Å; Q241-E245 WeakPolarHBondContact O-CB 3.43Å; Q241-E245 VanDerWaalsContact O-CG 3.27Å; Q241-E245 WeakPolarHBondContact O-CG 3.5Å; Q241-E245 PolarHBondContact O-N 3.17Å; T242-E245 PolarHBondContact O-N 3.36Å; E245-L248 PolarHBondContact O-N 2.85Å; E245-K249 WeakPolarHBondContact O-CG 3.33Å; E245-K249 PolarHBondContact O-N 3.22Å; E245-V462 HydrophobicContact CG-CG1 3.94Å; E245-V462 HydrophobicContact CG-CG2 3.97Å; E245-V462 WeakPolarHBondContact OE1-CG1 3.46Å
246	Q	94.3	Very high	93.7	Very high	126 Å²	126	52 Å²	52	59%	0.589	24%	0.244	S	C	*	.	H	α-helix	trans	-65.4	-43	173.1	-74.9	174.5	6.7	0	0	111.4	T242 E243 I244 L248 K249	T242-Q246 WeakPolarHBondContact O-CB 3.35Å; T242-Q246 VanDerWaalsContact O-CG 3.26Å; T242-Q246 WeakPolarHBondContact O-CG 3.43Å; T242-Q246 PolarHBondContact O-N 3.43Å; E243-Q246 PolarHBondContact O-N 3.3Å; I244-Q246 VanDerWaalsContact C-N 3.33Å; I244-Q246 PolarHBondContact O-N 3.49Å; Q246-L248 VanDerWaalsContact C-N 3.31Å; Q246-L248 PolarHBondContact O-N 3.46Å; Q246-K249 WeakPolarHBondContact O-CB 3.26Å; Q246-K249 PolarHBondContact O-N 3.32Å; Q246-K249 VanDerWaalsContact O-N 3.08Å
247	H	94.4	Very high	93.6	Very high	23 Å²	23	51.4 Å²	51.4	11%	0.106	24%	0.24	C	C	.	.	H	α-helix	trans	-65.6	-32.7	176.8	-174.5	76.8	0	0	0	112.8	Y199 W202 E243 I244 K249 P447 L449	Y199-H247 AromaticContact CE1-NE2 3.93Å; W202-H247 HydrophobicContact CH2-CB 3.85Å; W202-H247 AromaticContact CH2-CD2 3.83Å; W202-H247 AromaticContact CH2-CG 3.82Å; W202-H247 HydrophobicContact CZ2-CB 4.46Å; E243-H247 WeakPolarHBondContact O-CB 3.29Å; E243-H247 PolarHBondContact O-N 3.47Å; I244-H247 PolarHBondContact O-N 2.97Å; H247-K249 VanDerWaalsContact C-N 3.26Å; H247-K249 PolarHBondContact O-N 3.35Å; H247-P447 PolarHBondContact CE1-O 2.94Å; H247-L449 VanDerWaalsContact NE2-CD2 3.35Å; H247-L449 WeakPolarHBondContact NE2-CD2 3.4Å
248	L	93.5	Very high	93.4	Very high	27 Å²	27	55.9 Å²	55.9	14%	0.141	26%	0.256	C	S	.	.	H	α-helix	trans	-68.9	-20.5	172.1	-78	169.2	0	0	0	113.4	I244 E245 Q246 D250 L449 R455 L458 Q459 V462	I244-L248 HydrophobicContact CG2-CD1 4.12Å; I244-L248 HydrophobicContact CG2-CG 4.47Å; I244-L248 WeakPolarHBondContact O-CB 3.37Å; I244-L248 WeakPolarHBondContact O-CG 3.25Å; I244-L248 PolarHBondContact O-N 2.89Å; E245-L248 PolarHBondContact O-N 2.85Å; Q246-L248 VanDerWaalsContact C-N 3.31Å; Q246-L248 PolarHBondContact O-N 3.46Å; L248-D250 PolarHBondContact O-N 3.28Å; L248-L449 HydrophobicContact CD2-CD1 4.12Å; L248-R455 HydrophobicContact CD2-CB 4.42Å; L248-R455 HydrophobicContact CD2-CG 3.69Å; L248-R455 PolarHBondContact O-NH1 2.83Å; L248-L458 HydrophobicContact CD1-CB 4.26Å; L248-L458 HydrophobicContact CD2-CB 3.84Å; L248-L458 HydrophobicContact CD2-CD1 4.38Å; L248-L458 HydrophobicContact CG-CB 4.16Å; L248-Q459 HydrophobicContact CD1-CG 4.14Å; L248-Q459 HydrophobicContact CD2-CG 4.09Å; L248-V462 HydrophobicContact CD1-CG2 3.99Å
249	K	91.4	Very high	93	Very high	158 Å²	158	56.2 Å²	56.2	69%	0.687	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	33.8	176.9	-70.1	170.4	-175.9	174.9	0	112.5	E245 Q246 H247 E251	E245-K249 WeakPolarHBondContact O-CG 3.33Å; E245-K249 PolarHBondContact O-N 3.22Å; Q246-K249 WeakPolarHBondContact O-CB 3.26Å; Q246-K249 PolarHBondContact O-N 3.32Å; Q246-K249 VanDerWaalsContact O-N 3.08Å; H247-K249 VanDerWaalsContact C-N 3.26Å; H247-K249 PolarHBondContact O-N 3.35Å; K249-E251 PolarHBondContact O-N 3.02Å
250	D	87.9	Confident	92.7	Very high	21 Å²	21	52.6 Å²	52.6	11%	0.112	24%	0.24	C	C	.	.	S	Bend	trans	-80.1	6	178.5	74.6	-27.7	0	0	0	114.1	L248 R252 R253 L449 R455	L248-D250 PolarHBondContact O-N 3.28Å; D250-R252 PolarHBondContact O-N 2.97Å; D250-R252 PolarHBondContact OD1-N 2.96Å; D250-R252 VanDerWaalsContact OD1-N 3.12Å; D250-R253 VanDerWaalsContact O-CB 3.29Å; D250-R253 WeakPolarHBondContact O-CB 3.45Å; D250-R253 WeakPolarHBondContact O-CD 3.48Å; D250-R253 WeakPolarHBondContact O-CG 3.49Å; D250-R253 PolarHBondContact O-N 3.41Å; D250-L449 WeakPolarHBondContact OD2-CB 3.42Å; D250-R455 IonicContact OD1-CZ 2.73Å; D250-R455 VanDerWaalsContact OD1-CZ 3.28Å; D250-R455 IonicContact OD1-NH1 3.59Å; D250-R455 PolarHBondContact OD1-NH1 2.94Å; D250-R455 IonicContact OD1-NH2 3.99Å; D250-R455 PolarHBondContact OD1-NH2 3.47Å; D250-R455 IonicContact OD2-NH2 2.76Å; D250-R455 PolarHBondContact OD2-NH2 3.39Å
251	E	86.4	Confident	92.5	Very high	126 Å²	126	52.6 Å²	52.6	59%	0.589	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	53	26	-177.1	-59.4	178.4	173.8	0	0	114	K249 R253 R256	K249-E251 PolarHBondContact O-N 3.02Å; E251-R253 PolarHBondContact O-N 2.88Å; E251-R256 VanDerWaalsContact O-CZ 3.28Å; E251-R256 PolarHBondContact O-NH1 2.86Å; E251-R256 PolarHBondContact O-NH2 3.08Å
252	R	88.7	Confident	92.2	Very high	127 Å²	127	54.4 Å²	54.4	48%	0.479	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	24.6	-176	-50.3	178.1	65.4	-156.4	-6.9	114	D250 G254 E255 R256	D250-R252 PolarHBondContact O-N 2.97Å; D250-R252 PolarHBondContact OD1-N 2.96Å; D250-R252 VanDerWaalsContact OD1-N 3.12Å; R252-G254 PolarHBondContact O-N 3.42Å; R252-E255 HydrophobicContact CB-CB 4.36Å; R252-E255 IonicContact CZ-OE2 2.76Å; R252-E255 IonicContact NE-OE2 2.79Å; R252-E255 PolarHBondContact NE-OE2 3.4Å; R252-E255 IonicContact NH2-OE2 2.89Å; R252-E255 PolarHBondContact NH2-OE2 3Å; R252-E255 PolarHBondContact O-N 3.4Å; R252-R256 WeakPolarHBondContact O-CG 3.2Å; R252-R256 PolarHBondContact O-N 3.02Å
253	R	91.3	Very high	91.9	Very high	96 Å²	96	51.7 Å²	51.7	36%	0.362	23%	0.232	S	C	.	.	H	α-helix	trans	-54.5	-48.6	-179.4	-81.6	171	166.9	-162.7	-4	113.3	D250 E251 R256 L257 M438 C439	D250-R253 VanDerWaalsContact O-CB 3.29Å; D250-R253 WeakPolarHBondContact O-CB 3.45Å; D250-R253 WeakPolarHBondContact O-CD 3.48Å; D250-R253 WeakPolarHBondContact O-CG 3.49Å; D250-R253 PolarHBondContact O-N 3.41Å; E251-R253 PolarHBondContact O-N 2.88Å; R253-R256 PolarHBondContact O-N 3.09Å; R253-L257 WeakPolarHBondContact O-CB 3.5Å; R253-L257 PolarHBondContact O-N 3.22Å; R253-M438 VanDerWaalsContact CG-O 3.3Å; R253-M438 WeakPolarHBondContact CG-O 3.39Å; R253-C439 WeakPolarHBondContact CB-O 3.45Å
254	G	91.4	Very high	91.6	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-69.7	-37.7	-178.3	0	0	0	0	0	113.3	Q186 R252 L257 R258 L449	Q186-G254 PolarHBondContact NE2-O 3.06Å; Q186-G254 PolarHBondContact OE1-O 2.85Å; R252-G254 PolarHBondContact O-N 3.42Å; G254-L257 PolarHBondContact O-N 3.03Å; G254-R258 WeakPolarHBondContact O-CB 3.13Å; G254-R258 PolarHBondContact O-N 3.47Å; G254-L449 CarbonylContact C-O 3.59Å; G254-L449 WeakPolarHBondContact CA-O 3.32Å
255	E	91.9	Very high	91.3	Very high	15 Å²	15	48.8 Å²	48.8	7%	0.07	22%	0.219	C	C	.	.	H	α-helix	trans	-61.6	-49.5	173.8	-69.3	168.4	-154.6	0	0	110.7	R252 L257 R258 S259 L449 R455	R252-E255 HydrophobicContact CB-CB 4.36Å; R252-E255 IonicContact CZ-OE2 2.76Å; R252-E255 IonicContact NE-OE2 2.79Å; R252-E255 PolarHBondContact NE-OE2 3.4Å; R252-E255 IonicContact NH2-OE2 2.89Å; R252-E255 PolarHBondContact NH2-OE2 3Å; R252-E255 PolarHBondContact O-N 3.4Å; E255-L257 PolarHBondContact O-N 2.9Å; E255-R258 WeakPolarHBondContact O-CB 3.25Å; E255-R258 PolarHBondContact O-N 3.13Å; E255-R258 VanDerWaalsContact O-N 3.13Å; E255-S259 PolarHBondContact O-N 2.87Å; E255-S259 PolarHBondContact O-OG 3.41Å; E255-L449 PolarHBondContact N-O 2.88Å; E255-R455 IonicContact OE1-CZ 3.37Å; E255-R455 IonicContact OE1-NE 3.88Å; E255-R455 PolarHBondContact OE1-NE 2.55Å; E255-R455 IonicContact OE1-NH2 3.07Å; E255-R455 PolarHBondContact OE1-NH2 3.19Å
256	R	92.3	Very high	90.9	Very high	30 Å²	30	46 Å²	46	11%	0.113	21%	0.206	C	C	.	.	H	α-helix	trans	-61.1	-43.2	176.8	-73.3	-173.6	-169.4	115.9	9.6	112.4	E251 R252 R253 R258 G260 V261 D341 M438	E251-R256 VanDerWaalsContact O-CZ 3.28Å; E251-R256 PolarHBondContact O-NH1 2.86Å; E251-R256 PolarHBondContact O-NH2 3.08Å; R252-R256 WeakPolarHBondContact O-CG 3.2Å; R252-R256 PolarHBondContact O-N 3.02Å; R253-R256 PolarHBondContact O-N 3.09Å; R256-R258 PolarHBondContact O-N 2.94Å; R256-G260 CarbonylContact O-C 3.56Å; R256-G260 VanDerWaalsContact O-CA 3.26Å; R256-G260 WeakPolarHBondContact O-CA 3.23Å; R256-G260 PolarHBondContact O-N 3.13Å; R256-V261 HydrophobicContact CB-CG2 4.37Å; R256-D341 IonicContact CZ-OD1 2.76Å; R256-D341 IonicContact NE-OD1 3.17Å; R256-D341 PolarHBondContact NE-OD1 2.91Å; R256-D341 IonicContact NE-OD2 3.41Å; R256-D341 IonicContact NH2-OD1 3.4Å; R256-M438 PolarHBondContact NH1-O 3.24Å
257	L	93.2	Very high	90.4	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.7	-31.9	177.3	179.7	54.1	0	0	0	111.5	A182 Q183 Q186 R253 G254 E255 F308 P309 C439 P442	A182-L257 HydrophobicContact CB-CD1 3.52Å; A182-L257 HydrophobicContact CB-CD2 4.24Å; Q183-L257 HydrophobicContact CG-CD1 4.48Å; Q183-L257 WeakPolarHBondContact CG-O 3.34Å; Q186-L257 HydrophobicContact CB-CD2 4.02Å; Q186-L257 HydrophobicContact CB-CG 4.49Å; R253-L257 WeakPolarHBondContact O-CB 3.5Å; R253-L257 PolarHBondContact O-N 3.22Å; G254-L257 PolarHBondContact O-N 3.03Å; E255-L257 PolarHBondContact O-N 2.9Å; L257-F308 HydrophobicContact CD1-CD1 4.09Å; L257-P309 HydrophobicContact CD1-CG 4.11Å; L257-P309 VanDerWaalsContact O-CG 3.24Å; L257-P309 WeakPolarHBondContact O-CG 3.44Å; L257-C439 HydrophobicContact CB-CB 4.07Å; L257-C439 HydrophobicContact CD1-CB 4.29Å; L257-P442 HydrophobicContact CD2-CB 3.65Å; L257-P442 HydrophobicContact CD2-CG 3.97Å
258	R	91.4	Very high	89.7	Confident	93 Å²	93	42 Å²	42	35%	0.351	20%	0.2	S	C	.	.	H	α-helix	trans	-71.5	-56.8	175.6	-176.4	-171.3	178.7	-90	-10.7	111.7	D174 Q183 G254 E255 R256 T450	D174-R258 IonicContact OD1-CZ 3.17Å; D174-R258 IonicContact OD1-NE 2.97Å; D174-R258 PolarHBondContact OD1-NE 2.93Å; D174-R258 IonicContact OD1-NH2 3.36Å; D174-R258 PolarHBondContact OD1-NH2 3.44Å; D174-R258 WeakPolarHBondContact OD2-CD 3.5Å; D174-R258 IonicContact OD2-NE 2.71Å; D174-R258 PolarHBondContact OD2-NE 2.93Å; Q183-R258 PolarHBondContact NE2-O 2.83Å; G254-R258 WeakPolarHBondContact O-CB 3.13Å; G254-R258 PolarHBondContact O-N 3.47Å; E255-R258 WeakPolarHBondContact O-CB 3.25Å; E255-R258 PolarHBondContact O-N 3.13Å; E255-R258 VanDerWaalsContact O-N 3.13Å; R256-R258 PolarHBondContact O-N 2.94Å; R258-T450 WeakPolarHBondContact CD-O 3.15Å
259	S	88.6	Confident	88.9	Confident	55 Å²	55	44 Å²	44	39%	0.385	21%	0.213	S	C	.	.	H	α-helix	trans	-80.5	-19.8	-172	60.7	0	0	0	0	114.1	E255 L311	E255-S259 PolarHBondContact O-N 2.87Å; E255-S259 PolarHBondContact O-OG 3.41Å; S259-L311 WeakPolarHBondContact O-CD1 3.01Å
260	G	91.7	Very high	88.4	Confident	1 Å²	1	43 Å²	43	1%	0.01	22%	0.215	C	C	.	.			trans	100.2	143	-166.2	0	0	0	0	0	111.6	R256 H262 P309	R256-G260 CarbonylContact O-C 3.56Å; R256-G260 VanDerWaalsContact O-CA 3.26Å; R256-G260 WeakPolarHBondContact O-CA 3.23Å; R256-G260 PolarHBondContact O-N 3.13Å; G260-H262 PolarHBondContact O-N 3.34Å; G260-P309 WeakPolarHBondContact CA-O 3.04Å
261	V	92.1	Very high	88.4	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	120.5	170.7	178.8	0	0	0	0	108.1	R256 V263 P309 V310 L311 D341 V435 M438 C439	R256-V261 HydrophobicContact CB-CG2 4.37Å; V261-V263 HydrophobicContact CG1-CG2 4.08Å; V261-V263 PolarHBondContact O-N 3.29Å; V261-P309 PolarHBondContact N-O 3.46Å; V261-V310 HydrophobicContact CB-CG2 4.49Å; V261-V310 WeakPolarHBondContact O-CA 3.15Å; V261-L311 PolarHBondContact O-N 2.98Å; V261-D341 HydrophobicContact CG1-CB 3.7Å; V261-V435 HydrophobicContact CB-CG1 4.41Å; V261-V435 HydrophobicContact CG2-CG1 3.9Å; V261-M438 HydrophobicContact CG1-SD 3.86Å; V261-C439 WeakPolarHBondContact CG2-SG 3.16Å
262	H	91.1	Very high	88.4	Confident	58 Å²	58	36.5 Å²	36.5	27%	0.269	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	110.6	178.8	-71	-90.4	0	0	0	109.9	G260 L311 D341 L342	G260-H262 PolarHBondContact O-N 3.34Å; H262-L311 VanDerWaalsContact CE1-CD1 3.46Å; H262-L311 WeakPolarHBondContact CE1-CD1 3.43Å; H262-D341 IonicContact CD2-OD2 3.81Å; H262-D341 PolarHBondContact N-OD2 3.06Å; H262-D341 VanDerWaalsContact N-OD2 3.08Å; H262-D341 PolarHBondContact O-N 3.35Å; H262-L342 PolarHBondContact O-N 3.1Å; H262-L342 VanDerWaalsContact O-N 3.16Å
263	V	91.1	Very high	88.3	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	123.5	-179.4	-177.9	0	0	0	0	109.3	V261 V310 L311 L312 S313 L342 L344	V261-V263 HydrophobicContact CG1-CG2 4.08Å; V261-V263 PolarHBondContact O-N 3.29Å; V263-V310 HydrophobicContact CB-CG1 3.88Å; V263-V310 HydrophobicContact CG2-CG1 3.49Å; V263-V310 VanDerWaalsContact CG2-CG1 3.49Å; V263-V310 HydrophobicContact CG2-CG2 4.41Å; V263-L311 PolarHBondContact N-O 3.32Å; V263-L312 HydrophobicContact CB-CD1 3.97Å; V263-L312 HydrophobicContact CG1-CD1 3.72Å; V263-L312 WeakPolarHBondContact O-CA 3.43Å; V263-S313 PolarHBondContact O-N 3.27Å; V263-L342 VanDerWaalsContact CA-O 3.31Å; V263-L342 WeakPolarHBondContact CA-O 3.47Å; V263-L342 HydrophobicContact CG2-CB 4.23Å; V263-L342 HydrophobicContact CG2-CD2 4.36Å; V263-L344 HydrophobicContact CG1-CD1 3.68Å; V263-L344 HydrophobicContact CG1-CD2 4.21Å; V263-L344 HydrophobicContact CG1-CG 3.59Å
264	V	89.6	Confident	87.9	Confident	5 Å²	5	30.1 Å²	30.1	3%	0.03	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	132	178.9	171.9	0	0	0	0	110.2	T315 R336 V337 A340 L342 T343 L344	V264-T315 HydrophobicContact CG1-CG2 3.65Å; V264-R336 HydrophobicContact CG2-CB 4.18Å; V264-V337 HydrophobicContact CG1-CG2 3.88Å; V264-A340 HydrophobicContact CB-CB 4.01Å; V264-A340 HydrophobicContact CG2-CB 3.65Å; V264-L342 PolarHBondContact N-O 2.94Å; V264-T343 CarbonylContact O-C 3.6Å; V264-T343 WeakPolarHBondContact O-CA 3.47Å; V264-L344 PolarHBondContact O-N 2.87Å
265	I	88.3	Confident	87.7	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	115.6	170	-57	180	0	0	0	108.8	K273 L277 L312 S313 T315 L344 V346	I265-K273 HydrophobicContact CG2-CB 3.74Å; I265-K273 HydrophobicContact CG2-CD 4.18Å; I265-K273 HydrophobicContact CG2-CG 3.83Å; I265-L277 HydrophobicContact CD1-CB 3.93Å; I265-L277 HydrophobicContact CD1-CD1 4.41Å; I265-L312 HydrophobicContact CD1-CD1 3.93Å; I265-L312 HydrophobicContact CD1-CD2 4Å; I265-L312 HydrophobicContact CD1-CG 4.22Å; I265-L312 HydrophobicContact CG1-CD1 3.77Å; I265-L312 HydrophobicContact CG1-CG 4.46Å; I265-S313 PolarHBondContact N-O 3.35Å; I265-T315 WeakPolarHBondContact O-CG2 3.39Å; I265-T315 PolarHBondContact O-OG1 3.44Å; I265-L344 HydrophobicContact CG1-CB 4.38Å; I265-L344 HydrophobicContact CG1-CD1 4.09Å; I265-V346 HydrophobicContact CG2-CG2 3.61Å
266	A	87.4	Confident	87.6	Confident	5 Å²	5	32.2 Å²	32.2	4%	0.041	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	159	177.8	0	0	0	0	0	110.9	V337 T343 L344 L345 V346 V370	A266-V337 HydrophobicContact CB-CG2 4.25Å; A266-T343 HydrophobicContact CB-CG2 3.81Å; A266-L344 PolarHBondContact N-O 3.47Å; A266-L344 VanDerWaalsContact O-O 3.13Å; A266-L345 HydrophobicContact CB-CD1 4.37Å; A266-V346 PolarHBondContact O-N 3.32Å; A266-V370 HydrophobicContact CB-CG1 4.03Å
267	G	84.5	Confident	87.2	Confident	10 Å²	10	31.9 Å²	31.9	10%	0.103	19%	0.191	C	C	.	.			trans	147.4	167	177.8	0	0	0	0	0	113.3	K273 V346	G267-K273 PolarHBondContact O-NZ 3.24Å; G267-V346 WeakPolarHBondContact CA-O 3.08Å
268	A	80.8	Confident	86.7	Confident	55 Å²	55	35.8 Å²	35.8	46%	0.455	21%	0.212	S	C	.	.			trans	-60.8	162.2	179.7	0	0	0	0	0	112.8	A271 K273	A268-A271 WeakPolarHBondContact O-CB 3.36Å; A268-A271 PolarHBondContact O-N 3.34Å; A268-K273 PolarHBondContact O-NZ 3.08Å
269	T	74.9	Confident	86.5	Confident	69 Å²	69	33.7 Å²	33.7	42%	0.423	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	144.4	168.4	50.6	0	0	0	0	109.4	A271 L318	T269-A271 PolarHBondContact O-N 3.25Å; T269-L318 WeakPolarHBondContact CG2-O 3.11Å
270	N	82.1	Confident	86.3	Confident	136 Å²	136	31.2 Å²	31.2	73%	0.727	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.2	3.8	-178.6	-52.7	-38.7	0	0	0	117.3	G272 K388	N270-G272 PolarHBondContact O-N 3.2Å; N270-G272 VanDerWaalsContact O-N 3.08Å; N270-K388 WeakPolarHBondContact O-CE 3.5Å; N270-K388 PolarHBondContact O-NZ 3.06Å
271	A	87.1	Confident	85.7	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.008	19%	0.194	C	C	.	.	S	Bend	trans	-62.3	-15.2	172.5	0	0	0	0	0	113.3	A268 T269 V346 N387	A268-A271 WeakPolarHBondContact O-CB 3.36Å; A268-A271 PolarHBondContact O-N 3.34Å; T269-A271 PolarHBondContact O-N 3.25Å; A271-V346 HydrophobicContact CB-CB 4.46Å; A271-V346 HydrophobicContact CB-CG1 4.11Å; A271-V346 WeakPolarHBondContact CB-O 3.38Å; A271-V346 WeakPolarHBondContact O-CG1 3.28Å; A271-N387 WeakPolarHBondContact O-CB 3.34Å; A271-N387 PolarHBondContact O-ND2 3.34Å
272	G	87.4	Confident	84.7	Confident	11 Å²	11	39 Å²	39	11%	0.113	23%	0.226	C	C	.	.	S	Bend	trans	94.6	26.1	178.1	0	0	0	0	0	114.6	N270 S274 S275 L276 N387	N270-G272 PolarHBondContact O-N 3.2Å; N270-G272 VanDerWaalsContact O-N 3.08Å; G272-S274 PolarHBondContact O-N 2.75Å; G272-S275 WeakPolarHBondContact O-CB 3.36Å; G272-S275 PolarHBondContact O-N 3.26Å; G272-L276 PolarHBondContact O-N 2.99Å; G272-N387 WeakPolarHBondContact CA-ND2 3.41Å
273	K	87.1	Confident	83.5	Confident	20 Å²	20	40 Å²	40	9%	0.087	23%	0.228	C	C	.	.	H	α-helix	trans	-50.9	-53.8	173.4	-60.1	-171.8	-65	-81.9	0	112.9	I265 G267 A268 S275 L276 L277 V346	I265-K273 HydrophobicContact CG2-CB 3.74Å; I265-K273 HydrophobicContact CG2-CD 4.18Å; I265-K273 HydrophobicContact CG2-CG 3.83Å; G267-K273 PolarHBondContact O-NZ 3.24Å; A268-K273 PolarHBondContact O-NZ 3.08Å; K273-S275 VanDerWaalsContact C-N 3.28Å; K273-S275 PolarHBondContact O-N 3.34Å; K273-L276 WeakPolarHBondContact O-CB 3.33Å; K273-L276 PolarHBondContact O-N 2.9Å; K273-L276 VanDerWaalsContact O-N 3.15Å; K273-L277 PolarHBondContact O-N 2.93Å; K273-V346 HydrophobicContact CG-CB 4.2Å; K273-V346 HydrophobicContact CG-CG2 4.37Å
274	S	81.8	Confident	81.6	Confident	68 Å²	68	46.1 Å²	46.1	48%	0.476	27%	0.267	S	S	.	.	H	α-helix	trans	-65.5	-32.3	-179.8	-48.7	0	0	0	0	112.3	G272 N278	G272-S274 PolarHBondContact O-N 2.75Å; S274-N278 WeakPolarHBondContact O-CB 3.38Å; S274-N278 VanDerWaalsContact O-CG 3.25Å; S274-N278 PolarHBondContact O-N 3Å; S274-N278 PolarHBondContact O-ND2 3.04Å; S274-N278 VanDerWaalsContact O-ND2 3.12Å
275	S	87.3	Confident	79.7	Confident	60 Å²	60	46.2 Å²	46.2	42%	0.42	27%	0.269	S	S	.	.	H	α-helix	trans	-65.5	-45.3	172.9	-53.1	0	0	0	0	111.1	G272 K273 N278 K279	G272-S275 WeakPolarHBondContact O-CB 3.36Å; G272-S275 PolarHBondContact O-N 3.26Å; K273-S275 VanDerWaalsContact C-N 3.28Å; K273-S275 PolarHBondContact O-N 3.34Å; S275-N278 PolarHBondContact O-N 2.85Å; S275-K279 VanDerWaalsContact O-CG 3.28Å; S275-K279 WeakPolarHBondContact O-CG 3.41Å; S275-K279 PolarHBondContact O-N 3.19Å
276	L	88.9	Confident	77.9	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.4	-46.2	176.2	178.9	60.8	0	0	0	111.7	G272 K273 N278 K279 L280 V346 V385 I416 L424 F427	G272-L276 PolarHBondContact O-N 2.99Å; K273-L276 WeakPolarHBondContact O-CB 3.33Å; K273-L276 PolarHBondContact O-N 2.9Å; K273-L276 VanDerWaalsContact O-N 3.15Å; L276-N278 PolarHBondContact O-N 2.7Å; L276-K279 PolarHBondContact O-N 3.12Å; L276-K279 VanDerWaalsContact O-N 3.13Å; L276-L280 HydrophobicContact CD1-CD1 4.43Å; L276-L280 HydrophobicContact CD1-CG 4.34Å; L276-L280 HydrophobicContact CG-CD1 4.22Å; L276-L280 WeakPolarHBondContact O-CG 3.46Å; L276-L280 PolarHBondContact O-N 2.89Å; L276-V346 HydrophobicContact CD2-CG2 3.69Å; L276-V385 HydrophobicContact CD2-CG1 4.1Å; L276-I416 HydrophobicContact CD1-CD1 3.75Å; L276-L424 HydrophobicContact CD1-CD1 4.13Å; L276-F427 HydrophobicContact CD1-CE1 3.95Å; L276-F427 HydrophobicContact CD1-CZ 4.33Å; L276-F427 HydrophobicContact CD2-CZ 4.45Å
