A0A087WSY1_HUMAN Loading...

receptor protein-tyrosine kinase

AlphaFold DB , UniProt , Accession A0A087WSY1, Species HUMAN (Homo sapiens, Human), Gene MUSK, Length 861 aa.

						>A0A087WSY1_HUMAN|A0A087WSY1|MUSK
MRELVNIPLVHILTLVAFSGTEKLPKAPVITTPLETVDALVEEVATFMCAVESYPQPEISWTRNKILIKLFDTRYSIRENGQLLTILSVEDSDDGIYCCTANNGVGGAVESCGALQVKMKPKITRPPINVKIIEGLKAVLPCTTMGNPKPSVSWIKGDSPLRENSRIAVLESGSLRIHNVQKEDAGQYRCVAKNSLGTAYSKVVKLEVEVFARILRAPESHNVTFGSFVTLHCTATGIPVPTITWIENGNAVSSGSIQESVKDRVIDSRLQLFITKPGLYTCIATNKHGEKFSTAKAAATISIAEWSKPQKDNKGYCAQYRGEVCNAVLAKDALVFLNTSYADPEEAQELLVHTAWNELKVVSPVCRPAAEALLCNHIFQECSPGVVPTPIPICREYCLAVKELFCAKEWLVMEEKTHRGLYRSEMHLLSVPECSKLPSMHWDPTACARLPHLAFPPMTSSKPSVDIPNLPSSSSSSFSVSPTYSMTVIISIMSSFAIFVLLTITTLYCCRRRKQWKNKKRESAAVTLTTLPSELLLDRLHPNPMYQRMPLLLNPKLLSLEYPRNNIEYVRDIGEGAFGRVFQARAPGLLPYEPFTMVAVKMLKEEASADMQADFQREAALMAEFDNPNIVKLLGVCAVGKPMCLLFEYMAYGDLNEFLRSMSPHTVCSLSHSDLSMRAQVSSPGPPPLSCAEQLCIARQVAAGMAYLSERKFVHRDLATRNCLVGENMVVKIADFGLSRNIYSADYYKANENDAIPIRWMPPESIFYNRYTTESDVWAYGVVLWEIFSYGLQPYYGMAHEEVIYYVRDGNILSCPENCPVELYNLMRLCWSKLPADRPSFTSIHRILERMCERAEGTVSV
					

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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	34.7	Very low	38.9	Very low	236 Å²	236	148.9 Å²	148.9	100%	1.163	76%	0.756	S	S	*	*				0	109.8	0	-70.2	-172.6	-87.3	0	0	105.7
2	R	34.9	Very low	38.9	Very low	223 Å²	223	148.6 Å²	148.6	84%	0.842	76%	0.755	S	S	*	*				44.1	121.4	87	-74.1	-166.3	-170.3	-179.3	3.1	109.6
3	E	36.3	Very low	38.7	Very low	141 Å²	141	148 Å²	148	66%	0.659	75%	0.754	S	S	*	*			cis	-178	155.2	28.1	-112.1	171.5	-166.6	0	0	107.5
4	L	37.1	Very low	38.4	Very low	142 Å²	142	145.3 Å²	145.3	74%	0.743	75%	0.748	S	S	*	*			trans	46.6	138.7	131.7	-60.9	163.2	0	0	0	118.4
5	V	43.3	Very low	38.6	Very low	108 Å²	108	145.9 Å²	145.9	66%	0.655	75%	0.753	S	S	*	*			cis	175.8	153.8	36.9	110.4	0	0	0	0	110.8
6	N	35.6	Very low	38.7	Very low	124 Å²	124	144.8 Å²	144.8	66%	0.663	75%	0.754	S	S	*	*			trans	64.8	119	149.7	-72.7	-7.5	0	0	0	124.3
7	I	35.5	Very low	39.2	Very low	140 Å²	140	141.1 Å²	141.1	72%	0.718	75%	0.749	S	S	*	*				84.8	144	92.9	-68	171	0	0	0	112.8
8	P	53.6	Low	39.2	Very low	99 Å²	99	144.1 Å²	144.1	64%	0.643	76%	0.755	S	S	*	*			cis	-144.3	-178.9	-32.1	41.3	-20.3	0	0	0	116
9	L	39.1	Very low	39.5	Very low	145 Å²	145	142.2 Å²	142.2	76%	0.759	76%	0.755	S	S	*	*			trans	49.9	128	142.5	-89.4	129.2	0	0	0	122.6
10	V	38.8	Very low	39.7	Very low	126 Å²	126	138 Å²	138	76%	0.764	75%	0.748	S	S	*	*				-177.3	106.3	122.9	156.9	0	0	0	0	107.1
11	H	38.8	Very low	40.3	Very low	154 Å²	154	137.4 Å²	137.4	71%	0.713	75%	0.748	S	S	*	*				85.4	120	97	-113.8	-170.1	0	0	0	111.2
12	I	39.6	Very low	41.4	Very low	145 Å²	145	135 Å²	135	74%	0.744	74%	0.735	S	S	*	*				-175.8	132.1	84.2	-86	159.2	0	0	0	110.3
13	L	35.9	Very low	42.8	Very low	141 Å²	141	131 Å²	131	74%	0.738	72%	0.723	S	S	*	*			trans	12	143	140	-61.3	135.1	0	0	0	118.1
14	T	35	Very low	44.9	Very low	110 Å²	110	131.6 Å²	131.6	68%	0.675	73%	0.73	S	S	*	*			cis	-172.8	141.3	30.4	-10.6	0	0	0	0	109.6
15	L	41.3	Very low	47.2	Very low	155 Å²	155	129 Å²	129	81%	0.812	72%	0.721	S	S	*	*			trans	34.8	106.6	142.7	-70.2	160.7	0	0	0	119.8
16	V	40	Very low	49.4	Very low	127 Å²	127	128 Å²	128	77%	0.77	71%	0.708	S	S	*	*			trans	-120.4	118.4	132.1	176.5	0	0	0	0	107.3	F18	V16-F18 HydrophobicContact CG1-CD2 4.45Å; V16-F18 PolarHBondContact O-N 2.75Å
17	A	46.1	Very low	52	Low	82 Å²	82	123.6 Å²	123.6	68%	0.678	69%	0.69	S	S	*	*			trans	-58.3	116.9	166.9	0	0	0	0	0	109.4
18	F	40.8	Very low	54.8	Low	195 Å²	195	117.1 Å²	117.1	86%	0.855	66%	0.657	S	S	*	*			trans	-102.8	91.4	150	-98.7	-87.7	0	0	0	106.9	V16 G20	V16-F18 HydrophobicContact CG1-CD2 4.45Å; V16-F18 PolarHBondContact O-N 2.75Å; F18-G20 PolarHBondContact O-N 3.3Å
19	S	44.2	Very low	56.7	Low	109 Å²	109	116 Å²	116	76%	0.762	65%	0.647	S	S	*	*			trans	-64.9	77.4	151.7	57.4	0	0	0	0	107.6	T21	S19-T21 VanDerWaalsContact C-N 3.34Å; S19-T21 PolarHBondContact O-N 3.26Å; S19-T21 VanDerWaalsContact O-N 3.17Å
20	G	42.9	Very low	59.3	Low	58 Å²	58	110.6 Å²	110.6	60%	0.598	62%	0.619	S	S	*	*			trans	-72.3	98.2	158.2	0	0	0	0	0	106.1	F18 E22	F18-G20 PolarHBondContact O-N 3.3Å; G20-E22 VanDerWaalsContact C-N 3.31Å; G20-E22 PolarHBondContact O-N 3.37Å
21	T	52.1	Low	61.9	Low	125 Å²	125	107.6 Å²	107.6	77%	0.767	60%	0.601	S	S	*	*			trans	-55.1	105.8	156.9	49.3	0	0	0	0	105.6	S19 K23	S19-T21 VanDerWaalsContact C-N 3.34Å; S19-T21 PolarHBondContact O-N 3.26Å; S19-T21 VanDerWaalsContact O-N 3.17Å; T21-K23 PolarHBondContact O-N 3.17Å
22	E	57.8	Low	64.3	Low	187 Å²	187	103.6 Å²	103.6	87%	0.874	59%	0.588	S	S	*	*			trans	-55.7	107.4	166.6	-80.5	-175.4	156.5	0	0	105.9	G20 L24	G20-E22 VanDerWaalsContact C-N 3.31Å; G20-E22 PolarHBondContact O-N 3.37Å; E22-L24 PolarHBondContact O-N 3.15Å; E22-L24 VanDerWaalsContact O-N 3.09Å
23	K	64.7	Low	66.8	Low	139 Å²	139	101.2 Å²	101.2	60%	0.604	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-57.3	121.1	173.3	-88.5	-178.1	176.6	-178.3	0	106.1	T21 Y54	T21-K23 PolarHBondContact O-N 3.17Å; K23-Y54 HydrophobicContact CB-CD1 3.5Å; K23-Y54 HydrophobicContact CB-CD2 4.01Å; K23-Y54 HydrophobicContact CB-CE1 3.41Å; K23-Y54 VanDerWaalsContact CB-CE1 3.41Å; K23-Y54 HydrophobicContact CB-CE2 3.89Å; K23-Y54 HydrophobicContact CB-CG 3.81Å; K23-Y54 HydrophobicContact CD-CD2 3.71Å; K23-Y54 HydrophobicContact CD-CE2 3.8Å; K23-Y54 HydrophobicContact CD-CG 4.16Å; K23-Y54 HydrophobicContact CG-CE2 4.44Å; K23-Y54 VanDerWaalsContact O-CD1 3.23Å; K23-Y54 WeakPolarHBondContact O-CD1 3.47Å; K23-Y54 WeakPolarHBondContact O-CE1 3.5Å
24	L	79.8	Confident	69.6	Low	153 Å²	153	95.3 Å²	95.3	80%	0.801	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-53.6	133.9	175	-83.9	144.1	0	0	0	109	E22 K26	E22-L24 PolarHBondContact O-N 3.15Å; E22-L24 VanDerWaalsContact O-N 3.09Å; L24-K26 PolarHBondContact O-N 3.28Å; L24-K26 VanDerWaalsContact O-N 3.12Å
25	P	85.5	Confident	72.4	Confident	86 Å²	86	97.4 Å²	97.4	56%	0.558	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-54.4	120.5	175.2	-24	32.6	0	0	0	110.3	Y54 V105	P25-Y54 CarbonylContact C-O 3.55Å; P25-Y54 VanDerWaalsContact CA-O 3.3Å; P25-Y54 WeakPolarHBondContact CA-O 3.27Å; P25-V105 HydrophobicContact CB-CG1 4.21Å; P25-V105 HydrophobicContact CB-CG2 3.99Å
26	K	89.8	Confident	75	Confident	87 Å²	87	93.8 Å²	93.8	38%	0.378	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	118.1	179	-175.5	-178.2	176.6	-179.6	0	108.2	L24 E52 Y54 N103	L24-K26 PolarHBondContact O-N 3.28Å; L24-K26 VanDerWaalsContact O-N 3.12Å; K26-E52 IonicContact NZ-OE2 2.67Å; K26-E52 PolarHBondContact NZ-OE2 3.4Å; K26-Y54 PolarHBondContact N-O 3.45Å; K26-Y54 PolarHBondContact O-N 3.21Å; K26-N103 PolarHBondContact O-ND2 2.74Å
27	A	91.4	Very high	77.6	Confident	33 Å²	33	89.5 Å²	89.5	27%	0.273	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.8	150.4	171.5	0	0	0	0	0	110.9	V29 V105	A27-V29 PolarHBondContact O-N 2.84Å; A27-V105 VanDerWaalsContact CA-O 3.29Å; A27-V105 WeakPolarHBondContact CA-O 3.33Å; A27-V105 HydrophobicContact CB-CG1 4.26Å; A27-V105 WeakPolarHBondContact CB-O 2.92Å
28	P	93.4	Very high	79.9	Confident	4 Å²	4	90.6 Å²	90.6	3%	0.026	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	129.1	-177.1	29.3	-29	0	0	0	109.9	V51 P57 A101 N103 V105 V109	P28-V51 HydrophobicContact CB-CG1 3.8Å; P28-P57 HydrophobicContact CB-CB 4.44Å; P28-A101 HydrophobicContact CB-CB 4.23Å; P28-N103 WeakPolarHBondContact CD-OD1 3.22Å; P28-V105 WeakPolarHBondContact CD-O 2.99Å; P28-V109 HydrophobicContact CB-CG2 3.93Å; P28-V109 HydrophobicContact CG-CG2 3.99Å; P28-V109 VanDerWaalsContact O-CG1 3.27Å; P28-V109 WeakPolarHBondContact O-CG1 3.32Å; P28-V109 WeakPolarHBondContact O-CG2 3.22Å
29	V	93.8	Very high	82.4	Confident	74 Å²	74	81.7 Å²	81.7	45%	0.448	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	121.1	174.1	-179.3	0	0	0	0	108.1	A27 T31 V51 E52	A27-V29 PolarHBondContact O-N 2.84Å; V29-T31 PolarHBondContact O-N 2.92Å; V29-V51 WeakPolarHBondContact O-CA 3.46Å; V29-E52 PolarHBondContact N-O 3.45Å; V29-E52 PolarHBondContact O-N 3.24Å
30	I	93.9	Very high	84.8	Confident	32 Å²	32	78.1 Å²	78.1	16%	0.164	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	114	170.7	-65	170.6	0	0	0	106.9	T32 A50 V51 V109 E110	I30-T32 WeakPolarHBondContact CG2-O 3.39Å; I30-A50 WeakPolarHBondContact CA-O 3.42Å; I30-V51 HydrophobicContact CG1-CG2 4.2Å; I30-V109 HydrophobicContact CD1-CB 4.29Å; I30-V109 HydrophobicContact CD1-CG2 3.95Å; I30-V109 HydrophobicContact CG1-CG2 3.8Å; I30-E110 VanDerWaalsContact CD1-C 3.45Å
31	T	92.5	Very high	87	Confident	64 Å²	64	77.1 Å²	77.1	39%	0.393	42%	0.423	S	S	.	.	S	Bend	trans	-83.2	-23.3	-174.8	53.5	0	0	0	0	112.7	V29 A50 E52	V29-T31 PolarHBondContact O-N 2.92Å; T31-A50 PolarHBondContact N-O 3.49Å; T31-A50 WeakPolarHBondContact OG1-CB 3.36Å; T31-A50 PolarHBondContact OG1-O 3.47Å; T31-E52 HydrophobicContact CG2-CB 4.01Å; T31-E52 HydrophobicContact CG2-CG 3.53Å
32	T	90.4	Very high	88.8	Confident	69 Å²	69	78.2 Å²	78.2	42%	0.423	42%	0.419	S	S	.	.	S	Bend	trans	-133.2	121	176.5	48.4	0	0	0	0	109.3	I30 A50	I30-T32 WeakPolarHBondContact CG2-O 3.39Å; T32-A50 WeakPolarHBondContact OG1-CB 2.87Å
33	P	91.9	Very high	90.4	Very high	96 Å²	96	74.1 Å²	74.1	62%	0.623	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-66.8	148.4	175.8	29	-33.6	0	0	0	110.2	E35 S111	P33-E35 PolarHBondContact O-N 3.48Å; P33-S111 WeakPolarHBondContact CA-OG 2.95Å
34	L	95.1	Very high	91.8	Very high	16 Å²	16	71.6 Å²	71.6	8%	0.084	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-68.6	132.2	174.4	-82.7	81.6	0	0	0	110.5	F47 C49 W61 C99 S111	L34-F47 HydrophobicContact CD2-CB 4.15Å; L34-F47 HydrophobicContact CD2-CD1 3.96Å; L34-F47 HydrophobicContact CD2-CG 4.39Å; L34-C49 HydrophobicContact CD1-CB 4.28Å; L34-W61 HydrophobicContact CD2-CH2 3.71Å; L34-W61 HydrophobicContact CD2-CZ3 3.5Å; L34-C99 HydrophobicContact CD1-CB 4.47Å; L34-C99 WeakPolarHBondContact CD1-SG 3.23Å; L34-S111 PolarHBondContact N-OG 3.47Å
35	E	93.6	Very high	92.6	Very high	155 Å²	155	64.4 Å²	64.4	72%	0.724	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-99.2	169.2	176.2	-64.1	-173.5	172.4	0	0	111.8	P33 G113	P33-E35 PolarHBondContact O-N 3.48Å; E35-G113 WeakPolarHBondContact O-CA 3.3Å
36	T	94.9	Very high	93	Very high	79 Å²	79	63.7 Å²	63.7	49%	0.485	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-70.5	131.1	170.8	-61.9	0	0	0	0	110.4	A114 Q116	T36-A114 CarbonylContact C-O 3.56Å; T36-A114 VanDerWaalsContact CA-O 3.23Å; T36-A114 WeakPolarHBondContact CA-O 3.39Å; T36-A114 HydrophobicContact CG2-CB 4.22Å; T36-A114 WeakPolarHBondContact CG2-O 3.46Å; T36-Q116 HydrophobicContact CG2-CG 3.92Å
37	V	95.8	Very high	93.3	Very high	37 Å²	37	59.8 Å²	59.8	22%	0.224	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	121.8	175.7	178.5	0	0	0	0	108.7	A45 F47 A114 L115 Q116	V37-A45 HydrophobicContact CG1-CB 4.38Å; V37-F47 HydrophobicContact CB-CE1 4.05Å; V37-F47 HydrophobicContact CB-CZ 4Å; V37-F47 HydrophobicContact CG2-CD1 3.93Å; V37-F47 HydrophobicContact CG2-CE1 3.54Å; V37-F47 HydrophobicContact CG2-CZ 3.96Å; V37-A114 PolarHBondContact N-O 3.25Å; V37-L115 HydrophobicContact CB-CD1 4.13Å; V37-L115 HydrophobicContact CG1-CD1 4.05Å; V37-L115 WeakPolarHBondContact O-CA 3.43Å; V37-Q116 PolarHBondContact O-N 2.87Å
38	D	93.8	Very high	93.4	Very high	105 Å²	105	62.2 Å²	62.2	56%	0.561	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	128.2	165.9	-78.9	-38	0	0	0	108.9	Q116 K118	D38-Q116 WeakPolarHBondContact OD1-CB 3.48Å; D38-Q116 PolarHBondContact OD1-OE1 3.02Å; D38-K118 WeakPolarHBondContact OD1-CE 3.29Å; D38-K118 IonicContact OD1-NZ 3.75Å
39	A	94.4	Very high	93.4	Very high	7 Å²	7	62 Å²	62	6%	0.058	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	144.3	176.6	0	0	0	0	0	111.4	A45 V89 L115 Q116 K118	A39-A45 HydrophobicContact CB-CB 3.87Å; A39-V89 HydrophobicContact CB-CG1 4.36Å; A39-V89 HydrophobicContact CB-CG2 4.01Å; A39-L115 HydrophobicContact CB-CD1 4.02Å; A39-Q116 PolarHBondContact N-O 3.32Å; A39-Q116 VanDerWaalsContact N-O 3.15Å; A39-K118 PolarHBondContact O-N 2.66Å
40	L	92.6	Very high	93.4	Very high	35 Å²	35	59.5 Å²	59.5	18%	0.183	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	147.2	172.5	-65.1	169.7	0	0	0	110.8	E43 K118 L196	L40-E43 HydrophobicContact CB-CB 4.47Å; L40-E43 HydrophobicContact CB-CG 3.97Å; L40-E43 WeakPolarHBondContact O-CB 3.29Å; L40-E43 PolarHBondContact O-N 3.41Å; L40-K118 CarbonylContact C-O 3.59Å; L40-K118 VanDerWaalsContact CA-O 3.26Å; L40-K118 WeakPolarHBondContact CA-O 3.24Å; L40-K118 HydrophobicContact CD2-CB 3.77Å; L40-L196 HydrophobicContact CD2-CD1 3.89Å
41	V	91.1	Very high	93.3	Very high	37 Å²	37	58.6 Å²	58.6	22%	0.224	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	140	169.3	172.9	0	0	0	0	110.4	E43 V89 V117 K118 M119	V41-E43 PolarHBondContact O-N 3.22Å; V41-V89 CarbonylContact C-O 3.52Å; V41-V89 WeakPolarHBondContact CA-O 3.47Å; V41-V117 HydrophobicContact CG2-CG1 3.45Å; V41-V117 VanDerWaalsContact CG2-CG1 3.45Å; V41-K118 PolarHBondContact N-O 2.94Å; V41-M119 HydrophobicContact CB-CG 4.49Å; V41-M119 HydrophobicContact CG2-CB 4.06Å; V41-M119 HydrophobicContact CG2-CE 3.8Å; V41-M119 HydrophobicContact CG2-CG 4.23Å
42	E	88.9	Confident	93.3	Very high	147 Å²	147	60.5 Å²	60.5	69%	0.687	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	-2.1	-173.4	-61.4	164.2	-165.1	0	0	115.3	V89	E42-V89 PolarHBondContact N-O 3.32Å
43	E	92.2	Very high	93.3	Very high	102 Å²	102	58 Å²	58	48%	0.477	31%	0.314	S	S	.	.	S	Bend	trans	-91.3	177.8	171.8	-63.6	-171	167.2	0	0	112.3	L40 V41 V89	L40-E43 HydrophobicContact CB-CB 4.47Å; L40-E43 HydrophobicContact CB-CG 3.97Å; L40-E43 WeakPolarHBondContact O-CB 3.29Å; L40-E43 PolarHBondContact O-N 3.41Å; V41-E43 PolarHBondContact O-N 3.22Å; E43-V89 VanDerWaalsContact O-CG2 3.31Å; E43-V89 WeakPolarHBondContact O-CG2 3.36Å; E43-V89 PolarHBondContact O-N 3.07Å
44	V	93.5	Very high	93.2	Very high	85 Å²	85	58.3 Å²	58.3	52%	0.515	30%	0.304	S	S	.	.			trans	-97.9	135.1	178.6	177.2	0	0	0	0	109.3	T46 T85 I86 L87	V44-T46 HydrophobicContact CG1-CG2 4.33Å; V44-T85 HydrophobicContact CG1-CG2 3.47Å; V44-T85 VanDerWaalsContact CG1-CG2 3.47Å; V44-I86 WeakPolarHBondContact CA-O 2.89Å; V44-I86 WeakPolarHBondContact CG1-O 3.25Å; V44-L87 WeakPolarHBondContact CG2-O 3.44Å
45	A	95.6	Very high	92.9	Very high	2 Å²	2	60.9 Å²	60.9	2%	0.017	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	141.8	171.4	0	0	0	0	0	111	V37 A39 T85 I86 V89 L115	V37-A45 HydrophobicContact CG1-CB 4.38Å; A39-A45 HydrophobicContact CB-CB 3.87Å; A45-T85 CarbonylContact O-C 3.59Å; A45-T85 WeakPolarHBondContact O-CA 3.39Å; A45-I86 HydrophobicContact CB-CB 4.32Å; A45-I86 HydrophobicContact CB-CD1 4.29Å; A45-I86 PolarHBondContact N-O 3.47Å; A45-I86 VanDerWaalsContact N-O 3.13Å; A45-I86 PolarHBondContact O-N 2.81Å; A45-V89 HydrophobicContact CB-CG2 3.59Å; A45-L115 HydrophobicContact CB-CD1 3.67Å
46	T	94.9	Very high	92.7	Very high	72 Å²	72	59.5 Å²	59.5	44%	0.442	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	135.5	-178	54.4	0	0	0	0	112	V44 L84 T85	V44-T46 HydrophobicContact CG1-CG2 4.33Å; T46-L84 CarbonylContact C-O 3.58Å; T46-L84 VanDerWaalsContact CA-O 3.29Å; T46-L84 WeakPolarHBondContact CA-O 3.4Å; T46-T85 HydrophobicContact CG2-CG2 3.91Å
47	F	95.5	Very high	92.5	Very high	5 Å²	5	56.3 Å²	56.3	2%	0.022	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128.7	169.2	-67.1	-85.7	0	0	0	109.7	L34 V37 W61 L84 Y97 L115	L34-F47 HydrophobicContact CD2-CB 4.15Å; L34-F47 HydrophobicContact CD2-CD1 3.96Å; L34-F47 HydrophobicContact CD2-CG 4.39Å; V37-F47 HydrophobicContact CB-CE1 4.05Å; V37-F47 HydrophobicContact CB-CZ 4Å; V37-F47 HydrophobicContact CG2-CD1 3.93Å; V37-F47 HydrophobicContact CG2-CE1 3.54Å; V37-F47 HydrophobicContact CG2-CZ 3.96Å; F47-W61 HydrophobicContact CB-CH2 3.5Å; F47-W61 VanDerWaalsContact CB-CH2 3.5Å; F47-W61 HydrophobicContact CB-CZ3 3.64Å; F47-W61 HydrophobicContact CG-CZ3 4.34Å; F47-L84 HydrophobicContact CB-CB 4.42Å; F47-L84 HydrophobicContact CD2-CD2 4.43Å; F47-L84 PolarHBondContact N-O 2.96Å; F47-L84 PolarHBondContact O-N 3.28Å; F47-Y97 HydrophobicContact CD2-CG 4.23Å; F47-Y97 HydrophobicContact CE2-CD1 4.33Å; F47-Y97 AromaticContact CE2-CD2 3.8Å; F47-Y97 HydrophobicContact CE2-CD2 3.8Å; F47-Y97 HydrophobicContact CE2-CE2 4.32Å; F47-Y97 AromaticContact CE2-CG 3.8Å; F47-Y97 HydrophobicContact CE2-CG 3.8Å; F47-Y97 AromaticContact CZ-CD2 3.92Å; F47-Y97 HydrophobicContact CZ-CD2 3.92Å; F47-Y97 HydrophobicContact CZ-CG 4.16Å; F47-L115 HydrophobicContact CE2-CB 4.23Å; F47-L115 HydrophobicContact CE2-CD1 4.28Å; F47-L115 HydrophobicContact CZ-CB 3.87Å; F47-L115 HydrophobicContact CZ-CD1 4.21Å
48	M	94.1	Very high	92.4	Very high	83 Å²	83	62.1 Å²	62.1	41%	0.409	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	123.5	176.3	-179.2	61	80.3	0	0	109.6	E79 Q82 L83	M48-E79 VanDerWaalsContact CE-OE2 3.28Å; M48-E79 WeakPolarHBondContact CE-OE2 3.19Å; M48-Q82 HydrophobicContact SD-CB 4.32Å; M48-L83 HydrophobicContact CE-CB 4.24Å; M48-L83 HydrophobicContact CE-CD1 3.9Å; M48-L83 HydrophobicContact CE-CG 4.46Å; M48-L83 HydrophobicContact SD-CB 4.41Å
49	C	93.3	Very high	92.4	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.299	C	S	.	.			trans	-111.1	85.8	174.5	-176	0	0	0	0	108.4	L34 V51 W61 Q82 C99	L34-C49 HydrophobicContact CD1-CB 4.28Å; C49-V51 PolarHBondContact O-N 3.12Å; C49-W61 HydrophobicContact CB-CH2 3.88Å; C49-W61 HydrophobicContact CB-CZ2 3.6Å; C49-Q82 PolarHBondContact N-O 3.24Å; C49-Q82 WeakPolarHBondContact O-CB 3.43Å; C49-Q82 VanDerWaalsContact O-CG 3.3Å; C49-Q82 WeakPolarHBondContact O-CG 3.41Å; C49-Q82 PolarHBondContact O-OE1 3.49Å; C49-C99 HydrophobicContact CB-CB 3.5Å; C49-C99 VanDerWaalsContact CB-CB 3.5Å; C49-C99 WeakPolarHBondContact CB-SG 3.44Å; C49-C99 WeakPolarHBondContact SG-CB 3.46Å; C49-C99 CovalentContact SG-SG 2.04Å; C49-C99 PolarHBondContact SG-SG 3.39Å