277	L	85.8	Confident	76.1	Confident	23 Å²	23	53.4 Å²	53.4	12%	0.12	31%	0.313	C	S	.	.	H	α-helix	trans	-56.2	-51.2	176.5	-176.9	144.5	0	0	0	111.1	I265 K273 K279 L280 C281 L312 D314	I265-L277 HydrophobicContact CD1-CB 3.93Å; I265-L277 HydrophobicContact CD1-CD1 4.41Å; K273-L277 PolarHBondContact O-N 2.93Å; L277-K279 VanDerWaalsContact C-N 3.26Å; L277-K279 PolarHBondContact O-N 3.35Å; L277-L280 WeakPolarHBondContact O-CB 3.45Å; L277-L280 PolarHBondContact O-N 2.83Å; L277-L280 VanDerWaalsContact O-N 3.13Å; L277-C281 PolarHBondContact O-N 3.42Å; L277-C281 PolarHBondContact O-SG 3.12Å; L277-L312 HydrophobicContact CD1-CD2 4.3Å; L277-L312 HydrophobicContact CG-CD2 4.13Å; L277-D314 HydrophobicContact CD1-CB 3.57Å
278	N	82.8	Confident	74.5	Confident	82 Å²	82	54.4 Å²	54.4	44%	0.439	32%	0.317	S	S	.	.	H	α-helix	trans	-59.4	-39	177.6	-75.1	-30.9	0	0	0	111.8	S274 S275 L276 C281 Q282	S274-N278 WeakPolarHBondContact O-CB 3.38Å; S274-N278 VanDerWaalsContact O-CG 3.25Å; S274-N278 PolarHBondContact O-N 3Å; S274-N278 PolarHBondContact O-ND2 3.04Å; S274-N278 VanDerWaalsContact O-ND2 3.12Å; S275-N278 PolarHBondContact O-N 2.85Å; L276-N278 PolarHBondContact O-N 2.7Å; N278-C281 PolarHBondContact O-N 3.01Å; N278-Q282 VanDerWaalsContact O-CB 3.25Å; N278-Q282 WeakPolarHBondContact O-CB 3.32Å; N278-Q282 WeakPolarHBondContact O-CG 3.47Å; N278-Q282 PolarHBondContact O-N 3.41Å
279	K	86.6	Confident	72.8	Confident	48 Å²	48	55 Å²	55	21%	0.209	32%	0.318	C	S	.	.	H	α-helix	trans	-67.9	-36.8	176.8	-71.7	-60	-176.4	176.1	0	113.2	S275 L276 L277 R283 C418 N421 L424	S275-K279 VanDerWaalsContact O-CG 3.28Å; S275-K279 WeakPolarHBondContact O-CG 3.41Å; S275-K279 PolarHBondContact O-N 3.19Å; L276-K279 PolarHBondContact O-N 3.12Å; L276-K279 VanDerWaalsContact O-N 3.13Å; L277-K279 VanDerWaalsContact C-N 3.26Å; L277-K279 PolarHBondContact O-N 3.35Å; K279-R283 WeakPolarHBondContact O-CB 3.35Å; K279-R283 PolarHBondContact O-N 3.33Å; K279-C418 WeakPolarHBondContact CE-O 3.22Å; K279-C418 HydrophobicContact CG-CB 4.42Å; K279-N421 WeakPolarHBondContact CD-OD1 3.33Å; K279-N421 WeakPolarHBondContact CE-OD1 3.39Å; K279-N421 PolarHBondContact NZ-OD1 3.34Å; K279-L424 HydrophobicContact CB-CD2 3.93Å; K279-L424 HydrophobicContact CG-CD2 4.36Å
280	L	84.6	Confident	71.2	Confident	3 Å²	3	57.3 Å²	57.3	2%	0.016	33%	0.334	C	S	.	.	H	α-helix	trans	-64.7	-46	173.7	-76	175.1	0	0	0	110.7	L276 L277 Q282 L303 L312 L344 F427 L428 L431	L276-L280 HydrophobicContact CD1-CD1 4.43Å; L276-L280 HydrophobicContact CD1-CG 4.34Å; L276-L280 HydrophobicContact CG-CD1 4.22Å; L276-L280 WeakPolarHBondContact O-CG 3.46Å; L276-L280 PolarHBondContact O-N 2.89Å; L277-L280 WeakPolarHBondContact O-CB 3.45Å; L277-L280 PolarHBondContact O-N 2.83Å; L277-L280 VanDerWaalsContact O-N 3.13Å; L280-Q282 VanDerWaalsContact C-N 3.34Å; L280-Q282 PolarHBondContact O-N 3.45Å; L280-L303 HydrophobicContact CB-CD1 4.25Å; L280-L312 HydrophobicContact CB-CD2 4.31Å; L280-L312 HydrophobicContact CD1-CD2 3.87Å; L280-L344 HydrophobicContact CD1-CD1 4.38Å; L280-F427 HydrophobicContact CD2-CE1 3.94Å; L280-L428 HydrophobicContact CD2-CD2 3.62Å; L280-L431 HydrophobicContact CD2-CD2 4.41Å
281	C	79.3	Confident	69.3	Low	22 Å²	22	56.9 Å²	56.9	15%	0.149	33%	0.331	C	S	.	.	H	α-helix	trans	-70.8	-23.3	179.8	-61	0	0	0	0	114.3	L277 N278 I287	L277-C281 PolarHBondContact O-N 3.42Å; L277-C281 PolarHBondContact O-SG 3.12Å; N278-C281 PolarHBondContact O-N 3.01Å; C281-I287 HydrophobicContact CB-CD1 4.06Å; C281-I287 HydrophobicContact CB-CG1 4.36Å; C281-I287 WeakPolarHBondContact O-CD1 3.49Å
282	Q	70.8	Confident	66.9	Low	143 Å²	143	61.8 Å²	61.8	67%	0.668	37%	0.371	S	S	*	.	H	α-helix	trans	-94.6	-14.3	-177.7	-73	172.9	9.3	0	0	114.6	N278 L280	N278-Q282 VanDerWaalsContact O-CB 3.25Å; N278-Q282 WeakPolarHBondContact O-CB 3.32Å; N278-Q282 WeakPolarHBondContact O-CG 3.47Å; N278-Q282 PolarHBondContact O-N 3.41Å; L280-Q282 VanDerWaalsContact C-N 3.34Å; L280-Q282 PolarHBondContact O-N 3.45Å
283	R	64.3	Low	64.6	Low	80 Å²	80	64.3 Å²	64.3	30%	0.302	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	175.8	179.4	-92.7	-164.6	174.9	-174.4	0.2	110.7	K279 A285 N421 L424	K279-R283 WeakPolarHBondContact O-CB 3.35Å; K279-R283 PolarHBondContact O-N 3.33Å; R283-A285 CarbonylContact O-C 3.56Å; R283-A285 PolarHBondContact O-N 2.71Å; R283-A285 VanDerWaalsContact O-O 3.11Å; R283-N421 VanDerWaalsContact NH2-CB 3.34Å; R283-L424 VanDerWaalsContact CZ-CD2 3.41Å; R283-L424 VanDerWaalsContact NH1-CG 3.27Å
284	P	51.3	Low	62	Low	127 Å²	127	69.9 Å²	69.9	83%	0.825	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	25.9	-179.5	29.1	-37.8	0	0	0	114.7	A286	P284-A286 VanDerWaalsContact C-N 3.28Å; P284-A286 PolarHBondContact O-N 2.94Å
285	A	50.7	Low	59.7	Low	8 Å²	8	72.7 Å²	72.7	7%	0.066	45%	0.448	C	S	.	.	S	Bend	trans	-74.6	93.9	147.2	0	0	0	0	0	105.9	R283 I287 L303 D304 I305	R283-A285 CarbonylContact O-C 3.56Å; R283-A285 PolarHBondContact O-N 2.71Å; R283-A285 VanDerWaalsContact O-O 3.11Å; A285-I287 PolarHBondContact O-N 3.19Å; A285-L303 HydrophobicContact CB-CB 4.34Å; A285-L303 HydrophobicContact CB-CD2 4.3Å; A285-D304 WeakPolarHBondContact CA-O 3.45Å; A285-I305 HydrophobicContact CB-CD1 3.53Å
286	A	49.8	Very low	57.2	Low	56 Å²	56	80.8 Å²	80.8	46%	0.463	47%	0.469	S	S	.	.			trans	-55.6	119.7	178.9	0	0	0	0	0	107.5	P284 V288 D304	P284-A286 VanDerWaalsContact C-N 3.28Å; P284-A286 PolarHBondContact O-N 2.94Å; A286-V288 WeakPolarHBondContact O-CG2 3.41Å; A286-V288 PolarHBondContact O-N 3.03Å; A286-D304 PolarHBondContact O-N 3.46Å
287	I	50.6	Low	54.7	Low	100 Å²	100	87.8 Å²	87.8	51%	0.513	51%	0.506	S	S	.	.	B	Isolated β-bridge	trans	-60.8	115.5	164.8	-62.6	173.6	0	0	0	104.6	C281 A285 L303	C281-I287 HydrophobicContact CB-CD1 4.06Å; C281-I287 HydrophobicContact CB-CG1 4.36Å; C281-I287 WeakPolarHBondContact O-CD1 3.49Å; A285-I287 PolarHBondContact O-N 3.19Å; I287-L303 HydrophobicContact CG1-CD2 4.31Å
288	V	50.8	Low	52.7	Low	30 Å²	30	89.7 Å²	89.7	18%	0.182	52%	0.519	C	S	.	.			trans	-87.9	146.9	175.9	-128.7	0	0	0	0	108.2	E179 A286 A302 D304	E179-V288 HydrophobicContact CB-CB 3.83Å; E179-V288 HydrophobicContact CB-CG1 3.49Å; E179-V288 VanDerWaalsContact CB-CG1 3.49Å; E179-V288 HydrophobicContact CB-CG2 4.08Å; E179-V288 VanDerWaalsContact CD-CB 3.44Å; E179-V288 HydrophobicContact CG-CB 3.88Å; E179-V288 HydrophobicContact CG-CG1 3.56Å; E179-V288 WeakPolarHBondContact OE2-CB 3.46Å; A286-V288 WeakPolarHBondContact O-CG2 3.41Å; A286-V288 PolarHBondContact O-N 3.03Å; V288-A302 PolarHBondContact N-O 3.25Å; V288-D304 HydrophobicContact CG2-CB 4.42Å
289	S	43.9	Very low	51.4	Low	69 Å²	69	91.8 Å²	91.8	48%	0.483	53%	0.534	S	S	.	.			trans	-45	138.9	-147.8	175.7	0	0	0	0	115.5	E179 I291	E179-S289 PolarHBondContact OE1-N 3.08Å; S289-I291 VanDerWaalsContact C-N 3.3Å; S289-I291 PolarHBondContact O-N 2.95Å
290	P	43.2	Very low	50.7	Low	117 Å²	117	94 Å²	94	76%	0.76	55%	0.545	S	S	*	.			trans	-74.7	85.3	163.6	32.5	-30.5	0	0	0	108.3	A292	P290-A292 PolarHBondContact O-N 3.37Å
291	I	41.7	Very low	50.4	Low	127 Å²	127	95 Å²	95	65%	0.651	55%	0.553	S	S	*	*			trans	-67.7	109.2	168.3	-59.7	178.1	0	0	0	107.2	S289 G293	S289-I291 VanDerWaalsContact C-N 3.3Å; S289-I291 PolarHBondContact O-N 2.95Å; I291-G293 PolarHBondContact O-N 3.08Å; I291-G293 VanDerWaalsContact O-N 3.14Å
292	A	35.4	Very low	50.6	Low	104 Å²	104	95 Å²	95	86%	0.86	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	110.8	173.8	0	0	0	0	0	109.5	P290	P290-A292 PolarHBondContact O-N 3.37Å
293	G	39.1	Very low	51.4	Low	64 Å²	64	88.3 Å²	88.3	66%	0.66	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-174.6	-35	179.4	0	0	0	0	0	116.3	I291 T295	I291-G293 PolarHBondContact O-N 3.08Å; I291-G293 VanDerWaalsContact O-N 3.14Å; G293-T295 PolarHBondContact O-N 3.08Å
294	T	33.7	Very low	52.7	Low	136 Å²	136	86.2 Å²	86.2	83%	0.834	52%	0.518	S	S	*	.			trans	-97.3	71.4	178.8	48.7	0	0	0	0	111	R296	T294-R296 PolarHBondContact O-N 3.31Å
295	T	33.9	Very low	54.5	Low	128 Å²	128	80.6 Å²	80.6	79%	0.785	48%	0.481	S	S	*	.			trans	-67.7	124.9	164.1	49.7	0	0	0	0	109.5	G293	G293-T295 PolarHBondContact O-N 3.08Å
296	R	33.9	Very low	56.3	Low	230 Å²	230	82.1 Å²	82.1	87%	0.868	50%	0.498	S	S	*	.	S	Bend	trans	88.6	67.7	172.8	-53.5	171.5	175.4	174.2	-1.4	115	T294	T294-R296 PolarHBondContact O-N 3.31Å
297	D	35.5	Very low	58.2	Low	146 Å²	146	80.3 Å²	80.3	78%	0.781	48%	0.484	S	S	*	.	S	Bend		-180	139.7	126.5	-85.8	-31.2	0	0	0	108.7
298	V	44.7	Very low	60.2	Low	63 Å²	63	76.4 Å²	76.4	38%	0.382	46%	0.464	S	S	.	.			trans	35.8	117.2	165.7	-165.5	0	0	0	0	117.4	E300	V298-E300 PolarHBondContact O-N 2.87Å
299	V	55.8	Low	62.2	Low	127 Å²	127	75.3 Å²	75.3	77%	0.77	46%	0.457	S	S	*	.			trans	-65.9	89	175.1	-175	0	0	0	0	110.4
300	E	71.9	Confident	64.5	Low	93 Å²	93	72.3 Å²	72.3	44%	0.435	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	138.3	165.1	-57.6	-163.5	144.5	0	0	109.2	V298 S313	V298-E300 PolarHBondContact O-N 2.87Å; E300-S313 PolarHBondContact OE1-OG 3.44Å
301	S	78.2	Confident	66.7	Low	25 Å²	25	68.4 Å²	68.4	18%	0.175	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	116.9	178.1	-60.3	0	0	0	0	109.6	L312	S301-L312 PolarHBondContact N-O 2.98Å; S301-L312 PolarHBondContact O-N 3.45Å
302	A	84.3	Confident	68.8	Low	21 Å²	21	62.5 Å²	62.5	17%	0.174	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	124.3	172.5	0	0	0	0	0	110.2	V288 L311	V288-A302 PolarHBondContact N-O 3.25Å; A302-L311 HydrophobicContact CB-CD2 4.11Å
303	L	87.3	Confident	71	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.016	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	139.7	-176	-60.8	178.5	0	0	0	110.9	L280 A285 I287 I305 V310 L312	L280-L303 HydrophobicContact CB-CD1 4.25Å; A285-L303 HydrophobicContact CB-CB 4.34Å; A285-L303 HydrophobicContact CB-CD2 4.3Å; I287-L303 HydrophobicContact CG1-CD2 4.31Å; L303-I305 HydrophobicContact CB-CD1 4.28Å; L303-I305 HydrophobicContact CB-CG1 4.29Å; L303-V310 HydrophobicContact CB-CB 4.29Å; L303-V310 PolarHBondContact N-O 3.03Å; L303-V310 PolarHBondContact O-N 3.44Å; L303-L312 HydrophobicContact CD1-CB 3.92Å; L303-L312 HydrophobicContact CD1-CD2 3.79Å; L303-L312 HydrophobicContact CD1-CG 4.45Å
304	D	90.4	Very high	72.5	Confident	37 Å²	37	55.9 Å²	55.9	20%	0.198	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	106.9	163.1	-175	-20.5	0	0	0	110.2	T180 A285 A286 V288 G306 G307 F308	T180-D304 HydrophobicContact CG2-CB 3.85Å; A285-D304 WeakPolarHBondContact CA-O 3.45Å; A286-D304 PolarHBondContact O-N 3.46Å; V288-D304 HydrophobicContact CG2-CB 4.42Å; D304-G306 PolarHBondContact OD1-N 3.21Å; D304-G307 WeakPolarHBondContact OD1-CA 3.12Å; D304-G307 PolarHBondContact OD1-N 2.89Å; D304-F308 PolarHBondContact OD1-N 3.39Å
305	I	89.9	Confident	73.8	Confident	8 Å²	8	49.6 Å²	49.6	4%	0.041	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	91.8	174.7	-56	-63.1	0	0	0	109.8	A285 L303 G307 F308 V310 L431 Q432	A285-I305 HydrophobicContact CB-CD1 3.53Å; L303-I305 HydrophobicContact CB-CD1 4.28Å; L303-I305 HydrophobicContact CB-CG1 4.29Å; I305-G307 VanDerWaalsContact C-N 3.34Å; I305-G307 PolarHBondContact O-N 3.39Å; I305-F308 PolarHBondContact N-O 2.92Å; I305-F308 PolarHBondContact O-N 3.34Å; I305-V310 HydrophobicContact CB-CG2 3.94Å; I305-V310 HydrophobicContact CG1-CB 3.94Å; I305-V310 HydrophobicContact CG1-CG1 4.49Å; I305-V310 HydrophobicContact CG1-CG2 3.64Å; I305-L431 HydrophobicContact CG2-CD2 4.39Å; I305-L431 HydrophobicContact CG2-CG 4.24Å; I305-Q432 HydrophobicContact CG2-CB 4.06Å
306	G	88.2	Confident	74.2	Confident	41 Å²	41	47.1 Å²	47.1	42%	0.423	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.8	36	173.1	0	0	0	0	0	113.8	D304 F308 Q432	D304-G306 PolarHBondContact OD1-N 3.21Å; G306-F308 WeakPolarHBondContact O-CD2 3.48Å; G306-Q432 PolarHBondContact O-NE2 3.5Å
307	G	90.5	Very high	74.5	Confident	18 Å²	18	37.9 Å²	37.9	19%	0.186	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	92	4.3	-178.5	0	0	0	0	0	114.3	T180 A182 D304 I305	T180-G307 WeakPolarHBondContact CB-O 3.2Å; A182-G307 WeakPolarHBondContact CB-O 3.35Å; A182-G307 PolarHBondContact N-O 3.06Å; D304-G307 WeakPolarHBondContact OD1-CA 3.12Å; D304-G307 PolarHBondContact OD1-N 2.89Å; I305-G307 VanDerWaalsContact C-N 3.34Å; I305-G307 PolarHBondContact O-N 3.39Å
308	F	92.5	Very high	74.4	Confident	17 Å²	17	33.5 Å²	33.5	8%	0.075	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	142	-176.9	-66	-89.6	0	0	0	111.8	A182 L257 D304 I305 G306 V435 K436 C439	A182-F308 HydrophobicContact CB-CD1 3.87Å; A182-F308 HydrophobicContact CB-CE1 3.91Å; A182-F308 HydrophobicContact CB-CG 4.42Å; A182-F308 HydrophobicContact CB-CZ 4.49Å; L257-F308 HydrophobicContact CD1-CD1 4.09Å; D304-F308 PolarHBondContact OD1-N 3.39Å; I305-F308 PolarHBondContact N-O 2.92Å; I305-F308 PolarHBondContact O-N 3.34Å; G306-F308 WeakPolarHBondContact O-CD2 3.48Å; F308-V435 HydrophobicContact CB-CG1 3.43Å; F308-V435 VanDerWaalsContact CB-CG1 3.43Å; F308-V435 HydrophobicContact CG-CG1 4.06Å; F308-K436 HydrophobicContact CD2-CB 4.23Å; F308-K436 HydrophobicContact CE1-CB 4.43Å; F308-K436 HydrophobicContact CE1-CG 4.38Å; F308-K436 HydrophobicContact CE2-CB 3.67Å; F308-K436 HydrophobicContact CE2-CD 4.06Å; F308-K436 HydrophobicContact CE2-CG 3.79Å; F308-K436 HydrophobicContact CZ-CB 3.8Å; F308-K436 HydrophobicContact CZ-CD 4.11Å; F308-K436 HydrophobicContact CZ-CG 3.56Å; F308-C439 HydrophobicContact CD1-CB 3.73Å; F308-C439 HydrophobicContact CE1-CB 3.88Å
309	P	92.5	Very high	74.1	Confident	8 Å²	8	39.7 Å²	39.7	5%	0.052	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	131.6	-178.3	32.2	-32.5	0	0	0	111	T180 Q183 L257 G260 V261	T180-P309 HydrophobicContact CG2-CB 3.94Å; T180-P309 WeakPolarHBondContact OG1-CD 3.46Å; Q183-P309 HydrophobicContact CG-CB 4.32Å; Q183-P309 HydrophobicContact CG-CG 3.78Å; L257-P309 HydrophobicContact CD1-CG 4.11Å; L257-P309 VanDerWaalsContact O-CG 3.24Å; L257-P309 WeakPolarHBondContact O-CG 3.44Å; G260-P309 WeakPolarHBondContact CA-O 3.04Å; V261-P309 PolarHBondContact N-O 3.46Å
310	V	91.6	Very high	73.1	Confident	5 Å²	5	40.2 Å²	40.2	3%	0.03	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	128.7	175.1	167.7	0	0	0	0	109.1	V261 V263 L303 I305 V435	V261-V310 HydrophobicContact CB-CG2 4.49Å; V261-V310 WeakPolarHBondContact O-CA 3.15Å; V263-V310 HydrophobicContact CB-CG1 3.88Å; V263-V310 HydrophobicContact CG2-CG1 3.49Å; V263-V310 VanDerWaalsContact CG2-CG1 3.49Å; V263-V310 HydrophobicContact CG2-CG2 4.41Å; L303-V310 HydrophobicContact CB-CB 4.29Å; L303-V310 PolarHBondContact N-O 3.03Å; L303-V310 PolarHBondContact O-N 3.44Å; I305-V310 HydrophobicContact CB-CG2 3.94Å; I305-V310 HydrophobicContact CG1-CB 3.94Å; I305-V310 HydrophobicContact CG1-CG1 4.49Å; I305-V310 HydrophobicContact CG1-CG2 3.64Å; V310-V435 HydrophobicContact CG2-CG1 3.96Å; V310-V435 HydrophobicContact CG2-CG2 3.77Å
311	L	89.6	Confident	71.5	Confident	36 Å²	36	38.5 Å²	38.5	19%	0.188	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	104.9	168.8	-68.4	177.2	0	0	0	108	S259 V261 H262 V263 A302	S259-L311 WeakPolarHBondContact O-CD1 3.01Å; V261-L311 PolarHBondContact O-N 2.98Å; H262-L311 VanDerWaalsContact CE1-CD1 3.46Å; H262-L311 WeakPolarHBondContact CE1-CD1 3.43Å; V263-L311 PolarHBondContact N-O 3.32Å; A302-L311 HydrophobicContact CB-CD2 4.11Å
312	L	86.8	Confident	69.5	Low	2 Å²	2	44.1 Å²	44.1	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	115.9	-179.1	-171.2	69.7	0	0	0	109.9	V263 I265 L277 L280 S301 L303 L344	V263-L312 HydrophobicContact CB-CD1 3.97Å; V263-L312 HydrophobicContact CG1-CD1 3.72Å; V263-L312 WeakPolarHBondContact O-CA 3.43Å; I265-L312 HydrophobicContact CD1-CD1 3.93Å; I265-L312 HydrophobicContact CD1-CD2 4Å; I265-L312 HydrophobicContact CD1-CG 4.22Å; I265-L312 HydrophobicContact CG1-CD1 3.77Å; I265-L312 HydrophobicContact CG1-CG 4.46Å; L277-L312 HydrophobicContact CD1-CD2 4.3Å; L277-L312 HydrophobicContact CG-CD2 4.13Å; L280-L312 HydrophobicContact CB-CD2 4.31Å; L280-L312 HydrophobicContact CD1-CD2 3.87Å; S301-L312 PolarHBondContact N-O 2.98Å; S301-L312 PolarHBondContact O-N 3.45Å; L303-L312 HydrophobicContact CD1-CB 3.92Å; L303-L312 HydrophobicContact CD1-CD2 3.79Å; L303-L312 HydrophobicContact CD1-CG 4.45Å; L312-L344 HydrophobicContact CD1-CD1 4.46Å
313	S	80.9	Confident	67.7	Low	4 Å²	4	48.4 Å²	48.4	3%	0.028	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	123.2	177.7	-45.2	0	0	0	0	109.7	V263 I265 E300	V263-S313 PolarHBondContact O-N 3.27Å; I265-S313 PolarHBondContact N-O 3.35Å; E300-S313 PolarHBondContact OE1-OG 3.44Å
314	D	70.6	Confident	65.8	Low	25 Å²	25	55.2 Å²	55.2	13%	0.134	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	138.2	172	-158.2	-9.4	0	0	0	109.9	L277 A316	L277-D314 HydrophobicContact CD1-CB 3.57Å; D314-A316 HydrophobicContact CB-CB 4.07Å; D314-A316 PolarHBondContact O-N 2.74Å; D314-A316 PolarHBondContact OD1-N 3.44Å; D314-A316 VanDerWaalsContact OD1-N 3.16Å; D314-A316 WeakPolarHBondContact OD2-CB 3.44Å
315	T	61.3	Low	63.9	Low	4 Å²	4	59 Å²	59	3%	0.025	35%	0.349	C	S	.	.			trans	-84.5	32.2	162.9	57.5	0	0	0	0	111.1	V264 I265 G317 L318 A333	V264-T315 HydrophobicContact CG1-CG2 3.65Å; I265-T315 WeakPolarHBondContact O-CG2 3.39Å; I265-T315 PolarHBondContact O-OG1 3.44Å; T315-G317 VanDerWaalsContact C-N 3.32Å; T315-G317 PolarHBondContact O-N 3.48Å; T315-L318 PolarHBondContact O-N 2.99Å; T315-A333 HydrophobicContact CG2-CB 4.18Å
316	A	41.7	Very low	62.2	Low	77 Å²	77	60.8 Å²	60.8	64%	0.636	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	95	174.5	0	0	0	0	0	109.6	D314	D314-A316 HydrophobicContact CB-CB 4.07Å; D314-A316 PolarHBondContact O-N 2.74Å; D314-A316 PolarHBondContact OD1-N 3.44Å; D314-A316 VanDerWaalsContact OD1-N 3.16Å; D314-A316 WeakPolarHBondContact OD2-CB 3.44Å
317	G	39.3	Very low	60.7	Low	35 Å²	35	66 Å²	66	36%	0.361	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	150	1.6	-169.4	0	0	0	0	0	117.6	T315 R319	T315-G317 VanDerWaalsContact C-N 3.32Å; T315-G317 PolarHBondContact O-N 3.48Å; G317-R319 PolarHBondContact O-N 3.16Å
318	L	35.4	Very low	59.2	Low	55 Å²	55	67.9 Å²	67.9	29%	0.288	38%	0.375	S	S	.	.			trans	-75.3	77.5	157.1	-63.6	174.2	0	0	0	107.9	T269 T315 V330 A333	T269-L318 WeakPolarHBondContact CG2-O 3.11Å; T315-L318 PolarHBondContact O-N 2.99Å; L318-V330 HydrophobicContact CD2-CB 4.35Å; L318-V330 HydrophobicContact CD2-CG2 3.86Å; L318-A333 HydrophobicContact CD2-CB 3.85Å; L318-A333 HydrophobicContact CG-CB 4.3Å
319	R	37	Very low	57.6	Low	193 Å²	193	67.9 Å²	67.9	73%	0.728	38%	0.38	S	S	*	.			trans	-87	151.2	166.1	-68.2	-177.1	178.3	-175.5	-0.4	108	G317 E326	G317-R319 PolarHBondContact O-N 3.16Å; R319-E326 WeakPolarHBondContact O-CG 3.34Å
320	D	35.9	Very low	56.3	Low	137 Å²	137	69.6 Å²	69.6	73%	0.733	39%	0.389	S	S	*	.			trans	-98	107.9	154.4	-66.2	-64.8	0	0	0	106.4	E326	D320-E326 WeakPolarHBondContact CA-OE1 3.2Å
321	S	36.8	Very low	55.3	Low	57 Å²	57	74.5 Å²	74.5	40%	0.399	41%	0.408	S	S	.	.			trans	-160.1	123.4	174	-175.6	0	0	0	0	108.5	D323 E326	S321-D323 PolarHBondContact O-N 3.04Å; S321-E326 WeakPolarHBondContact CA-OE2 3.46Å; S321-E326 VanDerWaalsContact N-CD 3.32Å; S321-E326 PolarHBondContact N-OE2 2.92Å; S321-E326 WeakPolarHBondContact O-CB 3.05Å
322	P	36.1	Very low	54.3	Low	143 Å²	143	78.5 Å²	78.5	93%	0.929	42%	0.42	S	S	*	.	S	Bend	trans	-65.4	17.9	-159.2	28	-37.4	0	0	0	117.4
323	D	46.5	Very low	53.5	Low	112 Å²	112	78.9 Å²	78.9	60%	0.599	42%	0.424	S	S	*	.	S	Bend	trans	-94.3	150.2	-176.3	-110.9	-30.4	0	0	0	112.8	S321 V325 E326	S321-D323 PolarHBondContact O-N 3.04Å; D323-V325 PolarHBondContact O-N 2.75Å; D323-E326 VanDerWaalsContact O-CB 3.3Å; D323-E326 WeakPolarHBondContact O-CB 3.24Å; D323-E326 PolarHBondContact O-N 3.42Å
324	L	48.3	Very low	53.2	Low	146 Å²	146	86 Å²	86	76%	0.764	45%	0.45	S	S	*	.	H	α-helix	trans	-53.1	-18.7	177.6	-70.6	164.2	0	0	0	114.7	E326	L324-E326 VanDerWaalsContact C-N 3.27Å; L324-E326 PolarHBondContact O-N 3.48Å
325	V	50.3	Low	53.5	Low	117 Å²	117	88.2 Å²	88.2	71%	0.709	46%	0.459	S	S	*	.	H	α-helix	trans	-67.1	-26.7	175.1	-178.9	0	0	0	0	112.1	D323 G329	D323-V325 PolarHBondContact O-N 2.75Å; V325-G329 PolarHBondContact O-N 2.87Å
326	E	53.4	Low	54.4	Low	45 Å²	45	90.8 Å²	90.8	21%	0.21	47%	0.469	C	S	.	.	H	α-helix	trans	-76.6	-44.6	-174.8	-156.7	-159.3	140.1	0	0	113	R319 D320 S321 D323 L324 E328 G329 V330	R319-E326 WeakPolarHBondContact O-CG 3.34Å; D320-E326 WeakPolarHBondContact CA-OE1 3.2Å; S321-E326 WeakPolarHBondContact CA-OE2 3.46Å; S321-E326 VanDerWaalsContact N-CD 3.32Å; S321-E326 PolarHBondContact N-OE2 2.92Å; S321-E326 WeakPolarHBondContact O-CB 3.05Å; D323-E326 VanDerWaalsContact O-CB 3.3Å; D323-E326 WeakPolarHBondContact O-CB 3.24Å; D323-E326 PolarHBondContact O-N 3.42Å; L324-E326 VanDerWaalsContact C-N 3.27Å; L324-E326 PolarHBondContact O-N 3.48Å; E326-E328 PolarHBondContact O-N 2.69Å; E326-G329 WeakPolarHBondContact O-CA 3.34Å; E326-G329 PolarHBondContact O-N 2.72Å; E326-V330 PolarHBondContact O-N 3.26Å
327	Q	57.8	Low	56.2	Low	150 Å²	150	87.9 Å²	87.9	70%	0.701	44%	0.443	S	S	*	.	H	α-helix	trans	-60.2	-38.4	175.7	-68.4	-175.2	-7.9	0	0	111	R331	Q327-R331 VanDerWaalsContact O-CB 3.27Å; Q327-R331 WeakPolarHBondContact O-CB 3.41Å; Q327-R331 PolarHBondContact O-N 2.79Å
328	E	58.1	Low	58.2	Low	58 Å²	58	92.2 Å²	92.2	27%	0.271	45%	0.454	S	S	.	.	H	α-helix	trans	-68.2	-34.4	173.7	-176.7	58.5	-163	0	0	112	E326 R331 R332	E326-E328 PolarHBondContact O-N 2.69Å; E328-R331 IonicContact OE1-CZ 2.6Å; E328-R331 IonicContact OE1-NE 2.68Å; E328-R331 IonicContact OE1-NH2 3.17Å; E328-R331 PolarHBondContact OE1-NH2 3.06Å; E328-R331 IonicContact OE2-CZ 3.65Å; E328-R331 IonicContact OE2-NE 3.65Å; E328-R331 PolarHBondContact OE2-NE 3.22Å; E328-R331 IonicContact OE2-NH2 3.51Å; E328-R331 PolarHBondContact OE2-NH2 3.14Å; E328-R332 WeakPolarHBondContact O-CB 3.45Å; E328-R332 WeakPolarHBondContact O-CG 3.34Å; E328-R332 PolarHBondContact O-N 2.85Å; E328-R332 IonicContact OE1-CZ 3.39Å; E328-R332 IonicContact OE1-NE 3.48Å; E328-R332 PolarHBondContact OE1-NE 3.06Å; E328-R332 IonicContact OE1-NH2 3.61Å; E328-R332 PolarHBondContact OE1-NH2 2.97Å
329	G	59.7	Low	60.4	Low	17 Å²	17	96.8 Å²	96.8	18%	0.175	47%	0.474	C	S	.	.	H	α-helix	trans	-63.7	-46.7	173.1	0	0	0	0	0	113.4	V325 E326 R332 A333	V325-G329 PolarHBondContact O-N 2.87Å; E326-G329 WeakPolarHBondContact O-CA 3.34Å; E326-G329 PolarHBondContact O-N 2.72Å; G329-R332 PolarHBondContact O-N 3.48Å; G329-A333 WeakPolarHBondContact O-CB 3.49Å; G329-A333 PolarHBondContact O-N 3.44Å
330	V	65.4	Low	62.8	Low	43 Å²	43	88 Å²	88	26%	0.261	44%	0.442	S	S	.	.	H	α-helix	trans	-65.4	-42.4	175.3	176.6	0	0	0	0	111.1	L318 E326 A333 R334	L318-V330 HydrophobicContact CD2-CB 4.35Å; L318-V330 HydrophobicContact CD2-CG2 3.86Å; E326-V330 PolarHBondContact O-N 3.26Å; V330-A333 PolarHBondContact O-N 2.63Å; V330-R334 WeakPolarHBondContact O-CG 3.2Å; V330-R334 PolarHBondContact O-N 3.34Å
331	R	70.3	Confident	65.4	Low	109 Å²	109	82.2 Å²	82.2	41%	0.411	41%	0.411	S	S	.	.	H	α-helix	trans	-58.9	-50.7	176.3	-166.9	-173	75.2	71.7	15.3	111	Q327 E328 A333 R334 E335	Q327-R331 VanDerWaalsContact O-CB 3.27Å; Q327-R331 WeakPolarHBondContact O-CB 3.41Å; Q327-R331 PolarHBondContact O-N 2.79Å; E328-R331 IonicContact OE1-CZ 2.6Å; E328-R331 IonicContact OE1-NE 2.68Å; E328-R331 IonicContact OE1-NH2 3.17Å; E328-R331 PolarHBondContact OE1-NH2 3.06Å; E328-R331 IonicContact OE2-CZ 3.65Å; E328-R331 IonicContact OE2-NE 3.65Å; E328-R331 PolarHBondContact OE2-NE 3.22Å; E328-R331 IonicContact OE2-NH2 3.51Å; E328-R331 PolarHBondContact OE2-NH2 3.14Å; R331-A333 PolarHBondContact O-N 2.78Å; R331-R334 PolarHBondContact O-N 3.23Å; R331-E335 IonicContact CZ-OE1 2.88Å; R331-E335 IonicContact CZ-OE2 3.64Å; R331-E335 IonicContact NH1-OE1 2.75Å; R331-E335 PolarHBondContact NH1-OE1 2.91Å; R331-E335 IonicContact NH1-OE2 3.94Å; R331-E335 PolarHBondContact NH1-OE2 3.03Å; R331-E335 IonicContact NH2-OE2 3.33Å; R331-E335 PolarHBondContact NH2-OE2 3.15Å; R331-E335 WeakPolarHBondContact O-CG 3.46Å; R331-E335 PolarHBondContact O-N 3.06Å
332	R	68.7	Low	68	Low	120 Å²	120	79.6 Å²	79.6	45%	0.453	39%	0.393	S	S	.	.	H	α-helix	trans	-62.3	-39.3	177.2	-73.8	174.3	-173	-165.2	2.5	113	E328 G329 R334 E335 R336	E328-R332 WeakPolarHBondContact O-CB 3.45Å; E328-R332 WeakPolarHBondContact O-CG 3.34Å; E328-R332 PolarHBondContact O-N 2.85Å; E328-R332 IonicContact OE1-CZ 3.39Å; E328-R332 IonicContact OE1-NE 3.48Å; E328-R332 PolarHBondContact OE1-NE 3.06Å; E328-R332 IonicContact OE1-NH2 3.61Å; E328-R332 PolarHBondContact OE1-NH2 2.97Å; G329-R332 PolarHBondContact O-N 3.48Å; R332-R334 VanDerWaalsContact C-N 3.34Å; R332-E335 PolarHBondContact O-N 3.29Å; R332-R336 WeakPolarHBondContact O-CG 3.43Å; R332-R336 PolarHBondContact O-N 3.08Å
333	A	69.1	Low	70.7	Confident	10 Å²	10	72.9 Å²	72.9	8%	0.083	35%	0.349	C	S	.	.	H	α-helix	trans	-62.9	-42.2	176.2	0	0	0	0	0	111.4	T315 L318 G329 V330 R331 R336 V337	T315-A333 HydrophobicContact CG2-CB 4.18Å; L318-A333 HydrophobicContact CD2-CB 3.85Å; L318-A333 HydrophobicContact CG-CB 4.3Å; G329-A333 WeakPolarHBondContact O-CB 3.49Å; G329-A333 PolarHBondContact O-N 3.44Å; V330-A333 PolarHBondContact O-N 2.63Å; R331-A333 PolarHBondContact O-N 2.78Å; A333-R336 PolarHBondContact O-N 2.93Å; A333-V337 WeakPolarHBondContact O-CG2 3.32Å; A333-V337 PolarHBondContact O-N 3.42Å
334	R	76	Confident	72.8	Confident	154 Å²	154	67.6 Å²	67.6	58%	0.581	32%	0.321	S	S	*	.	H	α-helix	trans	-65.3	-43.2	175.1	-73.7	179.5	177.2	173.7	1.4	112.4	V330 R331 R332 R336 V337 Q338	V330-R334 WeakPolarHBondContact O-CG 3.2Å; V330-R334 PolarHBondContact O-N 3.34Å; R331-R334 PolarHBondContact O-N 3.23Å; R332-R334 VanDerWaalsContact C-N 3.34Å; R334-R336 VanDerWaalsContact C-N 3.31Å; R334-R336 PolarHBondContact O-N 3.08Å; R334-V337 PolarHBondContact O-N 2.9Å; R334-Q338 WeakPolarHBondContact O-CG 3.18Å; R334-Q338 PolarHBondContact O-N 3.11Å
335	E	77.4	Confident	74.9	Confident	71 Å²	71	60.8 Å²	60.8	33%	0.332	29%	0.285	S	S	.	.	H	α-helix	trans	-59.5	-41.7	175.7	-73.3	179.9	147	0	0	111.9	R331 R332 Q338 Q339	R331-E335 IonicContact CZ-OE1 2.88Å; R331-E335 IonicContact CZ-OE2 3.64Å; R331-E335 IonicContact NH1-OE1 2.75Å; R331-E335 PolarHBondContact NH1-OE1 2.91Å; R331-E335 IonicContact NH1-OE2 3.94Å; R331-E335 PolarHBondContact NH1-OE2 3.03Å; R331-E335 IonicContact NH2-OE2 3.33Å; R331-E335 PolarHBondContact NH2-OE2 3.15Å; R331-E335 WeakPolarHBondContact O-CG 3.46Å; R331-E335 PolarHBondContact O-N 3.06Å; R332-E335 PolarHBondContact O-N 3.29Å; E335-Q338 PolarHBondContact O-N 3.37Å; E335-Q339 WeakPolarHBondContact O-CG 3.41Å; E335-Q339 PolarHBondContact O-N 2.93Å
336	R	78.3	Confident	76.9	Confident	57 Å²	57	55.2 Å²	55.2	22%	0.215	25%	0.252	C	S	.	.	H	α-helix	trans	-65	-43.1	176.2	-74	-172.6	-169.7	121.5	16.9	112.7	V264 R332 A333 R334 Q338 Q339 A340	V264-R336 HydrophobicContact CG2-CB 4.18Å; R332-R336 WeakPolarHBondContact O-CG 3.43Å; R332-R336 PolarHBondContact O-N 3.08Å; A333-R336 PolarHBondContact O-N 2.93Å; R334-R336 VanDerWaalsContact C-N 3.31Å; R334-R336 PolarHBondContact O-N 3.08Å; R336-Q338 VanDerWaalsContact C-N 3.27Å; R336-Q338 PolarHBondContact O-N 3.4Å; R336-Q339 PolarHBondContact O-N 3.44Å; R336-A340 WeakPolarHBondContact O-CB 3.3Å; R336-A340 PolarHBondContact O-N 3.17Å
337	V	81.3	Confident	78.8	Confident	16 Å²	16	53.3 Å²	53.3	10%	0.097	24%	0.243	C	C	.	.	H	α-helix	trans	-60.9	-39	175.6	169.9	0	0	0	0	110.8	V264 A266 A333 R334 Q339 A340 T343 V370 L371	V264-V337 HydrophobicContact CG1-CG2 3.88Å; A266-V337 HydrophobicContact CB-CG2 4.25Å; A333-V337 WeakPolarHBondContact O-CG2 3.32Å; A333-V337 PolarHBondContact O-N 3.42Å; R334-V337 PolarHBondContact O-N 2.9Å; V337-Q339 VanDerWaalsContact C-N 3.33Å; V337-Q339 PolarHBondContact O-N 3.38Å; V337-A340 PolarHBondContact O-N 3.22Å; V337-T343 HydrophobicContact CG1-CG2 4.41Å; V337-T343 HydrophobicContact CG2-CG2 4.47Å; V337-V370 HydrophobicContact CG1-CG1 3.95Å; V337-V370 HydrophobicContact CG2-CG1 4.28Å; V337-L371 HydrophobicContact CG1-CD2 4.29Å
338	Q	81.2	Confident	80.5	Confident	126 Å²	126	47.3 Å²	47.3	59%	0.589	22%	0.216	S	C	*	.	H	α-helix	trans	-66.7	-32.7	176.1	-73.4	175.2	-0.4	0	0	113.3	R334 E335 R336	R334-Q338 WeakPolarHBondContact O-CG 3.18Å; R334-Q338 PolarHBondContact O-N 3.11Å; E335-Q338 PolarHBondContact O-N 3.37Å; R336-Q338 VanDerWaalsContact C-N 3.27Å; R336-Q338 PolarHBondContact O-N 3.4Å
339	Q	81.3	Confident	82.2	Confident	152 Å²	152	44.6 Å²	44.6	71%	0.71	20%	0.203	S	C	*	.	H	α-helix	trans	-86.9	-12.7	179.2	-68.9	175.3	-6.2	0	0	113.3	E335 R336 V337	E335-Q339 WeakPolarHBondContact O-CG 3.41Å; E335-Q339 PolarHBondContact O-N 2.93Å; R336-Q339 PolarHBondContact O-N 3.44Å; V337-Q339 VanDerWaalsContact C-N 3.33Å; V337-Q339 PolarHBondContact O-N 3.38Å
340	A	87.9	Confident	83.7	Confident	8 Å²	8	46.9 Å²	46.9	7%	0.066	21%	0.214	C	C	.	.			trans	-69.6	143	-177.3	0	0	0	0	0	112.2	V264 R336 V337	V264-A340 HydrophobicContact CB-CB 4.01Å; V264-A340 HydrophobicContact CG2-CB 3.65Å; R336-A340 WeakPolarHBondContact O-CB 3.3Å; R336-A340 PolarHBondContact O-N 3.17Å; V337-A340 PolarHBondContact O-N 3.22Å
341	D	90.4	Very high	84.9	Confident	15 Å²	15	49.1 Å²	49.1	8%	0.08	22%	0.224	C	C	.	.	S	Bend	trans	-76.3	-31.9	167.4	-67.1	-58.9	0	0	0	111	R256 V261 H262 M438	R256-D341 IonicContact CZ-OD1 2.76Å; R256-D341 IonicContact NE-OD1 3.17Å; R256-D341 PolarHBondContact NE-OD1 2.91Å; R256-D341 IonicContact NE-OD2 3.41Å; R256-D341 IonicContact NH2-OD1 3.4Å; V261-D341 HydrophobicContact CG1-CB 3.7Å; H262-D341 IonicContact CD2-OD2 3.81Å; H262-D341 PolarHBondContact N-OD2 3.06Å; H262-D341 VanDerWaalsContact N-OD2 3.08Å; H262-D341 PolarHBondContact O-N 3.35Å; D341-M438 HydrophobicContact CB-SD 4.36Å
342	L	91.3	Very high	85.8	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.01	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	132.1	178.7	178.8	60.8	0	0	0	111.6	H262 V263 V264 L344 R381 L383 L431 M438	H262-L342 PolarHBondContact O-N 3.1Å; H262-L342 VanDerWaalsContact O-N 3.16Å; V263-L342 VanDerWaalsContact CA-O 3.31Å; V263-L342 WeakPolarHBondContact CA-O 3.47Å; V263-L342 HydrophobicContact CG2-CB 4.23Å; V263-L342 HydrophobicContact CG2-CD2 4.36Å; V264-L342 PolarHBondContact N-O 2.94Å; L342-L344 HydrophobicContact CD2-CD2 4.24Å; L342-L344 HydrophobicContact CG-CD2 4.33Å; L342-R381 WeakPolarHBondContact CA-O 3.5Å; L342-L383 HydrophobicContact CD1-CB 4.37Å; L342-L431 HydrophobicContact CD2-CD1 3.5Å; L342-L431 VanDerWaalsContact CD2-CD1 3.5Å; L342-M438 HydrophobicContact CB-CE 3.92Å; L342-M438 HydrophobicContact CB-SD 4.33Å; L342-M438 HydrophobicContact CD1-CE 4.05Å; L342-M438 HydrophobicContact CD2-CE 4.38Å; L342-M438 HydrophobicContact CG-CE 4.33Å
343	T	91.3	Very high	86.8	Confident	3 Å²	3	40.1 Å²	40.1	2%	0.018	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	121.7	173.6	-61.2	0	0	0	0	111.1	V264 A266 V337 L345 V370 R381 C382 L383	V264-T343 CarbonylContact O-C 3.6Å; V264-T343 WeakPolarHBondContact O-CA 3.47Å; A266-T343 HydrophobicContact CB-CG2 3.81Å; V337-T343 HydrophobicContact CG1-CG2 4.41Å; V337-T343 HydrophobicContact CG2-CG2 4.47Å; T343-L345 PolarHBondContact O-N 2.85Å; T343-V370 HydrophobicContact CG2-CG1 4.35Å; T343-R381 PolarHBondContact N-O 2.97Å; T343-C382 CarbonylContact O-C 3.58Å; T343-C382 VanDerWaalsContact O-CA 3.29Å; T343-C382 WeakPolarHBondContact O-CA 3.47Å; T343-C382 PolarHBondContact O-SG 3.49Å; T343-C382 VanDerWaalsContact O-SG 3.41Å; T343-L383 PolarHBondContact O-N 3.36Å
344	L	92.3	Very high	87.4	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	99.9	168.9	-53.6	-176.5	0	0	0	108.6	V263 V264 I265 A266 L280 L312 L342 V346 L383 V385 F427 L431	V263-L344 HydrophobicContact CG1-CD1 3.68Å; V263-L344 HydrophobicContact CG1-CD2 4.21Å; V263-L344 HydrophobicContact CG1-CG 3.59Å; V264-L344 PolarHBondContact O-N 2.87Å; I265-L344 HydrophobicContact CG1-CB 4.38Å; I265-L344 HydrophobicContact CG1-CD1 4.09Å; A266-L344 PolarHBondContact N-O 3.47Å; A266-L344 VanDerWaalsContact O-O 3.13Å; L280-L344 HydrophobicContact CD1-CD1 4.38Å; L312-L344 HydrophobicContact CD1-CD1 4.46Å; L342-L344 HydrophobicContact CD2-CD2 4.24Å; L342-L344 HydrophobicContact CG-CD2 4.33Å; L344-V346 PolarHBondContact O-N 2.96Å; L344-L383 HydrophobicContact CD2-CB 3.82Å; L344-L383 HydrophobicContact CD2-CD2 3.84Å; L344-L383 HydrophobicContact CD2-CG 4.28Å; L344-V385 HydrophobicContact CB-CG2 4.48Å; L344-F427 HydrophobicContact CD1-CZ 4.05Å; L344-F427 HydrophobicContact CD2-CE2 4.38Å; L344-F427 HydrophobicContact CD2-CZ 4.44Å; L344-L431 HydrophobicContact CD2-CD1 4.1Å
345	L	91.6	Very high	87.8	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.016	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	101.9	178.4	179.8	57.7	0	0	0	109.7	A266 T343 V347 H366 L367 V370 L383 L384 V385	A266-L345 HydrophobicContact CB-CD1 4.37Å; T343-L345 PolarHBondContact O-N 2.85Å; L345-V347 HydrophobicContact CG-CG2 4.21Å; L345-H366 HydrophobicContact CD2-CB 4.3Å; L345-L367 HydrophobicContact CD2-CD2 3.63Å; L345-L367 HydrophobicContact CD2-CG 3.94Å; L345-V370 HydrophobicContact CD1-CG2 3.97Å; L345-L383 PolarHBondContact N-O 2.92Å; L345-L384 HydrophobicContact CB-CD2 4.07Å; L345-L384 HydrophobicContact CD2-CD2 3.72Å; L345-L384 HydrophobicContact CG-CD2 3.97Å; L345-V385 PolarHBondContact O-N 2.94Å
346	V	92.4	Very high	88.1	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	122.2	-179.3	-170.3	0	0	0	0	110	I265 A266 G267 A271 K273 L276 L344 V385 N387	I265-V346 HydrophobicContact CG2-CG2 3.61Å; A266-V346 PolarHBondContact O-N 3.32Å; G267-V346 WeakPolarHBondContact CA-O 3.08Å; A271-V346 HydrophobicContact CB-CB 4.46Å; A271-V346 HydrophobicContact CB-CG1 4.11Å; A271-V346 WeakPolarHBondContact CB-O 3.38Å; A271-V346 WeakPolarHBondContact O-CG1 3.28Å; K273-V346 HydrophobicContact CG-CB 4.2Å; K273-V346 HydrophobicContact CG-CG2 4.37Å; L276-V346 HydrophobicContact CD2-CG2 3.69Å; L344-V346 PolarHBondContact O-N 2.96Å; V346-V385 CarbonylContact C-O 3.6Å; V346-V385 WeakPolarHBondContact CA-O 3.35Å; V346-V385 HydrophobicContact CG2-CB 4.3Å; V346-N387 HydrophobicContact CG1-CB 4Å
347	V	92.9	Very high	88.4	Confident	5 Å²	5	46.6 Å²	46.6	3%	0.03	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	137.2	179.4	-175.7	0	0	0	0	108.9	L345 S349 I351 L352 L363 L384 V385 L386 N387	L345-V347 HydrophobicContact CG-CG2 4.21Å; V347-S349 PolarHBondContact O-N 2.87Å; V347-I351 HydrophobicContact CG1-CD1 4.3Å; V347-L352 HydrophobicContact CG1-CD2 4.28Å; V347-L363 HydrophobicContact CB-CD2 4.23Å; V347-L363 HydrophobicContact CG1-CD2 4.06Å; V347-L363 HydrophobicContact CG2-CD2 3.9Å; V347-L384 HydrophobicContact CG2-CD2 4.47Å; V347-V385 PolarHBondContact N-O 3.33Å; V347-L386 HydrophobicContact CB-CD2 3.9Å; V347-L386 HydrophobicContact CG1-CD2 4.48Å; V347-L386 HydrophobicContact CG2-CD2 4.48Å; V347-L386 WeakPolarHBondContact O-CA 3.38Å; V347-N387 PolarHBondContact O-N 3.37Å
348	D	93.8	Very high	88.7	Confident	23 Å²	23	51.5 Å²	51.5	12%	0.123	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	120.1	170.6	-170.3	-26.5	0	0	0	109	T350 I351 K388	D348-T350 PolarHBondContact O-N 3.24Å; D348-T350 WeakPolarHBondContact OD1-CB 3.32Å; D348-T350 WeakPolarHBondContact OD1-CG2 3.29Å; D348-T350 PolarHBondContact OD1-N 3.3Å; D348-T350 PolarHBondContact OD1-OG1 3.26Å; D348-T350 PolarHBondContact OD2-OG1 3.45Å; D348-I351 HydrophobicContact CB-CG1 4.23Å; D348-I351 WeakPolarHBondContact O-CG1 3.33Å; D348-I351 PolarHBondContact O-N 3.14Å; D348-K388 WeakPolarHBondContact OD2-CD 3.42Å; D348-K388 WeakPolarHBondContact OD2-CE 3.36Å; D348-K388 IonicContact OD2-NZ 3.23Å; D348-K388 PolarHBondContact OD2-NZ 3.35Å
349	S	93.5	Very high	89	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.007	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-69.5	-18.6	-178.6	63.6	0	0	0	0	113.1	V347 I351 L352 N387 K388 T389	V347-S349 PolarHBondContact O-N 2.87Å; S349-I351 VanDerWaalsContact C-N 3.32Å; S349-I351 PolarHBondContact O-N 3.44Å; S349-L352 PolarHBondContact O-N 3.43Å; S349-N387 WeakPolarHBondContact CB-O 3.5Å; S349-N387 PolarHBondContact N-O 3.45Å; S349-N387 PolarHBondContact OG-O 3.41Å; S349-K388 VanDerWaalsContact OG-C 3.3Å; S349-K388 PolarHBondContact OG-O 3.14Å; S349-T389 PolarHBondContact OG-N 3.19Å
350	T	91.8	Very high	89.3	Confident	65 Å²	65	38.4 Å²	38.4	40%	0.399	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-74.3	-19.1	-179.9	65.1	0	0	0	0	114.3	D348 L352 L391 L392	D348-T350 PolarHBondContact O-N 3.24Å; D348-T350 WeakPolarHBondContact OD1-CB 3.32Å; D348-T350 WeakPolarHBondContact OD1-CG2 3.29Å; D348-T350 PolarHBondContact OD1-N 3.3Å; D348-T350 PolarHBondContact OD1-OG1 3.26Å; D348-T350 PolarHBondContact OD2-OG1 3.45Å; T350-L352 VanDerWaalsContact C-N 3.35Å; T350-L391 HydrophobicContact CG2-CB 3.65Å; T350-L391 HydrophobicContact CG2-CD1 3.85Å; T350-L391 HydrophobicContact CG2-CG 4.37Å; T350-L392 HydrophobicContact CG2-CD2 4.48Å
351	I	90.6	Very high	89.3	Confident	91 Å²	91	40.7 Å²	40.7	47%	0.467	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-87.8	-7.7	175.8	63.4	158.4	0	0	0	112.6	V347 D348 S349	V347-I351 HydrophobicContact CG1-CD1 4.3Å; D348-I351 HydrophobicContact CB-CG1 4.23Å; D348-I351 WeakPolarHBondContact O-CG1 3.33Å; D348-I351 PolarHBondContact O-N 3.14Å; S349-I351 VanDerWaalsContact C-N 3.32Å; S349-I351 PolarHBondContact O-N 3.44Å
352	L	89.8	Confident	89.1	Confident	6 Å²	6	42.1 Å²	42.1	3%	0.031	23%	0.227	C	C	.	.	S	Bend	trans	-78.1	133.3	-179.6	-63.6	179.4	0	0	0	110.2	V347 S349 T350 A359 L362 L363 L386	V347-L352 HydrophobicContact CG1-CD2 4.28Å; S349-L352 PolarHBondContact O-N 3.43Å; T350-L352 VanDerWaalsContact C-N 3.35Å; L352-A359 HydrophobicContact CB-CB 4.38Å; L352-L362 HydrophobicContact CD2-CD2 3.81Å; L352-L363 HydrophobicContact CD2-CD2 4.03Å; L352-L363 HydrophobicContact CD2-CG 4.11Å; L352-L386 HydrophobicContact CD1-CD1 3.84Å; L352-L386 HydrophobicContact CD1-CD2 4.04Å; L352-L386 HydrophobicContact CD1-CG 4.47Å