50	A	92.6	Very high	92.3	Very high	22 Å²	22	60 Å²	60	18%	0.182	31%	0.311	C	S	.	.			trans	-75.6	115.5	-179.8	0	0	0	0	0	110.1	I30 T31 T32	I30-A50 WeakPolarHBondContact CA-O 3.42Å; T31-A50 PolarHBondContact N-O 3.49Å; T31-A50 WeakPolarHBondContact OG1-CB 3.36Å; T31-A50 PolarHBondContact OG1-O 3.47Å; T32-A50 WeakPolarHBondContact OG1-CB 2.87Å
51	V	93.6	Very high	92.5	Very high	13 Å²	13	58.4 Å²	58.4	8%	0.079	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.3	-176.6	-173.4	0	0	0	0	110.8	P28 V29 I30 C49 P57 I59 A101	P28-V51 HydrophobicContact CB-CG1 3.8Å; V29-V51 WeakPolarHBondContact O-CA 3.46Å; I30-V51 HydrophobicContact CG1-CG2 4.2Å; C49-V51 PolarHBondContact O-N 3.12Å; V51-P57 HydrophobicContact CB-CG 4.17Å; V51-P57 HydrophobicContact CG1-CB 4.48Å; V51-P57 HydrophobicContact CG1-CG 3.78Å; V51-I59 HydrophobicContact CG2-CD1 3.99Å; V51-A101 HydrophobicContact CG1-CB 3.97Å; V51-A101 HydrophobicContact CG2-CB 3.82Å
52	E	92.3	Very high	92.6	Very high	103 Å²	103	57.7 Å²	57.7	48%	0.481	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	116.5	168.5	-77	-174.6	-171	0	0	110.9	K26 V29 T31	K26-E52 IonicContact NZ-OE2 2.67Å; K26-E52 PolarHBondContact NZ-OE2 3.4Å; V29-E52 PolarHBondContact N-O 3.45Å; V29-E52 PolarHBondContact O-N 3.24Å; T31-E52 HydrophobicContact CG2-CB 4.01Å; T31-E52 HydrophobicContact CG2-CG 3.53Å
53	S	90.3	Very high	92.9	Very high	18 Å²	18	54 Å²	54	13%	0.126	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	162.2	177.4	82	0	0	0	0	112.5	P55 P57 N103	S53-P55 CarbonylContact C-O 3.56Å; S53-P55 PolarHBondContact OG-O 3.17Å; S53-P57 WeakPolarHBondContact OG-CD 3.35Å; S53-P57 WeakPolarHBondContact OG-CG 3.43Å; S53-N103 WeakPolarHBondContact CB-ND2 3.31Å
54	Y	89.2	Confident	92.9	Very high	102 Å²	102	53.1 Å²	53.1	40%	0.4	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	121.7	166.5	-177.3	-95.1	0	0	0	109.7	K23 P25 K26	K23-Y54 HydrophobicContact CB-CD1 3.5Å; K23-Y54 HydrophobicContact CB-CD2 4.01Å; K23-Y54 HydrophobicContact CB-CE1 3.41Å; K23-Y54 VanDerWaalsContact CB-CE1 3.41Å; K23-Y54 HydrophobicContact CB-CE2 3.89Å; K23-Y54 HydrophobicContact CB-CG 3.81Å; K23-Y54 HydrophobicContact CD-CD2 3.71Å; K23-Y54 HydrophobicContact CD-CE2 3.8Å; K23-Y54 HydrophobicContact CD-CG 4.16Å; K23-Y54 HydrophobicContact CG-CE2 4.44Å; K23-Y54 VanDerWaalsContact O-CD1 3.23Å; K23-Y54 WeakPolarHBondContact O-CD1 3.47Å; K23-Y54 WeakPolarHBondContact O-CE1 3.5Å; P25-Y54 CarbonylContact C-O 3.55Å; P25-Y54 VanDerWaalsContact CA-O 3.3Å; P25-Y54 WeakPolarHBondContact CA-O 3.27Å; K26-Y54 PolarHBondContact N-O 3.45Å; K26-Y54 PolarHBondContact O-N 3.21Å
55	P	89.8	Confident	92.8	Very high	70 Å²	70	58.4 Å²	58.4	46%	0.455	29%	0.293	S	S	.	.	S	Bend	cis	-61.2	171.7	-4.4	-22.1	35.1	0	0	0	114	S53 N103	S53-P55 CarbonylContact C-O 3.56Å; S53-P55 PolarHBondContact OG-O 3.17Å; P55-N103 WeakPolarHBondContact O-CB 3.35Å; P55-N103 PolarHBondContact O-ND2 3.01Å
56	Q	88.3	Confident	92.6	Very high	125 Å²	125	64.3 Å²	64.3	58%	0.584	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-57.4	140.4	177.4	-72.2	-68.8	-33.3	0	0	110.8
57	P	91	Very high	92.4	Very high	13 Å²	13	65.7 Å²	65.7	8%	0.084	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-86	150.2	-174.1	32.9	-23.9	0	0	0	111.3	P28 V51 S53 I59 A101 N102 N103	P28-P57 HydrophobicContact CB-CB 4.44Å; V51-P57 HydrophobicContact CB-CG 4.17Å; V51-P57 HydrophobicContact CG1-CB 4.48Å; V51-P57 HydrophobicContact CG1-CG 3.78Å; S53-P57 WeakPolarHBondContact OG-CD 3.35Å; S53-P57 WeakPolarHBondContact OG-CG 3.43Å; P57-I59 HydrophobicContact CB-CG1 4.48Å; P57-I59 HydrophobicContact CG-CD1 4.29Å; P57-I59 HydrophobicContact CG-CG1 4.17Å; P57-A101 HydrophobicContact CB-CB 4.2Å; P57-N102 CarbonylContact C-O 3.58Å; P57-N102 WeakPolarHBondContact CA-O 3.42Å; P57-N103 HydrophobicContact CB-CB 4.16Å
58	E	92.6	Very high	92.2	Very high	159 Å²	159	66.2 Å²	66.2	74%	0.743	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	124.9	160	-173.3	177.8	-178.2	0	0	108.2	A101 N102	E58-A101 WeakPolarHBondContact O-CA 3.22Å; E58-N102 PolarHBondContact N-O 2.84Å; E58-N102 PolarHBondContact O-N 2.89Å
59	I	94	Very high	91.5	Very high	22 Å²	22	68.1 Å²	68.1	11%	0.113	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	127.5	-179.3	-57.7	175.8	0	0	0	109.3	V51 P57 G81 Q82 C99 T100 A101	V51-I59 HydrophobicContact CG2-CD1 3.99Å; P57-I59 HydrophobicContact CB-CG1 4.48Å; P57-I59 HydrophobicContact CG-CD1 4.29Å; P57-I59 HydrophobicContact CG-CG1 4.17Å; I59-G81 WeakPolarHBondContact CG2-O 3.24Å; I59-Q82 HydrophobicContact CD1-CB 4.28Å; I59-Q82 HydrophobicContact CD1-CG 3.32Å; I59-C99 HydrophobicContact CG2-CB 4.28Å; I59-T100 WeakPolarHBondContact CA-O 3.44Å; I59-A101 HydrophobicContact CG1-CB 4.07Å
60	S	93.6	Very high	90.3	Very high	44 Å²	44	75.4 Å²	75.4	31%	0.308	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	146.3	174.2	63.6	0	0	0	0	110.5	C99 T100	S60-C99 WeakPolarHBondContact O-CA 3.18Å; S60-T100 PolarHBondContact N-O 2.88Å; S60-T100 PolarHBondContact O-N 2.02Å
61	W	95.6	Very high	89.4	Confident	3 Å²	3	82 Å²	82	1%	0.011	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	133.6	179.7	-73.6	88.6	0	0	0	110.5	L34 F47 C49 I68 G81 L84 C98 C99	L34-W61 HydrophobicContact CD2-CH2 3.71Å; L34-W61 HydrophobicContact CD2-CZ3 3.5Å; F47-W61 HydrophobicContact CB-CH2 3.5Å; F47-W61 VanDerWaalsContact CB-CH2 3.5Å; F47-W61 HydrophobicContact CB-CZ3 3.64Å; F47-W61 HydrophobicContact CG-CZ3 4.34Å; C49-W61 HydrophobicContact CB-CH2 3.88Å; C49-W61 HydrophobicContact CB-CZ2 3.6Å; W61-I68 HydrophobicContact CB-CB 4.39Å; W61-I68 HydrophobicContact CB-CD1 4.04Å; W61-I68 HydrophobicContact CB-CG1 4.43Å; W61-I68 PolarHBondContact O-N 3.44Å; W61-G81 PolarHBondContact NE1-O 3.15Å; W61-L84 HydrophobicContact CB-CD2 4.3Å; W61-L84 HydrophobicContact CD2-CB 3.73Å; W61-L84 HydrophobicContact CD2-CD2 3.77Å; W61-L84 HydrophobicContact CD2-CG 4.29Å; W61-L84 HydrophobicContact CE3-CB 4.03Å; W61-L84 HydrophobicContact CE3-CD2 3.52Å; W61-L84 HydrophobicContact CE3-CG 4.4Å; W61-L84 HydrophobicContact CG-CB 4.24Å; W61-L84 HydrophobicContact CG-CD2 4.12Å; W61-L84 HydrophobicContact CH2-CB 4.06Å; W61-L84 HydrophobicContact CZ2-CB 3.79Å; W61-L84 HydrophobicContact CZ3-CB 4.16Å; W61-L84 HydrophobicContact CZ3-CD2 4.05Å; W61-C98 WeakPolarHBondContact CA-O 3.48Å; W61-C99 HydrophobicContact CD2-CB 4.02Å; W61-C99 HydrophobicContact CE3-CB 3.99Å; W61-C99 HydrophobicContact CH2-CB 3.79Å; W61-C99 HydrophobicContact CZ2-CB 3.78Å; W61-C99 HydrophobicContact CZ3-CB 3.89Å
62	T	94.8	Very high	88.6	Confident	21 Å²	21	84 Å²	84	13%	0.129	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	145.1	172.9	70.6	0	0	0	0	110.7	I66 L67 Y97 C98	T62-I66 CarbonylContact C-O 3.48Å; T62-I66 VanDerWaalsContact CA-O 3.22Å; T62-I66 WeakPolarHBondContact CA-O 3.18Å; T62-L67 HydrophobicContact CG2-CD1 4.4Å; T62-Y97 CarbonylContact O-C 3.5Å; T62-Y97 VanDerWaalsContact O-CA 3.31Å; T62-Y97 WeakPolarHBondContact O-CA 3.04Å; T62-C98 PolarHBondContact N-O 2.84Å; T62-C98 PolarHBondContact O-N 3.25Å
63	R	94.1	Very high	88.1	Confident	69 Å²	69	85 Å²	85	26%	0.26	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	119.8	167.6	-176.7	-177.7	74.3	170.2	7.5	108.2	K65 I66 I68 Y75 S92 D93 I96 Y97	R63-K65 PolarHBondContact O-N 3.02Å; R63-I66 PolarHBondContact N-O 3.05Å; R63-I66 WeakPolarHBondContact O-CB 3.2Å; R63-I66 PolarHBondContact O-N 3.03Å; R63-I68 HydrophobicContact CB-CD1 4.23Å; R63-I68 HydrophobicContact CB-CG1 4.15Å; R63-Y75 PolarHBondContact NH1-OH 2.68Å; R63-S92 PolarHBondContact NH1-O 2.88Å; R63-D93 IonicContact NH1-OD1 3.47Å; R63-D93 PolarHBondContact NH1-OD1 3.01Å; R63-I96 CarbonylContact C-O 3.58Å; R63-I96 WeakPolarHBondContact CA-O 3.03Å; R63-Y97 HydrophobicContact CB-CD1 4.28Å; R63-Y97 HydrophobicContact CB-CE1 4Å; R63-Y97 WeakPolarHBondContact CD-OH 3.49Å; R63-Y97 HydrophobicContact CG-CD1 4.48Å; R63-Y97 HydrophobicContact CG-CE1 3.99Å; R63-Y97 HydrophobicContact CG-CE2 4.05Å
64	N	92.2	Very high	87.9	Confident	85 Å²	85	87 Å²	87	46%	0.455	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	43.7	-176.1	-60.9	-31.4	0	0	0	111.9	I66 I96	N64-I66 PolarHBondContact O-N 2.9Å; N64-I96 PolarHBondContact N-O 2.7Å; N64-I96 PolarHBondContact OD1-N 2.88Å
65	K	91.4	Very high	87.9	Confident	195 Å²	195	83.2 Å²	83.2	85%	0.848	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	3.4	-176.8	-49.2	179.3	179.3	-178.5	0	115.9	R63	R63-K65 PolarHBondContact O-N 3.02Å
66	I	91.1	Very high	87.9	Confident	126 Å²	126	81.2 Å²	81.2	65%	0.646	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96	126.6	174.5	-57.8	176.4	0	0	0	108.6	T62 R63 N64 I68	T62-I66 CarbonylContact C-O 3.48Å; T62-I66 VanDerWaalsContact CA-O 3.22Å; T62-I66 WeakPolarHBondContact CA-O 3.18Å; R63-I66 PolarHBondContact N-O 3.05Å; R63-I66 WeakPolarHBondContact O-CB 3.2Å; R63-I66 PolarHBondContact O-N 3.03Å; N64-I66 PolarHBondContact O-N 2.9Å; I66-I68 PolarHBondContact O-N 3.01Å
67	L	91.4	Very high	88.1	Confident	101 Å²	101	77.7 Å²	77.7	53%	0.529	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	127.4	178	-173.3	72.7	0	0	0	111.3	T62 K69	T62-L67 HydrophobicContact CG2-CD1 4.4Å; L67-K69 PolarHBondContact O-N 2.87Å
68	I	90.4	Very high	88	Confident	16 Å²	16	82.9 Å²	82.9	8%	0.082	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-73.6	118.3	171.9	-59.3	-179.4	0	0	0	107.6	W61 R63 I66 Y75 L84 Y97	W61-I68 HydrophobicContact CB-CB 4.39Å; W61-I68 HydrophobicContact CB-CD1 4.04Å; W61-I68 HydrophobicContact CB-CG1 4.43Å; W61-I68 PolarHBondContact O-N 3.44Å; R63-I68 HydrophobicContact CB-CD1 4.23Å; R63-I68 HydrophobicContact CB-CG1 4.15Å; I66-I68 PolarHBondContact O-N 3.01Å; I68-Y75 HydrophobicContact CD1-CD1 4.39Å; I68-Y75 HydrophobicContact CD1-CE1 4.19Å; I68-Y75 HydrophobicContact CG2-CD1 4.17Å; I68-Y75 HydrophobicContact CG2-CD2 3.63Å; I68-Y75 HydrophobicContact CG2-CE2 4.04Å; I68-Y75 HydrophobicContact CG2-CG 3.69Å; I68-L84 HydrophobicContact CD1-CD1 4.33Å; I68-L84 HydrophobicContact CD1-CD2 3.7Å; I68-Y97 HydrophobicContact CD1-CD1 3.8Å; I68-Y97 HydrophobicContact CD1-CE1 3.72Å
69	K	80.7	Confident	88	Confident	123 Å²	123	80.7 Å²	80.7	54%	0.535	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-83.7	131.7	-175.8	-57.8	-172.8	-175	177.4	0	110	L67 F71 D72	L67-K69 PolarHBondContact O-N 2.87Å; K69-F71 HydrophobicContact CB-CD1 3.97Å; K69-F71 HydrophobicContact CB-CD2 4.46Å; K69-F71 HydrophobicContact CB-CE1 3.62Å; K69-F71 HydrophobicContact CB-CE2 4.14Å; K69-F71 HydrophobicContact CB-CG 4.41Å; K69-F71 HydrophobicContact CB-CZ 3.74Å; K69-F71 HydrophobicContact CD-CE1 3.56Å; K69-F71 HydrophobicContact CD-CE2 4.01Å; K69-F71 HydrophobicContact CD-CZ 3.17Å; K69-F71 HydrophobicContact CG-CE1 4.14Å; K69-F71 HydrophobicContact CG-CZ 4.08Å; K69-F71 PolarHBondContact O-N 3.21Å; K69-D72 WeakPolarHBondContact O-CB 3.39Å; K69-D72 PolarHBondContact O-N 3.18Å
70	L	67.3	Low	87.6	Confident	154 Å²	154	86 Å²	86	81%	0.806	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-15.3	-177.3	-77.5	153.3	0	0	0	115.3	I77	L70-I77 HydrophobicContact CD2-CD1 4.05Å
71	F	73.6	Confident	87.4	Confident	159 Å²	159	84.5 Å²	84.5	70%	0.697	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-3.5	176.9	58.1	-103.6	0	0	0	113.8	K69 T73	K69-F71 HydrophobicContact CB-CD1 3.97Å; K69-F71 HydrophobicContact CB-CD2 4.46Å; K69-F71 HydrophobicContact CB-CE1 3.62Å; K69-F71 HydrophobicContact CB-CE2 4.14Å; K69-F71 HydrophobicContact CB-CG 4.41Å; K69-F71 HydrophobicContact CB-CZ 3.74Å; K69-F71 HydrophobicContact CD-CE1 3.56Å; K69-F71 HydrophobicContact CD-CE2 4.01Å; K69-F71 HydrophobicContact CD-CZ 3.17Å; K69-F71 HydrophobicContact CG-CE1 4.14Å; K69-F71 HydrophobicContact CG-CZ 4.08Å; K69-F71 PolarHBondContact O-N 3.21Å; F71-T73 PolarHBondContact O-N 3.12Å
72	D	77.7	Confident	87.3	Confident	55 Å²	55	86.1 Å²	86.1	29%	0.294	42%	0.42	S	S	.	.			trans	-74.6	108.1	173.1	-172.7	-20.2	0	0	0	109.1	K69 R74 Y75	K69-D72 WeakPolarHBondContact O-CB 3.39Å; K69-D72 PolarHBondContact O-N 3.18Å; D72-R74 PolarHBondContact O-N 3.46Å; D72-R74 VanDerWaalsContact O-N 3.09Å; D72-R74 WeakPolarHBondContact OD1-CB 3.28Å; D72-R74 PolarHBondContact OD1-N 3.38Å; D72-Y75 HydrophobicContact CB-CD2 3.88Å; D72-Y75 HydrophobicContact CB-CE2 4.45Å; D72-Y75 PolarHBondContact O-N 2.97Å; D72-Y75 VanDerWaalsContact O-N 3.13Å; D72-Y75 VanDerWaalsContact OD2-CE2 3.3Å; D72-Y75 WeakPolarHBondContact OD2-CE2 3.23Å
73	T	80.8	Confident	87.2	Confident	126 Å²	126	86.2 Å²	86.2	77%	0.773	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-10.6	-174.9	53.8	0	0	0	0	113.8	F71	F71-T73 PolarHBondContact O-N 3.12Å
74	R	86.5	Confident	87.3	Confident	59 Å²	59	82.9 Å²	82.9	22%	0.223	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-19.4	175.8	-56.6	-163.9	-53	125.3	14.2	113.1	D72 L87 E90 D93	D72-R74 PolarHBondContact O-N 3.46Å; D72-R74 VanDerWaalsContact O-N 3.09Å; D72-R74 WeakPolarHBondContact OD1-CB 3.28Å; D72-R74 PolarHBondContact OD1-N 3.38Å; R74-L87 PolarHBondContact O-N 3.23Å; R74-E90 IonicContact CZ-OE1 3.63Å; R74-E90 IonicContact NH1-OE1 3.83Å; R74-E90 PolarHBondContact NH1-OE1 3.4Å; R74-E90 IonicContact NH1-OE2 2.73Å; R74-D93 IonicContact CZ-OD1 2.76Å; R74-D93 IonicContact CZ-OD2 3.82Å; R74-D93 IonicContact NH1-OD1 2.91Å; R74-D93 PolarHBondContact NH1-OD1 2.98Å; R74-D93 IonicContact NH1-OD2 3.79Å; R74-D93 PolarHBondContact NH1-OD2 2.82Å; R74-D93 IonicContact NH2-OD1 3.28Å; R74-D93 PolarHBondContact NH2-OD1 2.71Å; R74-D93 IonicContact NH2-OD2 2.97Å
75	Y	88.9	Confident	87.4	Confident	23 Å²	23	79 Å²	79	9%	0.09	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	140.7	177.5	-59.4	-80.4	0	0	0	111.1	R63 I68 D72 L84 T85 I86 D93 Y97	R63-Y75 PolarHBondContact NH1-OH 2.68Å; I68-Y75 HydrophobicContact CD1-CD1 4.39Å; I68-Y75 HydrophobicContact CD1-CE1 4.19Å; I68-Y75 HydrophobicContact CG2-CD1 4.17Å; I68-Y75 HydrophobicContact CG2-CD2 3.63Å; I68-Y75 HydrophobicContact CG2-CE2 4.04Å; I68-Y75 HydrophobicContact CG2-CG 3.69Å; D72-Y75 HydrophobicContact CB-CD2 3.88Å; D72-Y75 HydrophobicContact CB-CE2 4.45Å; D72-Y75 PolarHBondContact O-N 2.97Å; D72-Y75 VanDerWaalsContact O-N 3.13Å; D72-Y75 VanDerWaalsContact OD2-CE2 3.3Å; D72-Y75 WeakPolarHBondContact OD2-CE2 3.23Å; Y75-L84 HydrophobicContact CD1-CD1 4.01Å; Y75-L84 HydrophobicContact CG-CD1 4.48Å; Y75-T85 CarbonylContact C-O 3.49Å; Y75-T85 WeakPolarHBondContact CA-O 3.45Å; Y75-I86 HydrophobicContact CD1-CG1 3.93Å; Y75-I86 HydrophobicContact CE1-CD1 4.22Å; Y75-I86 HydrophobicContact CE1-CG1 3.83Å; Y75-D93 PolarHBondContact OH-OD1 2.74Å; Y75-Y97 HydrophobicContact CE1-CE1 4.03Å
76	S	90.5	Very high	87.5	Confident	28 Å²	28	69.7 Å²	69.7	20%	0.196	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	117.9	171.3	-177.4	0	0	0	0	109.1	R78 T85	S76-R78 PolarHBondContact OG-NH1 2.94Å; S76-T85 PolarHBondContact N-O 3.09Å; S76-T85 PolarHBondContact O-N 3.42Å
77	I	91.4	Very high	87.5	Confident	51 Å²	51	67.6 Å²	67.6	26%	0.262	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	121.8	175.5	-59.6	178.1	0	0	0	108.1	L70 L83 L84	L70-I77 HydrophobicContact CD2-CD1 4.05Å; I77-L83 CarbonylContact C-O 3.58Å; I77-L83 WeakPolarHBondContact CA-O 3.06Å; I77-L84 HydrophobicContact CD1-CD1 4.29Å; I77-L84 HydrophobicContact CG1-CD1 3.74Å
78	R	90.1	Very high	87.5	Confident	122 Å²	122	65.4 Å²	65.4	46%	0.46	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	176.7	-177	-67.1	-172.8	-74.6	-124.5	-1.7	110.5	S76 N80 G81 Q82 L83 T85	S76-R78 PolarHBondContact OG-NH1 2.94Å; R78-N80 PolarHBondContact O-N 3.41Å; R78-G81 PolarHBondContact O-N 3.35Å; R78-Q82 PolarHBondContact O-N 3.42Å; R78-L83 HydrophobicContact CB-CB 4.48Å; R78-L83 HydrophobicContact CB-CD2 4.48Å; R78-L83 PolarHBondContact N-O 2.93Å; R78-L83 PolarHBondContact O-N 3.47Å; R78-L83 VanDerWaalsContact O-N 3.11Å; R78-T85 PolarHBondContact NH2-OG1 3.47Å; R78-T85 VanDerWaalsContact NH2-OG1 3.13Å
79	E	91.1	Very high	87.6	Confident	113 Å²	113	64.6 Å²	64.6	53%	0.528	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	56.3	54	176.4	-57.3	-176.2	-176.3	0	0	113.1	M48 G81 Q82 L83	M48-E79 VanDerWaalsContact CE-OE2 3.28Å; M48-E79 WeakPolarHBondContact CE-OE2 3.19Å; E79-G81 PolarHBondContact O-N 3.29Å; E79-G81 VanDerWaalsContact O-N 3.13Å; E79-Q82 HydrophobicContact CB-CB 4.41Å; E79-Q82 WeakPolarHBondContact O-CB 3.31Å; E79-Q82 PolarHBondContact O-N 3.46Å; E79-L83 HydrophobicContact CB-CB 4.28Å; E79-L83 HydrophobicContact CG-CB 4.31Å
80	N	87.4	Confident	88.1	Confident	133 Å²	133	62.8 Å²	62.8	71%	0.711	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	54	32	-178.9	-58.5	-24.4	0	0	0	114	R78	R78-N80 PolarHBondContact O-N 3.41Å
81	G	88.1	Confident	89	Confident	12 Å²	12	59.6 Å²	59.6	12%	0.124	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	96.9	-9.1	179.7	0	0	0	0	0	114.7	I59 W61 R78 E79	I59-G81 WeakPolarHBondContact CG2-O 3.24Å; W61-G81 PolarHBondContact NE1-O 3.15Å; R78-G81 PolarHBondContact O-N 3.35Å; E79-G81 PolarHBondContact O-N 3.29Å; E79-G81 VanDerWaalsContact O-N 3.13Å
82	Q	92.9	Very high	89.7	Confident	37 Å²	37	55.6 Å²	55.6	17%	0.173	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-26.5	-174	-67	-174.9	54.5	0	0	113.8	M48 C49 I59 R78 E79	M48-Q82 HydrophobicContact SD-CB 4.32Å; C49-Q82 PolarHBondContact N-O 3.24Å; C49-Q82 WeakPolarHBondContact O-CB 3.43Å; C49-Q82 VanDerWaalsContact O-CG 3.3Å; C49-Q82 WeakPolarHBondContact O-CG 3.41Å; C49-Q82 PolarHBondContact O-OE1 3.49Å; I59-Q82 HydrophobicContact CD1-CB 4.28Å; I59-Q82 HydrophobicContact CD1-CG 3.32Å; R78-Q82 PolarHBondContact O-N 3.42Å; E79-Q82 HydrophobicContact CB-CB 4.41Å; E79-Q82 WeakPolarHBondContact O-CB 3.31Å; E79-Q82 PolarHBondContact O-N 3.46Å
83	L	94.1	Very high	90.3	Very high	23 Å²	23	53 Å²	53	12%	0.12	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	111.8	-177.9	-179.4	63.1	0	0	0	111.1	M48 I77 R78 E79	M48-L83 HydrophobicContact CE-CB 4.24Å; M48-L83 HydrophobicContact CE-CD1 3.9Å; M48-L83 HydrophobicContact CE-CG 4.46Å; M48-L83 HydrophobicContact SD-CB 4.41Å; I77-L83 CarbonylContact C-O 3.58Å; I77-L83 WeakPolarHBondContact CA-O 3.06Å; R78-L83 HydrophobicContact CB-CB 4.48Å; R78-L83 HydrophobicContact CB-CD2 4.48Å; R78-L83 PolarHBondContact N-O 2.93Å; R78-L83 PolarHBondContact O-N 3.47Å; R78-L83 VanDerWaalsContact O-N 3.11Å; E79-L83 HydrophobicContact CB-CB 4.28Å; E79-L83 HydrophobicContact CG-CB 4.31Å