353	P	88.4	Confident	89	Confident	34 Å²	34	42 Å²	42	22%	0.221	23%	0.227	C	C	.	.			trans	-62.4	154.4	173	27.7	-34.4	0	0	0	110.7	E355 E358 A359	P353-E355 PolarHBondContact O-N 2.73Å; P353-E358 HydrophobicContact CB-CB 4.02Å; P353-E358 HydrophobicContact CG-CB 3.5Å; P353-E358 VanDerWaalsContact CG-CB 3.5Å; P353-A359 HydrophobicContact CG-CB 4.05Å; P353-A359 VanDerWaalsContact CG-N 3.34Å
354	S	81.4	Confident	88.8	Confident	71 Å²	71	43.9 Å²	43.9	50%	0.497	24%	0.237	S	C	.	.	S	Bend	trans	-69.1	-23.7	180	-58.3	0	0	0	0	113
355	E	85.6	Confident	88.4	Confident	119 Å²	119	50.1 Å²	50.1	56%	0.556	27%	0.266	S	S	*	.	S	Bend	trans	-81.9	128.6	177.2	-71.7	-59.3	149.1	0	0	111.1	P353 Q357 E358 A359	P353-E355 PolarHBondContact O-N 2.73Å; E355-Q357 PolarHBondContact O-N 2.93Å; E355-E358 HydrophobicContact CB-CB 4.32Å; E355-E358 HydrophobicContact CB-CG 4.14Å; E355-E358 PolarHBondContact O-N 3.5Å; E355-A359 WeakPolarHBondContact O-CB 3.4Å; E355-A359 PolarHBondContact O-N 2.72Å
356	E	83	Confident	88.1	Confident	71 Å²	71	52.5 Å²	52.5	33%	0.332	28%	0.277	S	S	.	.	H	α-helix	trans	-60.5	-43.6	-173.2	178.3	-170.6	155.8	0	0	112.8	A359 A360 G403	E356-A359 PolarHBondContact O-N 2.84Å; E356-A360 VanDerWaalsContact O-CB 3.27Å; E356-A360 WeakPolarHBondContact O-CB 3.49Å; E356-A360 PolarHBondContact O-N 3.45Å; E356-G403 VanDerWaalsContact CD-C 3.4Å; E356-G403 WeakPolarHBondContact OE1-CA 3.38Å; E356-G403 WeakPolarHBondContact OE2-CA 3.48Å
357	Q	84.8	Confident	87.6	Confident	166 Å²	166	53.1 Å²	53.1	78%	0.776	28%	0.28	S	S	*	.	H	α-helix	trans	-67.1	-39	-177.2	-68.5	179.6	-10.2	0	0	111.6	E355 A361	E355-Q357 PolarHBondContact O-N 2.93Å; Q357-A361 WeakPolarHBondContact O-CB 3.46Å; Q357-A361 PolarHBondContact O-N 3.2Å
358	E	87.3	Confident	87.1	Confident	119 Å²	119	61.3 Å²	61.3	56%	0.556	31%	0.31	S	S	*	.	H	α-helix	trans	-70	-40.9	176.6	-62.3	-178.1	177.8	0	0	110.9	P353 E355 A360 A361 L362	P353-E358 HydrophobicContact CB-CB 4.02Å; P353-E358 HydrophobicContact CG-CB 3.5Å; P353-E358 VanDerWaalsContact CG-CB 3.5Å; E355-E358 HydrophobicContact CB-CB 4.32Å; E355-E358 HydrophobicContact CB-CG 4.14Å; E355-E358 PolarHBondContact O-N 3.5Å; E358-A360 VanDerWaalsContact C-N 3.34Å; E358-A360 PolarHBondContact O-N 3.34Å; E358-A361 PolarHBondContact O-N 3.33Å; E358-L362 PolarHBondContact O-N 3.38Å
359	A	87.4	Confident	86.5	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-64	-43.3	177.6	0	0	0	0	0	110.8	L352 P353 E355 E356 L362 L363 L400 L404	L352-A359 HydrophobicContact CB-CB 4.38Å; P353-A359 HydrophobicContact CG-CB 4.05Å; P353-A359 VanDerWaalsContact CG-N 3.34Å; E355-A359 WeakPolarHBondContact O-CB 3.4Å; E355-A359 PolarHBondContact O-N 2.72Å; E356-A359 PolarHBondContact O-N 2.84Å; A359-L362 PolarHBondContact O-N 3.1Å; A359-L363 VanDerWaalsContact O-CG 3.26Å; A359-L363 WeakPolarHBondContact O-CG 3.44Å; A359-L363 PolarHBondContact O-N 3.19Å; A359-L400 HydrophobicContact CB-CD2 3.93Å; A359-L404 HydrophobicContact CB-CD2 4.36Å
360	A	87.1	Confident	85.7	Confident	4 Å²	4	65.7 Å²	65.7	3%	0.033	34%	0.341	C	S	.	.	H	α-helix	trans	-61.9	-42.9	174.5	0	0	0	0	0	112.7	E356 E358 L362 L363 L364 L404 V407 L410	E356-A360 VanDerWaalsContact O-CB 3.27Å; E356-A360 WeakPolarHBondContact O-CB 3.49Å; E356-A360 PolarHBondContact O-N 3.45Å; E358-A360 VanDerWaalsContact C-N 3.34Å; E358-A360 PolarHBondContact O-N 3.34Å; A360-L362 VanDerWaalsContact C-N 3.34Å; A360-L362 PolarHBondContact O-N 3.06Å; A360-L363 PolarHBondContact O-N 3.37Å; A360-L364 WeakPolarHBondContact O-CB 3.29Å; A360-L364 WeakPolarHBondContact O-CG 2.99Å; A360-L364 PolarHBondContact O-N 3.03Å; A360-L404 HydrophobicContact CB-CD2 3.99Å; A360-V407 HydrophobicContact CB-CB 4.42Å; A360-V407 HydrophobicContact CB-CG1 3.95Å; A360-V407 HydrophobicContact CB-CG2 3.91Å; A360-L410 HydrophobicContact CB-CD1 4.2Å
361	A	87.6	Confident	84.8	Confident	56 Å²	56	64.3 Å²	64.3	46%	0.463	33%	0.331	S	S	.	.	H	α-helix	trans	-60.3	-44.7	177.1	0	0	0	0	0	111.6	Q357 E358 L364 E365	Q357-A361 WeakPolarHBondContact O-CB 3.46Å; Q357-A361 PolarHBondContact O-N 3.2Å; E358-A361 PolarHBondContact O-N 3.33Å; A361-L364 PolarHBondContact O-N 3.37Å; A361-E365 PolarHBondContact O-N 3.07Å
362	L	87.8	Confident	83.6	Confident	44 Å²	44	61.9 Å²	61.9	23%	0.23	32%	0.322	C	S	.	.	H	α-helix	trans	-64.9	-40.9	177.4	-171.9	154	0	0	0	111.8	L352 E358 A359 A360 E365 H366	L352-L362 HydrophobicContact CD2-CD2 3.81Å; E358-L362 PolarHBondContact O-N 3.38Å; A359-L362 PolarHBondContact O-N 3.1Å; A360-L362 VanDerWaalsContact C-N 3.34Å; A360-L362 PolarHBondContact O-N 3.06Å; L362-E365 WeakPolarHBondContact O-CB 3.34Å; L362-E365 PolarHBondContact O-N 3.36Å; L362-H366 WeakPolarHBondContact CD2-CE1 3.22Å; L362-H366 WeakPolarHBondContact CD2-ND1 3.17Å; L362-H366 PolarHBondContact O-N 3.07Å; L362-H366 PolarHBondContact O-ND1 2.93Å
363	L	88.1	Confident	81.9	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-65.1	-40.7	175.7	-70.7	172.6	0	0	0	112.1	V347 L352 A359 A360 E365 H366 L367 L384 L386 L404 L410	V347-L363 HydrophobicContact CB-CD2 4.23Å; V347-L363 HydrophobicContact CG1-CD2 4.06Å; V347-L363 HydrophobicContact CG2-CD2 3.9Å; L352-L363 HydrophobicContact CD2-CD2 4.03Å; L352-L363 HydrophobicContact CD2-CG 4.11Å; A359-L363 VanDerWaalsContact O-CG 3.26Å; A359-L363 WeakPolarHBondContact O-CG 3.44Å; A359-L363 PolarHBondContact O-N 3.19Å; A360-L363 PolarHBondContact O-N 3.37Å; L363-E365 VanDerWaalsContact C-N 3.31Å; L363-E365 PolarHBondContact O-N 3.39Å; L363-H366 PolarHBondContact O-N 2.87Å; L363-L367 WeakPolarHBondContact O-CG 3.12Å; L363-L367 PolarHBondContact O-N 3.26Å; L363-L384 HydrophobicContact CB-CD1 4.45Å; L363-L384 HydrophobicContact CD1-CD1 4.47Å; L363-L384 HydrophobicContact CD2-CD2 4.24Å; L363-L386 HydrophobicContact CD1-CD2 4.32Å; L363-L386 HydrophobicContact CD2-CD2 3.81Å; L363-L404 HydrophobicContact CD1-CD1 3.77Å; L363-L404 HydrophobicContact CD1-CD2 3.99Å; L363-L410 HydrophobicContact CB-CD2 4.02Å
364	L	86.8	Confident	80.1	Confident	43 Å²	43	73.1 Å²	73.1	23%	0.225	38%	0.382	C	S	.	.	H	α-helix	trans	-63.6	-37.2	174.2	-74.5	169.5	0	0	0	111.9	A360 A361 L367 R368 L410	A360-L364 WeakPolarHBondContact O-CB 3.29Å; A360-L364 WeakPolarHBondContact O-CG 2.99Å; A360-L364 PolarHBondContact O-N 3.03Å; A361-L364 PolarHBondContact O-N 3.37Å; L364-L367 HydrophobicContact CD2-CD1 4.33Å; L364-L367 PolarHBondContact O-N 3.32Å; L364-R368 VanDerWaalsContact O-CG 3.27Å; L364-R368 WeakPolarHBondContact O-CG 3.5Å; L364-R368 PolarHBondContact O-N 3.48Å; L364-L410 HydrophobicContact CD2-CD2 3.73Å; L364-L410 HydrophobicContact CD2-CG 4.41Å; L364-L410 HydrophobicContact CG-CD2 3.75Å; L364-L410 HydrophobicContact CG-CG 4.49Å
365	E	85.4	Confident	78.7	Confident	131 Å²	131	71.9 Å²	71.9	61%	0.612	37%	0.37	S	S	*	.	H	α-helix	trans	-63.7	-45.2	173.6	-172.7	178.4	-175.9	0	0	111.8	A361 L362 L363 L367 R368 S369	A361-E365 PolarHBondContact O-N 3.07Å; L362-E365 WeakPolarHBondContact O-CB 3.34Å; L362-E365 PolarHBondContact O-N 3.36Å; L363-E365 VanDerWaalsContact C-N 3.31Å; L363-E365 PolarHBondContact O-N 3.39Å; E365-L367 VanDerWaalsContact C-N 3.34Å; E365-L367 PolarHBondContact O-N 3.2Å; E365-R368 PolarHBondContact O-N 2.95Å; E365-S369 PolarHBondContact O-N 2.84Å
366	H	83.9	Confident	76.9	Confident	53 Å²	53	73.4 Å²	73.4	25%	0.245	38%	0.377	C	S	.	.	H	α-helix	trans	-63.2	-39.4	175.3	-77	70.5	0	0	0	112.4	L345 L362 L363 R368 S369 V370	L345-H366 HydrophobicContact CD2-CB 4.3Å; L362-H366 WeakPolarHBondContact CD2-CE1 3.22Å; L362-H366 WeakPolarHBondContact CD2-ND1 3.17Å; L362-H366 PolarHBondContact O-N 3.07Å; L362-H366 PolarHBondContact O-ND1 2.93Å; L363-H366 PolarHBondContact O-N 2.87Å; H366-R368 VanDerWaalsContact C-N 3.33Å; H366-R368 PolarHBondContact O-N 2.84Å; H366-S369 PolarHBondContact O-N 3.11Å; H366-S369 PolarHBondContact O-OG 3.41Å; H366-V370 WeakPolarHBondContact O-CG2 3.28Å; H366-V370 PolarHBondContact O-N 2.97Å
367	L	83.2	Confident	75.2	Confident	13 Å²	13	76 Å²	76	7%	0.068	40%	0.403	C	S	.	.	H	α-helix	trans	-60.9	-43.9	174.3	-76.5	165.4	0	0	0	111.4	L345 L363 L364 E365 S369 V370 L371 C382 L384 L410 P411	L345-L367 HydrophobicContact CD2-CD2 3.63Å; L345-L367 HydrophobicContact CD2-CG 3.94Å; L363-L367 WeakPolarHBondContact O-CG 3.12Å; L363-L367 PolarHBondContact O-N 3.26Å; L364-L367 HydrophobicContact CD2-CD1 4.33Å; L364-L367 PolarHBondContact O-N 3.32Å; E365-L367 VanDerWaalsContact C-N 3.34Å; E365-L367 PolarHBondContact O-N 3.2Å; L367-S369 VanDerWaalsContact C-N 3.31Å; L367-S369 PolarHBondContact O-N 2.87Å; L367-V370 PolarHBondContact O-N 3.02Å; L367-L371 HydrophobicContact CD2-CD1 4.07Å; L367-L371 VanDerWaalsContact O-CB 3.27Å; L367-L371 WeakPolarHBondContact O-CB 3.17Å; L367-L371 WeakPolarHBondContact O-CG 3.38Å; L367-L371 PolarHBondContact O-N 2.88Å; L367-C382 HydrophobicContact CD2-CB 4.3Å; L367-C382 WeakPolarHBondContact CD2-SG 3.47Å; L367-L384 HydrophobicContact CD1-CD1 4.05Å; L367-L384 HydrophobicContact CD2-CD2 4.19Å; L367-L384 HydrophobicContact CD2-CG 4.39Å; L367-L384 HydrophobicContact CG-CD2 4.31Å; L367-L410 HydrophobicContact CD1-CD2 3.9Å; L367-P411 VanDerWaalsContact CD1-CD 3.4Å; L367-P411 HydrophobicContact CD1-CG 3.92Å; L367-P411 HydrophobicContact CD2-CG 3.98Å
368	R	82.1	Confident	73.4	Confident	178 Å²	178	68.9 Å²	68.9	67%	0.672	37%	0.374	S	S	*	.	H	α-helix	trans	-68.5	-26.4	178.3	-71	171	-170.8	156.2	3.4	113.5	L364 E365 H366 L371	L364-R368 VanDerWaalsContact O-CG 3.27Å; L364-R368 WeakPolarHBondContact O-CG 3.5Å; L364-R368 PolarHBondContact O-N 3.48Å; E365-R368 PolarHBondContact O-N 2.95Å; H366-R368 VanDerWaalsContact C-N 3.33Å; H366-R368 PolarHBondContact O-N 2.84Å; R368-L371 VanDerWaalsContact O-O 3.07Å
369	S	79.8	Confident	71.6	Confident	77 Å²	77	66 Å²	66	54%	0.538	37%	0.371	S	S	.	.	H	α-helix	trans	-79.4	-26.9	177.8	74	0	0	0	0	112.6	E365 H366 L367	E365-S369 PolarHBondContact O-N 2.84Å; H366-S369 PolarHBondContact O-N 3.11Å; H366-S369 PolarHBondContact O-OG 3.41Å; L367-S369 VanDerWaalsContact C-N 3.31Å; L367-S369 PolarHBondContact O-N 2.87Å
370	V	76.8	Confident	70.4	Confident	39 Å²	39	69 Å²	69	24%	0.236	40%	0.401	C	S	.	.	H	α-helix	trans	-93.7	-41.7	-179.5	175.7	0	0	0	0	112	A266 V337 T343 L345 H366 L367	A266-V370 HydrophobicContact CB-CG1 4.03Å; V337-V370 HydrophobicContact CG1-CG1 3.95Å; V337-V370 HydrophobicContact CG2-CG1 4.28Å; T343-V370 HydrophobicContact CG2-CG1 4.35Å; L345-V370 HydrophobicContact CD1-CG2 3.97Å; H366-V370 WeakPolarHBondContact O-CG2 3.28Å; H366-V370 PolarHBondContact O-N 2.97Å; L367-V370 PolarHBondContact O-N 3.02Å
371	L	74.6	Confident	70.1	Confident	35 Å²	35	74 Å²	74	18%	0.183	42%	0.419	C	S	.	.	S	Bend	trans	-92.1	137	179.7	-58.8	172.5	0	0	0	110.3	V337 L367 R368 C382	V337-L371 HydrophobicContact CG1-CD2 4.29Å; L367-L371 HydrophobicContact CD2-CD1 4.07Å; L367-L371 VanDerWaalsContact O-CB 3.27Å; L367-L371 WeakPolarHBondContact O-CB 3.17Å; L367-L371 WeakPolarHBondContact O-CG 3.38Å; L367-L371 PolarHBondContact O-N 2.88Å; R368-L371 VanDerWaalsContact O-O 3.07Å; L371-C382 HydrophobicContact CD1-CB 4.14Å
372	S	64.4	Low	70.1	Confident	40 Å²	40	71.7 Å²	71.7	28%	0.28	40%	0.399	S	S	.	.			trans	-67.1	152.9	178.8	81.5	0	0	0	0	111.5	Q374 D375	S372-Q374 PolarHBondContact O-N 3.21Å; S372-Q374 VanDerWaalsContact O-N 3.09Å; S372-D375 PolarHBondContact O-N 2.87Å; S372-D375 PolarHBondContact OG-OD2 3.45Å
373	S	53.7	Low	70.3	Confident	96 Å²	96	69.6 Å²	69.6	67%	0.671	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-62.2	-16.2	-179.8	46.9	0	0	0	0	114.3	Q376	S373-Q376 WeakPolarHBondContact O-CG 3.49Å
374	Q	50.4	Low	70.5	Confident	181 Å²	181	69.6 Å²	69.6	85%	0.846	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-84.1	-14.6	174.3	-65.6	-165.1	-11.5	0	0	113.5	S372	S372-Q374 PolarHBondContact O-N 3.21Å; S372-Q374 VanDerWaalsContact O-N 3.09Å
375	D	53.3	Low	70.9	Confident	45 Å²	45	67.6 Å²	67.6	24%	0.241	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-92.7	14.2	178.4	-71.7	-60.3	0	0	0	113.1	S372 S377 G378 R381	S372-D375 PolarHBondContact O-N 2.87Å; S372-D375 PolarHBondContact OG-OD2 3.45Å; D375-S377 PolarHBondContact O-N 3.16Å; D375-S377 VanDerWaalsContact O-N 3.07Å; D375-G378 VanDerWaalsContact O-CA 3.26Å; D375-G378 WeakPolarHBondContact O-CA 3.27Å; D375-G378 PolarHBondContact O-N 3.25Å; D375-R381 IonicContact OD1-NH1 2.76Å; D375-R381 PolarHBondContact OD1-NH1 3.23Å
376	Q	47.7	Very low	71.4	Confident	150 Å²	150	61.3 Å²	61.3	70%	0.701	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-10.9	-176.8	-70.6	-176.3	13.2	0	0	114.3	S373 G378	S373-Q376 WeakPolarHBondContact O-CG 3.49Å; Q376-G378 VanDerWaalsContact C-N 3.3Å
377	S	46.3	Very low	71.9	Confident	126 Å²	126	59 Å²	59	88%	0.881	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-3.6	167.1	-54.7	0	0	0	0	113.1	D375 A379	D375-S377 PolarHBondContact O-N 3.16Å; D375-S377 VanDerWaalsContact O-N 3.07Å; S377-A379 PolarHBondContact O-N 2.91Å
378	G	47.1	Very low	72.5	Confident	16 Å²	16	61 Å²	61	17%	0.165	35%	0.346	C	S	.	.			trans	-93.4	35.4	-165.3	0	0	0	0	0	115.9	D375 Q376 G380 R381	D375-G378 VanDerWaalsContact O-CA 3.26Å; D375-G378 WeakPolarHBondContact O-CA 3.27Å; D375-G378 PolarHBondContact O-N 3.25Å; Q376-G378 VanDerWaalsContact C-N 3.3Å; G378-G380 PolarHBondContact O-N 3.34Å; G378-R381 PolarHBondContact O-N 3.41Å
379	A	50.6	Low	73.1	Confident	60 Å²	60	52.6 Å²	52.6	50%	0.496	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-19	171.8	0	0	0	0	0	113.2	S377	S377-A379 PolarHBondContact O-N 2.91Å
380	G	62.2	Low	73.8	Confident	61 Å²	61	51.4 Å²	51.4	63%	0.629	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-3.2	173.8	0	0	0	0	0	116.3	G378	G378-G380 PolarHBondContact O-N 3.34Å
381	R	79.4	Confident	74.6	Confident	111 Å²	111	54.9 Å²	54.9	42%	0.419	32%	0.319	S	S	.	.	S	Bend	trans	-106.8	3.4	-178	-75.5	-176.8	156.7	173.7	-8.1	114.1	L342 T343 D375 G378	L342-R381 WeakPolarHBondContact CA-O 3.5Å; T343-R381 PolarHBondContact N-O 2.97Å; D375-R381 IonicContact OD1-NH1 2.76Å; D375-R381 PolarHBondContact OD1-NH1 3.23Å; G378-R381 PolarHBondContact O-N 3.41Å
382	C	88.6	Confident	75.4	Confident	6 Å²	6	53.9 Å²	53.9	4%	0.041	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	145.7	179.7	-169.8	0	0	0	0	111.3	T343 L367 L371 P411	T343-C382 CarbonylContact O-C 3.58Å; T343-C382 VanDerWaalsContact O-CA 3.29Å; T343-C382 WeakPolarHBondContact O-CA 3.47Å; T343-C382 PolarHBondContact O-SG 3.49Å; T343-C382 VanDerWaalsContact O-SG 3.41Å; L367-C382 HydrophobicContact CD2-CB 4.3Å; L367-C382 WeakPolarHBondContact CD2-SG 3.47Å; L371-C382 HydrophobicContact CD1-CB 4.14Å; C382-P411 HydrophobicContact CB-CB 4.26Å; C382-P411 HydrophobicContact CB-CG 4.27Å; C382-P411 VanDerWaalsContact O-CB 3.27Å; C382-P411 WeakPolarHBondContact O-CB 3.3Å
383	L	91.4	Very high	76.7	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.005	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	120.2	170.1	-177.5	62.5	0	0	0	107.7	L342 T343 L344 L345 V385 P412 F427 V430 L431	L342-L383 HydrophobicContact CD1-CB 4.37Å; T343-L383 PolarHBondContact O-N 3.36Å; L344-L383 HydrophobicContact CD2-CB 3.82Å; L344-L383 HydrophobicContact CD2-CD2 3.84Å; L344-L383 HydrophobicContact CD2-CG 4.28Å; L345-L383 PolarHBondContact N-O 2.92Å; L383-V385 HydrophobicContact CG-CG2 4.42Å; L383-P412 HydrophobicContact CD1-CB 3.74Å; L383-P412 WeakPolarHBondContact CD1-O 3.39Å; L383-F427 HydrophobicContact CD2-CD2 3.91Å; L383-F427 HydrophobicContact CD2-CE2 3.49Å; L383-F427 VanDerWaalsContact CD2-CE2 3.49Å; L383-F427 HydrophobicContact CD2-CZ 4.48Å; L383-F427 HydrophobicContact CG-CE2 4.32Å; L383-V430 HydrophobicContact CD1-CG1 3.61Å; L383-V430 HydrophobicContact CD2-CG1 4.31Å; L383-L431 HydrophobicContact CD2-CB 4.46Å
384	L	92.7	Very high	78.4	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	125	177.4	-83	170.9	0	0	0	109.8	L345 V347 L363 L367 L410 P411 P412 V413 C414	L345-L384 HydrophobicContact CB-CD2 4.07Å; L345-L384 HydrophobicContact CD2-CD2 3.72Å; L345-L384 HydrophobicContact CG-CD2 3.97Å; V347-L384 HydrophobicContact CG2-CD2 4.47Å; L363-L384 HydrophobicContact CB-CD1 4.45Å; L363-L384 HydrophobicContact CD1-CD1 4.47Å; L363-L384 HydrophobicContact CD2-CD2 4.24Å; L367-L384 HydrophobicContact CD1-CD1 4.05Å; L367-L384 HydrophobicContact CD2-CD2 4.19Å; L367-L384 HydrophobicContact CD2-CG 4.39Å; L367-L384 HydrophobicContact CG-CD2 4.31Å; L384-L410 HydrophobicContact CD1-CD2 3.91Å; L384-P411 HydrophobicContact CB-CG 4.49Å; L384-P411 HydrophobicContact CD1-CG 3.72Å; L384-P411 HydrophobicContact CG-CG 3.7Å; L384-P412 PolarHBondContact N-O 2.83Å; L384-V413 HydrophobicContact CB-CB 4.44Å; L384-V413 HydrophobicContact CB-CG1 4.38Å; L384-V413 HydrophobicContact CB-CG2 4.12Å; L384-V413 HydrophobicContact CD1-CG2 3.92Å; L384-C414 PolarHBondContact O-N 3.35Å
385	V	94.6	Very high	80.2	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	99.9	-178.5	-174	0	0	0	0	109	L276 L344 L345 V346 V347 L383 N387 C414 I416 F427	L276-V385 HydrophobicContact CD2-CG1 4.1Å; L344-V385 HydrophobicContact CB-CG2 4.48Å; L345-V385 PolarHBondContact O-N 2.94Å; V346-V385 CarbonylContact C-O 3.6Å; V346-V385 WeakPolarHBondContact CA-O 3.35Å; V346-V385 HydrophobicContact CG2-CB 4.3Å; V347-V385 PolarHBondContact N-O 3.33Å; L383-V385 HydrophobicContact CG-CG2 4.42Å; V385-N387 PolarHBondContact O-N 2.83Å; V385-C414 CarbonylContact C-O 3.43Å; V385-C414 WeakPolarHBondContact CA-O 3.33Å; V385-I416 HydrophobicContact CG1-CD1 3.26Å; V385-I416 HydrophobicContact CG1-CG1 3.64Å; V385-F427 HydrophobicContact CG1-CE2 4.49Å; V385-F427 HydrophobicContact CG2-CD2 4.03Å; V385-F427 HydrophobicContact CG2-CE2 3.47Å; V385-F427 VanDerWaalsContact CG2-CE2 3.47Å; V385-F427 HydrophobicContact CG2-CZ 4.29Å
386	L	95.4	Very high	81.8	Confident	0 Å²	0	52 Å²	52	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	104.4	177.8	-52.5	-172.3	0	0	0	108.8	V347 L352 L363 T389 L404 V413 C414 L415 I416	V347-L386 HydrophobicContact CB-CD2 3.9Å; V347-L386 HydrophobicContact CG1-CD2 4.48Å; V347-L386 HydrophobicContact CG2-CD2 4.48Å; V347-L386 WeakPolarHBondContact O-CA 3.38Å; L352-L386 HydrophobicContact CD1-CD1 3.84Å; L352-L386 HydrophobicContact CD1-CD2 4.04Å; L352-L386 HydrophobicContact CD1-CG 4.47Å; L363-L386 HydrophobicContact CD1-CD2 4.32Å; L363-L386 HydrophobicContact CD2-CD2 3.81Å; L386-T389 WeakPolarHBondContact O-CG2 3.31Å; L386-L404 HydrophobicContact CD1-CD1 3.57Å; L386-V413 HydrophobicContact CD1-CG1 3.68Å; L386-V413 HydrophobicContact CG-CG1 3.81Å; L386-C414 PolarHBondContact N-O 2.94Å; L386-L415 HydrophobicContact CB-CG 4.38Å; L386-L415 HydrophobicContact CD1-CD1 4.38Å; L386-L415 HydrophobicContact CD1-CG 4.31Å; L386-I416 PolarHBondContact O-N 3.13Å
387	N	95.5	Very high	83.7	Confident	5 Å²	5	47.4 Å²	47.4	3%	0.027	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	165.5	-174.5	-173.4	36.5	0	0	0	112.2	A271 G272 V346 V347 S349 V385 I416 C418	A271-N387 WeakPolarHBondContact O-CB 3.34Å; A271-N387 PolarHBondContact O-ND2 3.34Å; G272-N387 WeakPolarHBondContact CA-ND2 3.41Å; V346-N387 HydrophobicContact CG1-CB 4Å; V347-N387 PolarHBondContact O-N 3.37Å; S349-N387 WeakPolarHBondContact CB-O 3.5Å; S349-N387 PolarHBondContact N-O 3.45Å; S349-N387 PolarHBondContact OG-O 3.41Å; V385-N387 PolarHBondContact O-N 2.83Å; N387-I416 CarbonylContact C-O 3.3Å; N387-I416 VanDerWaalsContact CA-O 3.27Å; N387-I416 WeakPolarHBondContact CA-O 3.29Å; N387-I416 HydrophobicContact CB-CG1 4.21Å; N387-C418 PolarHBondContact OD1-N 3.4Å; N387-C418 VanDerWaalsContact OD1-N 3.09Å; N387-C418 PolarHBondContact OD1-SG 3.24Å