84	L	94.8	Very high	90.9	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	124.2	169.2	175.4	68.2	0	0	0	109.7	T46 F47 W61 I68 Y75 I77 Y97	T46-L84 CarbonylContact C-O 3.58Å; T46-L84 VanDerWaalsContact CA-O 3.29Å; T46-L84 WeakPolarHBondContact CA-O 3.4Å; F47-L84 HydrophobicContact CB-CB 4.42Å; F47-L84 HydrophobicContact CD2-CD2 4.43Å; F47-L84 PolarHBondContact N-O 2.96Å; F47-L84 PolarHBondContact O-N 3.28Å; W61-L84 HydrophobicContact CB-CD2 4.3Å; W61-L84 HydrophobicContact CD2-CB 3.73Å; W61-L84 HydrophobicContact CD2-CD2 3.77Å; W61-L84 HydrophobicContact CD2-CG 4.29Å; W61-L84 HydrophobicContact CE3-CB 4.03Å; W61-L84 HydrophobicContact CE3-CD2 3.52Å; W61-L84 HydrophobicContact CE3-CG 4.4Å; W61-L84 HydrophobicContact CG-CB 4.24Å; W61-L84 HydrophobicContact CG-CD2 4.12Å; W61-L84 HydrophobicContact CH2-CB 4.06Å; W61-L84 HydrophobicContact CZ2-CB 3.79Å; W61-L84 HydrophobicContact CZ3-CB 4.16Å; W61-L84 HydrophobicContact CZ3-CD2 4.05Å; I68-L84 HydrophobicContact CD1-CD1 4.33Å; I68-L84 HydrophobicContact CD1-CD2 3.7Å; Y75-L84 HydrophobicContact CD1-CD1 4.01Å; Y75-L84 HydrophobicContact CG-CD1 4.48Å; I77-L84 HydrophobicContact CD1-CD1 4.29Å; I77-L84 HydrophobicContact CG1-CD1 3.74Å; L84-Y97 HydrophobicContact CD2-CD1 3.59Å; L84-Y97 HydrophobicContact CD2-CE1 4.06Å
85	T	94.4	Very high	91.2	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.012	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	130.8	175.3	-52.7	0	0	0	0	110.4	V44 A45 T46 Y75 S76 R78 L87	V44-T85 HydrophobicContact CG1-CG2 3.47Å; V44-T85 VanDerWaalsContact CG1-CG2 3.47Å; A45-T85 CarbonylContact O-C 3.59Å; A45-T85 WeakPolarHBondContact O-CA 3.39Å; T46-T85 HydrophobicContact CG2-CG2 3.91Å; Y75-T85 CarbonylContact C-O 3.49Å; Y75-T85 WeakPolarHBondContact CA-O 3.45Å; S76-T85 PolarHBondContact N-O 3.09Å; S76-T85 PolarHBondContact O-N 3.42Å; R78-T85 PolarHBondContact NH2-OG1 3.47Å; R78-T85 VanDerWaalsContact NH2-OG1 3.13Å; T85-L87 HydrophobicContact CG2-CD2 4.09Å
86	I	95.1	Very high	91.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	114.8	168.6	-51.4	176	0	0	0	106.7	V44 A45 Y75 V89 Y97 L115	V44-I86 WeakPolarHBondContact CA-O 2.89Å; V44-I86 WeakPolarHBondContact CG1-O 3.25Å; A45-I86 HydrophobicContact CB-CB 4.32Å; A45-I86 HydrophobicContact CB-CD1 4.29Å; A45-I86 PolarHBondContact N-O 3.47Å; A45-I86 VanDerWaalsContact N-O 3.13Å; A45-I86 PolarHBondContact O-N 2.81Å; Y75-I86 HydrophobicContact CD1-CG1 3.93Å; Y75-I86 HydrophobicContact CE1-CD1 4.22Å; Y75-I86 HydrophobicContact CE1-CG1 3.83Å; I86-V89 HydrophobicContact CB-CG2 4.3Å; I86-V89 HydrophobicContact CG2-CG2 4.06Å; I86-Y97 HydrophobicContact CD1-CE1 4.05Å; I86-Y97 HydrophobicContact CD1-CE2 4.36Å; I86-Y97 WeakPolarHBondContact CD1-OH 3.34Å; I86-L115 HydrophobicContact CD1-CD2 3.56Å
87	L	90.6	Very high	91.8	Very high	83 Å²	83	50.1 Å²	50.1	44%	0.435	26%	0.264	S	S	.	.	S	Bend	trans	-75.6	-27.2	-168	-64.7	175.1	0	0	0	114	V44 R74 T85	V44-L87 WeakPolarHBondContact CG2-O 3.44Å; R74-L87 PolarHBondContact O-N 3.23Å; T85-L87 HydrophobicContact CG2-CD2 4.09Å
88	S	91.2	Very high	92.1	Very high	54 Å²	54	48.2 Å²	48.2	38%	0.378	26%	0.255	S	S	.	.	S	Bend	trans	-150.4	101.3	176	172	0	0	0	0	107.8	E90	S88-E90 PolarHBondContact O-N 2.89Å
89	V	92.8	Very high	92.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.233	C	C	.	.			trans	-65.2	126.9	-177.4	172.1	0	0	0	0	110.2	A39 V41 E42 E43 A45 I86 L115 V117	A39-V89 HydrophobicContact CB-CG1 4.36Å; A39-V89 HydrophobicContact CB-CG2 4.01Å; V41-V89 CarbonylContact C-O 3.52Å; V41-V89 WeakPolarHBondContact CA-O 3.47Å; E42-V89 PolarHBondContact N-O 3.32Å; E43-V89 VanDerWaalsContact O-CG2 3.31Å; E43-V89 WeakPolarHBondContact O-CG2 3.36Å; E43-V89 PolarHBondContact O-N 3.07Å; A45-V89 HydrophobicContact CB-CG2 3.59Å; I86-V89 HydrophobicContact CB-CG2 4.3Å; I86-V89 HydrophobicContact CG2-CG2 4.06Å; V89-L115 HydrophobicContact CG1-CD2 4.46Å; V89-V117 HydrophobicContact CG1-CB 4.28Å; V89-V117 HydrophobicContact CG1-CG1 3.69Å; V89-V117 HydrophobicContact CG1-CG2 3.65Å
90	E	90.8	Very high	92.6	Very high	85 Å²	85	38.6 Å²	38.6	40%	0.397	22%	0.218	S	C	.	.			trans	-108.9	160.3	170	-66.4	172	-141.9	0	0	110.5	R74 S88 S92 D93	R74-E90 IonicContact CZ-OE1 3.63Å; R74-E90 IonicContact NH1-OE1 3.83Å; R74-E90 PolarHBondContact NH1-OE1 3.4Å; R74-E90 IonicContact NH1-OE2 2.73Å; S88-E90 PolarHBondContact O-N 2.89Å; E90-S92 PolarHBondContact O-N 3.39Å; E90-S92 VanDerWaalsContact O-N 3.13Å; E90-D93 PolarHBondContact N-OD2 3.3Å; E90-D93 WeakPolarHBondContact O-CB 3.23Å; E90-D93 PolarHBondContact O-N 3.11Å
91	D	85.4	Confident	93	Very high	87 Å²	87	32.2 Å²	32.2	47%	0.465	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-56.4	-30.6	176.3	-166.4	65.7	0	0	0	112.4	D93 D94 M119	D91-D93 PolarHBondContact O-N 3.36Å; D91-D94 PolarHBondContact O-N 2.74Å; D91-M119 HydrophobicContact CB-CE 4.31Å
92	S	88.6	Confident	93.3	Very high	75 Å²	75	35 Å²	35	52%	0.524	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-74.7	-7.1	177.9	75.1	0	0	0	0	114.8	R63 E90 D94	R63-S92 PolarHBondContact NH1-O 2.88Å; E90-S92 PolarHBondContact O-N 3.39Å; E90-S92 VanDerWaalsContact O-N 3.13Å; S92-D94 VanDerWaalsContact C-N 3.34Å
93	D	90.4	Very high	93.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-86.1	-7.9	177.4	-63.1	-43.7	0	0	0	112.6	R63 R74 Y75 E90 D91 G95 Y97 L115	R63-D93 IonicContact NH1-OD1 3.47Å; R63-D93 PolarHBondContact NH1-OD1 3.01Å; R74-D93 IonicContact CZ-OD1 2.76Å; R74-D93 IonicContact CZ-OD2 3.82Å; R74-D93 IonicContact NH1-OD1 2.91Å; R74-D93 PolarHBondContact NH1-OD1 2.98Å; R74-D93 IonicContact NH1-OD2 3.79Å; R74-D93 PolarHBondContact NH1-OD2 2.82Å; R74-D93 IonicContact NH2-OD1 3.28Å; R74-D93 PolarHBondContact NH2-OD1 2.71Å; R74-D93 IonicContact NH2-OD2 2.97Å; Y75-D93 PolarHBondContact OH-OD1 2.74Å; E90-D93 PolarHBondContact N-OD2 3.3Å; E90-D93 WeakPolarHBondContact O-CB 3.23Å; E90-D93 PolarHBondContact O-N 3.11Å; D91-D93 PolarHBondContact O-N 3.36Å; D93-G95 PolarHBondContact O-N 2.83Å; D93-Y97 WeakPolarHBondContact O-CE2 3.06Å; D93-Y97 PolarHBondContact O-OH 2.88Å; D93-Y97 VanDerWaalsContact O-OH 3.07Å; D93-L115 HydrophobicContact CB-CD2 3.97Å; D93-L115 WeakPolarHBondContact O-CD2 3.45Å
94	D	93	Very high	93	Very high	77 Å²	77	36.7 Å²	36.7	41%	0.412	22%	0.222	S	C	.	.			trans	-55.9	129.6	172.4	-165.9	-74.2	0	0	0	111.2	D91 S92 V117	D91-D94 PolarHBondContact O-N 2.74Å; S92-D94 VanDerWaalsContact C-N 3.34Å; D94-V117 HydrophobicContact CB-CB 4.34Å; D94-V117 HydrophobicContact CB-CG2 3.97Å; D94-V117 PolarHBondContact OD2-N 2.63Å; D94-V117 VanDerWaalsContact OD2-N 3.09Å
95	G	93.4	Very high	92.6	Very high	8 Å²	8	38.8 Å²	38.8	8%	0.082	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.1	-176.8	-176.9	0	0	0	0	0	114.8	D93 A114 L115	D93-G95 PolarHBondContact O-N 2.83Å; G95-A114 CarbonylContact O-C 3.49Å; G95-A114 WeakPolarHBondContact O-CA 3.44Å; G95-L115 PolarHBondContact N-O 2.9Å; G95-L115 PolarHBondContact O-N 2.75Å
96	I	96.8	Very high	91.9	Very high	90 Å²	90	42.4 Å²	42.4	46%	0.462	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	121.9	-178.2	-57.3	173.6	0	0	0	109	R63 N64 C112	R63-I96 CarbonylContact C-O 3.58Å; R63-I96 WeakPolarHBondContact CA-O 3.03Å; N64-I96 PolarHBondContact N-O 2.7Å; N64-I96 PolarHBondContact OD1-N 2.88Å; I96-C112 HydrophobicContact CG2-CB 3.88Å
97	Y	96.4	Very high	91.5	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	122.5	176.6	-72.4	-98.8	0	0	0	109.4	F47 T62 R63 I68 Y75 L84 I86 D93 C112 G113 L115	F47-Y97 HydrophobicContact CD2-CG 4.23Å; F47-Y97 HydrophobicContact CE2-CD1 4.33Å; F47-Y97 AromaticContact CE2-CD2 3.8Å; F47-Y97 HydrophobicContact CE2-CD2 3.8Å; F47-Y97 HydrophobicContact CE2-CE2 4.32Å; F47-Y97 AromaticContact CE2-CG 3.8Å; F47-Y97 HydrophobicContact CE2-CG 3.8Å; F47-Y97 AromaticContact CZ-CD2 3.92Å; F47-Y97 HydrophobicContact CZ-CD2 3.92Å; F47-Y97 HydrophobicContact CZ-CG 4.16Å; T62-Y97 CarbonylContact O-C 3.5Å; T62-Y97 VanDerWaalsContact O-CA 3.31Å; T62-Y97 WeakPolarHBondContact O-CA 3.04Å; R63-Y97 HydrophobicContact CB-CD1 4.28Å; R63-Y97 HydrophobicContact CB-CE1 4Å; R63-Y97 WeakPolarHBondContact CD-OH 3.49Å; R63-Y97 HydrophobicContact CG-CD1 4.48Å; R63-Y97 HydrophobicContact CG-CE1 3.99Å; R63-Y97 HydrophobicContact CG-CE2 4.05Å; I68-Y97 HydrophobicContact CD1-CD1 3.8Å; I68-Y97 HydrophobicContact CD1-CE1 3.72Å; Y75-Y97 HydrophobicContact CE1-CE1 4.03Å; L84-Y97 HydrophobicContact CD2-CD1 3.59Å; L84-Y97 HydrophobicContact CD2-CE1 4.06Å; I86-Y97 HydrophobicContact CD1-CE1 4.05Å; I86-Y97 HydrophobicContact CD1-CE2 4.36Å; I86-Y97 WeakPolarHBondContact CD1-OH 3.34Å; D93-Y97 WeakPolarHBondContact O-CE2 3.06Å; D93-Y97 PolarHBondContact O-OH 2.88Å; D93-Y97 VanDerWaalsContact O-OH 3.07Å; Y97-C112 CarbonylContact O-C 3.57Å; Y97-C112 VanDerWaalsContact O-CA 3.25Å; Y97-C112 WeakPolarHBondContact O-CA 3.32Å; Y97-G113 PolarHBondContact N-O 3.48Å; Y97-G113 PolarHBondContact O-N 3.31Å; Y97-L115 HydrophobicContact CD2-CB 3.9Å; Y97-L115 HydrophobicContact CE2-CB 3.62Å; Y97-L115 HydrophobicContact CE2-CD2 4.05Å; Y97-L115 HydrophobicContact CE2-CG 4.5Å
98	C	96.4	Very high	91.5	Very high	11 Å²	11	43.3 Å²	43.3	7%	0.074	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	132.3	178.8	-57.5	0	0	0	0	110.3	W61 T62 E110 S111 C112	W61-C98 WeakPolarHBondContact CA-O 3.48Å; T62-C98 PolarHBondContact N-O 2.84Å; T62-C98 PolarHBondContact O-N 3.25Å; C98-E110 HydrophobicContact CB-CG 4.12Å; C98-S111 CarbonylContact C-O 3.46Å; C98-S111 VanDerWaalsContact CA-O 3.29Å; C98-S111 WeakPolarHBondContact CA-O 3.26Å; C98-C112 HydrophobicContact CB-CB 4.06Å; C98-C112 WeakPolarHBondContact CB-SG 3.48Å; C98-C112 WeakPolarHBondContact SG-CB 3.5Å; C98-C112 CovalentContact SG-SG 2.04Å; C98-C112 PolarHBondContact SG-SG 3.34Å
99	C	96.1	Very high	91.7	Very high	0 Å²	0	43 Å²	43	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	135.3	165.1	72.4	0	0	0	0	109.6	L34 C49 I59 S60 W61 E110 S111	L34-C99 HydrophobicContact CD1-CB 4.47Å; L34-C99 WeakPolarHBondContact CD1-SG 3.23Å; C49-C99 HydrophobicContact CB-CB 3.5Å; C49-C99 VanDerWaalsContact CB-CB 3.5Å; C49-C99 WeakPolarHBondContact CB-SG 3.44Å; C49-C99 WeakPolarHBondContact SG-CB 3.46Å; C49-C99 CovalentContact SG-SG 2.04Å; C49-C99 PolarHBondContact SG-SG 3.39Å; I59-C99 HydrophobicContact CG2-CB 4.28Å; S60-C99 WeakPolarHBondContact O-CA 3.18Å; W61-C99 HydrophobicContact CD2-CB 4.02Å; W61-C99 HydrophobicContact CE3-CB 3.99Å; W61-C99 HydrophobicContact CH2-CB 3.79Å; W61-C99 HydrophobicContact CZ2-CB 3.78Å; W61-C99 HydrophobicContact CZ3-CB 3.89Å; C99-E110 VanDerWaalsContact O-CA 3.28Å; C99-E110 WeakPolarHBondContact O-CA 3.43Å; C99-S111 PolarHBondContact N-O 3.4Å; C99-S111 PolarHBondContact O-N 3Å
100	T	95.9	Very high	91.8	Very high	33 Å²	33	48.6 Å²	48.6	20%	0.202	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	120.9	174	-47.7	0	0	0	0	108.7	I59 S60 A108 V109	I59-T100 WeakPolarHBondContact CA-O 3.44Å; S60-T100 PolarHBondContact N-O 2.88Å; S60-T100 PolarHBondContact O-N 2.02Å; T100-A108 HydrophobicContact CG2-CB 4.04Å; T100-V109 CarbonylContact C-O 3.56Å; T100-V109 WeakPolarHBondContact CA-O 3.34Å
101	A	95.4	Very high	92.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	131.6	-179.2	0	0	0	0	0	111	P28 V51 P57 E58 I59 A108 V109	P28-A101 HydrophobicContact CB-CB 4.23Å; V51-A101 HydrophobicContact CG1-CB 3.97Å; V51-A101 HydrophobicContact CG2-CB 3.82Å; P57-A101 HydrophobicContact CB-CB 4.2Å; E58-A101 WeakPolarHBondContact O-CA 3.22Å; I59-A101 HydrophobicContact CG1-CB 4.07Å; A101-A108 WeakPolarHBondContact O-CA 3.41Å; A101-V109 HydrophobicContact CB-CG2 4.05Å; A101-V109 PolarHBondContact N-O 3.12Å; A101-V109 PolarHBondContact O-N 2.89Å
102	N	94.1	Very high	92.6	Very high	71 Å²	71	43.7 Å²	43.7	38%	0.38	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	131.2	179.3	-175.5	8.2	0	0	0	110.3	P57 E58 G104 A108	P57-N102 CarbonylContact C-O 3.58Å; P57-N102 WeakPolarHBondContact CA-O 3.42Å; E58-N102 PolarHBondContact N-O 2.84Å; E58-N102 PolarHBondContact O-N 2.89Å; N102-G104 PolarHBondContact OD1-N 3.5Å; N102-A108 HydrophobicContact CB-CB 4Å
103	N	92.6	Very high	93	Very high	25 Å²	25	40.4 Å²	40.4	13%	0.134	28%	0.277	C	S	.	.			trans	-123.8	13.9	173.5	76.6	-11.4	0	0	0	113.3	K26 P28 S53 P55 P57 V105	K26-N103 PolarHBondContact O-ND2 2.74Å; P28-N103 WeakPolarHBondContact CD-OD1 3.22Å; S53-N103 WeakPolarHBondContact CB-ND2 3.31Å; P55-N103 WeakPolarHBondContact O-CB 3.35Å; P55-N103 PolarHBondContact O-ND2 3.01Å; P57-N103 HydrophobicContact CB-CB 4.16Å; N103-V105 VanDerWaalsContact C-N 3.26Å; N103-V105 PolarHBondContact O-N 3.03Å; N103-V105 WeakPolarHBondContact OD1-CB 3.47Å; N103-V105 PolarHBondContact OD1-N 3.19Å; N103-V105 PolarHBondContact OD1-O 3.47Å
104	G	88.8	Confident	93.3	Very high	69 Å²	69	41.7 Å²	41.7	71%	0.711	29%	0.288	S	S	*	.	S	Bend	trans	79.5	-1.6	-177.6	0	0	0	0	0	115	N102	N102-G104 PolarHBondContact OD1-N 3.5Å
105	V	86	Confident	93.4	Very high	45 Å²	45	38 Å²	38	27%	0.273	27%	0.268	S	S	.	.	S	Bend	trans	-116.2	122.8	179.6	-175	0	0	0	0	109.2	P25 A27 P28 N103 G107	P25-V105 HydrophobicContact CB-CG1 4.21Å; P25-V105 HydrophobicContact CB-CG2 3.99Å; A27-V105 VanDerWaalsContact CA-O 3.29Å; A27-V105 WeakPolarHBondContact CA-O 3.33Å; A27-V105 HydrophobicContact CB-CG1 4.26Å; A27-V105 WeakPolarHBondContact CB-O 2.92Å; P28-V105 WeakPolarHBondContact CD-O 2.99Å; N103-V105 VanDerWaalsContact C-N 3.26Å; N103-V105 PolarHBondContact O-N 3.03Å; N103-V105 WeakPolarHBondContact OD1-CB 3.47Å; N103-V105 PolarHBondContact OD1-N 3.19Å; N103-V105 PolarHBondContact OD1-O 3.47Å; V105-G107 VanDerWaalsContact C-N 3.32Å; V105-G107 PolarHBondContact O-N 2.87Å
106	G	80.3	Confident	93.5	Very high	77 Å²	77	41.3 Å²	41.3	79%	0.794	28%	0.281	S	S	*	.	S	Bend	trans	75	8	172.1	0	0	0	0	0	117
107	G	85.7	Confident	93.4	Very high	41 Å²	41	37 Å²	37	42%	0.423	26%	0.259	S	S	.	.			trans	87.6	169.3	179.9	0	0	0	0	0	113.6	V105	V105-G107 VanDerWaalsContact C-N 3.32Å; V105-G107 PolarHBondContact O-N 2.87Å
108	A	91.3	Very high	93.2	Very high	62 Å²	62	39.5 Å²	39.5	51%	0.512	27%	0.27	S	S	.	.			trans	-80.5	142.5	177.4	0	0	0	0	0	110.9	T100 A101 N102	T100-A108 HydrophobicContact CG2-CB 4.04Å; A101-A108 WeakPolarHBondContact O-CA 3.41Å; N102-A108 HydrophobicContact CB-CB 4Å
109	V	95.4	Very high	93.1	Very high	46 Å²	46	40.4 Å²	40.4	28%	0.279	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	146.2	173.5	-65.3	0	0	0	0	110.2	P28 I30 T100 A101	P28-V109 HydrophobicContact CB-CG2 3.93Å; P28-V109 HydrophobicContact CG-CG2 3.99Å; P28-V109 VanDerWaalsContact O-CG1 3.27Å; P28-V109 WeakPolarHBondContact O-CG1 3.32Å; P28-V109 WeakPolarHBondContact O-CG2 3.22Å; I30-V109 HydrophobicContact CD1-CB 4.29Å; I30-V109 HydrophobicContact CD1-CG2 3.95Å; I30-V109 HydrophobicContact CG1-CG2 3.8Å; T100-V109 CarbonylContact C-O 3.56Å; T100-V109 WeakPolarHBondContact CA-O 3.34Å; A101-V109 HydrophobicContact CB-CG2 4.05Å; A101-V109 PolarHBondContact N-O 3.12Å; A101-V109 PolarHBondContact O-N 2.89Å
110	E	95.9	Very high	93	Very high	119 Å²	119	46 Å²	46	56%	0.556	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.3	143.8	-178	-177.6	178.4	-122.7	0	0	110.8	I30 C98 C99	I30-E110 VanDerWaalsContact CD1-C 3.45Å; C98-E110 HydrophobicContact CB-CG 4.12Å; C99-E110 VanDerWaalsContact O-CA 3.28Å; C99-E110 WeakPolarHBondContact O-CA 3.43Å
111	S	96.7	Very high	93	Very high	17 Å²	17	45 Å²	45	12%	0.119	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	142.9	165.6	-173.2	0	0	0	0	110	P33 L34 C98 C99	P33-S111 WeakPolarHBondContact CA-OG 2.95Å; L34-S111 PolarHBondContact N-OG 3.47Å; C98-S111 CarbonylContact C-O 3.46Å; C98-S111 VanDerWaalsContact CA-O 3.29Å; C98-S111 WeakPolarHBondContact CA-O 3.26Å; C99-S111 PolarHBondContact N-O 3.4Å; C99-S111 PolarHBondContact O-N 3Å
112	C	96.5	Very high	92.9	Very high	52 Å²	52	50.9 Å²	50.9	35%	0.351	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	137.9	-173.5	-58.4	0	0	0	0	111.5	I96 Y97 C98	I96-C112 HydrophobicContact CG2-CB 3.88Å; Y97-C112 CarbonylContact O-C 3.57Å; Y97-C112 VanDerWaalsContact O-CA 3.25Å; Y97-C112 WeakPolarHBondContact O-CA 3.32Å; C98-C112 HydrophobicContact CB-CB 4.06Å; C98-C112 WeakPolarHBondContact CB-SG 3.48Å; C98-C112 WeakPolarHBondContact SG-CB 3.5Å; C98-C112 CovalentContact SG-SG 2.04Å; C98-C112 PolarHBondContact SG-SG 3.34Å
113	G	96.1	Very high	92.7	Very high	5 Å²	5	49 Å²	49	5%	0.052	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	152.9	171.4	0	0	0	0	0	110.7	E35 Y97	E35-G113 WeakPolarHBondContact O-CA 3.3Å; Y97-G113 PolarHBondContact N-O 3.48Å; Y97-G113 PolarHBondContact O-N 3.31Å
114	A	96.1	Very high	92.4	Very high	27 Å²	27	51.1 Å²	51.1	22%	0.223	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	139.4	177.8	0	0	0	0	0	111.1	T36 V37 G95	T36-A114 CarbonylContact C-O 3.56Å; T36-A114 VanDerWaalsContact CA-O 3.23Å; T36-A114 WeakPolarHBondContact CA-O 3.39Å; T36-A114 HydrophobicContact CG2-CB 4.22Å; T36-A114 WeakPolarHBondContact CG2-O 3.46Å; V37-A114 PolarHBondContact N-O 3.25Å; G95-A114 CarbonylContact O-C 3.49Å; G95-A114 WeakPolarHBondContact O-CA 3.44Å
115	L	95.8	Very high	92.2	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	121.2	161.3	-173.9	67.5	0	0	0	108.3	V37 A39 A45 F47 I86 V89 D93 G95 Y97 V117	V37-L115 HydrophobicContact CB-CD1 4.13Å; V37-L115 HydrophobicContact CG1-CD1 4.05Å; V37-L115 WeakPolarHBondContact O-CA 3.43Å; A39-L115 HydrophobicContact CB-CD1 4.02Å; A45-L115 HydrophobicContact CB-CD1 3.67Å; F47-L115 HydrophobicContact CE2-CB 4.23Å; F47-L115 HydrophobicContact CE2-CD1 4.28Å; F47-L115 HydrophobicContact CZ-CB 3.87Å; F47-L115 HydrophobicContact CZ-CD1 4.21Å; I86-L115 HydrophobicContact CD1-CD2 3.56Å; V89-L115 HydrophobicContact CG1-CD2 4.46Å; D93-L115 HydrophobicContact CB-CD2 3.97Å; D93-L115 WeakPolarHBondContact O-CD2 3.45Å; G95-L115 PolarHBondContact N-O 2.9Å; G95-L115 PolarHBondContact O-N 2.75Å; Y97-L115 HydrophobicContact CD2-CB 3.9Å; Y97-L115 HydrophobicContact CE2-CB 3.62Å; Y97-L115 HydrophobicContact CE2-CD2 4.05Å; Y97-L115 HydrophobicContact CE2-CG 4.5Å; L115-V117 HydrophobicContact CD2-CG2 3.91Å; L115-V117 HydrophobicContact CG-CG2 4.03Å
116	Q	94.6	Very high	92	Very high	77 Å²	77	56.7 Å²	56.7	36%	0.36	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	109.7	171.2	-73.2	-170.1	20.9	0	0	109.5	T36 V37 D38 A39 K118	T36-Q116 HydrophobicContact CG2-CG 3.92Å; V37-Q116 PolarHBondContact O-N 2.87Å; D38-Q116 WeakPolarHBondContact OD1-CB 3.48Å; D38-Q116 PolarHBondContact OD1-OE1 3.02Å; A39-Q116 PolarHBondContact N-O 3.32Å; A39-Q116 VanDerWaalsContact N-O 3.15Å; Q116-K118 PolarHBondContact O-N 2.76Å
117	V	94.7	Very high	92.1	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	120.9	-176.9	-177.2	0	0	0	0	110.2	V41 V89 D94 L115 N147	V41-V117 HydrophobicContact CG2-CG1 3.45Å; V41-V117 VanDerWaalsContact CG2-CG1 3.45Å; V89-V117 HydrophobicContact CG1-CB 4.28Å; V89-V117 HydrophobicContact CG1-CG1 3.69Å; V89-V117 HydrophobicContact CG1-CG2 3.65Å; D94-V117 HydrophobicContact CB-CB 4.34Å; D94-V117 HydrophobicContact CB-CG2 3.97Å; D94-V117 PolarHBondContact OD2-N 2.63Å; D94-V117 VanDerWaalsContact OD2-N 3.09Å; L115-V117 HydrophobicContact CD2-CG2 3.91Å; L115-V117 HydrophobicContact CG-CG2 4.03Å; V117-N147 PolarHBondContact O-ND2 2.88Å
118	K	93.8	Very high	91.9	Very high	51 Å²	51	53.2 Å²	53.2	22%	0.222	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	148.2	179.1	-57.2	-57	179.7	-164.2	0	110	D38 A39 L40 V41 Q116 N147 L196	D38-K118 WeakPolarHBondContact OD1-CE 3.29Å; D38-K118 IonicContact OD1-NZ 3.75Å; A39-K118 PolarHBondContact O-N 2.66Å; L40-K118 CarbonylContact C-O 3.59Å; L40-K118 VanDerWaalsContact CA-O 3.26Å; L40-K118 WeakPolarHBondContact CA-O 3.24Å; L40-K118 HydrophobicContact CD2-CB 3.77Å; V41-K118 PolarHBondContact N-O 2.94Å; Q116-K118 PolarHBondContact O-N 2.76Å; K118-N147 CarbonylContact C-O 3.55Å; K118-L196 HydrophobicContact CB-CD1 3.78Å
119	M	93.1	Very high	91.3	Very high	30 Å²	30	54.8 Å²	54.8	15%	0.148	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	122.4	-176.9	-174.1	-165.2	-68.7	0	0	110.9	V41 D91 M145 G146 N147 N194	V41-M119 HydrophobicContact CB-CG 4.49Å; V41-M119 HydrophobicContact CG2-CB 4.06Å; V41-M119 HydrophobicContact CG2-CE 3.8Å; V41-M119 HydrophobicContact CG2-CG 4.23Å; D91-M119 HydrophobicContact CB-CE 4.31Å; M119-M145 HydrophobicContact CE-CE 4.31Å; M119-M145 HydrophobicContact SD-CB 4.03Å; M119-M145 HydrophobicContact SD-CE 4.47Å; M119-G146 WeakPolarHBondContact O-CA 3.13Å; M119-N147 HydrophobicContact CB-CB 4.14Å; M119-N147 PolarHBondContact N-O 3.47Å; M119-N147 PolarHBondContact O-N 3.01Å; M119-N194 PolarHBondContact O-ND2 2.83Å
120	K	94.3	Very high	90	Very high	117 Å²	117	54.1 Å²	54.1	51%	0.509	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	152.5	170	-75.9	178.2	-178.5	167.7	0	110.4	K122 L196	K120-K122 PolarHBondContact O-N 3.24Å; K120-L196 HydrophobicContact CG-CB 3.83Å
121	P	95.9	Very high	89.1	Confident	12 Å²	12	54.7 Å²	54.7	8%	0.078	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	132.2	-175.8	28.2	-28.8	0	0	0	109.5	M145 P150 A192 N194 G197 A199	P121-M145 CarbonylContact C-O 3.58Å; P121-M145 WeakPolarHBondContact CA-O 3.05Å; P121-P150 HydrophobicContact CB-CB 3.95Å; P121-P150 HydrophobicContact CB-CG 3.75Å; P121-A192 HydrophobicContact CB-CB 4.2Å; P121-A192 WeakPolarHBondContact CG-O 3.37Å; P121-N194 VanDerWaalsContact CD-OD1 3.32Å; P121-N194 WeakPolarHBondContact CD-OD1 3.3Å; P121-G197 WeakPolarHBondContact CG-O 3.37Å; P121-A199 HydrophobicContact CG-CB 4.41Å; P121-A199 VanDerWaalsContact O-CB 3.27Å; P121-A199 WeakPolarHBondContact O-CB 3.4Å
122	K	92.4	Very high	87.6	Confident	124 Å²	124	54.8 Å²	54.8	54%	0.539	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	125.1	178.1	-174.1	174	-176.9	172.7	0	109.1	K120 T124 T144 M145	K120-K122 PolarHBondContact O-N 3.24Å; K122-T124 PolarHBondContact O-N 2.87Å; K122-T144 CarbonylContact O-C 3.6Å; K122-T144 VanDerWaalsContact O-CA 3.24Å; K122-T144 WeakPolarHBondContact O-CA 3.39Å; K122-M145 PolarHBondContact N-O 2.92Å; K122-M145 PolarHBondContact O-N 3Å
123	I	91.6	Very high	86.3	Confident	31 Å²	31	54.4 Å²	54.4	16%	0.159	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	110.2	174	-59.4	171.1	0	0	0	107.5	P126 T143 T144 A192 A199 S201	I123-P126 HydrophobicContact CG2-CB 4.03Å; I123-T143 CarbonylContact C-O 3.54Å; I123-T144 HydrophobicContact CG1-CG2 4.13Å; I123-A192 HydrophobicContact CG1-CB 4.07Å; I123-A199 HydrophobicContact CD1-CB 4.35Å; I123-A199 HydrophobicContact CG1-CB 4.21Å; I123-S201 VanDerWaalsContact CD1-N 3.34Å
124	T	85.6	Confident	85.3	Confident	70 Å²	70	57 Å²	57	43%	0.429	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-30.7	-178.4	52.7	0	0	0	0	112.3	K122 T143 M145	K122-T124 PolarHBondContact O-N 2.87Å; T124-T143 PolarHBondContact N-O 3.37Å; T124-T143 PolarHBondContact OG1-O 3.2Å; T124-M145 HydrophobicContact CG2-CB 4.22Å; T124-M145 HydrophobicContact CG2-CG 3.68Å; T124-M145 HydrophobicContact CG2-SD 3.69Å
125	R	85.4	Confident	83.6	Confident	165 Å²	165	57.1 Å²	57.1	62%	0.623	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.9	87.5	176	-165.2	-179.1	-179.5	172.7	1.3	110.5	P141 C142 T143	R125-P141 HydrophobicContact CG-CB 4.03Å; R125-P141 CarbonylContact O-C 3.44Å; R125-C142 VanDerWaalsContact O-CA 3.23Å; R125-C142 WeakPolarHBondContact O-CA 3.25Å; R125-C142 PolarHBondContact O-N 2.69Å; R125-T143 PolarHBondContact N-O 2.67Å; R125-T143 PolarHBondContact O-N 3.22Å
126	P	81.8	Confident	81.8	Confident	67 Å²	67	58.3 Å²	58.3	44%	0.435	29%	0.288	S	S	.	.			trans	-74.2	155	-178	31	-35.2	0	0	0	111.8	I123 P141	I123-P126 HydrophobicContact CG2-CB 4.03Å; P126-P141 CarbonylContact C-O 3.5Å
127	P	81.5	Confident	80.5	Confident	6 Å²	6	57.4 Å²	57.4	4%	0.039	28%	0.284	C	S	.	.			trans	-70.3	161.9	173.5	29.1	-33.1	0	0	0	111.5	L140 P141 W154 C190 V204	P127-L140 HydrophobicContact CB-CB 4.18Å; P127-P141 VanDerWaalsContact CA-O 3.27Å; P127-P141 WeakPolarHBondContact CA-O 3.06Å; P127-P141 VanDerWaalsContact CB-O 3.3Å; P127-P141 WeakPolarHBondContact CB-O 3.24Å; P127-P141 WeakPolarHBondContact CD-O 3.39Å; P127-W154 HydrophobicContact CB-CH2 3.71Å; P127-W154 HydrophobicContact CB-CZ3 4.16Å; P127-W154 HydrophobicContact CG-CH2 3.72Å; P127-W154 HydrophobicContact CG-CZ3 3.98Å; P127-C190 HydrophobicContact CG-CB 4.49Å; P127-V204 HydrophobicContact CB-CG1 4.15Å; P127-V204 HydrophobicContact CB-CG2 3.93Å; P127-V204 HydrophobicContact CG-CG1 4.18Å; P127-V204 HydrophobicContact CG-CG2 4.24Å; P127-V204 WeakPolarHBondContact O-CG1 3.31Å
128	I	82.5	Confident	79.3	Confident	38 Å²	38	57.5 Å²	57.5	20%	0.195	28%	0.284	C	S	.	.			trans	-138.6	174.2	173	82.9	119.5	0	0	0	110.9	V204 L528 T529	I128-V204 VanDerWaalsContact CA-CG1 3.47Å; I128-L528 HydrophobicContact CD1-CD2 3.73Å; I128-L528 HydrophobicContact CD1-CG 4.24Å; I128-T529 HydrophobicContact CD1-CG2 3.51Å; I128-T529 WeakPolarHBondContact CD1-OG1 3.48Å; I128-T529 HydrophobicContact CG1-CG2 3.44Å; I128-T529 VanDerWaalsContact CG1-CG2 3.44Å; I128-T529 WeakPolarHBondContact CG1-OG1 3.36Å
129	N	76.9	Confident	78.7	Confident	95 Å²	95	58.1 Å²	58.1	51%	0.508	29%	0.292	S	S	.	.			trans	-63.3	135.3	-179.4	-64.9	-24.2	0	0	0	111.7	V204 K205	N129-V204 WeakPolarHBondContact OD1-CA 3.42Å; N129-K205 CarbonylContact C-O 3.52Å; N129-K205 WeakPolarHBondContact CA-O 3.04Å; N129-K205 PolarHBondContact OD1-N 2.91Å
130	V	69.9	Low	78.1	Confident	33 Å²	33	56.7 Å²	56.7	20%	0.2	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	134.4	-177.8	176.1	0	0	0	0	109.7	I132 L140 K205 L206 E207	V130-I132 HydrophobicContact CG1-CB 4.33Å; V130-L140 HydrophobicContact CB-CD2 4.17Å; V130-L140 HydrophobicContact CG2-CD2 3.63Å; V130-K205 PolarHBondContact N-O 3.47Å; V130-L206 HydrophobicContact CB-CD1 3.85Å; V130-L206 HydrophobicContact CG1-CD1 3.84Å; V130-L206 CarbonylContact O-C 3.51Å; V130-L206 WeakPolarHBondContact O-CA 3.29Å; V130-E207 PolarHBondContact O-N 3.02Å
131	K	75.1	Confident	77.3	Confident	130 Å²	130	52.4 Å²	52.4	57%	0.565	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.2	132.7	163.1	-53	-163.7	-175.8	-155.5	0	108.2	E207	K131-E207 CarbonylContact C-O 3.53Å; K131-E207 WeakPolarHBondContact CA-O 3.19Å; K131-E207 WeakPolarHBondContact CD-OE2 3.23Å; K131-E207 WeakPolarHBondContact CE-OE2 3.38Å; K131-E207 HydrophobicContact CG-CB 4.13Å; K131-E207 IonicContact NZ-OE2 2.67Å; K131-E207 PolarHBondContact NZ-OE2 2.89Å; K131-E207 VanDerWaalsContact NZ-OE2 3.09Å
132	I	67	Low	77	Confident	19 Å²	19	51.8 Å²	51.8	10%	0.097	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	146.6	-177.6	-166.2	162.2	0	0	0	111.4	V130 L136 K137 A138 V180 L206 E207 V208 E209	V130-I132 HydrophobicContact CG1-CB 4.33Å; I132-L136 HydrophobicContact CD1-CB 3.87Å; I132-L136 HydrophobicContact CG1-CB 3.84Å; I132-L136 HydrophobicContact CG1-CD1 4.4Å; I132-K137 VanDerWaalsContact CD1-O 3.23Å; I132-K137 WeakPolarHBondContact CD1-O 3.18Å; I132-A138 HydrophobicContact CD1-CB 3.68Å; I132-V180 HydrophobicContact CD1-CG2 4.29Å; I132-V180 HydrophobicContact CG2-CB 4.3Å; I132-V180 HydrophobicContact CG2-CG1 3.75Å; I132-V180 HydrophobicContact CG2-CG2 4.3Å; I132-L206 HydrophobicContact CG2-CD1 3.79Å; I132-E207 PolarHBondContact N-O 2.85Å; I132-V208 HydrophobicContact CG2-CG2 4.32Å; I132-V208 CarbonylContact O-C 3.26Å; I132-V208 VanDerWaalsContact O-CA 3.27Å; I132-V208 WeakPolarHBondContact O-CA 3.1Å; I132-E209 PolarHBondContact O-N 2.96Å
133	I	69.4	Low	76.8	Confident	45 Å²	45	48.2 Å²	48.2	23%	0.231	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	139.4	174.8	-60.3	154.8	0	0	0	109.5	L136 E209 F211	I133-L136 HydrophobicContact CB-CD1 3.76Å; I133-L136 HydrophobicContact CB-CG 4.12Å; I133-L136 HydrophobicContact CD1-CD1 4.23Å; I133-L136 HydrophobicContact CG1-CD1 4.45Å; I133-L136 VanDerWaalsContact O-CB 3.32Å; I133-L136 WeakPolarHBondContact O-CB 3.32Å; I133-L136 WeakPolarHBondContact O-CG 3.12Å; I133-L136 PolarHBondContact O-N 2.64Å; I133-L136 VanDerWaalsContact O-N 3.16Å; I133-E209 CarbonylContact C-O 3.48Å; I133-E209 VanDerWaalsContact CA-O 3.27Å; I133-E209 WeakPolarHBondContact CA-O 3.37Å; I133-F211 HydrophobicContact CD1-CE1 4.13Å; I133-F211 HydrophobicContact CD1-CE2 4.23Å; I133-F211 HydrophobicContact CD1-CZ 3.59Å; I133-F211 HydrophobicContact CG1-CZ 4.35Å; I133-F211 HydrophobicContact CG2-CD2 3.92Å; I133-F211 HydrophobicContact CG2-CE2 3.64Å; I133-F211 HydrophobicContact CG2-CZ 4.07Å
134	E	73.8	Confident	76.7	Confident	58 Å²	58	48 Å²	48	27%	0.271	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	140.4	172.6	178.6	172.7	-119.9	0	0	111.2	L136 V180 K182 V208 E209 V210	E134-L136 VanDerWaalsContact C-N 3.27Å; E134-L136 PolarHBondContact O-N 3.35Å; E134-V180 CarbonylContact C-O 3.5Å; E134-V180 WeakPolarHBondContact CA-O 3.5Å; E134-K182 VanDerWaalsContact CD-CE 3.42Å; E134-K182 WeakPolarHBondContact OE1-CE 3.12Å; E134-K182 WeakPolarHBondContact OE1-CG 3.47Å; E134-K182 WeakPolarHBondContact OE2-CE 3.22Å; E134-K182 IonicContact OE2-NZ 3.26Å; E134-V208 HydrophobicContact CB-CG1 4.01Å; E134-E209 PolarHBondContact N-O 2.97Å; E134-V210 HydrophobicContact CB-CG2 3.91Å; E134-V210 WeakPolarHBondContact OE2-CG1 3.43Å
135	G	61.6	Low	76.9	Confident	31 Å²	31	49.4 Å²	49.4	32%	0.32	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.6	-22.4	-175.2	0	0	0	0	0	114.6	N179 V180	G135-N179 WeakPolarHBondContact CA-OD1 3.33Å; G135-N179 WeakPolarHBondContact O-CA 3.34Å; G135-V180 PolarHBondContact N-O 2.95Å
136	L	57.1	Low	77.2	Confident	25 Å²	25	42.4 Å²	42.4	13%	0.131	24%	0.236	C	C	.	.	S	Bend	trans	-81.7	164.6	179.8	-56	-174	0	0	0	112.3	I132 I133 E134 V180 Y805	I132-L136 HydrophobicContact CD1-CB 3.87Å; I132-L136 HydrophobicContact CG1-CB 3.84Å; I132-L136 HydrophobicContact CG1-CD1 4.4Å; I133-L136 HydrophobicContact CB-CD1 3.76Å; I133-L136 HydrophobicContact CB-CG 4.12Å; I133-L136 HydrophobicContact CD1-CD1 4.23Å; I133-L136 HydrophobicContact CG1-CD1 4.45Å; I133-L136 VanDerWaalsContact O-CB 3.32Å; I133-L136 WeakPolarHBondContact O-CB 3.32Å; I133-L136 WeakPolarHBondContact O-CG 3.12Å; I133-L136 PolarHBondContact O-N 2.64Å; I133-L136 VanDerWaalsContact O-N 3.16Å; E134-L136 VanDerWaalsContact C-N 3.27Å; E134-L136 PolarHBondContact O-N 3.35Å; L136-V180 VanDerWaalsContact O-CB 3.24Å; L136-V180 WeakPolarHBondContact O-CB 3.31Å; L136-V180 WeakPolarHBondContact O-CG2 3.25Å; L136-V180 PolarHBondContact O-N 3.45Å; L136-Y805 HydrophobicContact CD1-CD2 4.19Å; L136-Y805 HydrophobicContact CD1-CE1 4.3Å; L136-Y805 HydrophobicContact CD1-CE2 3.86Å; L136-Y805 HydrophobicContact CD2-CD1 4.14Å; L136-Y805 HydrophobicContact CD2-CD2 3.76Å; L136-Y805 HydrophobicContact CD2-CE2 4.28Å; L136-Y805 HydrophobicContact CD2-CG 3.69Å
137	K	67.7	Low	77.6	Confident	59 Å²	59	42 Å²	42	26%	0.257	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-88	122.7	174.8	177.1	-174.1	73.8	-164.5	0	111.7	I132 V139 R176 I177 H178	I132-K137 VanDerWaalsContact CD1-O 3.23Å; I132-K137 WeakPolarHBondContact CD1-O 3.18Å; K137-V139 HydrophobicContact CD-CG2 4.5Å; K137-V139 HydrophobicContact CG-CG2 4.41Å; K137-R176 HydrophobicContact CD-CG 4.13Å; K137-R176 HydrophobicContact CG-CG 4.12Å; K137-I177 CarbonylContact C-O 3.55Å; K137-I177 VanDerWaalsContact CA-O 3.26Å; K137-I177 WeakPolarHBondContact CA-O 3.36Å; K137-H178 VanDerWaalsContact CD-CE1 3.47Å; K137-H178 WeakPolarHBondContact CD-CE1 3.44Å; K137-H178 VanDerWaalsContact CD-ND1 3.27Å; K137-H178 WeakPolarHBondContact CD-ND1 3.36Å; K137-H178 WeakPolarHBondContact CG-ND1 3.25Å
138	A	69.4	Low	78.1	Confident	2 Å²	2	44.3 Å²	44.3	2%	0.017	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	143	168.8	0	0	0	0	0	111.4	I132 R176 I177 V180 L206	I132-A138 HydrophobicContact CD1-CB 3.68Å; A138-R176 WeakPolarHBondContact O-CA 3.49Å; A138-I177 HydrophobicContact CB-CB 4.33Å; A138-I177 PolarHBondContact N-O 3.41Å; A138-I177 PolarHBondContact O-N 2.82Å; A138-V180 HydrophobicContact CB-CG2 3.66Å; A138-L206 HydrophobicContact CB-CD1 4.18Å
139	V	80.1	Confident	78.6	Confident	64 Å²	64	50.7 Å²	50.7	39%	0.388	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	115.8	169.3	-177.3	0	0	0	0	108.8	K137 L175 R176	K137-V139 HydrophobicContact CD-CG2 4.5Å; K137-V139 HydrophobicContact CG-CG2 4.41Å; V139-L175 CarbonylContact C-O 3.41Å; V139-L175 VanDerWaalsContact CA-O 3.27Å; V139-L175 WeakPolarHBondContact CA-O 3.31Å; V139-R176 HydrophobicContact CG2-CG 4.29Å
140	L	81.4	Confident	79.5	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	112	171.8	-54.7	-178.3	0	0	0	107.9	P127 V130 W154 S174 L175 Y188 V204	P127-L140 HydrophobicContact CB-CB 4.18Å; V130-L140 HydrophobicContact CB-CD2 4.17Å; V130-L140 HydrophobicContact CG2-CD2 3.63Å; L140-W154 HydrophobicContact CB-CH2 3.37Å; L140-W154 HydrophobicContact CB-CZ2 4.14Å; L140-W154 HydrophobicContact CB-CZ3 3.78Å; L140-W154 HydrophobicContact CD1-CH2 4.38Å; L140-W154 HydrophobicContact CD1-CZ3 3.9Å; L140-W154 WeakPolarHBondContact O-CH2 3.15Å; L140-W154 WeakPolarHBondContact O-CZ2 3.21Å; L140-S174 CarbonylContact O-C 3.58Å; L140-S174 WeakPolarHBondContact O-CA 3.02Å; L140-S174 WeakPolarHBondContact O-CB 2.86Å; L140-L175 HydrophobicContact CB-CB 4.28Å; L140-L175 HydrophobicContact CD1-CD2 4.14Å; L140-L175 PolarHBondContact N-O 3.4Å; L140-L175 PolarHBondContact O-N 3.2Å; L140-Y188 HydrophobicContact CD1-CD1 3.85Å; L140-Y188 HydrophobicContact CD1-CD2 4.06Å; L140-Y188 HydrophobicContact CD1-CG 3.56Å; L140-V204 HydrophobicContact CD1-CG2 4.37Å
141	P	77.4	Confident	80.7	Confident	26 Å²	26	48.8 Å²	48.8	17%	0.169	27%	0.267	C	S	.	.			trans	-69.7	141.9	-174.5	26.6	-32.1	0	0	0	111.2	R125 P126 P127 S174	R125-P141 HydrophobicContact CG-CB 4.03Å; R125-P141 CarbonylContact O-C 3.44Å; P126-P141 CarbonylContact C-O 3.5Å; P127-P141 VanDerWaalsContact CA-O 3.27Å; P127-P141 WeakPolarHBondContact CA-O 3.06Å; P127-P141 VanDerWaalsContact CB-O 3.3Å; P127-P141 WeakPolarHBondContact CB-O 3.24Å; P127-P141 WeakPolarHBondContact CD-O 3.39Å; P141-S174 WeakPolarHBondContact CA-OG 3.47Å
142	C	89	Confident	81.7	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.249	C	C	.	.			trans	-154.5	70.8	167.1	-170	0	0	0	0	111.4	R125 W154 S172 G173 S174 C190	R125-C142 VanDerWaalsContact O-CA 3.23Å; R125-C142 WeakPolarHBondContact O-CA 3.25Å; R125-C142 PolarHBondContact O-N 2.69Å; C142-W154 HydrophobicContact CB-CH2 4.09Å; C142-W154 HydrophobicContact CB-CZ2 3.37Å; C142-S172 VanDerWaalsContact O-O 3.06Å; C142-G173 CarbonylContact O-C 3.56Å; C142-G173 WeakPolarHBondContact O-CA 3.41Å; C142-S174 PolarHBondContact N-OG 3.41Å; C142-S174 VanDerWaalsContact N-OG 3.14Å; C142-C190 HydrophobicContact CB-CB 3.57Å; C142-C190 WeakPolarHBondContact CB-SG 3.27Å; C142-C190 WeakPolarHBondContact SG-CB 3.22Å; C142-C190 CovalentContact SG-SG 2Å; C142-C190 PolarHBondContact SG-SG 3.16Å
143	T	88.3	Confident	83.2	Confident	48 Å²	48	46.1 Å²	46.1	29%	0.294	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	140.1	176.3	-50.1	0	0	0	0	110.5	I123 T124 R125 S172	I123-T143 CarbonylContact C-O 3.54Å; T124-T143 PolarHBondContact N-O 3.37Å; T124-T143 PolarHBondContact OG1-O 3.2Å; R125-T143 PolarHBondContact N-O 2.67Å; R125-T143 PolarHBondContact O-N 3.22Å; T143-S172 WeakPolarHBondContact CA-O 3.25Å
144	T	90.7	Very high	84.5	Confident	28 Å²	28	44.2 Å²	44.2	17%	0.172	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	147.8	-172.2	61.5	0	0	0	0	112.1	K122 I123 V152 A192	K122-T144 CarbonylContact O-C 3.6Å; K122-T144 VanDerWaalsContact O-CA 3.24Å; K122-T144 WeakPolarHBondContact O-CA 3.39Å; I123-T144 HydrophobicContact CG1-CG2 4.13Å; T144-V152 HydrophobicContact CG2-CG2 3.69Å; T144-A192 HydrophobicContact CG2-CB 3.48Å; T144-A192 VanDerWaalsContact CG2-CB 3.48Å
145	M	89.4	Confident	85.7	Confident	98 Å²	98	43.6 Å²	43.6	48%	0.483	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	157.2	165.5	-68.3	-178.7	66.8	0	0	109.9	M119 P121 K122 T124 P150	M119-M145 HydrophobicContact CE-CE 4.31Å; M119-M145 HydrophobicContact SD-CB 4.03Å; M119-M145 HydrophobicContact SD-CE 4.47Å; P121-M145 CarbonylContact C-O 3.58Å; P121-M145 WeakPolarHBondContact CA-O 3.05Å; K122-M145 PolarHBondContact N-O 2.92Å; K122-M145 PolarHBondContact O-N 3Å; T124-M145 HydrophobicContact CG2-CB 4.22Å; T124-M145 HydrophobicContact CG2-CG 3.68Å; T124-M145 HydrophobicContact CG2-SD 3.69Å; M145-P150 WeakPolarHBondContact O-CG 3.45Å