388	K	95.6	Very high	85.7	Confident	53 Å²	53	47 Å²	47	23%	0.23	27%	0.266	C	S	.	.			trans	66.2	30	-178.6	-47.2	-174	-169	167.4	0	114.7	N270 D348 S349 D390 L391 I416	N270-K388 WeakPolarHBondContact O-CE 3.5Å; N270-K388 PolarHBondContact O-NZ 3.06Å; D348-K388 WeakPolarHBondContact OD2-CD 3.42Å; D348-K388 WeakPolarHBondContact OD2-CE 3.36Å; D348-K388 IonicContact OD2-NZ 3.23Å; D348-K388 PolarHBondContact OD2-NZ 3.35Å; S349-K388 VanDerWaalsContact OG-C 3.3Å; S349-K388 PolarHBondContact OG-O 3.14Å; K388-D390 VanDerWaalsContact C-OD1 3.25Å; K388-D390 VanDerWaalsContact CA-OD1 3.32Å; K388-D390 WeakPolarHBondContact CA-OD1 3.5Å; K388-D390 PolarHBondContact O-N 3.34Å; K388-D390 VanDerWaalsContact O-N 3.09Å; K388-L391 HydrophobicContact CB-CD1 4.09Å; K388-L391 HydrophobicContact CB-CG 4.39Å; K388-L391 HydrophobicContact CD-CD1 4.17Å; K388-L391 WeakPolarHBondContact O-CB 3.39Å; K388-L391 PolarHBondContact O-N 3.43Å; K388-I416 PolarHBondContact N-O 2.96Å
389	T	94.2	Very high	87.6	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.012	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-63.1	-18.4	-178.6	56.8	0	0	0	0	113.2	S349 L386 L391 L392 R397 L415 I416	S349-T389 PolarHBondContact OG-N 3.19Å; L386-T389 WeakPolarHBondContact O-CG2 3.31Å; T389-L391 PolarHBondContact O-N 2.93Å; T389-L392 PolarHBondContact O-N 3.42Å; T389-L392 VanDerWaalsContact O-N 3.11Å; T389-R397 PolarHBondContact O-NE 3.35Å; T389-R397 PolarHBondContact O-NH2 3.35Å; T389-L415 HydrophobicContact CG2-CB 3.94Å; T389-L415 HydrophobicContact CG2-CD2 4.14Å; T389-L415 HydrophobicContact CG2-CG 4.23Å; T389-I416 WeakPolarHBondContact CG2-O 3.47Å; T389-I416 PolarHBondContact N-O 3.43Å; T389-I416 VanDerWaalsContact OG1-C 3.26Å; T389-I416 PolarHBondContact OG1-O 3.17Å; T389-I416 VanDerWaalsContact OG1-O 3.14Å
390	D	94.3	Very high	89.3	Confident	53 Å²	53	49.6 Å²	49.6	28%	0.283	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-60.9	-24.1	171.7	56.2	-66.5	0	0	0	113.5	K388 S417 T420	K388-D390 VanDerWaalsContact C-OD1 3.25Å; K388-D390 VanDerWaalsContact CA-OD1 3.32Å; K388-D390 WeakPolarHBondContact CA-OD1 3.5Å; K388-D390 PolarHBondContact O-N 3.34Å; K388-D390 VanDerWaalsContact O-N 3.09Å; D390-S417 WeakPolarHBondContact OD1-CB 3.15Å; D390-S417 PolarHBondContact OD1-OG 2.86Å; D390-T420 HydrophobicContact CB-CG2 3.84Å
391	L	94.5	Very high	90.3	Very high	111 Å²	111	49.4 Å²	49.4	58%	0.581	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-85.6	-10.4	176.5	-57.8	-178.4	0	0	0	113.1	T350 K388 T389	T350-L391 HydrophobicContact CG2-CB 3.65Å; T350-L391 HydrophobicContact CG2-CD1 3.85Å; T350-L391 HydrophobicContact CG2-CG 4.37Å; K388-L391 HydrophobicContact CB-CD1 4.09Å; K388-L391 HydrophobicContact CB-CG 4.39Å; K388-L391 HydrophobicContact CD-CD1 4.17Å; K388-L391 WeakPolarHBondContact O-CB 3.39Å; K388-L391 PolarHBondContact O-N 3.43Å; T389-L391 PolarHBondContact O-N 2.93Å
392	L	92.1	Very high	90.5	Very high	14 Å²	14	49.1 Å²	49.1	7%	0.073	25%	0.253	C	S	.	.	S	Bend	trans	-89.1	140.5	178.2	-64.3	-175.1	0	0	0	111.6	T350 T389 R397 L400	T350-L392 HydrophobicContact CG2-CD2 4.48Å; T389-L392 PolarHBondContact O-N 3.42Å; T389-L392 VanDerWaalsContact O-N 3.11Å; L392-R397 PolarHBondContact O-NH2 2.86Å; L392-L400 HydrophobicContact CD1-CD1 3.74Å
393	P	91.8	Very high	90.3	Very high	81 Å²	81	49 Å²	49	53%	0.526	25%	0.252	S	S	.	.			trans	-55.7	143.9	166.7	-21.6	32.3	0	0	0	111.4	A395 Q396 R397	P393-A395 VanDerWaalsContact C-N 3.31Å; P393-A395 PolarHBondContact O-N 3.19Å; P393-Q396 HydrophobicContact CB-CB 4.49Å; P393-Q396 WeakPolarHBondContact O-CB 3.45Å; P393-Q396 PolarHBondContact O-N 3.36Å; P393-R397 PolarHBondContact O-N 2.9Å
394	E	89.1	Confident	90	Very high	147 Å²	147	49 Å²	49	69%	0.687	25%	0.252	S	S	*	.	H	α-helix	trans	-53.8	-45.8	-177.6	-172	172.6	-167.3	0	0	112.4	Q396 R397 E398	E394-Q396 VanDerWaalsContact C-N 3.29Å; E394-Q396 PolarHBondContact O-N 3.43Å; E394-R397 WeakPolarHBondContact O-CB 3.44Å; E394-R397 PolarHBondContact O-N 3.02Å; E394-R397 VanDerWaalsContact O-N 3.12Å; E394-E398 PolarHBondContact O-N 2.75Å
395	A	87.7	Confident	89.4	Confident	64 Å²	64	57.1 Å²	57.1	53%	0.529	28%	0.283	S	S	.	.	H	α-helix	trans	-60.1	-34.6	177.4	0	0	0	0	0	113.6	P393 K399	P393-A395 VanDerWaalsContact C-N 3.31Å; P393-A395 PolarHBondContact O-N 3.19Å; A395-K399 VanDerWaalsContact O-CG 3.31Å; A395-K399 WeakPolarHBondContact O-CG 3.5Å; A395-K399 PolarHBondContact O-N 2.88Å
396	Q	87.9	Confident	88.7	Confident	31 Å²	31	66.4 Å²	66.4	15%	0.145	32%	0.318	C	S	.	.	H	α-helix	trans	-75	-40	176.2	-172.9	178.7	-1.2	0	0	110.9	P393 E394 E398 K399 L400	P393-Q396 HydrophobicContact CB-CB 4.49Å; P393-Q396 WeakPolarHBondContact O-CB 3.45Å; P393-Q396 PolarHBondContact O-N 3.36Å; E394-Q396 VanDerWaalsContact C-N 3.29Å; E394-Q396 PolarHBondContact O-N 3.43Å; Q396-E398 PolarHBondContact O-N 3.45Å; Q396-K399 PolarHBondContact O-N 3.46Å; Q396-L400 HydrophobicContact CG-CD1 4.28Å; Q396-L400 WeakPolarHBondContact O-CG 3.31Å; Q396-L400 PolarHBondContact O-N 2.97Å
397	R	87.8	Confident	88	Confident	53 Å²	53	68.2 Å²	68.2	20%	0.2	33%	0.329	C	S	.	.	H	α-helix	trans	-60.2	-44.6	177.3	-166.4	-173	-57.9	172.3	8.3	111.7	T389 L392 P393 E394 N401 L415 E422	T389-R397 PolarHBondContact O-NE 3.35Å; T389-R397 PolarHBondContact O-NH2 3.35Å; L392-R397 PolarHBondContact O-NH2 2.86Å; P393-R397 PolarHBondContact O-N 2.9Å; E394-R397 WeakPolarHBondContact O-CB 3.44Å; E394-R397 PolarHBondContact O-N 3.02Å; E394-R397 VanDerWaalsContact O-N 3.12Å; R397-N401 WeakPolarHBondContact O-CB 3.48Å; R397-N401 PolarHBondContact O-N 3.3Å; R397-L415 HydrophobicContact CG-CD2 3.96Å; R397-E422 IonicContact CZ-OE1 3.94Å; R397-E422 IonicContact CZ-OE2 3.37Å; R397-E422 IonicContact NH1-OE1 3.12Å; R397-E422 PolarHBondContact NH1-OE1 2.82Å; R397-E422 IonicContact NH1-OE2 2.67Å; R397-E422 PolarHBondContact NH1-OE2 3.16Å
398	E	86.7	Confident	87.2	Confident	117 Å²	117	73.3 Å²	73.3	55%	0.547	37%	0.365	S	S	.	.	H	α-helix	trans	-64.7	-45.4	177	-71.8	-170.5	152	0	0	112.3	E394 Q396 L400 N401 L402	E394-E398 PolarHBondContact O-N 2.75Å; Q396-E398 PolarHBondContact O-N 3.45Å; E398-L400 PolarHBondContact O-N 3.34Å; E398-N401 PolarHBondContact O-N 2.93Å; E398-L402 PolarHBondContact O-N 3.19Å
399	K	87.2	Confident	86.4	Confident	130 Å²	130	73.7 Å²	73.7	57%	0.565	38%	0.384	S	S	*	.	H	α-helix	trans	-56.4	-49.1	175.6	-80.6	-178.5	176.8	-170	0	111.7	A395 Q396 N401 G403	A395-K399 VanDerWaalsContact O-CG 3.31Å; A395-K399 WeakPolarHBondContact O-CG 3.5Å; A395-K399 PolarHBondContact O-N 2.88Å; Q396-K399 PolarHBondContact O-N 3.46Å; K399-N401 PolarHBondContact O-N 2.6Å; K399-G403 WeakPolarHBondContact O-CA 3.31Å; K399-G403 PolarHBondContact O-N 3.46Å
400	L	86.1	Confident	85.8	Confident	1 Å²	1	74.6 Å²	74.6	1%	0.005	39%	0.389	C	S	.	.	H	α-helix	trans	-62.9	-42.6	178.5	-71.3	173.4	0	0	0	112.1	A359 L392 Q396 E398 L404 L415	A359-L400 HydrophobicContact CB-CD2 3.93Å; L392-L400 HydrophobicContact CD1-CD1 3.74Å; Q396-L400 HydrophobicContact CG-CD1 4.28Å; Q396-L400 WeakPolarHBondContact O-CG 3.31Å; Q396-L400 PolarHBondContact O-N 2.97Å; E398-L400 PolarHBondContact O-N 3.34Å; L400-L404 HydrophobicContact CB-CD1 4.3Å; L400-L404 HydrophobicContact CD2-CD1 4.09Å; L400-L404 HydrophobicContact CD2-CG 4.42Å; L400-L404 VanDerWaalsContact O-CB 3.29Å; L400-L404 WeakPolarHBondContact O-CB 3.5Å; L400-L404 WeakPolarHBondContact O-CG 3.34Å; L400-L404 PolarHBondContact O-N 3.36Å; L400-L415 HydrophobicContact CB-CD2 4.37Å
401	N	84.7	Confident	85.4	Confident	57 Å²	57	72.5 Å²	72.5	31%	0.305	38%	0.378	S	S	.	.	H	α-helix	trans	-66.1	-40.3	-178.8	-172.6	31.4	0	0	0	112.8	R397 E398 K399 R405 L415	R397-N401 WeakPolarHBondContact O-CB 3.48Å; R397-N401 PolarHBondContact O-N 3.3Å; E398-N401 PolarHBondContact O-N 2.93Å; K399-N401 PolarHBondContact O-N 2.6Å; N401-R405 VanDerWaalsContact O-CD 3.23Å; N401-R405 WeakPolarHBondContact O-CD 3.46Å; N401-R405 WeakPolarHBondContact O-CG 3.4Å; N401-R405 PolarHBondContact O-NE 3.47Å; N401-R405 PolarHBondContact OD1-NE 2.81Å; N401-R405 PolarHBondContact OD1-NH2 3.32Å; N401-L415 HydrophobicContact CB-CD1 4.03Å; N401-L415 HydrophobicContact CB-CD2 4.16Å
402	L	83.1	Confident	85.2	Confident	106 Å²	106	70.4 Å²	70.4	56%	0.555	37%	0.371	S	S	*	.	H	α-helix	trans	-77.3	-39.7	178.2	-76.4	165.3	0	0	0	112.4	E398	E398-L402 PolarHBondContact O-N 3.19Å
403	G	83.7	Confident	85.1	Confident	2 Å²	2	70.5 Å²	70.5	2%	0.021	37%	0.372	C	S	.	.	H	α-helix	trans	-72	-57.6	-174.9	0	0	0	0	0	113.1	E356 K399 R405 R406	E356-G403 VanDerWaalsContact CD-C 3.4Å; E356-G403 WeakPolarHBondContact OE1-CA 3.38Å; E356-G403 WeakPolarHBondContact OE2-CA 3.48Å; K399-G403 WeakPolarHBondContact O-CA 3.31Å; K399-G403 PolarHBondContact O-N 3.46Å; G403-R405 PolarHBondContact O-N 3Å; G403-R406 WeakPolarHBondContact O-CB 3.34Å; G403-R406 PolarHBondContact O-N 2.67Å
404	L	84.8	Confident	85.2	Confident	2 Å²	2	67.1 Å²	67.1	1%	0.01	35%	0.35	C	S	.	.	H	α-helix	trans	-62.1	-24.9	-174.2	-64.1	176.6	0	0	0	113.6	A359 A360 L363 L386 L400 R406 L410 V413	A359-L404 HydrophobicContact CB-CD2 4.36Å; A360-L404 HydrophobicContact CB-CD2 3.99Å; L363-L404 HydrophobicContact CD1-CD1 3.77Å; L363-L404 HydrophobicContact CD1-CD2 3.99Å; L386-L404 HydrophobicContact CD1-CD1 3.57Å; L400-L404 HydrophobicContact CB-CD1 4.3Å; L400-L404 HydrophobicContact CD2-CD1 4.09Å; L400-L404 HydrophobicContact CD2-CG 4.42Å; L400-L404 VanDerWaalsContact O-CB 3.29Å; L400-L404 WeakPolarHBondContact O-CB 3.5Å; L400-L404 WeakPolarHBondContact O-CG 3.34Å; L400-L404 PolarHBondContact O-N 3.36Å; L404-R406 VanDerWaalsContact C-N 3.26Å; L404-R406 PolarHBondContact O-N 3.12Å; L404-L410 HydrophobicContact CB-CD1 4.39Å; L404-L410 HydrophobicContact CD2-CD1 4.04Å; L404-V413 HydrophobicContact CB-CG2 4.36Å; L404-V413 HydrophobicContact CD1-CG1 4.36Å
405	R	80.1	Confident	85.5	Confident	171 Å²	171	61.4 Å²	61.4	65%	0.645	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-20.9	174.1	-70.8	-179.1	-170.5	-141.6	1.4	113.7	N401 G403	N401-R405 VanDerWaalsContact O-CD 3.23Å; N401-R405 WeakPolarHBondContact O-CD 3.46Å; N401-R405 WeakPolarHBondContact O-CG 3.4Å; N401-R405 PolarHBondContact O-NE 3.47Å; N401-R405 PolarHBondContact OD1-NE 2.81Å; N401-R405 PolarHBondContact OD1-NH2 3.32Å; G403-R405 PolarHBondContact O-N 3Å
406	R	80.2	Confident	85.8	Confident	195 Å²	195	58.3 Å²	58.3	74%	0.736	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-13.7	-177.6	-65.5	175.8	178.1	178.5	0.4	112.9	G403 L404 S408	G403-R406 WeakPolarHBondContact O-CB 3.34Å; G403-R406 PolarHBondContact O-N 2.67Å; L404-R406 VanDerWaalsContact C-N 3.26Å; L404-R406 PolarHBondContact O-N 3.12Å; R406-S408 PolarHBondContact O-N 2.73Å
407	V	81.2	Confident	86.2	Confident	37 Å²	37	56.9 Å²	56.9	22%	0.224	29%	0.292	C	S	.	.	S	Bend	trans	-73.5	119.2	-178.7	179.3	0	0	0	0	109.9	A360 G409 L410	A360-V407 HydrophobicContact CB-CB 4.42Å; A360-V407 HydrophobicContact CB-CG1 3.95Å; A360-V407 HydrophobicContact CB-CG2 3.91Å; V407-G409 PolarHBondContact O-N 3.06Å; V407-L410 HydrophobicContact CB-CD1 3.85Å; V407-L410 HydrophobicContact CB-CG 4.28Å; V407-L410 HydrophobicContact CG1-CD1 4Å; V407-L410 HydrophobicContact CG1-CG 4.06Å; V407-L410 HydrophobicContact CG2-CD1 4.43Å
408	S	78.3	Confident	86.4	Confident	112 Å²	112	54.7 Å²	54.7	78%	0.783	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	132.6	174.5	57.8	0	0	0	0	111.4	R406	R406-S408 PolarHBondContact O-N 2.73Å
409	G	78.6	Confident	86.7	Confident	61 Å²	61	56.5 Å²	56.5	63%	0.629	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.4	-6.7	175.2	0	0	0	0	0	114.9	V407	V407-G409 PolarHBondContact O-N 3.06Å
410	L	82.6	Confident	87	Confident	22 Å²	22	53.7 Å²	53.7	12%	0.115	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-79.2	138.4	165.7	-72.5	179.5	0	0	0	110.3	A360 L363 L364 L367 L384 L404 V407	A360-L410 HydrophobicContact CB-CD1 4.2Å; L363-L410 HydrophobicContact CB-CD2 4.02Å; L364-L410 HydrophobicContact CD2-CD2 3.73Å; L364-L410 HydrophobicContact CD2-CG 4.41Å; L364-L410 HydrophobicContact CG-CD2 3.75Å; L364-L410 HydrophobicContact CG-CG 4.49Å; L367-L410 HydrophobicContact CD1-CD2 3.9Å; L384-L410 HydrophobicContact CD1-CD2 3.91Å; L404-L410 HydrophobicContact CB-CD1 4.39Å; L404-L410 HydrophobicContact CD2-CD1 4.04Å; V407-L410 HydrophobicContact CB-CD1 3.85Å; V407-L410 HydrophobicContact CB-CG 4.28Å; V407-L410 HydrophobicContact CG1-CD1 4Å; V407-L410 HydrophobicContact CG1-CG 4.06Å; V407-L410 HydrophobicContact CG2-CD1 4.43Å
411	P	86.4	Confident	87.3	Confident	9 Å²	9	56.4 Å²	56.4	6%	0.058	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-66	171.1	166.2	31.9	-35.7	0	0	0	110.2	L367 C382 L384 V413	L367-P411 VanDerWaalsContact CD1-CD 3.4Å; L367-P411 HydrophobicContact CD1-CG 3.92Å; L367-P411 HydrophobicContact CD2-CG 3.98Å; C382-P411 HydrophobicContact CB-CB 4.26Å; C382-P411 HydrophobicContact CB-CG 4.27Å; C382-P411 VanDerWaalsContact O-CB 3.27Å; C382-P411 WeakPolarHBondContact O-CB 3.3Å; L384-P411 HydrophobicContact CB-CG 4.49Å; L384-P411 HydrophobicContact CD1-CG 3.72Å; L384-P411 HydrophobicContact CG-CG 3.7Å; P411-V413 WeakPolarHBondContact O-CG2 2.89Å; P411-V413 PolarHBondContact O-N 3.28Å
412	P	88.7	Confident	87.7	Confident	67 Å²	67	58.1 Å²	58.1	44%	0.435	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-52.1	135.1	176.4	-23.9	33.3	0	0	0	111.5	L383 L384 V430	L383-P412 HydrophobicContact CD1-CB 3.74Å; L383-P412 WeakPolarHBondContact CD1-O 3.39Å; L384-P412 PolarHBondContact N-O 2.83Å; P412-V430 HydrophobicContact CB-CG1 4.34Å
413	V	91.3	Very high	88.1	Confident	15 Å²	15	54.2 Å²	54.2	9%	0.091	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127.4	-176.5	-174.1	0	0	0	0	109.6	L384 L386 L404 P411 L415	L384-V413 HydrophobicContact CB-CB 4.44Å; L384-V413 HydrophobicContact CB-CG1 4.38Å; L384-V413 HydrophobicContact CB-CG2 4.12Å; L384-V413 HydrophobicContact CD1-CG2 3.92Å; L386-V413 HydrophobicContact CD1-CG1 3.68Å; L386-V413 HydrophobicContact CG-CG1 3.81Å; L404-V413 HydrophobicContact CB-CG2 4.36Å; L404-V413 HydrophobicContact CD1-CG1 4.36Å; P411-V413 WeakPolarHBondContact O-CG2 2.89Å; P411-V413 PolarHBondContact O-N 3.28Å; V413-L415 HydrophobicContact CG1-CD1 4.26Å
414	C	93.4	Very high	88.5	Confident	11 Å²	11	54.1 Å²	54.1	7%	0.074	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	120	175.5	-65	0	0	0	0	110.2	L384 V385 L386 F427	L384-C414 PolarHBondContact O-N 3.35Å; V385-C414 CarbonylContact C-O 3.43Å; V385-C414 WeakPolarHBondContact CA-O 3.33Å; L386-C414 PolarHBondContact N-O 2.94Å; C414-F427 HydrophobicContact CB-CB 4.14Å; C414-F427 HydrophobicContact CB-CD2 3.86Å; C414-F427 HydrophobicContact CB-CG 4.48Å
415	L	94.7	Very high	88.8	Confident	26 Å²	26	61.6 Å²	61.6	14%	0.136	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	123.5	171.2	-79.2	87.5	0	0	0	108.9	L386 T389 R397 L400 N401 V413 G423	L386-L415 HydrophobicContact CB-CG 4.38Å; L386-L415 HydrophobicContact CD1-CD1 4.38Å; L386-L415 HydrophobicContact CD1-CG 4.31Å; T389-L415 HydrophobicContact CG2-CB 3.94Å; T389-L415 HydrophobicContact CG2-CD2 4.14Å; T389-L415 HydrophobicContact CG2-CG 4.23Å; R397-L415 HydrophobicContact CG-CD2 3.96Å; L400-L415 HydrophobicContact CB-CD2 4.37Å; N401-L415 HydrophobicContact CB-CD1 4.03Å; N401-L415 HydrophobicContact CB-CD2 4.16Å; V413-L415 HydrophobicContact CG1-CD1 4.26Å; L415-G423 WeakPolarHBondContact O-CA 3.26Å
416	I	95.6	Very high	89.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.321	C	S	.	.			trans	-138.2	156.7	-179.3	69.6	167.4	0	0	0	112.2	L276 V385 L386 N387 K388 T389 E422 F427	L276-I416 HydrophobicContact CD1-CD1 3.75Å; V385-I416 HydrophobicContact CG1-CD1 3.26Å; V385-I416 HydrophobicContact CG1-CG1 3.64Å; L386-I416 PolarHBondContact O-N 3.13Å; N387-I416 CarbonylContact C-O 3.3Å; N387-I416 VanDerWaalsContact CA-O 3.27Å; N387-I416 WeakPolarHBondContact CA-O 3.29Å; N387-I416 HydrophobicContact CB-CG1 4.21Å; K388-I416 PolarHBondContact N-O 2.96Å; T389-I416 WeakPolarHBondContact CG2-O 3.47Å; T389-I416 PolarHBondContact N-O 3.43Å; T389-I416 VanDerWaalsContact OG1-C 3.26Å; T389-I416 PolarHBondContact OG1-O 3.17Å; T389-I416 VanDerWaalsContact OG1-O 3.14Å; I416-E422 WeakPolarHBondContact CA-O 3.32Å; I416-F427 HydrophobicContact CG2-CB 3.8Å; I416-F427 HydrophobicContact CG2-CG 4.33Å
417	S	95.6	Very high	89.9	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.286	C	S	.	.			trans	-120.8	114.4	158.1	174.3	0	0	0	0	109.5	D390 Q419 T420 N421 E422	D390-S417 WeakPolarHBondContact OD1-CB 3.15Å; D390-S417 PolarHBondContact OD1-OG 2.86Å; S417-Q419 PolarHBondContact O-N 2.94Å; S417-Q419 PolarHBondContact OG-N 3.5Å; S417-T420 WeakPolarHBondContact CB-OG1 3.49Å; S417-T420 PolarHBondContact OG-N 3.43Å; S417-T420 VanDerWaalsContact OG-N 3.12Å; S417-T420 PolarHBondContact OG-OG1 2.91Å; S417-N421 WeakPolarHBondContact O-CA 3.17Å; S417-N421 PolarHBondContact O-N 3.48Å; S417-E422 PolarHBondContact N-O 3.27Å
418	C	92.4	Very high	90.5	Very high	7 Å²	7	49.2 Å²	49.2	5%	0.047	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-20	170.9	-64.7	0	0	0	0	112.4	K279 N387	K279-C418 WeakPolarHBondContact CE-O 3.22Å; K279-C418 HydrophobicContact CG-CB 4.42Å; N387-C418 PolarHBondContact OD1-N 3.4Å; N387-C418 VanDerWaalsContact OD1-N 3.09Å; N387-C418 PolarHBondContact OD1-SG 3.24Å
419	Q	92.8	Very high	91.1	Very high	156 Å²	156	47.4 Å²	47.4	73%	0.729	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-51.6	179.6	-170.8	73.7	10.9	0	0	110.9	S417	S417-Q419 PolarHBondContact O-N 2.94Å; S417-Q419 PolarHBondContact OG-N 3.5Å
420	T	93.2	Very high	91.8	Very high	70 Å²	70	46.7 Å²	46.7	43%	0.429	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-14.9	-176.6	68.3	0	0	0	0	113.1	D390 S417 E422	D390-T420 HydrophobicContact CB-CG2 3.84Å; S417-T420 WeakPolarHBondContact CB-OG1 3.49Å; S417-T420 PolarHBondContact OG-N 3.43Å; S417-T420 VanDerWaalsContact OG-N 3.12Å; S417-T420 PolarHBondContact OG-OG1 2.91Å; T420-E422 PolarHBondContact O-N 3.03Å; T420-E422 WeakPolarHBondContact OG1-CB 3.33Å; T420-E422 PolarHBondContact OG1-N 3.34Å
421	N	91.5	Very high	92.3	Very high	58 Å²	58	45.8 Å²	45.8	31%	0.31	25%	0.247	S	C	.	.			trans	67.9	12.5	-171	-37.7	-84	0	0	0	115.5	K279 R283 S417	K279-N421 WeakPolarHBondContact CD-OD1 3.33Å; K279-N421 WeakPolarHBondContact CE-OD1 3.39Å; K279-N421 PolarHBondContact NZ-OD1 3.34Å; R283-N421 VanDerWaalsContact NH2-CB 3.34Å; S417-N421 WeakPolarHBondContact O-CA 3.17Å; S417-N421 PolarHBondContact O-N 3.48Å
422	E	93.2	Very high	92.6	Very high	93 Å²	93	48.9 Å²	48.9	44%	0.435	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	142.8	172.1	-165	-175.2	154.8	0	0	110.7	R397 I416 S417 T420 L424	R397-E422 IonicContact CZ-OE1 3.94Å; R397-E422 IonicContact CZ-OE2 3.37Å; R397-E422 IonicContact NH1-OE1 3.12Å; R397-E422 PolarHBondContact NH1-OE1 2.82Å; R397-E422 IonicContact NH1-OE2 2.67Å; R397-E422 PolarHBondContact NH1-OE2 3.16Å; I416-E422 WeakPolarHBondContact CA-O 3.32Å; S417-E422 PolarHBondContact N-O 3.27Å; T420-E422 PolarHBondContact O-N 3.03Å; T420-E422 WeakPolarHBondContact OG1-CB 3.33Å; T420-E422 PolarHBondContact OG1-N 3.34Å; E422-L424 PolarHBondContact O-N 3.2Å