146	G	91	Very high	87.3	Confident	18 Å²	18	45.2 Å²	45.2	19%	0.186	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.4	150.2	176.7	0	0	0	0	0	110.7	M119 P148 K149	M119-G146 WeakPolarHBondContact O-CA 3.13Å; G146-P148 CarbonylContact C-O 3.55Å; G146-P148 VanDerWaalsContact C-O 3.26Å; G146-P148 CarbonylContact O-C 3.58Å; G146-K149 WeakPolarHBondContact O-CA 3.33Å; G146-K149 PolarHBondContact O-N 3.13Å
147	N	89.8	Confident	89	Confident	59 Å²	59	45.7 Å²	45.7	32%	0.316	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	105.2	177.3	-171.6	11.2	0	0	0	108	V117 K118 M119 L196	V117-N147 PolarHBondContact O-ND2 2.88Å; K118-N147 CarbonylContact C-O 3.55Å; M119-N147 HydrophobicContact CB-CB 4.14Å; M119-N147 PolarHBondContact N-O 3.47Å; M119-N147 PolarHBondContact O-N 3.01Å; N147-L196 WeakPolarHBondContact O-CD1 3.46Å
148	P	93.1	Very high	90.2	Very high	54 Å²	54	50.8 Å²	50.8	35%	0.351	29%	0.292	S	S	.	.	S	Bend	cis	-67.6	154.7	9.7	-22.7	35.6	0	0	0	114.7	G146 N194	G146-P148 CarbonylContact C-O 3.55Å; G146-P148 VanDerWaalsContact C-O 3.26Å; G146-P148 CarbonylContact O-C 3.58Å; P148-N194 WeakPolarHBondContact O-CB 3.48Å; P148-N194 PolarHBondContact O-ND2 3.44Å
149	K	92.4	Very high	91.3	Very high	173 Å²	173	54.3 Å²	54.3	75%	0.752	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-50.9	123.3	-178.9	-175.9	177.5	179	-179.6	0	110.8	G146	G146-K149 WeakPolarHBondContact O-CA 3.33Å; G146-K149 PolarHBondContact O-N 3.13Å
150	P	95.3	Very high	92	Very high	12 Å²	12	56.2 Å²	56.2	8%	0.078	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-67.8	141.8	-179.1	-20.5	32.6	0	0	0	113	P121 M145 A192 K193	P121-P150 HydrophobicContact CB-CB 3.95Å; P121-P150 HydrophobicContact CB-CG 3.75Å; M145-P150 WeakPolarHBondContact O-CG 3.45Å; P150-A192 HydrophobicContact CB-CB 4.42Å; P150-K193 WeakPolarHBondContact CA-O 3.41Å
151	S	95.9	Very high	92.7	Very high	75 Å²	75	57.5 Å²	57.5	52%	0.524	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	138	161.1	61.2	0	0	0	0	109.8	A192 K193	S151-A192 CarbonylContact O-C 3.59Å; S151-A192 WeakPolarHBondContact O-CA 3.15Å; S151-K193 PolarHBondContact N-O 2.91Å; S151-K193 PolarHBondContact O-N 3.04Å; S151-K193 PolarHBondContact OG-O 3.07Å
152	V	96.9	Very high	93.4	Very high	32 Å²	32	66.7 Å²	66.7	19%	0.194	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	133.8	-178.1	-176.5	0	0	0	0	110.4	T144 G173 C190 V191 A192	T144-V152 HydrophobicContact CG2-CG2 3.69Å; V152-G173 VanDerWaalsContact CG1-O 3.29Å; V152-G173 WeakPolarHBondContact CG1-O 3.22Å; V152-C190 WeakPolarHBondContact CG1-SG 2.95Å; V152-V191 WeakPolarHBondContact CA-O 3.32Å; V152-A192 HydrophobicContact CG2-CB 4.49Å
153	S	96.9	Very high	93.5	Very high	61 Å²	61	72.2 Å²	72.2	43%	0.427	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	164.1	176.7	60	0	0	0	0	110.8	V191	S153-V191 PolarHBondContact N-O 3.46Å; S153-V191 PolarHBondContact O-N 3.32Å
154	W	98.1	Very high	93.6	Very high	6 Å²	6	73.8 Å²	73.8	2%	0.023	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	150.8	-176.1	-75.1	79.7	0	0	0	112.1	P127 L140 C142 L161 G173 L175 R189 C190	P127-W154 HydrophobicContact CB-CH2 3.71Å; P127-W154 HydrophobicContact CB-CZ3 4.16Å; P127-W154 HydrophobicContact CG-CH2 3.72Å; P127-W154 HydrophobicContact CG-CZ3 3.98Å; L140-W154 HydrophobicContact CB-CH2 3.37Å; L140-W154 HydrophobicContact CB-CZ2 4.14Å; L140-W154 HydrophobicContact CB-CZ3 3.78Å; L140-W154 HydrophobicContact CD1-CH2 4.38Å; L140-W154 HydrophobicContact CD1-CZ3 3.9Å; L140-W154 WeakPolarHBondContact O-CH2 3.15Å; L140-W154 WeakPolarHBondContact O-CZ2 3.21Å; C142-W154 HydrophobicContact CB-CH2 4.09Å; C142-W154 HydrophobicContact CB-CZ2 3.37Å; W154-L161 HydrophobicContact CB-CB 4.02Å; W154-L161 HydrophobicContact CB-CD2 4.42Å; W154-L161 WeakPolarHBondContact O-CB 2.98Å; W154-L161 PolarHBondContact O-N 2.86Å; W154-G173 PolarHBondContact NE1-O 3Å; W154-L175 HydrophobicContact CD2-CB 3.66Å; W154-L175 HydrophobicContact CD2-CD2 4.13Å; W154-L175 HydrophobicContact CD2-CG 4.39Å; W154-L175 VanDerWaalsContact CE2-CB 3.43Å; W154-L175 HydrophobicContact CE3-CB 4.16Å; W154-L175 HydrophobicContact CE3-CD2 4.1Å; W154-L175 HydrophobicContact CG-CB 4.02Å; W154-L175 HydrophobicContact CG-CD1 4.3Å; W154-L175 HydrophobicContact CG-CD2 4.34Å; W154-L175 HydrophobicContact CG-CG 4.47Å; W154-L175 HydrophobicContact CH2-CB 4.18Å; W154-L175 HydrophobicContact CZ2-CB 3.7Å; W154-L175 HydrophobicContact CZ3-CB 4.41Å; W154-R189 CarbonylContact C-O 3.59Å; W154-R189 WeakPolarHBondContact CA-O 3.31Å; W154-C190 HydrophobicContact CD2-CB 4.07Å; W154-C190 HydrophobicContact CE3-CB 4.15Å; W154-C190 HydrophobicContact CH2-CB 3.95Å; W154-C190 HydrophobicContact CZ2-CB 3.85Å; W154-C190 HydrophobicContact CZ3-CB 4.09Å
155	I	97.3	Very high	93.4	Very high	45 Å²	45	78.2 Å²	78.2	23%	0.231	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	134	174.7	-57.4	174.4	0	0	0	107.2	G157 S159 Y188 R189 V191	I155-G157 WeakPolarHBondContact CG2-O 3.19Å; I155-S159 CarbonylContact C-O 3.52Å; I155-S159 WeakPolarHBondContact CA-O 2.98Å; I155-S159 VanDerWaalsContact CG2-O 3.31Å; I155-S159 WeakPolarHBondContact CG2-O 3.3Å; I155-Y188 CarbonylContact O-C 3.51Å; I155-Y188 VanDerWaalsContact O-CA 3.27Å; I155-Y188 WeakPolarHBondContact O-CA 3.14Å; I155-R189 HydrophobicContact CB-CB 4.32Å; I155-R189 PolarHBondContact N-O 3.12Å; I155-R189 PolarHBondContact O-N 3.48Å; I155-V191 HydrophobicContact CD1-CG2 3.72Å; I155-V191 HydrophobicContact CG1-CG2 4.06Å
156	K	96.4	Very high	93.5	Very high	64 Å²	64	76.4 Å²	76.4	28%	0.278	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	119.2	171.2	-175.4	-173.3	-179.1	-171.6	0	109	D158 S159 L161 E183 Q187 Y188	K156-D158 PolarHBondContact O-N 3.44Å; K156-S159 PolarHBondContact N-O 3.41Å; K156-S159 PolarHBondContact O-N 3.46Å; K156-L161 HydrophobicContact CB-CB 4.43Å; K156-L161 HydrophobicContact CB-CD1 4.21Å; K156-E183 PolarHBondContact NZ-O 3.13Å; K156-Q187 CarbonylContact C-O 3.58Å; K156-Q187 VanDerWaalsContact CA-O 3.3Å; K156-Q187 WeakPolarHBondContact CA-O 3.06Å; K156-Y188 HydrophobicContact CB-CD1 4.29Å; K156-Y188 HydrophobicContact CB-CE1 4.07Å; K156-Y188 HydrophobicContact CD-CE1 4.11Å; K156-Y188 HydrophobicContact CD-CE2 4.41Å; K156-Y188 WeakPolarHBondContact CD-OH 3.26Å; K156-Y188 VanDerWaalsContact CE-OH 3.27Å; K156-Y188 WeakPolarHBondContact CE-OH 3.31Å; K156-Y188 HydrophobicContact CG-CD1 4.4Å; K156-Y188 HydrophobicContact CG-CE1 3.92Å; K156-Y188 HydrophobicContact CG-CE2 4.1Å
157	G	93.3	Very high	93.5	Very high	36 Å²	36	76.1 Å²	76.1	37%	0.371	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	-117.9	-167	0	0	0	0	0	109.6	I155 Q187	I155-G157 WeakPolarHBondContact CG2-O 3.19Å; G157-Q187 PolarHBondContact N-O 2.53Å
158	D	91.2	Very high	93.5	Very high	165 Å²	165	74.1 Å²	74.1	88%	0.882	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	2.1	179.6	-57.3	-48.5	0	0	0	113.6	K156	K156-D158 PolarHBondContact O-N 3.44Å
159	S	93.6	Very high	93.5	Very high	76 Å²	76	73 Å²	73	53%	0.531	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	145.4	-173.5	-67.8	0	0	0	0	112.7	I155 K156 L161	I155-S159 CarbonylContact C-O 3.52Å; I155-S159 WeakPolarHBondContact CA-O 2.98Å; I155-S159 VanDerWaalsContact CG2-O 3.31Å; I155-S159 WeakPolarHBondContact CG2-O 3.3Å; K156-S159 PolarHBondContact N-O 3.41Å; K156-S159 PolarHBondContact O-N 3.46Å; S159-L161 PolarHBondContact O-N 2.04Å
160	P	94.6	Very high	93.2	Very high	104 Å²	104	67.7 Å²	67.7	68%	0.675	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55	130.6	168.9	-22.9	33.2	0	0	0	110.6
161	L	95.3	Very high	92.7	Very high	28 Å²	28	76.2 Å²	76.2	15%	0.147	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-72.8	130.5	177.9	177.9	143.3	0	0	0	109.4	W154 K156 S159 I167 L175 Y188	W154-L161 HydrophobicContact CB-CB 4.02Å; W154-L161 HydrophobicContact CB-CD2 4.42Å; W154-L161 WeakPolarHBondContact O-CB 2.98Å; W154-L161 PolarHBondContact O-N 2.86Å; K156-L161 HydrophobicContact CB-CB 4.43Å; K156-L161 HydrophobicContact CB-CD1 4.21Å; S159-L161 PolarHBondContact O-N 2.04Å; L161-I167 HydrophobicContact CD1-CG2 4.11Å; L161-I167 HydrophobicContact CD2-CG2 3.68Å; L161-I167 HydrophobicContact CG-CG2 4.3Å; L161-L175 HydrophobicContact CD1-CD1 4.07Å; L161-L175 HydrophobicContact CD1-CD2 3.66Å; L161-L175 HydrophobicContact CD2-CD1 3.69Å; L161-Y188 HydrophobicContact CD1-CD1 4.01Å; L161-Y188 HydrophobicContact CD1-CE1 3.49Å; L161-Y188 VanDerWaalsContact CD1-CE1 3.49Å
162	R	92.5	Very high	92	Very high	218 Å²	218	75.1 Å²	75.1	82%	0.823	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-95.9	128.6	174.4	-63.1	-175.7	-179	-171.8	-0.1	109.8
163	E	91.4	Very high	91.5	Very high	116 Å²	116	73.6 Å²	73.6	54%	0.542	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-70.8	152.1	172.9	-64.7	-176	-114	0	0	111.2	I167 A168 V169	E163-I167 CarbonylContact C-O 3.39Å; E163-I167 VanDerWaalsContact CA-O 3.23Å; E163-I167 WeakPolarHBondContact CA-O 3.49Å; E163-I167 WeakPolarHBondContact CB-O 3.21Å; E163-A168 WeakPolarHBondContact OE2-CA 3.39Å; E163-V169 HydrophobicContact CG-CG2 4.15Å; E163-V169 PolarHBondContact OE2-N 3.13Å
164	N	91.3	Very high	91	Very high	81 Å²	81	71.1 Å²	71.1	43%	0.433	38%	0.383	S	S	.	.			trans	-155.5	-170.7	176.4	62.4	47	0	0	0	109.7	R166 I167	N164-R166 PolarHBondContact O-N 3.44Å; N164-R166 WeakPolarHBondContact OD1-CA 3.33Å; N164-R166 WeakPolarHBondContact OD1-CB 3.31Å; N164-R166 PolarHBondContact OD1-N 3.01Å; N164-I167 PolarHBondContact N-O 3.34Å; N164-I167 PolarHBondContact O-N 2.97Å; N164-I167 PolarHBondContact OD1-N 3.29Å
165	S	86.5	Confident	90.6	Very high	121 Å²	121	70.9 Å²	70.9	85%	0.846	38%	0.382	S	S	*	.	S	Bend	trans	-60	-26.9	-179.5	56.2	0	0	0	0	114.4
166	R	89.7	Confident	90.2	Very high	61 Å²	61	71.3 Å²	71.3	23%	0.23	38%	0.381	C	S	.	.	S	Bend	trans	-94.3	-39.4	177.2	-64.5	-168.3	-54.1	100.6	0.8	112.7	N164 H178 N179 D184	N164-R166 PolarHBondContact O-N 3.44Å; N164-R166 WeakPolarHBondContact OD1-CA 3.33Å; N164-R166 WeakPolarHBondContact OD1-CB 3.31Å; N164-R166 PolarHBondContact OD1-N 3.01Å; R166-H178 WeakPolarHBondContact CB-O 3.45Å; R166-H178 PolarHBondContact NH1-O 2.91Å; R166-H178 PolarHBondContact O-N 3.35Å; R166-N179 PolarHBondContact NH1-O 3.15Å; R166-N179 VanDerWaalsContact NH1-O 3.16Å; R166-D184 IonicContact CZ-OD1 3.09Å; R166-D184 IonicContact CZ-OD2 3.54Å; R166-D184 IonicContact NH1-OD1 3.93Å; R166-D184 IonicContact NH1-OD2 2.79Å; R166-D184 PolarHBondContact NH1-OD2 2.93Å; R166-D184 IonicContact NH2-OD1 2.89Å; R166-D184 PolarHBondContact NH2-OD1 2.03Å; R166-D184 IonicContact NH2-OD2 3.61Å; R166-D184 PolarHBondContact NH2-OD2 3.01Å
167	I	91.6	Very high	89.6	Confident	11 Å²	11	68.3 Å²	68.3	6%	0.056	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	116.6	-171.4	-54	-179.6	0	0	0	109.7	L161 E163 N164 L175 R176 I177	L161-I167 HydrophobicContact CD1-CG2 4.11Å; L161-I167 HydrophobicContact CD2-CG2 3.68Å; L161-I167 HydrophobicContact CG-CG2 4.3Å; E163-I167 CarbonylContact C-O 3.39Å; E163-I167 VanDerWaalsContact CA-O 3.23Å; E163-I167 WeakPolarHBondContact CA-O 3.49Å; E163-I167 WeakPolarHBondContact CB-O 3.21Å; N164-I167 PolarHBondContact N-O 3.34Å; N164-I167 PolarHBondContact O-N 2.97Å; N164-I167 PolarHBondContact OD1-N 3.29Å; I167-L175 HydrophobicContact CG2-CD1 3.64Å; I167-L175 HydrophobicContact CG2-CG 4.44Å; I167-R176 CarbonylContact C-O 3.49Å; I167-R176 WeakPolarHBondContact CA-O 3.38Å; I167-I177 HydrophobicContact CG1-CG1 4.2Å; I167-I177 HydrophobicContact CG1-CG2 4.07Å; I167-I177 HydrophobicContact CG2-CG1 4.19Å
168	A	90.3	Very high	88.4	Confident	17 Å²	17	70 Å²	70	14%	0.14	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	142.9	-179.6	0	0	0	0	0	111.8	E163 R176	E163-A168 WeakPolarHBondContact OE2-CA 3.39Å; A168-R176 PolarHBondContact N-O 2.79Å; A168-R176 PolarHBondContact O-N 2.78Å
169	V	92.8	Very high	87.4	Confident	31 Å²	31	66.2 Å²	66.2	19%	0.188	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	120.1	168.6	-175.7	0	0	0	0	107.7	E163 L175	E163-V169 HydrophobicContact CG-CG2 4.15Å; E163-V169 PolarHBondContact OE2-N 3.13Å; V169-L175 HydrophobicContact CG2-CD1 4.06Å
170	L	86.9	Confident	86.6	Confident	61 Å²	61	62.6 Å²	62.6	32%	0.319	32%	0.321	S	S	.	.			trans	-73.2	162.5	-179.4	-59.8	-177.9	0	0	0	111.1	S172 G173 S174 R176	L170-S172 PolarHBondContact O-N 3.26Å; L170-G173 WeakPolarHBondContact O-CA 3.2Å; L170-G173 PolarHBondContact O-N 2.84Å; L170-S174 WeakPolarHBondContact CB-O 3.35Å; L170-S174 WeakPolarHBondContact CG-O 3.41Å; L170-S174 PolarHBondContact N-O 2.96Å; L170-R176 HydrophobicContact CD1-CB 4.38Å; L170-R176 HydrophobicContact CD2-CB 4.21Å; L170-R176 HydrophobicContact CG-CB 4.19Å
171	E	83.3	Confident	86.1	Confident	191 Å²	191	60 Å²	60	89%	0.893	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-27.1	172.5	-66.9	-173.5	174	0	0	113.3	G173	E171-G173 PolarHBondContact O-N 2.04Å
172	S	82.5	Confident	85.6	Confident	52 Å²	52	62 Å²	62	36%	0.364	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-4.4	174.5	67.7	0	0	0	0	114.1	C142 T143 L170 S174	C142-S172 VanDerWaalsContact O-O 3.06Å; T143-S172 WeakPolarHBondContact CA-O 3.25Å; L170-S172 PolarHBondContact O-N 3.26Å; S172-S174 VanDerWaalsContact C-N 3.28Å; S172-S174 PolarHBondContact O-N 2.94Å; S172-S174 PolarHBondContact OG-N 3.37Å; S172-S174 PolarHBondContact OG-OG 3.36Å
173	G	85.7	Confident	85.5	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.01	30%	0.297	C	S	.	.	S	Bend	trans	83.4	-7.8	-172.3	0	0	0	0	0	114.8	C142 V152 W154 L170 E171	C142-G173 CarbonylContact O-C 3.56Å; C142-G173 WeakPolarHBondContact O-CA 3.41Å; V152-G173 VanDerWaalsContact CG1-O 3.29Å; V152-G173 WeakPolarHBondContact CG1-O 3.22Å; W154-G173 PolarHBondContact NE1-O 3Å; L170-G173 WeakPolarHBondContact O-CA 3.2Å; L170-G173 PolarHBondContact O-N 2.84Å; E171-G173 PolarHBondContact O-N 2.04Å
174	S	86.7	Confident	85.4	Confident	9 Å²	9	52.6 Å²	52.6	6%	0.063	27%	0.272	C	S	.	.			trans	-74.8	139	-177.9	-55.5	0	0	0	0	111.9	L140 P141 C142 L170 S172	L140-S174 CarbonylContact O-C 3.58Å; L140-S174 WeakPolarHBondContact O-CA 3.02Å; L140-S174 WeakPolarHBondContact O-CB 2.86Å; P141-S174 WeakPolarHBondContact CA-OG 3.47Å; C142-S174 PolarHBondContact N-OG 3.41Å; C142-S174 VanDerWaalsContact N-OG 3.14Å; L170-S174 WeakPolarHBondContact CB-O 3.35Å; L170-S174 WeakPolarHBondContact CG-O 3.41Å; L170-S174 PolarHBondContact N-O 2.96Å; S172-S174 VanDerWaalsContact C-N 3.28Å; S172-S174 PolarHBondContact O-N 2.94Å; S172-S174 PolarHBondContact OG-N 3.37Å; S172-S174 PolarHBondContact OG-OG 3.36Å
175	L	89.6	Confident	85.5	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	125.6	175.6	-177.9	69.6	0	0	0	110.1	V139 L140 W154 L161 I167 V169 I177 Y188	V139-L175 CarbonylContact C-O 3.41Å; V139-L175 VanDerWaalsContact CA-O 3.27Å; V139-L175 WeakPolarHBondContact CA-O 3.31Å; L140-L175 HydrophobicContact CB-CB 4.28Å; L140-L175 HydrophobicContact CD1-CD2 4.14Å; L140-L175 PolarHBondContact N-O 3.4Å; L140-L175 PolarHBondContact O-N 3.2Å; W154-L175 HydrophobicContact CD2-CB 3.66Å; W154-L175 HydrophobicContact CD2-CD2 4.13Å; W154-L175 HydrophobicContact CD2-CG 4.39Å; W154-L175 VanDerWaalsContact CE2-CB 3.43Å; W154-L175 HydrophobicContact CE3-CB 4.16Å; W154-L175 HydrophobicContact CE3-CD2 4.1Å; W154-L175 HydrophobicContact CG-CB 4.02Å; W154-L175 HydrophobicContact CG-CD1 4.3Å; W154-L175 HydrophobicContact CG-CD2 4.34Å; W154-L175 HydrophobicContact CG-CG 4.47Å; W154-L175 HydrophobicContact CH2-CB 4.18Å; W154-L175 HydrophobicContact CZ2-CB 3.7Å; W154-L175 HydrophobicContact CZ3-CB 4.41Å; L161-L175 HydrophobicContact CD1-CD1 4.07Å; L161-L175 HydrophobicContact CD1-CD2 3.66Å; L161-L175 HydrophobicContact CD2-CD1 3.69Å; I167-L175 HydrophobicContact CG2-CD1 3.64Å; I167-L175 HydrophobicContact CG2-CG 4.44Å; V169-L175 HydrophobicContact CG2-CD1 4.06Å; L175-I177 HydrophobicContact CD2-CD1 4.27Å; L175-I177 HydrophobicContact CD2-CG1 4.36Å; L175-I177 HydrophobicContact CG-CG1 4.32Å; L175-Y188 HydrophobicContact CD2-CD1 3.5Å; L175-Y188 VanDerWaalsContact CD2-CD1 3.5Å; L175-Y188 HydrophobicContact CD2-CE1 3.54Å
176	R	88.4	Confident	85.8	Confident	54 Å²	54	46.1 Å²	46.1	20%	0.204	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	127.7	173.6	179.6	175.1	57.1	60.6	-3	109.4	K137 A138 V139 I167 A168 L170 H178	K137-R176 HydrophobicContact CD-CG 4.13Å; K137-R176 HydrophobicContact CG-CG 4.12Å; A138-R176 WeakPolarHBondContact O-CA 3.49Å; V139-R176 HydrophobicContact CG2-CG 4.29Å; I167-R176 CarbonylContact C-O 3.49Å; I167-R176 WeakPolarHBondContact CA-O 3.38Å; A168-R176 PolarHBondContact N-O 2.79Å; A168-R176 PolarHBondContact O-N 2.78Å; L170-R176 HydrophobicContact CD1-CB 4.38Å; L170-R176 HydrophobicContact CD2-CB 4.21Å; L170-R176 HydrophobicContact CG-CB 4.19Å; R176-H178 PolarHBondContact NH1-CD2 2.86Å; R176-H178 PolarHBondContact NH1-CE1 2.78Å; R176-H178 VanDerWaalsContact NH1-CG 3.29Å; R176-H178 PolarHBondContact NH1-NE2 3.46Å
177	I	83.7	Confident	86.2	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	110.1	171.7	-54.4	172.7	0	0	0	106.7	K137 A138 I167 L175 V180 D184 Y188 L206	K137-I177 CarbonylContact C-O 3.55Å; K137-I177 VanDerWaalsContact CA-O 3.26Å; K137-I177 WeakPolarHBondContact CA-O 3.36Å; A138-I177 HydrophobicContact CB-CB 4.33Å; A138-I177 PolarHBondContact N-O 3.41Å; A138-I177 PolarHBondContact O-N 2.82Å; I167-I177 HydrophobicContact CG1-CG1 4.2Å; I167-I177 HydrophobicContact CG1-CG2 4.07Å; I167-I177 HydrophobicContact CG2-CG1 4.19Å; L175-I177 HydrophobicContact CD2-CD1 4.27Å; L175-I177 HydrophobicContact CD2-CG1 4.36Å; L175-I177 HydrophobicContact CG-CG1 4.32Å; I177-V180 HydrophobicContact CB-CG2 3.98Å; I177-V180 HydrophobicContact CG2-CB 4.47Å; I177-V180 HydrophobicContact CG2-CG2 3.61Å; I177-D184 HydrophobicContact CG2-CB 4.41Å; I177-Y188 HydrophobicContact CD1-CE1 4.13Å; I177-L206 HydrophobicContact CD1-CD2 3.76Å
178	H	68.1	Low	86.4	Confident	72 Å²	72	48 Å²	48	33%	0.333	25%	0.251	S	S	.	.	S	Bend	trans	-82.4	149.3	170.7	-75.1	-33.6	0	0	0	110.6	K137 R166 R176 V180	K137-H178 VanDerWaalsContact CD-CE1 3.47Å; K137-H178 WeakPolarHBondContact CD-CE1 3.44Å; K137-H178 VanDerWaalsContact CD-ND1 3.27Å; K137-H178 WeakPolarHBondContact CD-ND1 3.36Å; K137-H178 WeakPolarHBondContact CG-ND1 3.25Å; R166-H178 WeakPolarHBondContact CB-O 3.45Å; R166-H178 PolarHBondContact NH1-O 2.91Å; R166-H178 PolarHBondContact O-N 3.35Å; R176-H178 PolarHBondContact NH1-CD2 2.86Å; R176-H178 PolarHBondContact NH1-CE1 2.78Å; R176-H178 VanDerWaalsContact NH1-CG 3.29Å; R176-H178 PolarHBondContact NH1-NE2 3.46Å; H178-V180 PolarHBondContact O-N 3.4Å
179	N	69.8	Low	86.7	Confident	86 Å²	86	51.7 Å²	51.7	46%	0.46	26%	0.261	S	S	.	.	S	Bend	trans	47.1	60.2	177.1	-172.8	21.1	0	0	0	111.2	G135 R166 Q181	G135-N179 WeakPolarHBondContact CA-OD1 3.33Å; G135-N179 WeakPolarHBondContact O-CA 3.34Å; R166-N179 PolarHBondContact NH1-O 3.15Å; R166-N179 VanDerWaalsContact NH1-O 3.16Å; N179-Q181 VanDerWaalsContact CG-NE2 3.3Å; N179-Q181 PolarHBondContact ND2-NE2 3.18Å; N179-Q181 PolarHBondContact O-N 3.36Å; N179-Q181 PolarHBondContact O-NE2 3.28Å; N179-Q181 PolarHBondContact OD1-NE2 2.92Å
180	V	76.8	Confident	86.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.252	C	S	.	.			trans	-56.9	128.5	-175.1	168.9	0	0	0	0	109.7	I132 E134 G135 L136 A138 I177 H178 D184 V208	I132-V180 HydrophobicContact CD1-CG2 4.29Å; I132-V180 HydrophobicContact CG2-CB 4.3Å; I132-V180 HydrophobicContact CG2-CG1 3.75Å; I132-V180 HydrophobicContact CG2-CG2 4.3Å; E134-V180 CarbonylContact C-O 3.5Å; E134-V180 WeakPolarHBondContact CA-O 3.5Å; G135-V180 PolarHBondContact N-O 2.95Å; L136-V180 VanDerWaalsContact O-CB 3.24Å; L136-V180 WeakPolarHBondContact O-CB 3.31Å; L136-V180 WeakPolarHBondContact O-CG2 3.25Å; L136-V180 PolarHBondContact O-N 3.45Å; A138-V180 HydrophobicContact CB-CG2 3.66Å; I177-V180 HydrophobicContact CB-CG2 3.98Å; I177-V180 HydrophobicContact CG2-CB 4.47Å; I177-V180 HydrophobicContact CG2-CG2 3.61Å; H178-V180 PolarHBondContact O-N 3.4Å; V180-D184 HydrophobicContact CG1-CB 4.17Å; V180-V208 HydrophobicContact CG1-CG1 4.23Å; V180-V208 HydrophobicContact CG1-CG2 3.55Å
181	Q	85.1	Confident	87.4	Confident	50 Å²	50	48 Å²	48	23%	0.234	24%	0.241	C	C	.	.			trans	-106	163.5	176.4	-55.2	-60.1	-59.5	0	0	110.4	N179 E183 D184	N179-Q181 VanDerWaalsContact CG-NE2 3.3Å; N179-Q181 PolarHBondContact ND2-NE2 3.18Å; N179-Q181 PolarHBondContact O-N 3.36Å; N179-Q181 PolarHBondContact O-NE2 3.28Å; N179-Q181 PolarHBondContact OD1-NE2 2.92Å; Q181-E183 WeakPolarHBondContact CB-OE2 3.43Å; Q181-E183 PolarHBondContact O-N 3.18Å; Q181-E183 VanDerWaalsContact O-N 3.13Å; Q181-D184 PolarHBondContact N-OD2 3.29Å; Q181-D184 WeakPolarHBondContact O-CB 3.07Å; Q181-D184 PolarHBondContact O-N 3.05Å
182	K	83.9	Confident	88.1	Confident	68 Å²	68	38.9 Å²	38.9	30%	0.296	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-55.2	-31.6	177.4	-68.6	168.4	-146.1	-163.6	0	112.8	E134 D184 A185 V208 V210 I238	E134-K182 VanDerWaalsContact CD-CE 3.42Å; E134-K182 WeakPolarHBondContact OE1-CE 3.12Å; E134-K182 WeakPolarHBondContact OE1-CG 3.47Å; E134-K182 WeakPolarHBondContact OE2-CE 3.22Å; E134-K182 IonicContact OE2-NZ 3.26Å; K182-D184 VanDerWaalsContact C-N 3.25Å; K182-D184 PolarHBondContact O-N 2.97Å; K182-A185 VanDerWaalsContact O-CB 3.26Å; K182-A185 WeakPolarHBondContact O-CB 3.34Å; K182-A185 PolarHBondContact O-N 3.33Å; K182-V208 HydrophobicContact CG-CG1 4.46Å; K182-V210 HydrophobicContact CD-CG2 4.04Å; K182-V210 VanDerWaalsContact CE-CG2 3.48Å; K182-V210 HydrophobicContact CG-CG2 3.88Å; K182-I238 HydrophobicContact CD-CD1 3.98Å; K182-I238 HydrophobicContact CG-CD1 3.94Å
183	E	90.6	Very high	88.8	Confident	132 Å²	132	42.1 Å²	42.1	62%	0.617	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-73.7	-17.8	-179.8	-54.9	68.5	-137.9	0	0	112.3	K156 Q181 A185	K156-E183 PolarHBondContact NZ-O 3.13Å; Q181-E183 WeakPolarHBondContact CB-OE2 3.43Å; Q181-E183 PolarHBondContact O-N 3.18Å; Q181-E183 VanDerWaalsContact O-N 3.13Å; E183-A185 PolarHBondContact O-N 3.4Å
184	D	90.9	Very high	89.3	Confident	5 Å²	5	42.9 Å²	42.9	3%	0.027	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-74.6	-16.3	174.3	-60.8	-39.6	0	0	0	111.5	R166 I177 V180 Q181 K182 G186 Y188 L206	R166-D184 IonicContact CZ-OD1 3.09Å; R166-D184 IonicContact CZ-OD2 3.54Å; R166-D184 IonicContact NH1-OD1 3.93Å; R166-D184 IonicContact NH1-OD2 2.79Å; R166-D184 PolarHBondContact NH1-OD2 2.93Å; R166-D184 IonicContact NH2-OD1 2.89Å; R166-D184 PolarHBondContact NH2-OD1 2.03Å; R166-D184 IonicContact NH2-OD2 3.61Å; R166-D184 PolarHBondContact NH2-OD2 3.01Å; I177-D184 HydrophobicContact CG2-CB 4.41Å; V180-D184 HydrophobicContact CG1-CB 4.17Å; Q181-D184 PolarHBondContact N-OD2 3.29Å; Q181-D184 WeakPolarHBondContact O-CB 3.07Å; Q181-D184 PolarHBondContact O-N 3.05Å; K182-D184 VanDerWaalsContact C-N 3.25Å; K182-D184 PolarHBondContact O-N 2.97Å; D184-G186 PolarHBondContact O-N 2.93Å; D184-Y188 WeakPolarHBondContact O-CE2 2.87Å; D184-Y188 PolarHBondContact O-OH 3.49Å; D184-L206 HydrophobicContact CB-CD2 4.43Å
185	A	91.8	Very high	89.8	Confident	42 Å²	42	47.3 Å²	47.3	35%	0.347	24%	0.241	S	C	.	.			trans	-57.1	139.3	172.9	0	0	0	0	0	111.2	K182 E183 L206 V208	K182-A185 VanDerWaalsContact O-CB 3.26Å; K182-A185 WeakPolarHBondContact O-CB 3.34Å; K182-A185 PolarHBondContact O-N 3.33Å; E183-A185 PolarHBondContact O-N 3.4Å; A185-L206 VanDerWaalsContact CA-O 3.31Å; A185-L206 WeakPolarHBondContact CA-O 3.44Å; A185-V208 HydrophobicContact CB-CB 4.31Å; A185-V208 HydrophobicContact CB-CG2 3.87Å
186	G	93.7	Very high	90	Very high	24 Å²	24	50.1 Å²	50.1	25%	0.247	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.4	-171.5	-178.7	0	0	0	0	0	114.1	D184 K205 L206	D184-G186 PolarHBondContact O-N 2.93Å; G186-K205 CarbonylContact O-C 3.52Å; G186-K205 WeakPolarHBondContact O-CA 3.32Å; G186-L206 PolarHBondContact N-O 2.59Å; G186-L206 PolarHBondContact O-N 2.96Å
187	Q	97.2	Very high	90.3	Very high	112 Å²	112	48.9 Å²	48.9	52%	0.523	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	138.8	176.7	-70.8	-179.2	-7	0	0	110.5	K156 G157 V203 V204	K156-Q187 CarbonylContact C-O 3.58Å; K156-Q187 VanDerWaalsContact CA-O 3.3Å; K156-Q187 WeakPolarHBondContact CA-O 3.06Å; G157-Q187 PolarHBondContact N-O 2.53Å; Q187-V203 HydrophobicContact CB-CG1 3.7Å; Q187-V203 HydrophobicContact CG-CG1 4.05Å; Q187-V204 CarbonylContact C-O 3.58Å; Q187-V204 VanDerWaalsContact CA-O 3.27Å; Q187-V204 WeakPolarHBondContact CA-O 3.12Å
188	Y	96.8	Very high	91	Very high	1 Å²	1	51.5 Å²	51.5	0%	0.004	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	144.7	-176.9	-72.4	-100.7	0	0	0	110.9	L140 I155 K156 L161 L175 I177 D184 V203 V204 L206	L140-Y188 HydrophobicContact CD1-CD1 3.85Å; L140-Y188 HydrophobicContact CD1-CD2 4.06Å; L140-Y188 HydrophobicContact CD1-CG 3.56Å; I155-Y188 CarbonylContact O-C 3.51Å; I155-Y188 VanDerWaalsContact O-CA 3.27Å; I155-Y188 WeakPolarHBondContact O-CA 3.14Å; K156-Y188 HydrophobicContact CB-CD1 4.29Å; K156-Y188 HydrophobicContact CB-CE1 4.07Å; K156-Y188 HydrophobicContact CD-CE1 4.11Å; K156-Y188 HydrophobicContact CD-CE2 4.41Å; K156-Y188 WeakPolarHBondContact CD-OH 3.26Å; K156-Y188 VanDerWaalsContact CE-OH 3.27Å; K156-Y188 WeakPolarHBondContact CE-OH 3.31Å; K156-Y188 HydrophobicContact CG-CD1 4.4Å; K156-Y188 HydrophobicContact CG-CE1 3.92Å; K156-Y188 HydrophobicContact CG-CE2 4.1Å; L161-Y188 HydrophobicContact CD1-CD1 4.01Å; L161-Y188 HydrophobicContact CD1-CE1 3.49Å; L161-Y188 VanDerWaalsContact CD1-CE1 3.49Å; L175-Y188 HydrophobicContact CD2-CD1 3.5Å; L175-Y188 VanDerWaalsContact CD2-CD1 3.5Å; L175-Y188 HydrophobicContact CD2-CE1 3.54Å; I177-Y188 HydrophobicContact CD1-CE1 4.13Å; D184-Y188 WeakPolarHBondContact O-CE2 2.87Å; D184-Y188 PolarHBondContact O-OH 3.49Å; Y188-V203 WeakPolarHBondContact O-CA 3.34Å; Y188-V204 PolarHBondContact N-O 3.2Å; Y188-V204 WeakPolarHBondContact O-CG2 3.09Å; Y188-V204 PolarHBondContact O-N 3.48Å; Y188-L206 HydrophobicContact CD2-CB 3.98Å; Y188-L206 HydrophobicContact CE2-CB 3.78Å; Y188-L206 HydrophobicContact CE2-CD2 4.02Å
189	R	97.3	Very high	92.3	Very high	94 Å²	94	49 Å²	49	36%	0.355	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	136	176.1	-167.7	179.9	-163.2	176.4	-1.1	110.6	W154 I155 S201 V203	W154-R189 CarbonylContact C-O 3.59Å; W154-R189 WeakPolarHBondContact CA-O 3.31Å; I155-R189 HydrophobicContact CB-CB 4.32Å; I155-R189 PolarHBondContact N-O 3.12Å; I155-R189 PolarHBondContact O-N 3.48Å; R189-S201 PolarHBondContact NE-O 2.9Å; R189-V203 HydrophobicContact CB-CG2 4.47Å; R189-V203 HydrophobicContact CG-CG2 4.48Å
190	C	96.6	Very high	93.6	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	143.7	174.7	-180	0	0	0	0	111.5	P127 C142 V152 W154 S201	P127-C190 HydrophobicContact CG-CB 4.49Å; C142-C190 HydrophobicContact CB-CB 3.57Å; C142-C190 WeakPolarHBondContact CB-SG 3.27Å; C142-C190 WeakPolarHBondContact SG-CB 3.22Å; C142-C190 CovalentContact SG-SG 2Å; C142-C190 PolarHBondContact SG-SG 3.16Å; V152-C190 WeakPolarHBondContact CG1-SG 2.95Å; W154-C190 HydrophobicContact CD2-CB 4.07Å; W154-C190 HydrophobicContact CE3-CB 4.15Å; W154-C190 HydrophobicContact CH2-CB 3.95Å; W154-C190 HydrophobicContact CZ2-CB 3.85Å; W154-C190 HydrophobicContact CZ3-CB 4.09Å; C190-S201 PolarHBondContact N-OG 3.34Å; C190-S201 PolarHBondContact O-N 3.12Å
191	V	97.7	Very high	94.5	Very high	13 Å²	13	51.4 Å²	51.4	8%	0.079	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	120.4	179.4	-171.4	0	0	0	0	109.5	V152 S153 I155 T198 Y200	V152-V191 WeakPolarHBondContact CA-O 3.32Å; S153-V191 PolarHBondContact N-O 3.46Å; S153-V191 PolarHBondContact O-N 3.32Å; I155-V191 HydrophobicContact CD1-CG2 3.72Å; I155-V191 HydrophobicContact CG1-CG2 4.06Å; V191-T198 HydrophobicContact CG1-CG2 3.54Å; V191-Y200 HydrophobicContact CB-CD1 4.43Å; V191-Y200 HydrophobicContact CB-CE1 4.42Å; V191-Y200 HydrophobicContact CG1-CD1 4.1Å; V191-Y200 HydrophobicContact CG1-CE1 3.74Å; V191-Y200 HydrophobicContact CG2-CD1 3.81Å; V191-Y200 HydrophobicContact CG2-CE1 3.87Å
192	A	97.6	Very high	94.9	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	124.5	178.5	0	0	0	0	0	110.3	P121 I123 T144 P150 S151 V152 T198 A199	P121-A192 HydrophobicContact CB-CB 4.2Å; P121-A192 WeakPolarHBondContact CG-O 3.37Å; I123-A192 HydrophobicContact CG1-CB 4.07Å; T144-A192 HydrophobicContact CG2-CB 3.48Å; T144-A192 VanDerWaalsContact CG2-CB 3.48Å; P150-A192 HydrophobicContact CB-CB 4.42Å; S151-A192 CarbonylContact O-C 3.59Å; S151-A192 WeakPolarHBondContact O-CA 3.15Å; V152-A192 HydrophobicContact CG2-CB 4.49Å; A192-T198 CarbonylContact O-C 3.58Å; A192-T198 VanDerWaalsContact O-CA 3.27Å; A192-T198 WeakPolarHBondContact O-CA 3.48Å; A192-A199 HydrophobicContact CB-CB 4.48Å; A192-A199 PolarHBondContact N-O 3.5Å; A192-A199 PolarHBondContact O-N 2.92Å
193	K	97.3	Very high	95.5	Very high	120 Å²	120	57.9 Å²	57.9	52%	0.522	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	133.8	-172.8	-178.4	174.5	-179.1	-176.8	0	112.5	P150 S151 T198	P150-K193 WeakPolarHBondContact CA-O 3.41Å; S151-K193 PolarHBondContact N-O 2.91Å; S151-K193 PolarHBondContact O-N 3.04Å; S151-K193 PolarHBondContact OG-O 3.07Å; K193-T198 HydrophobicContact CB-CG2 4.32Å; K193-T198 WeakPolarHBondContact CG-OG1 3.17Å
194	N	96.4	Very high	95.5	Very high	18 Å²	18	51.9 Å²	51.9	10%	0.096	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	-173.5	164.2	73.6	7.8	0	0	0	110.1	M119 P121 P148 L196 G197	M119-N194 PolarHBondContact O-ND2 2.83Å; P121-N194 VanDerWaalsContact CD-OD1 3.32Å; P121-N194 WeakPolarHBondContact CD-OD1 3.3Å; P148-N194 WeakPolarHBondContact O-CB 3.48Å; P148-N194 PolarHBondContact O-ND2 3.44Å; N194-L196 PolarHBondContact O-N 3.37Å; N194-L196 WeakPolarHBondContact OD1-CA 3.28Å; N194-L196 WeakPolarHBondContact OD1-CB 3.45Å; N194-L196 PolarHBondContact OD1-N 3.44Å; N194-G197 PolarHBondContact N-O 3.06Å; N194-G197 VanDerWaalsContact N-O 3.11Å; N194-G197 PolarHBondContact O-N 2.89Å; N194-G197 VanDerWaalsContact O-O 3.07Å; N194-G197 PolarHBondContact OD1-N 3.46Å
195	S	95.6	Very high	95.6	Very high	101 Å²	101	56.3 Å²	56.3	71%	0.706	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-18.2	-179.2	51.4	0	0	0	0	114.4
196	L	94.4	Very high	95.4	Very high	60 Å²	60	54.4 Å²	54.4	31%	0.314	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-13.1	-174.1	-55.1	168	0	0	0	112.8	L40 K118 K120 N147 N194	L40-L196 HydrophobicContact CD2-CD1 3.89Å; K118-L196 HydrophobicContact CB-CD1 3.78Å; K120-L196 HydrophobicContact CG-CB 3.83Å; N147-L196 WeakPolarHBondContact O-CD1 3.46Å; N194-L196 PolarHBondContact O-N 3.37Å; N194-L196 WeakPolarHBondContact OD1-CA 3.28Å; N194-L196 WeakPolarHBondContact OD1-CB 3.45Å; N194-L196 PolarHBondContact OD1-N 3.44Å
197	G	95.1	Very high	95	Very high	27 Å²	27	56 Å²	56	28%	0.278	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	166.5	-168.4	178.8	0	0	0	0	0	115.4	P121 N194	P121-G197 WeakPolarHBondContact CG-O 3.37Å; N194-G197 PolarHBondContact N-O 3.06Å; N194-G197 VanDerWaalsContact N-O 3.11Å; N194-G197 PolarHBondContact O-N 2.89Å; N194-G197 VanDerWaalsContact O-O 3.07Å; N194-G197 PolarHBondContact OD1-N 3.46Å
198	T	97.4	Very high	94.2	Very high	56 Å²	56	51.1 Å²	51.1	34%	0.344	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	134.7	178.3	-56.6	0	0	0	0	110.1	V191 A192 K193 Y200	V191-T198 HydrophobicContact CG1-CG2 3.54Å; A192-T198 CarbonylContact O-C 3.58Å; A192-T198 VanDerWaalsContact O-CA 3.27Å; A192-T198 WeakPolarHBondContact O-CA 3.48Å; K193-T198 HydrophobicContact CB-CG2 4.32Å; K193-T198 WeakPolarHBondContact CG-OG1 3.17Å; T198-Y200 HydrophobicContact CG2-CD2 4.39Å; T198-Y200 HydrophobicContact CG2-CE1 4.38Å; T198-Y200 HydrophobicContact CG2-CE2 3.74Å
199	A	96.5	Very high	93.4	Very high	19 Å²	19	52.4 Å²	52.4	16%	0.157	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	143.1	174.3	0	0	0	0	0	110.7	P121 I123 A192	P121-A199 HydrophobicContact CG-CB 4.41Å; P121-A199 VanDerWaalsContact O-CB 3.27Å; P121-A199 WeakPolarHBondContact O-CB 3.4Å; I123-A199 HydrophobicContact CD1-CB 4.35Å; I123-A199 HydrophobicContact CG1-CB 4.21Å; A192-A199 HydrophobicContact CB-CB 4.48Å; A192-A199 PolarHBondContact N-O 3.5Å; A192-A199 PolarHBondContact O-N 2.92Å
200	Y	97	Very high	92.5	Very high	130 Å²	130	48.6 Å²	48.6	51%	0.51	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	138	-178.8	-63.6	-91.1	0	0	0	110.5	V191 T198	V191-Y200 HydrophobicContact CB-CD1 4.43Å; V191-Y200 HydrophobicContact CB-CE1 4.42Å; V191-Y200 HydrophobicContact CG1-CD1 4.1Å; V191-Y200 HydrophobicContact CG1-CE1 3.74Å; V191-Y200 HydrophobicContact CG2-CD1 3.81Å; V191-Y200 HydrophobicContact CG2-CE1 3.87Å; T198-Y200 HydrophobicContact CG2-CD2 4.39Å; T198-Y200 HydrophobicContact CG2-CE1 4.38Å; T198-Y200 HydrophobicContact CG2-CE2 3.74Å
201	S	95.4	Very high	91.6	Very high	7 Å²	7	52 Å²	52	5%	0.049	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-73.8	169.3	166.9	76	0	0	0	0	111.4	I123 R189 C190	I123-S201 VanDerWaalsContact CD1-N 3.34Å; R189-S201 PolarHBondContact NE-O 2.9Å; C190-S201 PolarHBondContact N-OG 3.34Å; C190-S201 PolarHBondContact O-N 3.12Å
202	K	93.4	Very high	90.8	Very high	180 Å²	180	51.9 Å²	51.9	78%	0.783	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-63.5	155.2	159	-64.7	-176.7	-178.8	179.5	0	109.7
203	V	95.6	Very high	90	Very high	74 Å²	74	59.4 Å²	59.4	45%	0.448	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-74	133.2	170.9	-179.7	0	0	0	0	108.6	Q187 Y188 R189	Q187-V203 HydrophobicContact CB-CG1 3.7Å; Q187-V203 HydrophobicContact CG-CG1 4.05Å; Y188-V203 WeakPolarHBondContact O-CA 3.34Å; R189-V203 HydrophobicContact CB-CG2 4.47Å; R189-V203 HydrophobicContact CG-CG2 4.48Å
204	V	90.9	Very high	89.4	Confident	6 Å²	6	55 Å²	55	4%	0.036	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	151.6	-179.9	-57.1	0	0	0	0	110.8	P127 I128 N129 L140 Q187 Y188	P127-V204 HydrophobicContact CB-CG1 4.15Å; P127-V204 HydrophobicContact CB-CG2 3.93Å; P127-V204 HydrophobicContact CG-CG1 4.18Å; P127-V204 HydrophobicContact CG-CG2 4.24Å; P127-V204 WeakPolarHBondContact O-CG1 3.31Å; I128-V204 VanDerWaalsContact CA-CG1 3.47Å; N129-V204 WeakPolarHBondContact OD1-CA 3.42Å; L140-V204 HydrophobicContact CD1-CG2 4.37Å; Q187-V204 CarbonylContact C-O 3.58Å; Q187-V204 VanDerWaalsContact CA-O 3.27Å; Q187-V204 WeakPolarHBondContact CA-O 3.12Å; Y188-V204 PolarHBondContact N-O 3.2Å; Y188-V204 WeakPolarHBondContact O-CG2 3.09Å; Y188-V204 PolarHBondContact O-N 3.48Å
205	K	93.8	Very high	88.9	Confident	99 Å²	99	57.9 Å²	57.9	43%	0.43	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	128.3	-179.2	-165.5	-178.2	179.7	-161.7	0	110.7	N129 V130 G186 E207	N129-K205 CarbonylContact C-O 3.52Å; N129-K205 WeakPolarHBondContact CA-O 3.04Å; N129-K205 PolarHBondContact OD1-N 2.91Å; V130-K205 PolarHBondContact N-O 3.47Å; G186-K205 CarbonylContact O-C 3.52Å; G186-K205 WeakPolarHBondContact O-CA 3.32Å; K205-E207 HydrophobicContact CD-CG 3.96Å; K205-E207 WeakPolarHBondContact CE-OE1 3.32Å; K205-E207 HydrophobicContact CG-CG 4.1Å; K205-E207 IonicContact NZ-OE1 3.69Å; K205-E207 PolarHBondContact NZ-OE1 2.86Å
206	L	87.9	Confident	88.7	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	115.7	164.5	-176.5	63.3	0	0	0	108.3	V130 I132 A138 I177 D184 A185 G186 Y188	V130-L206 HydrophobicContact CB-CD1 3.85Å; V130-L206 HydrophobicContact CG1-CD1 3.84Å; V130-L206 CarbonylContact O-C 3.51Å; V130-L206 WeakPolarHBondContact O-CA 3.29Å; I132-L206 HydrophobicContact CG2-CD1 3.79Å; A138-L206 HydrophobicContact CB-CD1 4.18Å; I177-L206 HydrophobicContact CD1-CD2 3.76Å; D184-L206 HydrophobicContact CB-CD2 4.43Å; A185-L206 VanDerWaalsContact CA-O 3.31Å; A185-L206 WeakPolarHBondContact CA-O 3.44Å; G186-L206 PolarHBondContact N-O 2.59Å; G186-L206 PolarHBondContact O-N 2.96Å; Y188-L206 HydrophobicContact CD2-CB 3.98Å; Y188-L206 HydrophobicContact CE2-CB 3.78Å; Y188-L206 HydrophobicContact CE2-CD2 4.02Å