423	G	91.6	Very high	92.8	Very high	24 Å²	24	48.8 Å²	48.8	25%	0.247	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	-14.6	-179.8	0	0	0	0	0	115.8	L415 K425 D426 F427	L415-G423 WeakPolarHBondContact O-CA 3.26Å; G423-K425 VanDerWaalsContact C-N 3.28Å; G423-K425 PolarHBondContact O-N 3.14Å; G423-D426 PolarHBondContact O-N 3.22Å; G423-F427 PolarHBondContact O-N 2.71Å
424	L	91.4	Very high	92.8	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-66.1	-27.5	-174	-171.3	63.8	0	0	0	113.2	L276 K279 R283 E422 F427 L428	L276-L424 HydrophobicContact CD1-CD1 4.13Å; K279-L424 HydrophobicContact CB-CD2 3.93Å; K279-L424 HydrophobicContact CG-CD2 4.36Å; R283-L424 VanDerWaalsContact CZ-CD2 3.41Å; R283-L424 VanDerWaalsContact NH1-CG 3.27Å; E422-L424 PolarHBondContact O-N 3.2Å; L424-F427 HydrophobicContact CD1-CD1 3.75Å; L424-F427 HydrophobicContact CD1-CE1 4.35Å; L424-L428 VanDerWaalsContact O-CG 3.28Å; L424-L428 WeakPolarHBondContact O-CG 3.17Å; L424-L428 PolarHBondContact O-N 3.29Å
425	K	91.3	Very high	92.7	Very high	158 Å²	158	49 Å²	49	69%	0.687	26%	0.264	S	S	*	.	H	α-helix	trans	-69.1	-42.9	175.5	-174.5	-177.2	177.3	-174.2	0	111.8	G423 L428 T429	G423-K425 VanDerWaalsContact C-N 3.28Å; G423-K425 PolarHBondContact O-N 3.14Å; K425-L428 PolarHBondContact O-N 3.03Å; K425-T429 PolarHBondContact O-N 2.91Å; K425-T429 VanDerWaalsContact O-N 3.08Å; K425-T429 PolarHBondContact O-OG1 3.43Å
426	D	91.8	Very high	92.6	Very high	106 Å²	106	53 Å²	53	57%	0.567	28%	0.28	S	S	*	.	H	α-helix	trans	-68.4	-42.5	179	-61.9	-16.9	0	0	0	109.9	G423 L428 T429 V430	G423-D426 PolarHBondContact O-N 3.22Å; D426-L428 PolarHBondContact O-N 3.3Å; D426-T429 WeakPolarHBondContact O-CB 3.21Å; D426-T429 PolarHBondContact O-N 3.2Å; D426-T429 VanDerWaalsContact O-N 3.1Å; D426-V430 WeakPolarHBondContact O-CG2 3.4Å; D426-V430 PolarHBondContact O-N 3.34Å
427	F	93.3	Very high	92.4	Very high	1 Å²	1	57.4 Å²	57.4	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-53.8	-48.9	171.1	166.8	-103.2	0	0	0	112.4	L276 L280 L344 L383 V385 C414 I416 G423 L424 T429 V430 L431	L276-F427 HydrophobicContact CD1-CE1 3.95Å; L276-F427 HydrophobicContact CD1-CZ 4.33Å; L276-F427 HydrophobicContact CD2-CZ 4.45Å; L280-F427 HydrophobicContact CD2-CE1 3.94Å; L344-F427 HydrophobicContact CD1-CZ 4.05Å; L344-F427 HydrophobicContact CD2-CE2 4.38Å; L344-F427 HydrophobicContact CD2-CZ 4.44Å; L383-F427 HydrophobicContact CD2-CD2 3.91Å; L383-F427 HydrophobicContact CD2-CE2 3.49Å; L383-F427 VanDerWaalsContact CD2-CE2 3.49Å; L383-F427 HydrophobicContact CD2-CZ 4.48Å; L383-F427 HydrophobicContact CG-CE2 4.32Å; V385-F427 HydrophobicContact CG1-CE2 4.49Å; V385-F427 HydrophobicContact CG2-CD2 4.03Å; V385-F427 HydrophobicContact CG2-CE2 3.47Å; V385-F427 VanDerWaalsContact CG2-CE2 3.47Å; V385-F427 HydrophobicContact CG2-CZ 4.29Å; C414-F427 HydrophobicContact CB-CB 4.14Å; C414-F427 HydrophobicContact CB-CD2 3.86Å; C414-F427 HydrophobicContact CB-CG 4.48Å; I416-F427 HydrophobicContact CG2-CB 3.8Å; I416-F427 HydrophobicContact CG2-CG 4.33Å; G423-F427 PolarHBondContact O-N 2.71Å; L424-F427 HydrophobicContact CD1-CD1 3.75Å; L424-F427 HydrophobicContact CD1-CE1 4.35Å; F427-T429 VanDerWaalsContact C-N 3.26Å; F427-T429 PolarHBondContact O-N 2.78Å; F427-V430 PolarHBondContact O-N 3.36Å; F427-L431 HydrophobicContact CE1-CD2 4.29Å; F427-L431 HydrophobicContact CZ-CD2 4.19Å; F427-L431 WeakPolarHBondContact O-CB 3.31Å; F427-L431 PolarHBondContact O-N 3.24Å
428	L	92.3	Very high	92.2	Very high	37 Å²	37	58.6 Å²	58.6	19%	0.194	31%	0.313	C	S	.	.	H	α-helix	trans	-60.9	-36.2	177.4	-76.4	171.4	0	0	0	112.4	L280 L424 K425 D426 L431 Q432	L280-L428 HydrophobicContact CD2-CD2 3.62Å; L424-L428 VanDerWaalsContact O-CG 3.28Å; L424-L428 WeakPolarHBondContact O-CG 3.17Å; L424-L428 PolarHBondContact O-N 3.29Å; K425-L428 PolarHBondContact O-N 3.03Å; D426-L428 PolarHBondContact O-N 3.3Å; L428-L431 PolarHBondContact O-N 3.48Å; L428-Q432 VanDerWaalsContact O-CB 3.25Å; L428-Q432 WeakPolarHBondContact O-CB 3.38Å; L428-Q432 PolarHBondContact O-N 3.09Å
429	T	92.3	Very high	92.2	Very high	73 Å²	73	58.4 Å²	58.4	45%	0.448	31%	0.312	S	S	.	.	H	α-helix	trans	-67	-40.9	177.7	-54.2	0	0	0	0	111.4	K425 D426 F427 S433	K425-T429 PolarHBondContact O-N 2.91Å; K425-T429 VanDerWaalsContact O-N 3.08Å; K425-T429 PolarHBondContact O-OG1 3.43Å; D426-T429 WeakPolarHBondContact O-CB 3.21Å; D426-T429 PolarHBondContact O-N 3.2Å; D426-T429 VanDerWaalsContact O-N 3.1Å; F427-T429 VanDerWaalsContact C-N 3.26Å; F427-T429 PolarHBondContact O-N 2.78Å; T429-S433 WeakPolarHBondContact O-CB 3.42Å; T429-S433 PolarHBondContact O-N 2.94Å; T429-S433 PolarHBondContact O-OG 2.83Å
430	V	92.9	Very high	92	Very high	46 Å²	46	51.5 Å²	51.5	28%	0.279	28%	0.282	S	S	.	.	H	α-helix	trans	-68	-43.4	175.7	176	0	0	0	0	111	L383 P412 D426 F427 S433 S434	L383-V430 HydrophobicContact CD1-CG1 3.61Å; L383-V430 HydrophobicContact CD2-CG1 4.31Å; P412-V430 HydrophobicContact CB-CG1 4.34Å; D426-V430 WeakPolarHBondContact O-CG2 3.4Å; D426-V430 PolarHBondContact O-N 3.34Å; F427-V430 PolarHBondContact O-N 3.36Å; V430-S433 PolarHBondContact O-N 3.35Å; V430-S434 PolarHBondContact O-N 3.48Å; V430-S434 PolarHBondContact O-OG 2.89Å
431	L	92.6	Very high	91.7	Very high	3 Å²	3	52 Å²	52	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-60.2	-49.3	176.1	-178.9	60.2	0	0	0	111	L280 I305 L342 L344 L383 F427 L428 S433 S434 V435	L280-L431 HydrophobicContact CD2-CD2 4.41Å; I305-L431 HydrophobicContact CG2-CD2 4.39Å; I305-L431 HydrophobicContact CG2-CG 4.24Å; L342-L431 HydrophobicContact CD2-CD1 3.5Å; L342-L431 VanDerWaalsContact CD2-CD1 3.5Å; L344-L431 HydrophobicContact CD2-CD1 4.1Å; L383-L431 HydrophobicContact CD2-CB 4.46Å; F427-L431 HydrophobicContact CE1-CD2 4.29Å; F427-L431 HydrophobicContact CZ-CD2 4.19Å; F427-L431 WeakPolarHBondContact O-CB 3.31Å; F427-L431 PolarHBondContact O-N 3.24Å; L428-L431 PolarHBondContact O-N 3.48Å; L431-S433 VanDerWaalsContact C-N 3.31Å; L431-S433 PolarHBondContact O-N 3.37Å; L431-S434 WeakPolarHBondContact O-CB 3.4Å; L431-S434 PolarHBondContact O-N 2.61Å; L431-S434 VanDerWaalsContact O-N 3.16Å; L431-V435 HydrophobicContact CD1-CG2 4.26Å; L431-V435 WeakPolarHBondContact O-CG2 3.33Å; L431-V435 PolarHBondContact O-N 3.19Å
432	Q	92.6	Very high	91.3	Very high	75 Å²	75	49.8 Å²	49.8	35%	0.35	27%	0.271	S	S	.	.	H	α-helix	trans	-57.1	-44.3	176.3	-179.3	-176.1	-1.8	0	0	111.8	I305 G306 L428 S434 V435 K436	I305-Q432 HydrophobicContact CG2-CB 4.06Å; G306-Q432 PolarHBondContact O-NE2 3.5Å; L428-Q432 VanDerWaalsContact O-CB 3.25Å; L428-Q432 WeakPolarHBondContact O-CB 3.38Å; L428-Q432 PolarHBondContact O-N 3.09Å; Q432-S434 VanDerWaalsContact C-N 3.31Å; Q432-S434 PolarHBondContact O-N 2.75Å; Q432-V435 PolarHBondContact O-N 3.35Å; Q432-K436 VanDerWaalsContact O-CB 3.24Å; Q432-K436 WeakPolarHBondContact O-CB 3.19Å; Q432-K436 PolarHBondContact O-N 3.3Å
433	S	92.3	Very high	90.8	Very high	65 Å²	65	49.9 Å²	49.9	46%	0.455	27%	0.274	S	S	.	.	H	α-helix	trans	-64.4	-37.8	179.1	-59	0	0	0	0	112	T429 V430 L431 T437	T429-S433 WeakPolarHBondContact O-CB 3.42Å; T429-S433 PolarHBondContact O-N 2.94Å; T429-S433 PolarHBondContact O-OG 2.83Å; V430-S433 PolarHBondContact O-N 3.35Å; L431-S433 VanDerWaalsContact C-N 3.31Å; L431-S433 PolarHBondContact O-N 3.37Å; S433-T437 WeakPolarHBondContact O-CB 3.02Å; S433-T437 PolarHBondContact O-N 3.46Å; S433-T437 VanDerWaalsContact O-N 3.08Å; S433-T437 PolarHBondContact O-OG1 3.21Å
434	S	91.9	Very high	90.4	Very high	29 Å²	29	52.5 Å²	52.5	20%	0.203	29%	0.289	C	S	.	.	H	α-helix	trans	-66.2	-50.2	177.1	-54.8	0	0	0	0	111.1	V430 L431 Q432 K436 T437 M438	V430-S434 PolarHBondContact O-N 3.48Å; V430-S434 PolarHBondContact O-OG 2.89Å; L431-S434 WeakPolarHBondContact O-CB 3.4Å; L431-S434 PolarHBondContact O-N 2.61Å; L431-S434 VanDerWaalsContact O-N 3.16Å; Q432-S434 VanDerWaalsContact C-N 3.31Å; Q432-S434 PolarHBondContact O-N 2.75Å; S434-K436 PolarHBondContact O-N 3.34Å; S434-T437 PolarHBondContact O-N 2.79Å; S434-M438 WeakPolarHBondContact O-CG 3.45Å; S434-M438 PolarHBondContact O-N 3.42Å; S434-M438 VanDerWaalsContact O-N 3.09Å
435	V	92.3	Very high	89.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-60.3	-46.5	177.6	172.8	0	0	0	0	111.1	V261 F308 V310 L431 Q432 T437 M438 C439	V261-V435 HydrophobicContact CB-CG1 4.41Å; V261-V435 HydrophobicContact CG2-CG1 3.9Å; F308-V435 HydrophobicContact CB-CG1 3.43Å; F308-V435 VanDerWaalsContact CB-CG1 3.43Å; F308-V435 HydrophobicContact CG-CG1 4.06Å; V310-V435 HydrophobicContact CG2-CG1 3.96Å; V310-V435 HydrophobicContact CG2-CG2 3.77Å; L431-V435 HydrophobicContact CD1-CG2 4.26Å; L431-V435 WeakPolarHBondContact O-CG2 3.33Å; L431-V435 PolarHBondContact O-N 3.19Å; Q432-V435 PolarHBondContact O-N 3.35Å; V435-T437 VanDerWaalsContact C-N 3.27Å; V435-T437 PolarHBondContact O-N 2.89Å; V435-M438 PolarHBondContact O-N 3.31Å; V435-M438 VanDerWaalsContact O-N 3.17Å; V435-C439 PolarHBondContact O-N 3.34Å
436	K	92.3	Very high	89.4	Confident	110 Å²	110	51 Å²	51	48%	0.478	31%	0.312	S	S	.	.	H	α-helix	trans	-57.6	-40	176.1	177	171.2	-177.6	-176.2	0	112.3	F308 Q432 S434 G440	F308-K436 HydrophobicContact CD2-CB 4.23Å; F308-K436 HydrophobicContact CE1-CB 4.43Å; F308-K436 HydrophobicContact CE1-CG 4.38Å; F308-K436 HydrophobicContact CE2-CB 3.67Å; F308-K436 HydrophobicContact CE2-CD 4.06Å; F308-K436 HydrophobicContact CE2-CG 3.79Å; F308-K436 HydrophobicContact CZ-CB 3.8Å; F308-K436 HydrophobicContact CZ-CD 4.11Å; F308-K436 HydrophobicContact CZ-CG 3.56Å; Q432-K436 VanDerWaalsContact O-CB 3.24Å; Q432-K436 WeakPolarHBondContact O-CB 3.19Å; Q432-K436 PolarHBondContact O-N 3.3Å; S434-K436 PolarHBondContact O-N 3.34Å; K436-G440 WeakPolarHBondContact O-CA 3.49Å; K436-G440 PolarHBondContact O-N 2.95Å
437	T	91.7	Very high	89.1	Confident	94 Å²	94	47.1 Å²	47.1	58%	0.577	29%	0.293	S	S	*	.	H	α-helix	trans	-68	-38.2	179.2	-57.4	0	0	0	0	111.7	S433 S434 V435	S433-T437 WeakPolarHBondContact O-CB 3.02Å; S433-T437 PolarHBondContact O-N 3.46Å; S433-T437 VanDerWaalsContact O-N 3.08Å; S433-T437 PolarHBondContact O-OG1 3.21Å; S434-T437 PolarHBondContact O-N 2.79Å; V435-T437 VanDerWaalsContact C-N 3.27Å; V435-T437 PolarHBondContact O-N 2.89Å
438	M	90.9	Very high	88.9	Confident	24 Å²	24	48.9 Å²	48.9	12%	0.118	30%	0.304	C	S	.	.	H	α-helix	trans	-70.5	-33.2	178.4	-68.2	171.4	-167.6	0	0	113.6	R253 R256 V261 D341 L342 S434 V435	R253-M438 VanDerWaalsContact CG-O 3.3Å; R253-M438 WeakPolarHBondContact CG-O 3.39Å; R256-M438 PolarHBondContact NH1-O 3.24Å; V261-M438 HydrophobicContact CG1-SD 3.86Å; D341-M438 HydrophobicContact CB-SD 4.36Å; L342-M438 HydrophobicContact CB-CE 3.92Å; L342-M438 HydrophobicContact CB-SD 4.33Å; L342-M438 HydrophobicContact CD1-CE 4.05Å; L342-M438 HydrophobicContact CD2-CE 4.38Å; L342-M438 HydrophobicContact CG-CE 4.33Å; S434-M438 WeakPolarHBondContact O-CG 3.45Å; S434-M438 PolarHBondContact O-N 3.42Å; S434-M438 VanDerWaalsContact O-N 3.09Å; V435-M438 PolarHBondContact O-N 3.31Å; V435-M438 VanDerWaalsContact O-N 3.17Å
439	C	91.3	Very high	88.9	Confident	4 Å²	4	47.1 Å²	47.1	3%	0.027	29%	0.294	C	S	.	.	H	α-helix	trans	-87.4	-25.9	177.8	-67.3	0	0	0	0	112.9	R253 L257 V261 F308 V435	R253-C439 WeakPolarHBondContact CB-O 3.45Å; L257-C439 HydrophobicContact CB-CB 4.07Å; L257-C439 HydrophobicContact CD1-CB 4.29Å; V261-C439 WeakPolarHBondContact CG2-SG 3.16Å; F308-C439 HydrophobicContact CD1-CB 3.73Å; F308-C439 HydrophobicContact CE1-CB 3.88Å; V435-C439 PolarHBondContact O-N 3.34Å
440	G	88.9	Confident	88.8	Confident	10 Å²	10	43.9 Å²	43.9	10%	0.103	27%	0.274	C	S	.	.			trans	71.7	-175.3	-169.5	0	0	0	0	0	112.8	K436	K436-G440 WeakPolarHBondContact O-CA 3.49Å; K436-G440 PolarHBondContact O-N 2.95Å
441	D	87.3	Confident	88.7	Confident	82 Å²	82	43.5 Å²	43.5	44%	0.439	27%	0.269	S	S	.	.			trans	-92.8	115.2	172.3	-177.1	-6.8	0	0	0	109.5	L443 S444	D441-L443 PolarHBondContact O-N 3.3Å; D441-L443 VanDerWaalsContact O-N 3.08Å; D441-L443 PolarHBondContact OD1-N 3.36Å; D441-S444 PolarHBondContact O-N 2.87Å; D441-S444 VanDerWaalsContact O-N 3.1Å
442	P	82.8	Confident	88.5	Confident	10 Å²	10	46.6 Å²	46.6	7%	0.065	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-12.2	-179.9	25.7	-34.4	0	0	0	113.9	A182 R185 Q186 R189 L257	A182-P442 HydrophobicContact CB-CG 4.18Å; R185-P442 HydrophobicContact CB-CB 4.34Å; R185-P442 HydrophobicContact CB-CG 4.11Å; Q186-P442 HydrophobicContact CB-CB 4.1Å; R189-P442 WeakPolarHBondContact CD-O 3.47Å; R189-P442 PolarHBondContact NH1-O 3.39Å; L257-P442 HydrophobicContact CD2-CB 3.65Å; L257-P442 HydrophobicContact CD2-CG 3.97Å
443	L	83.6	Confident	88.4	Confident	96 Å²	96	44.6 Å²	44.6	50%	0.503	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-6.7	177.7	-62.1	-178.9	0	0	0	113.4	R185 D441	R185-L443 HydrophobicContact CB-CD2 4.12Å; R185-L443 HydrophobicContact CG-CD2 4.34Å; D441-L443 PolarHBondContact O-N 3.3Å; D441-L443 VanDerWaalsContact O-N 3.08Å; D441-L443 PolarHBondContact OD1-N 3.36Å
444	S	82.4	Confident	88.5	Confident	79 Å²	79	41.5 Å²	41.5	55%	0.552	26%	0.263	S	S	*	.	S	Bend	trans	-103.3	143.7	-176.6	-166	0	0	0	0	111.4	D441	D441-S444 PolarHBondContact O-N 2.87Å; D441-S444 VanDerWaalsContact O-N 3.1Å
445	G	80.4	Confident	88.6	Confident	60 Å²	60	41.7 Å²	41.7	62%	0.619	26%	0.26	S	S	*	.	S	Bend	trans	71.4	-165.9	173.9	0	0	0	0	0	115.7	R189	R189-G445 PolarHBondContact NH2-O 2.89Å
446	A	81.2	Confident	88.8	Confident	68 Å²	68	43.4 Å²	43.4	56%	0.562	27%	0.274	S	S	*	.	S	Bend	trans	-61.8	152.7	176.5	0	0	0	0	0	111.2
447	P	85.9	Confident	88.9	Confident	24 Å²	24	39.4 Å²	39.4	16%	0.156	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-57.3	145	173.8	27.8	-36.1	0	0	0	109.8	E194 L195 L198 H247	E194-P447 HydrophobicContact CB-CB 4.34Å; L195-P447 HydrophobicContact CB-CB 4.3Å; L195-P447 HydrophobicContact CD1-CB 3.93Å; L195-P447 HydrophobicContact CD1-CG 4.02Å; L198-P447 HydrophobicContact CB-CG 4.39Å; L198-P447 HydrophobicContact CD2-CG 3.93Å; H247-P447 PolarHBondContact CE1-O 2.94Å
448	T	89.4	Confident	89.2	Confident	38 Å²	38	34.9 Å²	34.9	23%	0.233	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-96.7	158	-175.1	50.1	0	0	0	0	112.2	T450	T448-T450 PolarHBondContact O-N 3.49Å
449	L	91.5	Very high	89.5	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-73	117	171.2	-62.2	168.7	0	0	0	109.3	Y199 H247 L248 D250 G254 E255 H454 R455 L458	Y199-L449 WeakPolarHBondContact OH-CD2 3.38Å; H247-L449 VanDerWaalsContact NE2-CD2 3.35Å; H247-L449 WeakPolarHBondContact NE2-CD2 3.4Å; L248-L449 HydrophobicContact CD2-CD1 4.12Å; D250-L449 WeakPolarHBondContact OD2-CB 3.42Å; G254-L449 CarbonylContact C-O 3.59Å; G254-L449 WeakPolarHBondContact CA-O 3.32Å; E255-L449 PolarHBondContact N-O 2.88Å; L449-H454 HydrophobicContact CD2-CB 3.81Å; L449-R455 HydrophobicContact CD1-CB 4.43Å; L449-L458 HydrophobicContact CD1-CD1 4.36Å; L449-L458 HydrophobicContact CD2-CD1 3.56Å
450	T	90.9	Very high	89.7	Confident	5 Å²	5	43.6 Å²	43.6	3%	0.031	27%	0.269	C	S	.	.			trans	-99.7	-21.1	-177.4	56.9	0	0	0	0	112.7	Q186 Q190 R258 T448	Q186-T450 HydrophobicContact CG-CG2 3.95Å; Q190-T450 PolarHBondContact NE2-OG1 2.74Å; Q190-T450 PolarHBondContact OE1-OG1 2.76Å; R258-T450 WeakPolarHBondContact CD-O 3.15Å; T448-T450 PolarHBondContact O-N 3.49Å
451	Q	90.1	Very high	90.1	Very high	37 Å²	37	43.1 Å²	43.1	17%	0.173	26%	0.264	C	S	.	.	S	Bend	trans	-124.5	140.2	-176.1	-63.9	-123.3	14.9	0	0	112.2	E170 R453 H454 R455	E170-Q451 VanDerWaalsContact CG-NE2 3.31Å; E170-Q451 PolarHBondContact OE1-NE2 2.85Å; Q451-R453 HydrophobicContact CB-CG 4.27Å; Q451-R453 PolarHBondContact O-N 3.35Å; Q451-H454 WeakPolarHBondContact O-CB 3.41Å; Q451-H454 PolarHBondContact O-N 2.88Å; Q451-R455 PolarHBondContact O-N 2.68Å
452	A	89.6	Confident	90.6	Very high	68 Å²	68	40.2 Å²	40.2	56%	0.562	25%	0.249	S	C	*	.	H	α-helix	trans	-58.5	-33.3	175.4	0	0	0	0	0	112.6	H454 R455 A456	A452-H454 VanDerWaalsContact C-N 3.32Å; A452-H454 PolarHBondContact O-N 3.01Å; A452-R455 WeakPolarHBondContact O-CB 3.41Å; A452-R455 PolarHBondContact O-N 3.24Å; A452-A456 PolarHBondContact O-N 3.27Å
453	R	90.8	Very high	91.3	Very high	34 Å²	34	42.7 Å²	42.7	13%	0.128	27%	0.271	C	S	.	.	H	α-helix	trans	-64.5	-35.1	177.2	84.4	176.4	-178.5	85.1	11.6	112.5	E170 Q451 R455 A456 H457 R492 I493	E170-R453 IonicContact OE1-CZ 2.7Å; E170-R453 IonicContact OE1-NE 3.01Å; E170-R453 PolarHBondContact OE1-NE 2.9Å; E170-R453 IonicContact OE1-NH2 2.89Å; E170-R453 PolarHBondContact OE1-NH2 3.13Å; E170-R453 IonicContact OE2-CZ 3.93Å; E170-R453 IonicContact OE2-NE 3.56Å; E170-R453 IonicContact OE2-NH2 2.71Å; E170-R453 PolarHBondContact OE2-NH2 2.75Å; Q451-R453 HydrophobicContact CB-CG 4.27Å; Q451-R453 PolarHBondContact O-N 3.35Å; R453-R455 VanDerWaalsContact C-N 3.33Å; R453-A456 PolarHBondContact O-N 3Å; R453-H457 PolarHBondContact O-CD2 2.71Å; R453-H457 PolarHBondContact O-N 3.42Å; R453-R492 PolarHBondContact NH1-O 3.43Å; R453-I493 PolarHBondContact NH1-O 3.02Å; R453-I493 VanDerWaalsContact NH1-O 3.16Å; R453-I493 PolarHBondContact NH2-O 2.88Å
454	H	94	Very high	92	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-61.7	-48.7	177.6	-59.4	170.5	0	0	0	108.9	E170 L449 Q451 A452 A456 H457 L458 I493	E170-H454 IonicContact OE2-CD2 2.99Å; E170-H454 IonicContact OE2-CE1 2.69Å; E170-H454 PolarHBondContact OE2-CE1 2.95Å; E170-H454 IonicContact OE2-NE2 3.28Å; E170-H454 PolarHBondContact OE2-NE2 2.72Å; L449-H454 HydrophobicContact CD2-CB 3.81Å; Q451-H454 WeakPolarHBondContact O-CB 3.41Å; Q451-H454 PolarHBondContact O-N 2.88Å; A452-H454 VanDerWaalsContact C-N 3.32Å; A452-H454 PolarHBondContact O-N 3.01Å; H454-A456 PolarHBondContact O-N 3.4Å; H454-H457 PolarHBondContact O-N 2.94Å; H454-L458 WeakPolarHBondContact O-CB 3.4Å; H454-L458 WeakPolarHBondContact O-CG 3.3Å; H454-L458 PolarHBondContact O-N 3.07Å; H454-I493 HydrophobicContact CB-CG2 4.41Å
455	R	94.4	Very high	92.6	Very high	33 Å²	33	34.8 Å²	34.8	13%	0.125	22%	0.223	C	C	.	.	H	α-helix	trans	-57.2	-49	176.5	-174.2	178.1	-56.7	-75.2	-9.8	112.1	L248 D250 E255 L449 Q451 A452 R453 H457 L458 Q459	L248-R455 HydrophobicContact CD2-CB 4.42Å; L248-R455 HydrophobicContact CD2-CG 3.69Å; L248-R455 PolarHBondContact O-NH1 2.83Å; D250-R455 IonicContact OD1-CZ 2.73Å; D250-R455 VanDerWaalsContact OD1-CZ 3.28Å; D250-R455 IonicContact OD1-NH1 3.59Å; D250-R455 PolarHBondContact OD1-NH1 2.94Å; D250-R455 IonicContact OD1-NH2 3.99Å; D250-R455 PolarHBondContact OD1-NH2 3.47Å; D250-R455 IonicContact OD2-NH2 2.76Å; D250-R455 PolarHBondContact OD2-NH2 3.39Å; E255-R455 IonicContact OE1-CZ 3.37Å; E255-R455 IonicContact OE1-NE 3.88Å; E255-R455 PolarHBondContact OE1-NE 2.55Å; E255-R455 IonicContact OE1-NH2 3.07Å; E255-R455 PolarHBondContact OE1-NH2 3.19Å; L449-R455 HydrophobicContact CD1-CB 4.43Å; Q451-R455 PolarHBondContact O-N 2.68Å; A452-R455 WeakPolarHBondContact O-CB 3.41Å; A452-R455 PolarHBondContact O-N 3.24Å; R453-R455 VanDerWaalsContact C-N 3.33Å; R455-H457 PolarHBondContact O-N 3.46Å; R455-L458 PolarHBondContact O-N 3.08Å; R455-Q459 HydrophobicContact CG-CG 4.45Å; R455-Q459 WeakPolarHBondContact O-CB 3.29Å; R455-Q459 VanDerWaalsContact O-CG 3.31Å; R455-Q459 WeakPolarHBondContact O-CG 3.44Å; R455-Q459 PolarHBondContact O-N 2.78Å