207	E	84.9	Confident	88.4	Confident	58 Å²	58	57.4 Å²	57.4	27%	0.271	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	134	173.1	-56.6	-169.4	152.4	0	0	109.3	V130 K131 I132 K205	V130-E207 PolarHBondContact O-N 3.02Å; K131-E207 CarbonylContact C-O 3.53Å; K131-E207 WeakPolarHBondContact CA-O 3.19Å; K131-E207 WeakPolarHBondContact CD-OE2 3.23Å; K131-E207 WeakPolarHBondContact CE-OE2 3.38Å; K131-E207 HydrophobicContact CG-CB 4.13Å; K131-E207 IonicContact NZ-OE2 2.67Å; K131-E207 PolarHBondContact NZ-OE2 2.89Å; K131-E207 VanDerWaalsContact NZ-OE2 3.09Å; I132-E207 PolarHBondContact N-O 2.85Å; K205-E207 HydrophobicContact CD-CG 3.96Å; K205-E207 WeakPolarHBondContact CE-OE1 3.32Å; K205-E207 HydrophobicContact CG-CG 4.1Å; K205-E207 IonicContact NZ-OE1 3.69Å; K205-E207 PolarHBondContact NZ-OE1 2.86Å
208	V	81.2	Confident	88.2	Confident	10 Å²	10	56.5 Å²	56.5	6%	0.061	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.2	179	-177.8	0	0	0	0	109.5	I132 E134 V180 K182 A185 I238	I132-V208 HydrophobicContact CG2-CG2 4.32Å; I132-V208 CarbonylContact O-C 3.26Å; I132-V208 VanDerWaalsContact O-CA 3.27Å; I132-V208 WeakPolarHBondContact O-CA 3.1Å; E134-V208 HydrophobicContact CB-CG1 4.01Å; V180-V208 HydrophobicContact CG1-CG1 4.23Å; V180-V208 HydrophobicContact CG1-CG2 3.55Å; K182-V208 HydrophobicContact CG-CG1 4.46Å; A185-V208 HydrophobicContact CB-CB 4.31Å; A185-V208 HydrophobicContact CB-CG2 3.87Å; V208-I238 WeakPolarHBondContact O-CG2 3.14Å
209	E	78.5	Confident	87.8	Confident	27 Å²	27	58.7 Å²	58.7	13%	0.126	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	150.7	175.2	-62.3	-165.1	146.2	0	0	109.9	I132 I133 E134 I238 K287 H288	I132-E209 PolarHBondContact O-N 2.96Å; I133-E209 CarbonylContact C-O 3.48Å; I133-E209 VanDerWaalsContact CA-O 3.27Å; I133-E209 WeakPolarHBondContact CA-O 3.37Å; E134-E209 PolarHBondContact N-O 2.97Å; E209-I238 WeakPolarHBondContact CA-O 3.01Å; E209-K287 IonicContact OE1-NZ 3.47Å; E209-H288 IonicContact OE1-NE2 3.02Å; E209-H288 IonicContact OE2-CD2 3.54Å; E209-H288 IonicContact OE2-CE1 2.7Å; E209-H288 IonicContact OE2-NE2 2.59Å; E209-H288 PolarHBondContact OE2-NE2 2.96Å
210	V	79.3	Confident	87.4	Confident	14 Å²	14	61.5 Å²	61.5	9%	0.085	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	128.4	-173.1	-178.2	0	0	0	0	107.8	E134 K182 I238 N286	E134-V210 HydrophobicContact CB-CG2 3.91Å; E134-V210 WeakPolarHBondContact OE2-CG1 3.43Å; K182-V210 HydrophobicContact CD-CG2 4.04Å; K182-V210 VanDerWaalsContact CE-CG2 3.48Å; K182-V210 HydrophobicContact CG-CG2 3.88Å; V210-I238 HydrophobicContact CB-CB 3.95Å; V210-I238 HydrophobicContact CB-CD1 4.37Å; V210-I238 HydrophobicContact CB-CG1 3.97Å; V210-I238 HydrophobicContact CG2-CB 3.97Å; V210-I238 HydrophobicContact CG2-CD1 3.57Å; V210-I238 HydrophobicContact CG2-CG1 3.72Å; V210-I238 PolarHBondContact N-O 3.29Å; V210-I238 PolarHBondContact O-N 2.87Å; V210-N286 PolarHBondContact O-ND2 3.26Å; V210-N286 VanDerWaalsContact O-ND2 3.11Å
211	F	77.2	Confident	86.9	Confident	72 Å²	72	58.3 Å²	58.3	32%	0.316	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	155.9	177.8	-68	-56.2	0	0	0	112.3	I133 R213 F292	I133-F211 HydrophobicContact CD1-CE1 4.13Å; I133-F211 HydrophobicContact CD1-CE2 4.23Å; I133-F211 HydrophobicContact CD1-CZ 3.59Å; I133-F211 HydrophobicContact CG1-CZ 4.35Å; I133-F211 HydrophobicContact CG2-CD2 3.92Å; I133-F211 HydrophobicContact CG2-CE2 3.64Å; I133-F211 HydrophobicContact CG2-CZ 4.07Å; F211-R213 PolarHBondContact O-N 3.48Å; F211-F292 WeakPolarHBondContact CD1-O 3.26Å
212	A	80.8	Confident	86.3	Confident	11 Å²	11	63.9 Å²	63.9	9%	0.091	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	126	172.7	0	0	0	0	0	109.1	T236 P241 A284 S293	A212-T236 CarbonylContact C-O 3.52Å; A212-T236 VanDerWaalsContact CA-O 3.26Å; A212-T236 WeakPolarHBondContact CA-O 3.32Å; A212-P241 HydrophobicContact CB-CB 3.76Å; A212-P241 HydrophobicContact CB-CG 4.21Å; A212-A284 HydrophobicContact CB-CB 4.28Å; A212-A284 WeakPolarHBondContact CB-O 3.38Å; A212-S293 WeakPolarHBondContact CB-O 3.12Å
213	R	81.8	Confident	85.6	Confident	157 Å²	157	56.2 Å²	56.2	59%	0.592	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.1	126.9	176.6	-174.1	173.3	73	97.4	-8.1	109.4	F211 L215 A235 T236	F211-R213 PolarHBondContact O-N 3.48Å; R213-L215 PolarHBondContact O-N 3Å; R213-A235 CarbonylContact O-C 3.58Å; R213-A235 WeakPolarHBondContact O-CA 3.42Å; R213-A235 WeakPolarHBondContact O-CB 3.33Å; R213-T236 HydrophobicContact CB-CG2 4.27Å; R213-T236 PolarHBondContact N-O 2.95Å; R213-T236 PolarHBondContact O-N 3.15Å
214	I	84.8	Confident	84.5	Confident	28 Å²	28	56.6 Å²	56.6	14%	0.144	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	124.3	170.6	-70.6	167.3	0	0	0	108.2	R216 A217 T234 A235 A284 A295 A297	I214-R216 VanDerWaalsContact CG2-C 3.47Å; I214-R216 VanDerWaalsContact CG2-O 3.31Å; I214-R216 WeakPolarHBondContact CG2-O 3.37Å; I214-A217 HydrophobicContact CG2-CB 4.35Å; I214-T234 CarbonylContact C-O 3.54Å; I214-T234 WeakPolarHBondContact CA-O 3.22Å; I214-A235 HydrophobicContact CG1-CB 4.45Å; I214-A284 HydrophobicContact CG1-CB 4.23Å; I214-A295 HydrophobicContact CB-CB 4.29Å; I214-A295 VanDerWaalsContact CD1-C 3.47Å; I214-A295 HydrophobicContact CD1-CB 3.85Å; I214-A295 WeakPolarHBondContact CD1-O 3.35Å; I214-A295 HydrophobicContact CG1-CB 3.66Å; I214-A297 HydrophobicContact CD1-CB 3.74Å; I214-A297 HydrophobicContact CG2-CB 4.41Å
215	L	86.2	Confident	83.7	Confident	78 Å²	78	60.3 Å²	60.3	41%	0.408	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-40.4	175.4	-60.1	-177.6	0	0	0	111	R213 T234 T236 V265	R213-L215 PolarHBondContact O-N 3Å; L215-T234 PolarHBondContact N-O 2.84Å; L215-T236 HydrophobicContact CD1-CG2 4.15Å; L215-T236 HydrophobicContact CD2-CG2 3.89Å; L215-T236 HydrophobicContact CG-CG2 4.09Å; L215-V265 HydrophobicContact CD1-CG1 3.99Å; L215-V265 HydrophobicContact CD1-CG2 4.08Å
216	R	89.7	Confident	82.4	Confident	106 Å²	106	57.1 Å²	57.1	40%	0.4	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	117.7	174.3	-172.6	-178.8	-179.5	167	7.3	109	I214 E219 H232 C233 T234	I214-R216 VanDerWaalsContact CG2-C 3.47Å; I214-R216 VanDerWaalsContact CG2-O 3.31Å; I214-R216 WeakPolarHBondContact CG2-O 3.37Å; R216-E219 IonicContact CZ-OE1 3.13Å; R216-E219 IonicContact NE-OE1 3.91Å; R216-E219 IonicContact NH2-OE1 2.83Å; R216-E219 PolarHBondContact NH2-OE1 3.01Å; R216-H232 WeakPolarHBondContact CD-ND1 3.38Å; R216-H232 VanDerWaalsContact CZ-ND1 3.31Å; R216-H232 PolarHBondContact NH1-CE1 3.05Å; R216-H232 PolarHBondContact NH1-ND1 3.37Å; R216-C233 WeakPolarHBondContact O-CA 3.41Å; R216-T234 HydrophobicContact CB-CG2 4.18Å; R216-T234 WeakPolarHBondContact CB-OG1 3.26Å; R216-T234 PolarHBondContact N-O 2.83Å; R216-T234 PolarHBondContact N-OG1 2.85Å; R216-T234 PolarHBondContact O-N 3.01Å
217	A	89.2	Confident	81.9	Confident	45 Å²	45	58.3 Å²	58.3	37%	0.372	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-80.6	152.6	172.2	0	0	0	0	0	110.7	I214 H232 A297	I214-A217 HydrophobicContact CG2-CB 4.35Å; A217-H232 CarbonylContact C-O 3.59Å; A217-A297 HydrophobicContact CB-CB 3.6Å
218	P	90.3	Very high	81.6	Confident	8 Å²	8	62.1 Å²	62.1	5%	0.052	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-64.1	145	169.7	29.1	-34.2	0	0	0	110.3	L231 H232 W245 A299	P218-L231 HydrophobicContact CB-CB 4.21Å; P218-L231 HydrophobicContact CB-CD2 4.45Å; P218-H232 VanDerWaalsContact CA-O 3.26Å; P218-H232 WeakPolarHBondContact CA-O 3.14Å; P218-W245 HydrophobicContact CB-CH2 3.97Å; P218-W245 HydrophobicContact CB-CZ3 3.98Å; P218-W245 HydrophobicContact CG-CH2 4.31Å; P218-W245 HydrophobicContact CG-CZ3 4.07Å; P218-A299 HydrophobicContact CB-CB 3.76Å; P218-A299 HydrophobicContact CG-CB 3.98Å
219	E	89.5	Confident	81.9	Confident	102 Å²	102	62.1 Å²	62.1	48%	0.477	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-96.6	143.7	-179.1	-67.6	165.8	-141.4	0	0	110.2	R216 H221 A299	R216-E219 IonicContact CZ-OE1 3.13Å; R216-E219 IonicContact NE-OE1 3.91Å; R216-E219 IonicContact NH2-OE1 2.83Å; R216-E219 PolarHBondContact NH2-OE1 3.01Å; E219-H221 PolarHBondContact O-CE1 3.2Å; E219-H221 VanDerWaalsContact O-CE1 3.25Å; E219-H221 PolarHBondContact O-ND1 2.89Å; E219-A299 VanDerWaalsContact O-CB 3.31Å; E219-A299 WeakPolarHBondContact O-CB 3.34Å
220	S	88.8	Confident	82.5	Confident	78 Å²	78	64.1 Å²	64.1	55%	0.545	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-72.6	141.7	173.6	-65.3	0	0	0	0	110.6	T300	S220-T300 CarbonylContact C-O 3.56Å; S220-T300 VanDerWaalsContact CA-O 3.25Å; S220-T300 WeakPolarHBondContact CA-O 3.35Å; S220-T300 VanDerWaalsContact CB-O 3.31Å; S220-T300 WeakPolarHBondContact CB-O 3.25Å; S220-T300 PolarHBondContact OG-N 2.65Å
221	H	84.8	Confident	83.1	Confident	64 Å²	64	63.5 Å²	63.5	30%	0.296	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	143.2	-176.6	-67.8	76.2	0	0	0	111.1	E219 V223 T300 I301 S302	E219-H221 PolarHBondContact O-CE1 3.2Å; E219-H221 VanDerWaalsContact O-CE1 3.25Å; E219-H221 PolarHBondContact O-ND1 2.89Å; H221-V223 HydrophobicContact CB-CG1 3.89Å; H221-T300 PolarHBondContact N-O 3Å; H221-I301 WeakPolarHBondContact O-CA 3.49Å; H221-S302 PolarHBondContact O-N 3.11Å
222	N	83.5	Confident	83.9	Confident	123 Å²	123	61.5 Å²	61.5	66%	0.658	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	114	169.4	-68	0.2	0	0	0	107.5	S302 A304	N222-S302 WeakPolarHBondContact CA-O 3.41Å; N222-S302 PolarHBondContact OD1-OG 3.19Å; N222-A304 HydrophobicContact CB-CB 4.22Å
223	V	78.7	Confident	84.5	Confident	20 Å²	20	61 Å²	61	12%	0.121	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	163.7	-168.8	-57.4	0	0	0	0	112.9	H221 V229 I274 I301 S302 I303 A304	H221-V223 HydrophobicContact CB-CG1 3.89Å; V223-V229 HydrophobicContact CB-CG2 4.23Å; V223-V229 HydrophobicContact CG1-CG2 3.51Å; V223-V229 HydrophobicContact CG2-CG2 4.14Å; V223-I274 HydrophobicContact CG2-CB 4.03Å; V223-I274 HydrophobicContact CG2-CG1 4.01Å; V223-I274 HydrophobicContact CG2-CG2 3.78Å; V223-I301 HydrophobicContact CG2-CG2 3.77Å; V223-S302 PolarHBondContact N-O 2Å; V223-I303 VanDerWaalsContact O-CA 3.27Å; V223-I303 WeakPolarHBondContact O-CA 3.49Å; V223-A304 PolarHBondContact O-N 2.82Å
224	T	73.4	Confident	85.1	Confident	81 Å²	81	54.5 Å²	54.5	50%	0.497	30%	0.295	S	S	.	.			trans	-80	146.6	174.7	55.2	0	0	0	0	110.4	G226 S227	T224-G226 PolarHBondContact O-N 3.24Å; T224-S227 WeakPolarHBondContact O-CB 3.21Å; T224-S227 PolarHBondContact O-N 3.45Å; T224-S227 PolarHBondContact O-OG 3.38Å
225	F	73.9	Confident	85.3	Confident	85 Å²	85	53.1 Å²	53.1	37%	0.373	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	133.4	172.5	177.3	-89	0	0	0	110.4	T275 I303	F225-T275 WeakPolarHBondContact CE2-O 3.45Å; F225-I303 HydrophobicContact CB-CG2 4.22Å; F225-I303 HydrophobicContact CD2-CD1 4.28Å
226	G	67	Low	85.5	Confident	31 Å²	31	50.1 Å²	50.1	32%	0.32	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	79	16.7	179.9	0	0	0	0	0	115.3	T224 F273 I274	T224-G226 PolarHBondContact O-N 3.24Å; G226-F273 WeakPolarHBondContact O-CE2 3.2Å; G226-I274 PolarHBondContact N-O 3.23Å
227	S	75.6	Confident	85.1	Confident	26 Å²	26	45.1 Å²	45.1	18%	0.182	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	161.6	174.5	63.1	0	0	0	0	112.9	T224 I274	T224-S227 WeakPolarHBondContact O-CB 3.21Å; T224-S227 PolarHBondContact O-N 3.45Å; T224-S227 PolarHBondContact O-OG 3.38Å; S227-I274 PolarHBondContact O-N 3.36Å
228	F	80.4	Confident	84.9	Confident	139 Å²	139	44.3 Å²	44.3	61%	0.61	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	135.6	172.2	-72.9	-85.1	0	0	0	111.5	L272 F273	F228-L272 CarbonylContact C-O 3.57Å; F228-L272 VanDerWaalsContact CA-O 3.23Å; F228-L272 WeakPolarHBondContact CA-O 3.41Å; F228-F273 HydrophobicContact CD1-CB 4.05Å; F228-F273 HydrophobicContact CD1-CD2 4.03Å; F228-F273 AromaticContact CD2-CD2 3.97Å; F228-F273 HydrophobicContact CD2-CD2 3.97Å; F228-F273 HydrophobicContact CD2-CE2 4.44Å; F228-F273 HydrophobicContact CE1-CB 3.75Å; F228-F273 AromaticContact CE1-CD2 3.7Å; F228-F273 HydrophobicContact CE1-CD2 3.7Å; F228-F273 HydrophobicContact CE1-CG 4.15Å; F228-F273 AromaticContact CE2-CD2 3.62Å; F228-F273 HydrophobicContact CE2-CD2 3.62Å; F228-F273 AromaticContact CE2-CE2 3.98Å; F228-F273 HydrophobicContact CE2-CE2 3.98Å; F228-F273 HydrophobicContact CG-CD2 4.16Å; F228-F273 HydrophobicContact CZ-CB 4.33Å; F228-F273 AromaticContact CZ-CD2 3.48Å; F228-F273 HydrophobicContact CZ-CD2 3.48Å; F228-F273 VanDerWaalsContact CZ-CD2 3.48Å; F228-F273 HydrophobicContact CZ-CE2 4.15Å; F228-F273 HydrophobicContact CZ-CG 4.25Å
229	V	86.9	Confident	84.6	Confident	9 Å²	9	45.8 Å²	45.8	6%	0.055	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	144.4	175.2	171.6	0	0	0	0	109.7	V223 L231 Q271 L272 I274 I301	V223-V229 HydrophobicContact CB-CG2 4.23Å; V223-V229 HydrophobicContact CG1-CG2 3.51Å; V223-V229 HydrophobicContact CG2-CG2 4.14Å; V229-L231 HydrophobicContact CG1-CD2 4.05Å; V229-L231 HydrophobicContact CG1-CG 4.43Å; V229-Q271 CarbonylContact O-C 3.57Å; V229-Q271 WeakPolarHBondContact O-CA 3.41Å; V229-L272 PolarHBondContact N-O 3.18Å; V229-L272 PolarHBondContact O-N 3.42Å; V229-I274 HydrophobicContact CB-CD1 4.34Å; V229-I274 HydrophobicContact CB-CG1 4.16Å; V229-I274 HydrophobicContact CG2-CD1 4.46Å; V229-I274 HydrophobicContact CG2-CG1 3.81Å; V229-I301 HydrophobicContact CB-CD1 4.32Å; V229-I301 HydrophobicContact CG1-CD1 3.97Å
230	T	91.8	Very high	84.5	Confident	69 Å²	69	43.4 Å²	43.4	42%	0.423	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	115.1	170.9	-54.9	0	0	0	0	110.1	R269 L270	T230-R269 HydrophobicContact CG2-CB 4.09Å; T230-L270 CarbonylContact C-O 3.53Å; T230-L270 WeakPolarHBondContact CA-O 3.34Å
231	L	91.9	Very high	84.4	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	137.6	172.3	-60.2	-179	0	0	0	110	P218 V229 W245 R269 L270 L272 Y280 A299 I301	P218-L231 HydrophobicContact CB-CB 4.21Å; P218-L231 HydrophobicContact CB-CD2 4.45Å; V229-L231 HydrophobicContact CG1-CD2 4.05Å; V229-L231 HydrophobicContact CG1-CG 4.43Å; L231-W245 HydrophobicContact CB-CH2 3.64Å; L231-W245 HydrophobicContact CB-CZ2 4.49Å; L231-W245 HydrophobicContact CB-CZ3 3.79Å; L231-W245 HydrophobicContact CD1-CZ3 4.02Å; L231-R269 CarbonylContact O-C 3.54Å; L231-R269 WeakPolarHBondContact O-CA 3.35Å; L231-L270 HydrophobicContact CB-CB 4.43Å; L231-L270 HydrophobicContact CD1-CD2 4.49Å; L231-L270 PolarHBondContact N-O 3.39Å; L231-L270 PolarHBondContact O-N 3.03Å; L231-L272 HydrophobicContact CD1-CD1 3.87Å; L231-L272 HydrophobicContact CG-CD1 4.25Å; L231-Y280 HydrophobicContact CD1-CD1 4.25Å; L231-Y280 HydrophobicContact CD1-CD2 4.2Å; L231-Y280 HydrophobicContact CD1-CG 3.69Å; L231-A299 HydrophobicContact CD2-CB 4.34Å; L231-I301 HydrophobicContact CD1-CD1 4.33Å; L231-I301 HydrophobicContact CD2-CD1 4.36Å
232	H	93.9	Very high	84.6	Confident	31 Å²	31	40.8 Å²	40.8	14%	0.144	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	124.6	-176.3	-171	178.8	0	0	0	110	R216 A217 P218 T234 D267	R216-H232 WeakPolarHBondContact CD-ND1 3.38Å; R216-H232 VanDerWaalsContact CZ-ND1 3.31Å; R216-H232 PolarHBondContact NH1-CE1 3.05Å; R216-H232 PolarHBondContact NH1-ND1 3.37Å; A217-H232 CarbonylContact C-O 3.59Å; P218-H232 VanDerWaalsContact CA-O 3.26Å; P218-H232 WeakPolarHBondContact CA-O 3.14Å; H232-T234 VanDerWaalsContact NE2-CG2 3.25Å; H232-T234 WeakPolarHBondContact NE2-CG2 3.27Å; H232-D267 IonicContact CD2-OD1 3.96Å; H232-D267 PolarHBondContact CD2-OD1 2.86Å; H232-D267 IonicContact CE1-OD1 3.86Å; H232-D267 VanDerWaalsContact NE2-CG 3.3Å; H232-D267 IonicContact NE2-OD1 3.54Å; H232-D267 PolarHBondContact NE2-OD1 2.78Å; H232-D267 IonicContact NE2-OD2 3.84Å; H232-D267 PolarHBondContact NE2-OD2 2.74Å
233	C	93.1	Very high	85	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	127.1	172.4	-176.7	0	0	0	0	110.1	R216 I243 W245 S268 C282	R216-C233 WeakPolarHBondContact O-CA 3.41Å; C233-I243 HydrophobicContact CB-CD1 4.42Å; C233-I243 WeakPolarHBondContact O-CD1 3.34Å; C233-W245 HydrophobicContact CB-CH2 3.57Å; C233-W245 HydrophobicContact CB-CZ2 3.45Å; C233-W245 VanDerWaalsContact CB-CZ2 3.45Å; C233-S268 PolarHBondContact N-O 3.1Å; C233-S268 PolarHBondContact O-N 2.89Å; C233-S268 VanDerWaalsContact O-O 3.13Å; C233-C282 HydrophobicContact CB-CB 3.45Å; C233-C282 VanDerWaalsContact CB-CB 3.45Å; C233-C282 WeakPolarHBondContact CB-SG 3.35Å; C233-C282 WeakPolarHBondContact SG-CB 3.44Å; C233-C282 CovalentContact SG-SG 2.05Å; C233-C282 PolarHBondContact SG-SG 3.18Å
234	T	93.7	Very high	85.5	Confident	20 Å²	20	38 Å²	38	12%	0.123	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	141	173.9	66.1	0	0	0	0	110.4	I214 L215 R216 H232 I266 D267	I214-T234 CarbonylContact C-O 3.54Å; I214-T234 WeakPolarHBondContact CA-O 3.22Å; L215-T234 PolarHBondContact N-O 2.84Å; R216-T234 HydrophobicContact CB-CG2 4.18Å; R216-T234 WeakPolarHBondContact CB-OG1 3.26Å; R216-T234 PolarHBondContact N-O 2.83Å; R216-T234 PolarHBondContact N-OG1 2.85Å; R216-T234 PolarHBondContact O-N 3.01Å; H232-T234 VanDerWaalsContact NE2-CG2 3.25Å; H232-T234 WeakPolarHBondContact NE2-CG2 3.27Å; T234-I266 CarbonylContact C-O 3.45Å; T234-I266 WeakPolarHBondContact CA-O 3.29Å; T234-D267 HydrophobicContact CG2-CB 4.12Å
235	A	89.6	Confident	86.4	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	155.8	-179.4	0	0	0	0	0	112.6	R213 I214 P241 I243 V265 I266 A284	R213-A235 CarbonylContact O-C 3.58Å; R213-A235 WeakPolarHBondContact O-CA 3.42Å; R213-A235 WeakPolarHBondContact O-CB 3.33Å; I214-A235 HydrophobicContact CG1-CB 4.45Å; A235-P241 HydrophobicContact CB-CG 3.91Å; A235-I243 HydrophobicContact CB-CD1 4.31Å; A235-V265 CarbonylContact O-C 3.37Å; A235-V265 VanDerWaalsContact O-CA 3.3Å; A235-V265 WeakPolarHBondContact O-CA 3.23Å; A235-V265 WeakPolarHBondContact O-CG1 3.37Å; A235-I266 HydrophobicContact CB-CG2 3.89Å; A235-I266 PolarHBondContact N-O 2.78Å; A235-I266 WeakPolarHBondContact O-CG2 3.27Å; A235-I266 PolarHBondContact O-N 3.08Å; A235-A284 HydrophobicContact CB-CB 3.37Å