456	A	94.8	Very high	93.4	Very high	36 Å²	36	34 Å²	34	30%	0.298	21%	0.211	S	C	.	.	H	α-helix	trans	-58.9	-45.3	179.7	0	0	0	0	0	112.1	A452 R453 H454 Q459 H460	A452-A456 PolarHBondContact O-N 3.27Å; R453-A456 PolarHBondContact O-N 3Å; H454-A456 PolarHBondContact O-N 3.4Å; A456-Q459 PolarHBondContact O-N 3.06Å; A456-H460 PolarHBondContact O-N 2.72Å
457	H	95.8	Very high	94	Very high	25 Å²	25	33.5 Å²	33.5	12%	0.116	20%	0.197	C	C	.	.	H	α-helix	trans	-67.6	-35.7	177.1	-70.6	-46.8	0	0	0	113.2	R453 H454 R455 H460 C461 S489 I493	R453-H457 PolarHBondContact O-CD2 2.71Å; R453-H457 PolarHBondContact O-N 3.42Å; H454-H457 PolarHBondContact O-N 2.94Å; R455-H457 PolarHBondContact O-N 3.46Å; H457-H460 PolarHBondContact O-N 3.05Å; H457-C461 WeakPolarHBondContact O-CB 3.25Å; H457-C461 PolarHBondContact O-N 2.68Å; H457-S489 WeakPolarHBondContact O-CB 3.49Å; H457-I493 HydrophobicContact CB-CD1 3.68Å; H457-I493 HydrophobicContact CB-CG1 3.42Å; H457-I493 VanDerWaalsContact CB-CG1 3.42Å
458	L	96.7	Very high	94.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-69.1	-36.7	173.9	-70.7	179.3	0	0	0	112.4	Y199 W202 I244 L248 L449 H454 R455 C461 V462 L490 I493	Y199-L458 HydrophobicContact CE1-CD1 4.23Å; Y199-L458 HydrophobicContact CE1-CD2 4.31Å; W202-L458 HydrophobicContact CE3-CD2 4.37Å; W202-L458 HydrophobicContact CZ3-CD2 3.89Å; I244-L458 HydrophobicContact CG2-CB 4.04Å; I244-L458 HydrophobicContact CG2-CD2 4.03Å; I244-L458 HydrophobicContact CG2-CG 4.46Å; L248-L458 HydrophobicContact CD1-CB 4.26Å; L248-L458 HydrophobicContact CD2-CB 3.84Å; L248-L458 HydrophobicContact CD2-CD1 4.38Å; L248-L458 HydrophobicContact CG-CB 4.16Å; L449-L458 HydrophobicContact CD1-CD1 4.36Å; L449-L458 HydrophobicContact CD2-CD1 3.56Å; H454-L458 WeakPolarHBondContact O-CB 3.4Å; H454-L458 WeakPolarHBondContact O-CG 3.3Å; H454-L458 PolarHBondContact O-N 3.07Å; R455-L458 PolarHBondContact O-N 3.08Å; L458-C461 VanDerWaalsContact O-CB 3.29Å; L458-C461 WeakPolarHBondContact O-CB 3.18Å; L458-C461 PolarHBondContact O-N 2.91Å; L458-V462 WeakPolarHBondContact O-CG2 3.45Å; L458-V462 PolarHBondContact O-N 2.71Å; L458-L490 HydrophobicContact CD2-CD2 3.53Å; L458-I493 HydrophobicContact CD2-CD1 3.7Å; L458-I493 HydrophobicContact CG-CD1 3.75Å
459	Q	97.1	Very high	94.7	Very high	103 Å²	103	37.3 Å²	37.3	48%	0.481	20%	0.204	S	C	.	.	H	α-helix	trans	-62.3	-43.3	172.3	-73.9	170.4	-27.5	0	0	111.3	L248 R455 A456 C461 V462 A463	L248-Q459 HydrophobicContact CD1-CG 4.14Å; L248-Q459 HydrophobicContact CD2-CG 4.09Å; R455-Q459 HydrophobicContact CG-CG 4.45Å; R455-Q459 WeakPolarHBondContact O-CB 3.29Å; R455-Q459 VanDerWaalsContact O-CG 3.31Å; R455-Q459 WeakPolarHBondContact O-CG 3.44Å; R455-Q459 PolarHBondContact O-N 2.78Å; A456-Q459 PolarHBondContact O-N 3.06Å; Q459-C461 VanDerWaalsContact C-N 3.31Å; Q459-C461 PolarHBondContact O-N 3.28Å; Q459-V462 PolarHBondContact O-N 2.99Å; Q459-A463 PolarHBondContact O-N 3.37Å
460	H	96.9	Very high	94.9	Very high	107 Å²	107	46.5 Å²	46.5	50%	0.495	24%	0.239	S	C	.	.	H	α-helix	trans	-62.7	-38.2	172.2	-67.6	169.7	0	0	0	112.2	A456 H457 A463 A464	A456-H460 PolarHBondContact O-N 2.72Å; H457-H460 PolarHBondContact O-N 3.05Å; H460-A463 PolarHBondContact O-N 3.29Å; H460-A464 WeakPolarHBondContact O-CB 3.19Å; H460-A464 PolarHBondContact O-N 2.85Å
461	C	97.3	Very high	95.1	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-59.4	-49.1	174.6	-171.4	0	0	0	0	111.3	H457 L458 Q459 A463 A464 L465	H457-C461 WeakPolarHBondContact O-CB 3.25Å; H457-C461 PolarHBondContact O-N 2.68Å; L458-C461 VanDerWaalsContact O-CB 3.29Å; L458-C461 WeakPolarHBondContact O-CB 3.18Å; L458-C461 PolarHBondContact O-N 2.91Å; Q459-C461 VanDerWaalsContact C-N 3.31Å; Q459-C461 PolarHBondContact O-N 3.28Å; C461-A463 PolarHBondContact O-N 3.49Å; C461-A464 PolarHBondContact O-N 2.85Å; C461-L465 WeakPolarHBondContact O-CG 3.22Å; C461-L465 PolarHBondContact O-N 3Å
462	V	97.5	Very high	95.2	Very high	21 Å²	21	49.4 Å²	49.4	13%	0.127	25%	0.248	C	C	.	.	H	α-helix	trans	-60	-44.8	176.5	171.3	0	0	0	0	111.6	Q241 I244 E245 L248 L458 Q459 A464 L465 A466	Q241-V462 HydrophobicContact CG-CG1 4.23Å; I244-V462 HydrophobicContact CB-CG2 4.07Å; I244-V462 HydrophobicContact CG2-CG2 3.52Å; E245-V462 HydrophobicContact CG-CG1 3.94Å; E245-V462 HydrophobicContact CG-CG2 3.97Å; E245-V462 WeakPolarHBondContact OE1-CG1 3.46Å; L248-V462 HydrophobicContact CD1-CG2 3.99Å; L458-V462 WeakPolarHBondContact O-CG2 3.45Å; L458-V462 PolarHBondContact O-N 2.71Å; Q459-V462 PolarHBondContact O-N 2.99Å; V462-A464 VanDerWaalsContact C-N 3.29Å; V462-A464 PolarHBondContact O-N 3.24Å; V462-L465 PolarHBondContact O-N 3.15Å; V462-A466 PolarHBondContact O-N 2.85Å
463	A	97.2	Very high	95.3	Very high	63 Å²	63	53.3 Å²	53.3	52%	0.521	26%	0.26	S	S	.	.	H	α-helix	trans	-60.6	-39	176.9	0	0	0	0	0	112.3	Q459 H460 C461 A466 Q467	Q459-A463 PolarHBondContact O-N 3.37Å; H460-A463 PolarHBondContact O-N 3.29Å; C461-A463 PolarHBondContact O-N 3.49Å; A463-A466 WeakPolarHBondContact O-CB 3.35Å; A463-A466 PolarHBondContact O-N 2.86Å; A463-Q467 PolarHBondContact O-N 3.2Å; A463-Q467 VanDerWaalsContact O-N 3.08Å
464	A	97.1	Very high	95.5	Very high	8 Å²	8	56.1 Å²	56.1	7%	0.066	28%	0.284	C	S	.	.	H	α-helix	trans	-70.6	-35.8	176.9	0	0	0	0	0	112.9	H460 C461 V462 A466 Q467 Y468 G482 L485 A486	H460-A464 WeakPolarHBondContact O-CB 3.19Å; H460-A464 PolarHBondContact O-N 2.85Å; C461-A464 PolarHBondContact O-N 2.85Å; V462-A464 VanDerWaalsContact C-N 3.29Å; V462-A464 PolarHBondContact O-N 3.24Å; A464-A466 VanDerWaalsContact C-N 3.34Å; A464-Q467 VanDerWaalsContact O-CB 3.3Å; A464-Q467 WeakPolarHBondContact O-CB 3.27Å; A464-Q467 PolarHBondContact O-N 2.76Å; A464-Y468 PolarHBondContact O-N 2.92Å; A464-Y468 VanDerWaalsContact O-N 3.16Å; A464-G482 WeakPolarHBondContact CB-O 3.32Å; A464-G482 WeakPolarHBondContact O-CA 3.35Å; A464-L485 HydrophobicContact CB-CB 3.8Å; A464-A486 HydrophobicContact CB-CB 4.03Å
465	L	97.1	Very high	95.5	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-68.2	-34.2	171.8	-64.5	179.9	0	0	0	112.2	L206 V237 L240 Q241 I244 C461 V462 Q467 Y468 R469 A486	L206-L465 HydrophobicContact CD2-CD2 3.68Å; V237-L465 HydrophobicContact CG1-CB 4.14Å; V237-L465 HydrophobicContact CG1-CD2 4.12Å; L240-L465 HydrophobicContact CB-CD1 4.41Å; Q241-L465 HydrophobicContact CB-CB 4.45Å; Q241-L465 HydrophobicContact CB-CD1 4.06Å; I244-L465 HydrophobicContact CD1-CD1 4.19Å; C461-L465 WeakPolarHBondContact O-CG 3.22Å; C461-L465 PolarHBondContact O-N 3Å; V462-L465 PolarHBondContact O-N 3.15Å; L465-Q467 VanDerWaalsContact C-N 3.27Å; L465-Q467 PolarHBondContact O-N 2.86Å; L465-Y468 WeakPolarHBondContact O-CB 3.47Å; L465-Y468 PolarHBondContact O-N 3.05Å; L465-R469 PolarHBondContact O-N 3.38Å; L465-A486 HydrophobicContact CD2-CB 3.67Å; L465-A486 HydrophobicContact CG-CB 4.02Å
466	A	95.6	Very high	95.4	Very high	44 Å²	44	59.3 Å²	59.3	36%	0.364	30%	0.304	S	S	.	.	H	α-helix	trans	-64.4	-34	171.1	0	0	0	0	0	111.9	V462 A463 A464 R469 R470	V462-A466 PolarHBondContact O-N 2.85Å; A463-A466 WeakPolarHBondContact O-CB 3.35Å; A463-A466 PolarHBondContact O-N 2.86Å; A464-A466 VanDerWaalsContact C-N 3.34Å; A466-R469 PolarHBondContact O-N 2.97Å; A466-R470 PolarHBondContact O-N 3.44Å; A466-R470 VanDerWaalsContact O-N 3.1Å
467	Q	94.5	Very high	95.4	Very high	57 Å²	57	60.4 Å²	60.4	27%	0.266	31%	0.313	S	S	.	.	H	α-helix	trans	-62.5	-44	172.5	177	178.6	-16.9	0	0	112	A463 A464 L465 R469 R470 Y471	A463-Q467 PolarHBondContact O-N 3.2Å; A463-Q467 VanDerWaalsContact O-N 3.08Å; A464-Q467 VanDerWaalsContact O-CB 3.3Å; A464-Q467 WeakPolarHBondContact O-CB 3.27Å; A464-Q467 PolarHBondContact O-N 2.76Å; L465-Q467 VanDerWaalsContact C-N 3.27Å; L465-Q467 PolarHBondContact O-N 2.86Å; Q467-R469 VanDerWaalsContact C-N 3.32Å; Q467-R469 PolarHBondContact O-N 3.36Å; Q467-R470 WeakPolarHBondContact O-CB 3.47Å; Q467-R470 PolarHBondContact O-N 2.99Å; Q467-R470 VanDerWaalsContact O-N 3.16Å; Q467-Y471 HydrophobicContact CG-CD2 3.69Å; Q467-Y471 HydrophobicContact CG-CE2 3.77Å; Q467-Y471 WeakPolarHBondContact O-CD2 3.44Å; Q467-Y471 PolarHBondContact O-N 3.43Å
468	Y	95.9	Very high	95.4	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-52.5	-51.4	174	167	-89	0	0	0	111	V213 V233 D234 V237 A464 L465 R470 Y471 R472 A479 V483	V213-Y468 HydrophobicContact CG2-CE2 3.98Å; V233-Y468 HydrophobicContact CG1-CE2 3.95Å; V233-Y468 WeakPolarHBondContact CG1-OH 3.38Å; D234-Y468 WeakPolarHBondContact OD1-CE1 3.24Å; D234-Y468 VanDerWaalsContact OD1-CZ 3.28Å; D234-Y468 PolarHBondContact OD1-OH 3.35Å; V237-Y468 HydrophobicContact CB-CD1 4.06Å; V237-Y468 HydrophobicContact CB-CE1 4.09Å; V237-Y468 HydrophobicContact CG1-CD1 3.7Å; V237-Y468 HydrophobicContact CG1-CE1 4.22Å; V237-Y468 HydrophobicContact CG1-CG 4.42Å; V237-Y468 HydrophobicContact CG2-CD1 3.88Å; V237-Y468 HydrophobicContact CG2-CE1 3.86Å; V237-Y468 HydrophobicContact CG2-CG 4.35Å; A464-Y468 PolarHBondContact O-N 2.92Å; A464-Y468 VanDerWaalsContact O-N 3.16Å; L465-Y468 WeakPolarHBondContact O-CB 3.47Å; L465-Y468 PolarHBondContact O-N 3.05Å; Y468-R470 VanDerWaalsContact C-N 3.27Å; Y468-R470 PolarHBondContact O-N 3.31Å; Y468-Y471 PolarHBondContact O-N 2.98Å; Y468-R472 WeakPolarHBondContact O-CB 3.3Å; Y468-R472 PolarHBondContact O-N 3Å; Y468-R472 VanDerWaalsContact OH-CD 3.32Å; Y468-R472 WeakPolarHBondContact OH-CD 3.41Å; Y468-R472 PolarHBondContact OH-NE 3.48Å; Y468-A479 HydrophobicContact CD2-CB 3.72Å; Y468-A479 WeakPolarHBondContact CD2-O 3.5Å; Y468-A479 HydrophobicContact CE2-CB 4.09Å; Y468-A479 HydrophobicContact CG-CB 4.46Å; Y468-V483 HydrophobicContact CD2-CG2 3.51Å; Y468-V483 HydrophobicContact CE2-CG2 4.19Å; Y468-V483 HydrophobicContact CG-CG2 4.04Å
469	R	93.9	Very high	95.3	Very high	142 Å²	142	62.5 Å²	62.5	54%	0.536	32%	0.324	S	S	.	.	H	α-helix	trans	-61.4	-34.6	-179	-66	178.9	67.1	177.7	3.1	113	V237 L465 A466 Q467	V237-R469 HydrophobicContact CG1-CG 4.43Å; L465-R469 PolarHBondContact O-N 3.38Å; A466-R469 PolarHBondContact O-N 2.97Å; Q467-R469 VanDerWaalsContact C-N 3.32Å; Q467-R469 PolarHBondContact O-N 3.36Å
470	R	95.3	Very high	95.3	Very high	193 Å²	193	57.6 Å²	57.6	73%	0.728	30%	0.301	S	S	*	.	H	α-helix	trans	-67.1	-39.5	179.1	-179.6	177	176.4	159.4	0	112.5	A466 Q467 Y468	A466-R470 PolarHBondContact O-N 3.44Å; A466-R470 VanDerWaalsContact O-N 3.1Å; Q467-R470 WeakPolarHBondContact O-CB 3.47Å; Q467-R470 PolarHBondContact O-N 2.99Å; Q467-R470 VanDerWaalsContact O-N 3.16Å; Y468-R470 VanDerWaalsContact C-N 3.27Å; Y468-R470 PolarHBondContact O-N 3.31Å
471	Y	95.4	Very high	95.3	Very high	68 Å²	68	55.8 Å²	55.8	27%	0.267	29%	0.293	S	S	.	.	H	α-helix	trans	-98.6	-8.9	-175.4	-66.3	-68.9	0	0	0	114	Q467 Y468 N473 S474 D475 L478	Q467-Y471 HydrophobicContact CG-CD2 3.69Å; Q467-Y471 HydrophobicContact CG-CE2 3.77Å; Q467-Y471 WeakPolarHBondContact O-CD2 3.44Å; Q467-Y471 PolarHBondContact O-N 3.43Å; Y468-Y471 PolarHBondContact O-N 2.98Å; Y471-N473 PolarHBondContact O-N 2.98Å; Y471-S474 PolarHBondContact O-N 3.39Å; Y471-S474 PolarHBondContact O-OG 2.94Å; Y471-D475 WeakPolarHBondContact CB-O 3.45Å; Y471-D475 CarbonylContact O-C 3.57Å; Y471-D475 PolarHBondContact O-N 3.45Å; Y471-D475 VanDerWaalsContact O-O 3.13Å; Y471-L478 HydrophobicContact CD1-CB 4.14Å; Y471-L478 HydrophobicContact CD1-CD1 3.8Å; Y471-L478 HydrophobicContact CD2-CB 3.98Å; Y471-L478 HydrophobicContact CE1-CD1 3.81Å; Y471-L478 HydrophobicContact CG-CB 3.74Å; Y471-L478 HydrophobicContact CG-CD1 4.25Å
472	R	93.3	Very high	95.2	Very high	35 Å²	35	55.8 Å²	55.8	13%	0.132	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.5	-38.4	-177.2	173.7	55.3	-179.2	76.8	15.9	115.7	D234 Y468 L476	D234-R472 VanDerWaalsContact OD1-CD 3.27Å; D234-R472 WeakPolarHBondContact OD1-CD 3.48Å; D234-R472 WeakPolarHBondContact OD1-CG 3.38Å; D234-R472 IonicContact OD1-NE 2.78Å; D234-R472 PolarHBondContact OD1-NE 3.14Å; D234-R472 IonicContact OD2-CZ 3.65Å; D234-R472 VanDerWaalsContact OD2-CZ 3.32Å; D234-R472 IonicContact OD2-NE 3.98Å; D234-R472 PolarHBondContact OD2-NE 2.9Å; D234-R472 IonicContact OD2-NH2 3.68Å; D234-R472 PolarHBondContact OD2-NH2 3.13Å; Y468-R472 WeakPolarHBondContact O-CB 3.3Å; Y468-R472 PolarHBondContact O-N 3Å; Y468-R472 VanDerWaalsContact OH-CD 3.32Å; Y468-R472 WeakPolarHBondContact OH-CD 3.41Å; Y468-R472 PolarHBondContact OH-NE 3.48Å; R472-L476 WeakPolarHBondContact O-CD2 3.34Å
473	N	91.4	Very high	95.2	Very high	151 Å²	151	54.8 Å²	54.8	81%	0.807	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-6.2	-177.7	-65.5	-26.2	0	0	0	113.9	Y471	Y471-N473 PolarHBondContact O-N 2.98Å
474	S	93.6	Very high	95.2	Very high	92 Å²	92	56.5 Å²	56.5	64%	0.643	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.7	-39	-174.7	52.5	0	0	0	0	113.3	Y471	Y471-S474 PolarHBondContact O-N 3.39Å; Y471-S474 PolarHBondContact O-OG 2.94Å
475	D	94.9	Very high	95.2	Very high	63 Å²	63	59.4 Å²	59.4	34%	0.337	29%	0.294	S	S	.	.			trans	-153.9	102.8	-178.1	-172.7	-32.5	0	0	0	110.1	Y471 A477 L478 A479	Y471-D475 WeakPolarHBondContact CB-O 3.45Å; Y471-D475 CarbonylContact O-C 3.57Å; Y471-D475 PolarHBondContact O-N 3.45Å; Y471-D475 VanDerWaalsContact O-O 3.13Å; D475-A477 VanDerWaalsContact C-N 3.29Å; D475-A477 PolarHBondContact O-N 2.94Å; D475-A477 WeakPolarHBondContact OD1-CA 3.21Å; D475-A477 WeakPolarHBondContact OD1-CB 3.4Å; D475-A477 PolarHBondContact OD1-N 2.97Å; D475-L478 HydrophobicContact CB-CB 4.06Å; D475-L478 HydrophobicContact CB-CD1 3.98Å; D475-L478 HydrophobicContact CB-CG 4.13Å; D475-L478 PolarHBondContact O-N 3.4Å; D475-L478 PolarHBondContact OD1-N 2.77Å; D475-L478 WeakPolarHBondContact OD2-CD1 3.4Å; D475-L478 WeakPolarHBondContact OD2-CG 3.37Å; D475-A479 PolarHBondContact O-N 3Å
476	L	93.1	Very high	95.2	Very high	38 Å²	38	59.4 Å²	59.4	20%	0.199	29%	0.294	C	S	.	.	H	α-helix	trans	-67.8	-26.9	-179.8	-74.5	175.7	0	0	0	113	F216 I217 L230 R472 A479 A480	F216-L476 HydrophobicContact CD1-CD1 3.61Å; F216-L476 HydrophobicContact CE1-CD1 3.78Å; I217-L476 HydrophobicContact CD1-CB 4.1Å; I217-L476 HydrophobicContact CG1-CB 3.92Å; L230-L476 HydrophobicContact CD1-CD1 4.12Å; L230-L476 HydrophobicContact CD1-CD2 4.32Å; R472-L476 WeakPolarHBondContact O-CD2 3.34Å; L476-A479 PolarHBondContact O-N 2.93Å; L476-A480 WeakPolarHBondContact O-CB 3.34Å; L476-A480 PolarHBondContact O-N 2.77Å
477	A	94	Very high	95.2	Very high	58 Å²	58	58.9 Å²	58.9	48%	0.479	29%	0.285	S	S	.	.	H	α-helix	trans	-69.6	-42.9	176.6	0	0	0	0	0	110.7	D475 A479 A480 E481	D475-A477 VanDerWaalsContact C-N 3.29Å; D475-A477 PolarHBondContact O-N 2.94Å; D475-A477 WeakPolarHBondContact OD1-CA 3.21Å; D475-A477 WeakPolarHBondContact OD1-CB 3.4Å; D475-A477 PolarHBondContact OD1-N 2.97Å; A477-A479 VanDerWaalsContact C-N 3.3Å; A477-A479 PolarHBondContact O-N 2.81Å; A477-A480 PolarHBondContact O-N 2.86Å; A477-E481 PolarHBondContact O-N 2.8Å
478	L	95.3	Very high	95.3	Very high	69 Å²	69	58.6 Å²	58.6	36%	0.361	29%	0.288	S	S	.	.	H	α-helix	trans	-66.1	-32.6	171.8	-69.7	179.6	0	0	0	112.5	Y471 D475 G482	Y471-L478 HydrophobicContact CD1-CB 4.14Å; Y471-L478 HydrophobicContact CD1-CD1 3.8Å; Y471-L478 HydrophobicContact CD2-CB 3.98Å; Y471-L478 HydrophobicContact CE1-CD1 3.81Å; Y471-L478 HydrophobicContact CG-CB 3.74Å; Y471-L478 HydrophobicContact CG-CD1 4.25Å; D475-L478 HydrophobicContact CB-CB 4.06Å; D475-L478 HydrophobicContact CB-CD1 3.98Å; D475-L478 HydrophobicContact CB-CG 4.13Å; D475-L478 PolarHBondContact O-N 3.4Å; D475-L478 PolarHBondContact OD1-N 2.77Å; D475-L478 WeakPolarHBondContact OD2-CD1 3.4Å; D475-L478 WeakPolarHBondContact OD2-CG 3.37Å; L478-G482 PolarHBondContact O-N 2.86Å
479	A	95.3	Very high	95.2	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-66.1	-47.7	173.6	0	0	0	0	0	111.3	Y468 D475 L476 A477 E481 G482 V483	Y468-A479 HydrophobicContact CD2-CB 3.72Å; Y468-A479 WeakPolarHBondContact CD2-O 3.5Å; Y468-A479 HydrophobicContact CE2-CB 4.09Å; Y468-A479 HydrophobicContact CG-CB 4.46Å; D475-A479 PolarHBondContact O-N 3Å; L476-A479 PolarHBondContact O-N 2.93Å; A477-A479 VanDerWaalsContact C-N 3.3Å; A477-A479 PolarHBondContact O-N 2.81Å; A479-E481 VanDerWaalsContact C-N 3.26Å; A479-E481 PolarHBondContact O-N 3.02Å; A479-G482 WeakPolarHBondContact O-CA 3.47Å; A479-G482 PolarHBondContact O-N 3.02Å; A479-V483 PolarHBondContact O-N 3.16Å
480	A	95.8	Very high	95.2	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-56.5	-40.5	175.7	0	0	0	0	0	111.8	L210 V213 I217 L476 A477 G482 V483 R484	L210-A480 HydrophobicContact CD1-CB 4.28Å; V213-A480 HydrophobicContact CG1-CB 3.77Å; I217-A480 HydrophobicContact CD1-CB 4.14Å; L476-A480 WeakPolarHBondContact O-CB 3.34Å; L476-A480 PolarHBondContact O-N 2.77Å; A477-A480 PolarHBondContact O-N 2.86Å; A480-G482 VanDerWaalsContact C-N 3.3Å; A480-G482 PolarHBondContact O-N 2.94Å; A480-V483 WeakPolarHBondContact O-CB 3.43Å; A480-V483 PolarHBondContact O-N 3.03Å; A480-R484 PolarHBondContact O-N 2.86Å
481	E	97.3	Very high	95.1	Very high	70 Å²	70	43.6 Å²	43.6	33%	0.327	23%	0.234	S	C	.	.	H	α-helix	trans	-61.4	-37.3	176	-171.9	56.1	-153.9	0	0	112.5	A477 A479 V483 R484 L485	A477-E481 PolarHBondContact O-N 2.8Å; A479-E481 VanDerWaalsContact C-N 3.26Å; A479-E481 PolarHBondContact O-N 3.02Å; E481-V483 VanDerWaalsContact C-N 3.29Å; E481-V483 PolarHBondContact O-N 3.05Å; E481-R484 PolarHBondContact O-N 2.79Å; E481-R484 IonicContact OE2-NH1 3.46Å; E481-R484 PolarHBondContact OE2-NH1 3.34Å; E481-R484 VanDerWaalsContact OE2-NH1 3.17Å; E481-L485 HydrophobicContact CG-CD1 4.34Å; E481-L485 HydrophobicContact CG-CG 4.45Å; E481-L485 WeakPolarHBondContact O-CB 3.19Å; E481-L485 WeakPolarHBondContact O-CG 3.24Å; E481-L485 PolarHBondContact O-N 3.47Å
482	G	96.5	Very high	94.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.3	-41.6	171.4	0	0	0	0	0	112.6	A464 L478 A479 A480 A486	A464-G482 WeakPolarHBondContact CB-O 3.32Å; A464-G482 WeakPolarHBondContact O-CA 3.35Å; L478-G482 PolarHBondContact O-N 2.86Å; A479-G482 WeakPolarHBondContact O-CA 3.47Å; A479-G482 PolarHBondContact O-N 3.02Å; A480-G482 VanDerWaalsContact C-N 3.3Å; A480-G482 PolarHBondContact O-N 2.94Å; G482-A486 WeakPolarHBondContact O-CB 3.48Å; G482-A486 PolarHBondContact O-N 2.97Å
483	V	97.1	Very high	94.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-68.9	-39	176.3	-173.7	0	0	0	0	111.4	L206 T209 L210 Y468 A479 A480 E481 A486 L487	L206-V483 HydrophobicContact CB-CG1 4.47Å; L206-V483 HydrophobicContact CD2-CG1 4.28Å; T209-V483 HydrophobicContact CG2-CG1 4.19Å; T209-V483 HydrophobicContact CG2-CG2 4.27Å; L210-V483 HydrophobicContact CB-CG1 3.82Å; L210-V483 HydrophobicContact CD1-CB 4.23Å; L210-V483 HydrophobicContact CD1-CG1 4.38Å; Y468-V483 HydrophobicContact CD2-CG2 3.51Å; Y468-V483 HydrophobicContact CE2-CG2 4.19Å; Y468-V483 HydrophobicContact CG-CG2 4.04Å; A479-V483 PolarHBondContact O-N 3.16Å; A480-V483 WeakPolarHBondContact O-CB 3.43Å; A480-V483 PolarHBondContact O-N 3.03Å; E481-V483 VanDerWaalsContact C-N 3.29Å; E481-V483 PolarHBondContact O-N 3.05Å; V483-A486 PolarHBondContact O-N 3.31Å; V483-L487 WeakPolarHBondContact O-CB 3.21Å; V483-L487 PolarHBondContact O-N 3.38Å
484	R	97.1	Very high	94.7	Very high	98 Å²	98	37.1 Å²	37.1	37%	0.37	20%	0.199	S	C	.	.	H	α-helix	trans	-62.3	-45.2	174.7	-68.7	-174.5	-166.7	136.1	-2.9	112	L210 E214 A480 E481 A486 L487 T488	L210-R484 HydrophobicContact CD1-CG 3.73Å; L210-R484 HydrophobicContact CD2-CG 3.72Å; L210-R484 HydrophobicContact CG-CG 4.4Å; E214-R484 IonicContact OE1-CZ 2.88Å; E214-R484 VanDerWaalsContact OE1-CZ 3.31Å; E214-R484 IonicContact OE1-NE 3.35Å; E214-R484 PolarHBondContact OE1-NE 3.03Å; E214-R484 IonicContact OE1-NH2 2.95Å; E214-R484 PolarHBondContact OE1-NH2 3.43Å; A480-R484 PolarHBondContact O-N 2.86Å; E481-R484 PolarHBondContact O-N 2.79Å; E481-R484 IonicContact OE2-NH1 3.46Å; E481-R484 PolarHBondContact OE2-NH1 3.34Å; E481-R484 VanDerWaalsContact OE2-NH1 3.17Å; R484-A486 VanDerWaalsContact C-N 3.34Å; R484-A486 PolarHBondContact O-N 3.45Å; R484-L487 PolarHBondContact O-N 3.09Å; R484-T488 PolarHBondContact O-N 2.79Å; R484-T488 PolarHBondContact O-OG1 2.97Å
485	L	97	Very high	94.4	Very high	70 Å²	70	33.2 Å²	33.2	37%	0.366	17%	0.173	S	C	.	.	H	α-helix	trans	-62.5	-39.9	176.7	-71.1	173.2	0	0	0	112.1	A464 E481 T488 S489	A464-L485 HydrophobicContact CB-CB 3.8Å; E481-L485 HydrophobicContact CG-CD1 4.34Å; E481-L485 HydrophobicContact CG-CG 4.45Å; E481-L485 WeakPolarHBondContact O-CB 3.19Å; E481-L485 WeakPolarHBondContact O-CG 3.24Å; E481-L485 PolarHBondContact O-N 3.47Å; L485-T488 PolarHBondContact O-N 3.12Å; L485-S489 WeakPolarHBondContact O-CB 3.41Å; L485-S489 PolarHBondContact O-N 2.64Å; L485-S489 PolarHBondContact O-OG 3.46Å
486	A	96.9	Very high	93.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.9	-46.5	173.6	0	0	0	0	0	111.5	L206 A464 L465 G482 V483 R484 T488 S489 L490	L206-A486 HydrophobicContact CD1-CB 3.92Å; A464-A486 HydrophobicContact CB-CB 4.03Å; L465-A486 HydrophobicContact CD2-CB 3.67Å; L465-A486 HydrophobicContact CG-CB 4.02Å; G482-A486 WeakPolarHBondContact O-CB 3.48Å; G482-A486 PolarHBondContact O-N 2.97Å; V483-A486 PolarHBondContact O-N 3.31Å; R484-A486 VanDerWaalsContact C-N 3.34Å; R484-A486 PolarHBondContact O-N 3.45Å; A486-T488 PolarHBondContact O-N 3.17Å; A486-S489 WeakPolarHBondContact O-CB 3.36Å; A486-S489 PolarHBondContact O-N 2.94Å; A486-L490 PolarHBondContact O-N 3.43Å
487	L	95.9	Very high	93.4	Very high	33 Å²	33	37.9 Å²	37.9	17%	0.173	19%	0.19	C	C	.	.	H	α-helix	trans	-62.3	-43.5	177.3	-178.6	61.9	0	0	0	112.3	S203 L206 K207 L210 V483 R484 S489 L490 G491	S203-L487 WeakPolarHBondContact OG-CD1 3.46Å; L206-L487 HydrophobicContact CB-CD1 4.37Å; K207-L487 HydrophobicContact CG-CD1 3.92Å; K207-L487 HydrophobicContact CG-CD2 3.69Å; K207-L487 HydrophobicContact CG-CG 4.49Å; L210-L487 HydrophobicContact CD2-CD2 4.47Å; V483-L487 WeakPolarHBondContact O-CB 3.21Å; V483-L487 PolarHBondContact O-N 3.38Å; R484-L487 PolarHBondContact O-N 3.09Å; L487-S489 VanDerWaalsContact C-N 3.31Å; L487-S489 PolarHBondContact O-N 3.47Å; L487-L490 PolarHBondContact O-N 3.21Å; L487-G491 PolarHBondContact O-N 3.18Å
488	T	95.4	Very high	92.6	Very high	51 Å²	51	38 Å²	38	31%	0.313	20%	0.198	S	C	.	.	H	α-helix	trans	-61.1	-40.6	174.7	-72.3	0	0	0	0	111.2	R484 L485 A486 G491 R492 V497	R484-T488 PolarHBondContact O-N 2.79Å; R484-T488 PolarHBondContact O-OG1 2.97Å; L485-T488 PolarHBondContact O-N 3.12Å; A486-T488 PolarHBondContact O-N 3.17Å; T488-G491 PolarHBondContact O-N 3.32Å; T488-R492 WeakPolarHBondContact O-CG 3.34Å; T488-R492 PolarHBondContact O-N 3.46Å; T488-V497 HydrophobicContact CG2-CG1 4.2Å
489	S	95	Very high	91.8	Very high	11 Å²	11	35.1 Å²	35.1	8%	0.077	18%	0.184	C	C	.	.	H	α-helix	trans	-63.4	-44.4	178.4	-60.7	0	0	0	0	112	H457 L485 A486 L487 G491 R492	H457-S489 WeakPolarHBondContact O-CB 3.49Å; L485-S489 WeakPolarHBondContact O-CB 3.41Å; L485-S489 PolarHBondContact O-N 2.64Å; L485-S489 PolarHBondContact O-OG 3.46Å; A486-S489 WeakPolarHBondContact O-CB 3.36Å; A486-S489 PolarHBondContact O-N 2.94Å; L487-S489 VanDerWaalsContact C-N 3.31Å; L487-S489 PolarHBondContact O-N 3.47Å; S489-G491 VanDerWaalsContact C-N 3.35Å; S489-R492 PolarHBondContact O-N 3.46Å
490	L	94.1	Very high	90.9	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-65.1	-37.5	171.9	-69.7	-176.8	0	0	0	112.7	W202 L206 L458 A486 L487 R492 I493 T494	W202-L490 HydrophobicContact CB-CD1 3.75Å; W202-L490 HydrophobicContact CE3-CD2 4.26Å; L206-L490 HydrophobicContact CD1-CD1 3.65Å; L206-L490 HydrophobicContact CD1-CG 4.47Å; L458-L490 HydrophobicContact CD2-CD2 3.53Å; A486-L490 PolarHBondContact O-N 3.43Å; L487-L490 PolarHBondContact O-N 3.21Å; L490-R492 VanDerWaalsContact C-N 3.28Å; L490-R492 PolarHBondContact O-N 2.84Å; L490-I493 HydrophobicContact CD2-CD1 4.13Å; L490-I493 WeakPolarHBondContact O-CB 3.41Å; L490-I493 PolarHBondContact O-N 3.14Å; L490-I493 VanDerWaalsContact O-N 3.1Å; L490-T494 PolarHBondContact O-N 3.49Å; L490-T494 PolarHBondContact O-OG1 3.08Å
491	G	92.4	Very high	89.7	Confident	6 Å²	6	50.9 Å²	50.9	6%	0.062	26%	0.257	C	S	.	.	H	α-helix	trans	-60	-36.2	176.7	0	0	0	0	0	113.1	L487 T488 S489 I493 T494 G495 R496 V497	L487-G491 PolarHBondContact O-N 3.18Å; T488-G491 PolarHBondContact O-N 3.32Å; S489-G491 VanDerWaalsContact C-N 3.35Å; G491-I493 VanDerWaalsContact C-N 3.33Å; G491-T494 PolarHBondContact O-OG1 3.04Å; G491-G495 CarbonylContact O-C 3.58Å; G491-G495 PolarHBondContact O-N 3.46Å; G491-G495 VanDerWaalsContact O-N 3.07Å; G491-R496 PolarHBondContact O-N 3.07Å; G491-V497 PolarHBondContact O-N 3.09Å
492	R	92.6	Very high	88.5	Confident	110 Å²	110	49.5 Å²	49.5	42%	0.415	25%	0.251	S	S	.	.	H	α-helix	trans	-67.1	-30.8	174.1	-71.3	175.7	179.6	178.2	-0.1	113.1	R453 T488 S489 L490 V497	R453-R492 PolarHBondContact NH1-O 3.43Å; T488-R492 WeakPolarHBondContact O-CG 3.34Å; T488-R492 PolarHBondContact O-N 3.46Å; S489-R492 PolarHBondContact O-N 3.46Å; L490-R492 VanDerWaalsContact C-N 3.28Å; L490-R492 PolarHBondContact O-N 2.84Å; R492-V497 WeakPolarHBondContact CA-O 3.47Å; R492-V497 HydrophobicContact CG-CB 4.36Å; R492-V497 HydrophobicContact CG-CG1 4.45Å
493	I	91.8	Very high	87.6	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-67.3	-49.6	177.5	-57.8	172.9	0	0	0	110.8	T167 Y199 R453 H454 H457 L458 L490 G491 G495	T167-I493 HydrophobicContact CG2-CG2 4.05Å; Y199-I493 HydrophobicContact CD2-CB 4.28Å; Y199-I493 HydrophobicContact CD2-CG2 3.54Å; Y199-I493 HydrophobicContact CE2-CB 4.37Å; Y199-I493 HydrophobicContact CE2-CG2 3.29Å; R453-I493 PolarHBondContact NH1-O 3.02Å; R453-I493 VanDerWaalsContact NH1-O 3.16Å; R453-I493 PolarHBondContact NH2-O 2.88Å; H454-I493 HydrophobicContact CB-CG2 4.41Å; H457-I493 HydrophobicContact CB-CD1 3.68Å; H457-I493 HydrophobicContact CB-CG1 3.42Å; H457-I493 VanDerWaalsContact CB-CG1 3.42Å; L458-I493 HydrophobicContact CD2-CD1 3.7Å; L458-I493 HydrophobicContact CG-CD1 3.75Å; L490-I493 HydrophobicContact CD2-CD1 4.13Å; L490-I493 WeakPolarHBondContact O-CB 3.41Å; L490-I493 PolarHBondContact O-N 3.14Å; L490-I493 VanDerWaalsContact O-N 3.1Å; G491-I493 VanDerWaalsContact C-N 3.33Å; I493-G495 VanDerWaalsContact C-N 3.27Å; I493-G495 PolarHBondContact O-N 3.23Å
494	T	88.7	Confident	86.6	Confident	8 Å²	8	54 Å²	54	5%	0.049	28%	0.275	C	S	.	.	H	α-helix	trans	-77.7	-9.2	-178.9	56.1	0	0	0	0	113.9	L166 Y199 L490 G491 R496	L166-T494 WeakPolarHBondContact CB-O 3.27Å; L166-T494 PolarHBondContact N-O 3.47Å; Y199-T494 HydrophobicContact CD2-CG2 4.35Å; L490-T494 PolarHBondContact O-N 3.49Å; L490-T494 PolarHBondContact O-OG1 3.08Å; G491-T494 PolarHBondContact O-OG1 3.04Å; T494-R496 VanDerWaalsContact C-N 3.32Å
495	G	87.4	Confident	85.5	Confident	10 Å²	10	54.5 Å²	54.5	10%	0.103	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	8.7	-177.4	0	0	0	0	0	114.5	F159 G491 I493 V497	F159-G495 WeakPolarHBondContact CZ-O 3.35Å; G491-G495 CarbonylContact O-C 3.58Å; G491-G495 PolarHBondContact O-N 3.46Å; G491-G495 VanDerWaalsContact O-N 3.07Å; I493-G495 VanDerWaalsContact C-N 3.27Å; I493-G495 PolarHBondContact O-N 3.23Å; G495-V497 PolarHBondContact O-N 3.4Å
496	R	84.4	Confident	84.4	Confident	141 Å²	141	52 Å²	52	53%	0.532	27%	0.272	S	S	.	.	S	Bend	trans	-70.7	-18.6	174.1	-68.5	-178.8	177	176	-1.5	113	G491 T494	G491-R496 PolarHBondContact O-N 3.07Å; T494-R496 VanDerWaalsContact C-N 3.32Å
497	V	82.4	Confident	83.5	Confident	58 Å²	58	52.3 Å²	52.3	35%	0.352	27%	0.273	S	S	.	.	S	Bend	trans	-133.7	127.9	178.2	-176.6	0	0	0	0	109.6	T488 G491 R492 G495 A499	T488-V497 HydrophobicContact CG2-CG1 4.2Å; G491-V497 PolarHBondContact O-N 3.09Å; R492-V497 WeakPolarHBondContact CA-O 3.47Å; R492-V497 HydrophobicContact CG-CB 4.36Å; R492-V497 HydrophobicContact CG-CG1 4.45Å; G495-V497 PolarHBondContact O-N 3.4Å; V497-A499 PolarHBondContact O-N 2.94Å
498	G	76.9	Confident	82.3	Confident	62 Å²	62	58.2 Å²	58.2	64%	0.639	30%	0.297	S	S	*	.	S	Bend	trans	59.2	40.8	166.3	0	0	0	0	0	115.4
499	A	78.2	Confident	81	Confident	8 Å²	8	61.2 Å²	61.2	7%	0.066	31%	0.311	C	S	.	.			trans	-78.6	-22.5	-177.4	0	0	0	0	0	113.9	F159 V497 E501 I502 L503	F159-A499 HydrophobicContact CE1-CB 4.24Å; F159-A499 HydrophobicContact CZ-CB 3.97Å; V497-A499 PolarHBondContact O-N 2.94Å; A499-E501 PolarHBondContact O-N 3.41Å; A499-I502 PolarHBondContact O-N 2.97Å; A499-L503 HydrophobicContact CB-CD1 3.94Å; A499-L503 HydrophobicContact CB-CD2 4.43Å; A499-L503 HydrophobicContact CB-CG 4Å; A499-L503 VanDerWaalsContact O-CG 3.29Å; A499-L503 WeakPolarHBondContact O-CG 3.21Å; A499-L503 PolarHBondContact O-N 3Å
500	E	76.5	Confident	79.8	Confident	162 Å²	162	61.3 Å²	61.3	76%	0.757	31%	0.31	S	S	*	.	H	α-helix	trans	-52	-48.6	-165.5	-64.4	177.9	176	0	0	114.2	I502 L503 D504	E500-I502 VanDerWaalsContact C-N 3.29Å; E500-I502 PolarHBondContact O-N 2.86Å; E500-L503 PolarHBondContact O-N 3.43Å; E500-D504 PolarHBondContact O-N 3.04Å
501	E	70.3	Confident	78.6	Confident	168 Å²	168	65 Å²	65	79%	0.785	34%	0.335	S	S	*	.	H	α-helix	trans	-65.5	-31.2	-179.5	-63.3	178.3	179	0	0	113.1	A499	A499-E501 PolarHBondContact O-N 3.41Å
502	I	72.9	Confident	77.2	Confident	41 Å²	41	69.5 Å²	69.5	21%	0.21	36%	0.357	C	S	.	.	H	α-helix	trans	-81.9	-36.3	-179.2	-62.8	175.3	0	0	0	110.4	L166 A499 E500 D504 I505 I506	L166-I502 HydrophobicContact CD2-CG2 4.38Å; A499-I502 PolarHBondContact O-N 2.97Å; E500-I502 VanDerWaalsContact C-N 3.29Å; E500-I502 PolarHBondContact O-N 2.86Å; I502-D504 VanDerWaalsContact C-N 3.3Å; I502-D504 PolarHBondContact O-N 2.84Å; I502-I505 PolarHBondContact O-N 2.8Å; I502-I505 VanDerWaalsContact O-N 3.13Å; I502-I506 HydrophobicContact CG2-CD1 3.47Å; I502-I506 VanDerWaalsContact CG2-CD1 3.47Å; I502-I506 HydrophobicContact CG2-CG1 3.95Å; I502-I506 WeakPolarHBondContact O-CG1 3.11Å; I502-I506 PolarHBondContact O-N 3.13Å
503	L	76.3	Confident	75.3	Confident	7 Å²	7	64.3 Å²	64.3	4%	0.037	34%	0.338	C	S	.	.	H	α-helix	trans	-58.7	-42.9	-179.4	-69.7	172.9	0	0	0	111	F159 L166 A499 E500 I505 I506 F507	F159-L503 HydrophobicContact CD1-CD1 3.95Å; F159-L503 HydrophobicContact CD1-CD2 3.96Å; F159-L503 HydrophobicContact CE1-CD1 3.68Å; F159-L503 HydrophobicContact CE1-CD2 3.98Å; F159-L503 HydrophobicContact CE1-CG 4.43Å; F159-L503 HydrophobicContact CG-CD2 4.33Å; F159-L503 HydrophobicContact CZ-CD2 4.34Å; L166-L503 HydrophobicContact CD1-CD2 3.62Å; A499-L503 HydrophobicContact CB-CD1 3.94Å; A499-L503 HydrophobicContact CB-CD2 4.43Å; A499-L503 HydrophobicContact CB-CG 4Å; A499-L503 VanDerWaalsContact O-CG 3.29Å; A499-L503 WeakPolarHBondContact O-CG 3.21Å; A499-L503 PolarHBondContact O-N 3Å; E500-L503 PolarHBondContact O-N 3.43Å; L503-I505 VanDerWaalsContact C-N 3.27Å; L503-I505 PolarHBondContact O-N 3.48Å; L503-I506 PolarHBondContact O-N 3.06Å; L503-F507 HydrophobicContact CB-CD2 3.82Å; L503-F507 HydrophobicContact CB-CE2 3.67Å; L503-F507 HydrophobicContact CD1-CE2 4.48Å; L503-F507 HydrophobicContact CD2-CD2 4.38Å; L503-F507 HydrophobicContact CD2-CE2 3.44Å; L503-F507 VanDerWaalsContact CD2-CE2 3.44Å; L503-F507 HydrophobicContact CD2-CZ 3.85Å; L503-F507 HydrophobicContact CG-CE2 3.99Å; L503-F507 VanDerWaalsContact O-CB 3.28Å; L503-F507 WeakPolarHBondContact O-CB 3.47Å; L503-F507 WeakPolarHBondContact O-CD2 3.43Å; L503-F507 WeakPolarHBondContact O-CG 3.33Å; L503-F507 PolarHBondContact O-N 2.77Å
504	D	75.6	Confident	73.2	Confident	87 Å²	87	67.7 Å²	67.7	47%	0.465	35%	0.352	S	S	.	.	H	α-helix	trans	-64.7	-30.5	179.3	-78.8	-12.5	0	0	0	113.2	E500 I502 K508	E500-D504 PolarHBondContact O-N 3.04Å; I502-D504 VanDerWaalsContact C-N 3.3Å; I502-D504 PolarHBondContact O-N 2.84Å; D504-K508 WeakPolarHBondContact O-CB 3.46Å; D504-K508 VanDerWaalsContact O-CD 3.22Å; D504-K508 WeakPolarHBondContact O-CD 3.4Å; D504-K508 WeakPolarHBondContact O-CG 3.42Å; D504-K508 PolarHBondContact O-N 3.27Å
505	I	74.4	Confident	72.4	Confident	109 Å²	109	70.7 Å²	70.7	56%	0.559	37%	0.368	S	S	*	.	H	α-helix	trans	-74.5	-52	175.6	-61.5	171.4	0	0	0	109.2	I502 L503 F507 K508	I502-I505 PolarHBondContact O-N 2.8Å; I502-I505 VanDerWaalsContact O-N 3.13Å; L503-I505 VanDerWaalsContact C-N 3.27Å; L503-I505 PolarHBondContact O-N 3.48Å; I505-F507 PolarHBondContact O-N 3.44Å; I505-K508 PolarHBondContact O-N 2.85Å
506	I	75.1	Confident	71.7	Confident	19 Å²	19	73.8 Å²	73.8	10%	0.097	38%	0.381	C	S	.	.	H	α-helix	trans	-58.2	-49	-178.6	-71.1	178.9	0	0	0	110.5	L166 V169 E170 I502 L503 K508 D509 F510	L166-I506 HydrophobicContact CD1-CD1 3.79Å; L166-I506 HydrophobicContact CG-CD1 4.42Å; V169-I506 HydrophobicContact CG1-CG2 3.92Å; E170-I506 HydrophobicContact CG-CD1 3.82Å; E170-I506 WeakPolarHBondContact OE1-CD1 3.32Å; I502-I506 HydrophobicContact CG2-CD1 3.47Å; I502-I506 VanDerWaalsContact CG2-CD1 3.47Å; I502-I506 HydrophobicContact CG2-CG1 3.95Å; I502-I506 WeakPolarHBondContact O-CG1 3.11Å; I502-I506 PolarHBondContact O-N 3.13Å; L503-I506 PolarHBondContact O-N 3.06Å; I506-K508 PolarHBondContact O-N 2.91Å; I506-D509 PolarHBondContact O-N 3.3Å; I506-F510 HydrophobicContact CG2-CD2 4.32Å; I506-F510 HydrophobicContact CG2-CE2 3.61Å; I506-F510 WeakPolarHBondContact O-CD2 3.43Å
507	F	76.8	Confident	70.9	Confident	6 Å²	6	70.1 Å²	70.1	3%	0.026	37%	0.373	C	S	.	.	H	α-helix	trans	-73.2	-22.5	-174.8	-67.9	-48.2	0	0	0	114.5	A151 G152 T155 R156 V169 L503 I505 D509 F510	A151-F507 CarbonylContact C-O 3.41Å; G152-F507 WeakPolarHBondContact O-CD1 3.28Å; T155-F507 HydrophobicContact CG2-CE1 3.76Å; R156-F507 HydrophobicContact CB-CD1 4.46Å; R156-F507 HydrophobicContact CB-CD2 3.76Å; R156-F507 HydrophobicContact CB-CE1 4.24Å; R156-F507 HydrophobicContact CB-CE2 3.46Å; R156-F507 VanDerWaalsContact CB-CE2 3.46Å; R156-F507 HydrophobicContact CB-CG 4.27Å; R156-F507 HydrophobicContact CB-CZ 3.77Å; R156-F507 HydrophobicContact CG-CD2 3.94Å; R156-F507 HydrophobicContact CG-CE2 3.59Å; R156-F507 HydrophobicContact CG-CZ 4.3Å; V169-F507 HydrophobicContact CG1-CE1 3.62Å; V169-F507 HydrophobicContact CG1-CZ 4Å; L503-F507 HydrophobicContact CB-CD2 3.82Å; L503-F507 HydrophobicContact CB-CE2 3.67Å; L503-F507 HydrophobicContact CD1-CE2 4.48Å; L503-F507 HydrophobicContact CD2-CD2 4.38Å; L503-F507 HydrophobicContact CD2-CE2 3.44Å; L503-F507 VanDerWaalsContact CD2-CE2 3.44Å; L503-F507 HydrophobicContact CD2-CZ 3.85Å; L503-F507 HydrophobicContact CG-CE2 3.99Å; L503-F507 VanDerWaalsContact O-CB 3.28Å; L503-F507 WeakPolarHBondContact O-CB 3.47Å; L503-F507 WeakPolarHBondContact O-CD2 3.43Å; L503-F507 WeakPolarHBondContact O-CG 3.33Å; L503-F507 PolarHBondContact O-N 2.77Å; I505-F507 PolarHBondContact O-N 3.44Å; F507-D509 PolarHBondContact O-N 2.8Å; F507-F510 HydrophobicContact CD1-CD2 4.07Å; F507-F510 HydrophobicContact CD1-CE2 4.31Å; F507-F510 PolarHBondContact O-N 2.87Å
508	K	71.3	Confident	70.3	Confident	156 Å²	156	70.8 Å²	70.8	68%	0.678	37%	0.374	S	S	*	.	H	α-helix	trans	-65	-30.1	170.3	-82.5	171.4	-170.4	170.3	0	112.6	D504 I505 I506 F510	D504-K508 WeakPolarHBondContact O-CB 3.46Å; D504-K508 VanDerWaalsContact O-CD 3.22Å; D504-K508 WeakPolarHBondContact O-CD 3.4Å; D504-K508 WeakPolarHBondContact O-CG 3.42Å; D504-K508 PolarHBondContact O-N 3.27Å; I505-K508 PolarHBondContact O-N 2.85Å; I506-K508 PolarHBondContact O-N 2.91Å; K508-F510 VanDerWaalsContact C-N 3.27Å
509	D	67.2	Low	69.9	Low	115 Å²	115	71.4 Å²	71.4	62%	0.615	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-8.4	178.4	-62.8	-20.1	0	0	0	112.2	I506 F507	I506-D509 PolarHBondContact O-N 3.3Å; F507-D509 PolarHBondContact O-N 2.8Å
510	F	70.3	Confident	69.3	Low	13 Å²	13	75.6 Å²	75.6	6%	0.057	38%	0.377	C	S	.	.	S	Bend	trans	-82.4	143.7	171.9	-77.5	-100.4	0	0	0	111.6	A151 V169 L172 G173 I176 I506 F507 K508	A151-F510 WeakPolarHBondContact CB-O 3.21Å; V169-F510 HydrophobicContact CG1-CE2 4.34Å; V169-F510 HydrophobicContact CG1-CZ 4.22Å; V169-F510 WeakPolarHBondContact O-CZ 3.4Å; L172-F510 HydrophobicContact CG-CE1 4.34Å; G173-F510 VanDerWaalsContact CA-CZ 3.43Å; I176-F510 HydrophobicContact CD1-CD1 4.28Å; I176-F510 HydrophobicContact CD1-CE1 4.15Å; I506-F510 HydrophobicContact CG2-CD2 4.32Å; I506-F510 HydrophobicContact CG2-CE2 3.61Å; I506-F510 WeakPolarHBondContact O-CD2 3.43Å; F507-F510 HydrophobicContact CD1-CD2 4.07Å; F507-F510 HydrophobicContact CD1-CE2 4.31Å; F507-F510 PolarHBondContact O-N 2.87Å; K508-F510 VanDerWaalsContact C-N 3.27Å
511	C	68.2	Low	68.8	Low	79 Å²	79	69.4 Å²	69.4	53%	0.534	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-67.3	148	170.1	-60.8	0	0	0	0	111.6	G513 K514	C511-G513 PolarHBondContact O-N 3.14Å; C511-K514 PolarHBondContact O-N 2.82Å; C511-K514 VanDerWaalsContact O-O 3.12Å
512	I	63.1	Low	68.7	Low	100 Å²	100	61.8 Å²	61.8	51%	0.513	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	128.5	167	-59.4	171.5	0	0	0	108.8	A48 A151	A48-I512 HydrophobicContact CB-CG2 4.04Å; A151-I512 HydrophobicContact CB-CG1 4.33Å
513	G	54.6	Low	68.3	Low	2 Å²	2	63.6 Å²	63.6	2%	0.021	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	111.9	-8.5	-175	0	0	0	0	0	115.5	L49 S50 C511	L49-G513 WeakPolarHBondContact O-CA 3.38Å; S50-G513 WeakPolarHBondContact CB-O 3.27Å; S50-G513 PolarHBondContact OG-O 3.02Å; C511-G513 PolarHBondContact O-N 3.14Å
514	K	47.1	Very low	67.6	Low	70 Å²	70	68.7 Å²	68.7	30%	0.304	35%	0.352	S	S	.	.			trans	-138.7	0	166.7	-73.3	-172.4	178.9	178.3	0	109.3	G152 F154 T155 I176 C511	G152-K514 CarbonylContact C-O 3.17Å; G152-K514 VanDerWaalsContact C-O 3.3Å; G152-K514 WeakPolarHBondContact CA-O 3.46Å; G152-K514 PolarHBondContact N-O 3.49Å; F154-K514 WeakPolarHBondContact CB-OXT 3.34Å; F154-K514 PolarHBondContact N-OXT 3.21Å; T155-K514 VanDerWaalsContact CB-OXT 3.3Å; T155-K514 WeakPolarHBondContact CB-OXT 3.44Å; T155-K514 PolarHBondContact N-OXT 3.17Å; T155-K514 PolarHBondContact OG1-OXT 3.23Å; I176-K514 HydrophobicContact CD1-CD 3.56Å; I176-K514 HydrophobicContact CG1-CD 4.5Å; C511-K514 PolarHBondContact O-N 2.82Å; C511-K514 VanDerWaalsContact O-O 3.12Å

Retrieved 514 of 514 residues in 758.9 ms (Link to these results)

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