236	T	89.2	Confident	87.1	Confident	15 Å²	15	32.3 Å²	32.3	9%	0.092	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	161.8	176.6	-166.9	0	0	0	0	110.6	A212 R213 L215 R264	A212-T236 CarbonylContact C-O 3.52Å; A212-T236 VanDerWaalsContact CA-O 3.26Å; A212-T236 WeakPolarHBondContact CA-O 3.32Å; R213-T236 HydrophobicContact CB-CG2 4.27Å; R213-T236 PolarHBondContact N-O 2.95Å; R213-T236 PolarHBondContact O-N 3.15Å; L215-T236 HydrophobicContact CD1-CG2 4.15Å; L215-T236 HydrophobicContact CD2-CG2 3.89Å; L215-T236 HydrophobicContact CG-CG2 4.09Å; T236-R264 PolarHBondContact OG1-O 3.4Å; T236-R264 VanDerWaalsContact OG1-O 3.05Å
237	G	82.6	Confident	88.1	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.1	164.2	178.7	0	0	0	0	0	111.8	P239 V240	G237-P239 VanDerWaalsContact C-C 3.43Å; G237-P239 CarbonylContact C-O 3.43Å; G237-P239 CarbonylContact O-C 3.44Å; G237-P239 VanDerWaalsContact O-C 3.26Å; G237-V240 PolarHBondContact O-N 2.86Å
238	I	83.9	Confident	88.5	Confident	29 Å²	29	34.4 Å²	34.4	15%	0.149	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	105.4	169.9	-56.4	177.8	0	0	0	107.5	K182 V208 E209 V210	K182-I238 HydrophobicContact CD-CD1 3.98Å; K182-I238 HydrophobicContact CG-CD1 3.94Å; V208-I238 WeakPolarHBondContact O-CG2 3.14Å; E209-I238 WeakPolarHBondContact CA-O 3.01Å; V210-I238 HydrophobicContact CB-CB 3.95Å; V210-I238 HydrophobicContact CB-CD1 4.37Å; V210-I238 HydrophobicContact CB-CG1 3.97Å; V210-I238 HydrophobicContact CG2-CB 3.97Å; V210-I238 HydrophobicContact CG2-CD1 3.57Å; V210-I238 HydrophobicContact CG2-CG1 3.72Å; V210-I238 PolarHBondContact N-O 3.29Å; V210-I238 PolarHBondContact O-N 2.87Å
239	P	83.4	Confident	88.3	Confident	38 Å²	38	30.7 Å²	30.7	25%	0.247	19%	0.19	C	C	.	.	S	Bend	cis	-69.8	165.2	0.3	-19.4	34.4	0	0	0	114.1	G237 N286 K287	G237-P239 VanDerWaalsContact C-C 3.43Å; G237-P239 CarbonylContact C-O 3.43Å; G237-P239 CarbonylContact O-C 3.44Å; G237-P239 VanDerWaalsContact O-C 3.26Å; P239-N286 WeakPolarHBondContact O-CB 3.48Å; P239-K287 HydrophobicContact CG-CD 3.51Å; P239-K287 HydrophobicContact CG-CG 3.74Å
240	V	87.4	Confident	88.1	Confident	53 Å²	53	35.8 Å²	35.8	32%	0.321	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-54.7	128.9	176.8	-173.8	0	0	0	0	109.4	G237 V261 R264 I266	G237-V240 PolarHBondContact O-N 2.86Å; V240-V261 HydrophobicContact CG1-CG1 3.86Å; V240-V261 HydrophobicContact CG1-CG2 4.41Å; V240-V261 HydrophobicContact CG2-CG1 4.46Å; V240-R264 HydrophobicContact CG2-CB 3.91Å; V240-R264 HydrophobicContact CG2-CG 4.23Å; V240-I266 HydrophobicContact CG1-CB 4.26Å
241	P	87.8	Confident	87.7	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.013	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-76.8	157.5	-178.9	30.4	-33	0	0	0	112	A212 A235 I266 A284 T285 N286	A212-P241 HydrophobicContact CB-CB 3.76Å; A212-P241 HydrophobicContact CB-CG 4.21Å; A235-P241 HydrophobicContact CB-CG 3.91Å; P241-I266 HydrophobicContact CG-CG2 3.85Å; P241-I266 VanDerWaalsContact O-CD1 3.28Å; P241-I266 WeakPolarHBondContact O-CD1 3.41Å; P241-I266 WeakPolarHBondContact O-CG2 3.26Å; P241-A284 HydrophobicContact CB-CB 4.25Å; P241-A284 HydrophobicContact CG-CB 4.47Å; P241-T285 CarbonylContact C-O 3.58Å; P241-T285 WeakPolarHBondContact CA-O 3.37Å; P241-T285 WeakPolarHBondContact CB-O 3.46Å; P241-N286 HydrophobicContact CB-CB 4.28Å
242	T	89.2	Confident	87.3	Confident	85 Å²	85	37.9 Å²	37.9	52%	0.521	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	143.3	167.2	56.6	0	0	0	0	109.7	A284 T285	T242-A284 CarbonylContact O-C 3.56Å; T242-A284 WeakPolarHBondContact O-CA 3.4Å; T242-T285 PolarHBondContact N-O 3.11Å; T242-T285 PolarHBondContact O-N 3.13Å; T242-T285 PolarHBondContact OG1-O 2.87Å; T242-T285 VanDerWaalsContact OG1-O 3.13Å
243	I	90.8	Very high	86.3	Confident	14 Å²	14	41.9 Å²	41.9	7%	0.072	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	132	177.1	-67.1	175.7	0	0	0	110.4	C233 A235 I266 S268 C282 I283 A284	C233-I243 HydrophobicContact CB-CD1 4.42Å; C233-I243 WeakPolarHBondContact O-CD1 3.34Å; A235-I243 HydrophobicContact CB-CD1 4.31Å; I243-I266 HydrophobicContact CD1-CG1 4.24Å; I243-I266 HydrophobicContact CD1-CG2 3.74Å; I243-I266 HydrophobicContact CG1-CD1 4.33Å; I243-I266 HydrophobicContact CG1-CG1 4.49Å; I243-I266 HydrophobicContact CG1-CG2 3.94Å; I243-S268 VanDerWaalsContact CD1-CB 3.47Å; I243-C282 HydrophobicContact CG2-CB 4.24Å; I243-I283 CarbonylContact C-O 3.59Å; I243-I283 WeakPolarHBondContact CA-O 3.45Å; I243-A284 HydrophobicContact CG1-CB 4.27Å
244	T	90.4	Very high	85.1	Confident	71 Å²	71	45.7 Å²	45.7	44%	0.436	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	134.7	172	-49.4	0	0	0	0	109.1	I283	T244-I283 PolarHBondContact N-O 3.05Å; T244-I283 PolarHBondContact O-N 3.26Å
245	W	92.2	Very high	84.4	Confident	8 Å²	8	47 Å²	47	3%	0.03	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	140.5	176.4	-67.7	91.7	0	0	0	111.6	P218 L231 C233 V252 S268 L270 T281 C282	P218-W245 HydrophobicContact CB-CH2 3.97Å; P218-W245 HydrophobicContact CB-CZ3 3.98Å; P218-W245 HydrophobicContact CG-CH2 4.31Å; P218-W245 HydrophobicContact CG-CZ3 4.07Å; L231-W245 HydrophobicContact CB-CH2 3.64Å; L231-W245 HydrophobicContact CB-CZ2 4.49Å; L231-W245 HydrophobicContact CB-CZ3 3.79Å; L231-W245 HydrophobicContact CD1-CZ3 4.02Å; C233-W245 HydrophobicContact CB-CH2 3.57Å; C233-W245 HydrophobicContact CB-CZ2 3.45Å; C233-W245 VanDerWaalsContact CB-CZ2 3.45Å; W245-V252 HydrophobicContact CB-CG2 3.74Å; W245-V252 PolarHBondContact O-N 2.82Å; W245-S268 PolarHBondContact NE1-OG 2.81Å; W245-L270 HydrophobicContact CB-CD2 3.84Å; W245-L270 HydrophobicContact CD2-CB 3.88Å; W245-L270 HydrophobicContact CD2-CD2 3.63Å; W245-L270 HydrophobicContact CD2-CG 4.37Å; W245-L270 HydrophobicContact CE3-CB 4.37Å; W245-L270 HydrophobicContact CE3-CD2 3.7Å; W245-L270 HydrophobicContact CG-CB 4.2Å; W245-L270 HydrophobicContact CG-CD2 3.72Å; W245-L270 HydrophobicContact CG-CG 4.44Å; W245-L270 HydrophobicContact CH2-CB 4.47Å; W245-L270 HydrophobicContact CZ2-CB 4.01Å; W245-L270 HydrophobicContact CZ3-CD2 4.42Å; W245-T281 CarbonylContact C-O 3.52Å; W245-T281 WeakPolarHBondContact CA-O 3.33Å; W245-C282 HydrophobicContact CD2-CB 4Å; W245-C282 HydrophobicContact CE3-CB 3.77Å; W245-C282 HydrophobicContact CH2-CB 3.8Å; W245-C282 HydrophobicContact CZ2-CB 4.01Å; W245-C282 HydrophobicContact CZ3-CB 3.67Å
246	I	88.8	Confident	84.2	Confident	38 Å²	38	49.6 Å²	49.6	20%	0.195	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	132.1	179.3	-61.6	-165.8	0	0	0	109.4	G249 N250 Y280 T281 I283	I246-G249 VanDerWaalsContact CG2-CA 3.46Å; I246-N250 CarbonylContact C-O 3.37Å; I246-N250 VanDerWaalsContact CA-O 3.23Å; I246-N250 WeakPolarHBondContact CA-O 3.27Å; I246-N250 WeakPolarHBondContact CG2-O 3.49Å; I246-Y280 CarbonylContact O-C 3.49Å; I246-Y280 VanDerWaalsContact O-CA 3.27Å; I246-Y280 WeakPolarHBondContact O-CA 3.37Å; I246-T281 PolarHBondContact N-O 3.37Å; I246-T281 PolarHBondContact O-N 3.43Å; I246-I283 HydrophobicContact CD1-CD1 3.34Å; I246-I283 HydrophobicContact CD1-CG1 4.37Å; I246-I283 HydrophobicContact CG1-CD1 3.98Å
247	E	87.8	Confident	84.3	Confident	19 Å²	19	53.2 Å²	53.2	9%	0.089	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	121.3	170.5	-178.6	-167.9	170	0	0	109.7	G249 N250 V252 K276 L279 Y280	E247-G249 PolarHBondContact O-N 3.27Å; E247-G249 VanDerWaalsContact O-N 3.1Å; E247-N250 PolarHBondContact N-O 2.81Å; E247-N250 PolarHBondContact O-N 3.03Å; E247-V252 HydrophobicContact CB-CG2 4.04Å; E247-K276 WeakPolarHBondContact OE1-CE 3.01Å; E247-K276 IonicContact OE1-NZ 2.99Å; E247-K276 PolarHBondContact OE1-NZ 3.34Å; E247-L279 CarbonylContact C-O 3.48Å; E247-L279 WeakPolarHBondContact CA-O 3.45Å; E247-Y280 HydrophobicContact CB-CD1 4.03Å; E247-Y280 HydrophobicContact CB-CE1 3.78Å; E247-Y280 HydrophobicContact CG-CD1 4.22Å; E247-Y280 HydrophobicContact CG-CE1 3.64Å
248	N	83.1	Confident	84.8	Confident	81 Å²	81	59.3 Å²	59.3	43%	0.433	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	38.6	176.6	-61.7	-37.8	0	0	0	113.6	N250 L279	N248-N250 VanDerWaalsContact C-N 3.34Å; N248-N250 PolarHBondContact O-N 3.18Å; N248-L279 PolarHBondContact N-O 2.92Å; N248-L279 PolarHBondContact OD1-N 3.39Å
249	G	76.3	Confident	85.3	Confident	62 Å²	62	62.8 Å²	62.8	64%	0.639	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.3	-8.4	-178.9	0	0	0	0	0	115.6	I246 E247	I246-G249 VanDerWaalsContact CG2-CA 3.46Å; E247-G249 PolarHBondContact O-N 3.27Å; E247-G249 VanDerWaalsContact O-N 3.1Å
250	N	82.6	Confident	85.7	Confident	116 Å²	116	64.1 Å²	64.1	62%	0.62	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	157.8	179.1	-63.8	-57.7	0	0	0	112.1	I246 E247 N248 V252	I246-N250 CarbonylContact C-O 3.37Å; I246-N250 VanDerWaalsContact CA-O 3.23Å; I246-N250 WeakPolarHBondContact CA-O 3.27Å; I246-N250 WeakPolarHBondContact CG2-O 3.49Å; E247-N250 PolarHBondContact N-O 2.81Å; E247-N250 PolarHBondContact O-N 3.03Å; N248-N250 VanDerWaalsContact C-N 3.34Å; N248-N250 PolarHBondContact O-N 3.18Å; N250-V252 PolarHBondContact O-N 2.89Å
251	A	83.6	Confident	86.1	Confident	81 Å²	81	65.9 Å²	65.9	67%	0.669	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.8	136.3	173	0	0	0	0	0	110.4	S253	A251-S253 PolarHBondContact O-N 2.87Å
252	V	84.8	Confident	86.2	Confident	33 Å²	33	73.2 Å²	73.2	20%	0.2	45%	0.446	C	S	.	.			trans	-58.7	120.7	178.4	176.9	0	0	0	0	109.2	W245 E247 N250 S254 L270 L272 Y280	W245-V252 HydrophobicContact CB-CG2 3.74Å; W245-V252 PolarHBondContact O-N 2.82Å; E247-V252 HydrophobicContact CB-CG2 4.04Å; N250-V252 PolarHBondContact O-N 2.89Å; V252-S254 WeakPolarHBondContact CG1-O 3.44Å; V252-L270 HydrophobicContact CG1-CD1 4.3Å; V252-L270 HydrophobicContact CG2-CD2 4.16Å; V252-L272 HydrophobicContact CG1-CD2 4.17Å; V252-Y280 HydrophobicContact CG2-CD1 4.38Å
253	S	72.4	Confident	86	Confident	114 Å²	114	75.6 Å²	75.6	80%	0.797	46%	0.455	S	S	*	.			trans	-94.5	-15.8	-176.6	58.6	0	0	0	0	113.8	A251	A251-S253 PolarHBondContact O-N 2.87Å
254	S	67.9	Low	85.7	Confident	80 Å²	80	81.7 Å²	81.7	56%	0.559	48%	0.478	S	S	*	.	S	Bend	trans	-141.2	135.1	-178.6	-176.3	0	0	0	0	110.9	V252 L272	V252-S254 WeakPolarHBondContact CG1-O 3.44Å; S254-L272 VanDerWaalsContact O-CD2 3.32Å; S254-L272 WeakPolarHBondContact O-CD2 3.39Å
255	G	79.7	Confident	85.7	Confident	48 Å²	48	80.5 Å²	80.5	50%	0.495	47%	0.47	S	S	.	.			trans	137.6	166.9	-178.2	0	0	0	0	0	112.8	Q271	G255-Q271 CarbonylContact C-O 3.58Å; G255-Q271 WeakPolarHBondContact CA-O 3.32Å
256	S	85.4	Confident	85.7	Confident	54 Å²	54	80.4 Å²	80.4	38%	0.378	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	132.8	173.6	72.2	0	0	0	0	110.9	Q271	S256-Q271 PolarHBondContact N-O 3.17Å; S256-Q271 PolarHBondContact O-N 3.47Å
257	I	91.3	Very high	86	Confident	91 Å²	91	79.9 Å²	79.9	47%	0.467	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	127	-179.6	-60.5	169.8	0	0	0	108.4	E259 R269 L270	I257-E259 HydrophobicContact CG2-CG 3.8Å; I257-R269 CarbonylContact C-O 3.56Å; I257-R269 WeakPolarHBondContact CA-O 3.45Å; I257-L270 HydrophobicContact CD1-CD1 4.39Å; I257-L270 HydrophobicContact CG1-CD1 3.67Å
258	Q	92.4	Very high	86.4	Confident	129 Å²	129	79 Å²	79	60%	0.603	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.1	127.7	171.2	-64.6	-175.9	-3	0	0	109.6	S268 R269	Q258-S268 WeakPolarHBondContact O-CA 3.45Å; Q258-R269 PolarHBondContact N-O 3.06Å; Q258-R269 PolarHBondContact O-N 2.79Å
259	E	93.9	Very high	87	Confident	102 Å²	102	80.5 Å²	80.5	48%	0.477	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	144	-178.8	-55.9	-164	135.8	0	0	112	I257 D267 S268	I257-E259 HydrophobicContact CG2-CG 3.8Å; E259-D267 CarbonylContact C-O 3.54Å; E259-D267 VanDerWaalsContact CA-O 3.25Å; E259-D267 WeakPolarHBondContact CA-O 3.29Å; E259-S268 PolarHBondContact OE1-OG 3.28Å
260	S	92.8	Very high	87.7	Confident	65 Å²	65	77.6 Å²	77.6	46%	0.455	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	148.4	170.7	68.3	0	0	0	0	110.8	I266 D267	S260-I266 WeakPolarHBondContact O-CA 3.24Å; S260-D267 PolarHBondContact N-O 3.31Å; S260-D267 PolarHBondContact O-N 2.85Å
261	V	94.6	Very high	88.1	Confident	90 Å²	90	75.9 Å²	75.9	55%	0.545	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.1	178.7	179	0	0	0	0	109.2	V240 V265 I266	V240-V261 HydrophobicContact CG1-CG1 3.86Å; V240-V261 HydrophobicContact CG1-CG2 4.41Å; V240-V261 HydrophobicContact CG2-CG1 4.46Å; V261-V265 WeakPolarHBondContact CA-O 3.29Å; V261-I266 HydrophobicContact CG2-CB 4.26Å; V261-I266 HydrophobicContact CG2-CD1 4.4Å; V261-I266 HydrophobicContact CG2-CG1 4.13Å
262	K	90.1	Very high	88.2	Confident	156 Å²	156	72.2 Å²	72.2	68%	0.678	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.5	134.6	174.9	-167.9	-177.8	176.1	-177	0	109.7	R264 V265	K262-R264 PolarHBondContact O-N 3.17Å; K262-R264 VanDerWaalsContact O-N 3.11Å; K262-V265 PolarHBondContact N-O 3.49Å; K262-V265 WeakPolarHBondContact O-CA 3.42Å; K262-V265 WeakPolarHBondContact O-CB 3.47Å; K262-V265 PolarHBondContact O-N 3.45Å; K262-V265 VanDerWaalsContact O-O 3.12Å
263	D	86.4	Confident	88	Confident	136 Å²	136	74.9 Å²	74.9	73%	0.727	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	39.6	175.6	-57.6	-40.4	0	0	0	114.7	V265	D263-V265 PolarHBondContact O-N 2.05Å
264	R	83.6	Confident	88.3	Confident	142 Å²	142	69.5 Å²	69.5	54%	0.536	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	20.6	-176.7	-49.9	178.8	179.2	173.4	0.5	114.7	T236 V240 K262	T236-R264 PolarHBondContact OG1-O 3.4Å; T236-R264 VanDerWaalsContact OG1-O 3.05Å; V240-R264 HydrophobicContact CG2-CB 3.91Å; V240-R264 HydrophobicContact CG2-CG 4.23Å; K262-R264 PolarHBondContact O-N 3.17Å; K262-R264 VanDerWaalsContact O-N 3.11Å
265	V	89.3	Confident	88.5	Confident	45 Å²	45	69.2 Å²	69.2	27%	0.273	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	129	169.1	-177.9	0	0	0	0	107.9	L215 A235 V261 K262 D263	L215-V265 HydrophobicContact CD1-CG1 3.99Å; L215-V265 HydrophobicContact CD1-CG2 4.08Å; A235-V265 CarbonylContact O-C 3.37Å; A235-V265 VanDerWaalsContact O-CA 3.3Å; A235-V265 WeakPolarHBondContact O-CA 3.23Å; A235-V265 WeakPolarHBondContact O-CG1 3.37Å; V261-V265 WeakPolarHBondContact CA-O 3.29Å; K262-V265 PolarHBondContact N-O 3.49Å; K262-V265 WeakPolarHBondContact O-CA 3.42Å; K262-V265 WeakPolarHBondContact O-CB 3.47Å; K262-V265 PolarHBondContact O-N 3.45Å; K262-V265 VanDerWaalsContact O-O 3.12Å; D263-V265 PolarHBondContact O-N 2.05Å
266	I	93.3	Very high	88.2	Confident	6 Å²	6	72 Å²	72	3%	0.031	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	133.4	169.1	-174.7	165.1	0	0	0	108.9	T234 A235 V240 P241 I243 S260 V261	T234-I266 CarbonylContact C-O 3.45Å; T234-I266 WeakPolarHBondContact CA-O 3.29Å; A235-I266 HydrophobicContact CB-CG2 3.89Å; A235-I266 PolarHBondContact N-O 2.78Å; A235-I266 WeakPolarHBondContact O-CG2 3.27Å; A235-I266 PolarHBondContact O-N 3.08Å; V240-I266 HydrophobicContact CG1-CB 4.26Å; P241-I266 HydrophobicContact CG-CG2 3.85Å; P241-I266 VanDerWaalsContact O-CD1 3.28Å; P241-I266 WeakPolarHBondContact O-CD1 3.41Å; P241-I266 WeakPolarHBondContact O-CG2 3.26Å; I243-I266 HydrophobicContact CD1-CG1 4.24Å; I243-I266 HydrophobicContact CD1-CG2 3.74Å; I243-I266 HydrophobicContact CG1-CD1 4.33Å; I243-I266 HydrophobicContact CG1-CG1 4.49Å; I243-I266 HydrophobicContact CG1-CG2 3.94Å; S260-I266 WeakPolarHBondContact O-CA 3.24Å; V261-I266 HydrophobicContact CG2-CB 4.26Å; V261-I266 HydrophobicContact CG2-CD1 4.4Å; V261-I266 HydrophobicContact CG2-CG1 4.13Å
267	D	95.2	Very high	87.8	Confident	27 Å²	27	73.1 Å²	73.1	14%	0.144	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.5	170.9	177.8	13.8	0	0	0	108.2	H232 T234 E259 S260 R269	H232-D267 IonicContact CD2-OD1 3.96Å; H232-D267 PolarHBondContact CD2-OD1 2.86Å; H232-D267 IonicContact CE1-OD1 3.86Å; H232-D267 VanDerWaalsContact NE2-CG 3.3Å; H232-D267 IonicContact NE2-OD1 3.54Å; H232-D267 PolarHBondContact NE2-OD1 2.78Å; H232-D267 IonicContact NE2-OD2 3.84Å; H232-D267 PolarHBondContact NE2-OD2 2.74Å; T234-D267 HydrophobicContact CG2-CB 4.12Å; E259-D267 CarbonylContact C-O 3.54Å; E259-D267 VanDerWaalsContact CA-O 3.25Å; E259-D267 WeakPolarHBondContact CA-O 3.29Å; S260-D267 PolarHBondContact N-O 3.31Å; S260-D267 PolarHBondContact O-N 2.85Å; D267-R269 IonicContact OD1-NE 3.63Å; D267-R269 IonicContact OD2-CZ 3.35Å; D267-R269 IonicContact OD2-NE 3.67Å; D267-R269 PolarHBondContact OD2-NE 3.31Å; D267-R269 IonicContact OD2-NH2 3.57Å; D267-R269 PolarHBondContact OD2-NH2 3.1Å; D267-R269 VanDerWaalsContact OD2-NH2 3.13Å
268	S	95.5	Very high	87.5	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.9	177.2	-172.9	0	0	0	0	110.3	C233 I243 W245 Q258 E259	C233-S268 PolarHBondContact N-O 3.1Å; C233-S268 PolarHBondContact O-N 2.89Å; C233-S268 VanDerWaalsContact O-O 3.13Å; I243-S268 VanDerWaalsContact CD1-CB 3.47Å; W245-S268 PolarHBondContact NE1-OG 2.81Å; Q258-S268 WeakPolarHBondContact O-CA 3.45Å; E259-S268 PolarHBondContact OE1-OG 3.28Å
269	R	95.1	Very high	87.1	Confident	114 Å²	114	66.5 Å²	66.5	43%	0.43	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	119.8	-179.9	-59.2	-178.1	-171.7	-156.2	1.6	109.7	T230 L231 I257 Q258 D267	T230-R269 HydrophobicContact CG2-CB 4.09Å; L231-R269 CarbonylContact O-C 3.54Å; L231-R269 WeakPolarHBondContact O-CA 3.35Å; I257-R269 CarbonylContact C-O 3.56Å; I257-R269 WeakPolarHBondContact CA-O 3.45Å; Q258-R269 PolarHBondContact N-O 3.06Å; Q258-R269 PolarHBondContact O-N 2.79Å; D267-R269 IonicContact OD1-NE 3.63Å; D267-R269 IonicContact OD2-CZ 3.35Å; D267-R269 IonicContact OD2-NE 3.67Å; D267-R269 PolarHBondContact OD2-NE 3.31Å; D267-R269 IonicContact OD2-NH2 3.57Å; D267-R269 PolarHBondContact OD2-NH2 3.1Å; D267-R269 VanDerWaalsContact OD2-NH2 3.13Å
270	L	92.4	Very high	86.9	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	110.4	178.8	171.9	64.6	0	0	0	109.5	T230 L231 W245 V252 I257 L272 Y280	T230-L270 CarbonylContact C-O 3.53Å; T230-L270 WeakPolarHBondContact CA-O 3.34Å; L231-L270 HydrophobicContact CB-CB 4.43Å; L231-L270 HydrophobicContact CD1-CD2 4.49Å; L231-L270 PolarHBondContact N-O 3.39Å; L231-L270 PolarHBondContact O-N 3.03Å; W245-L270 HydrophobicContact CB-CD2 3.84Å; W245-L270 HydrophobicContact CD2-CB 3.88Å; W245-L270 HydrophobicContact CD2-CD2 3.63Å; W245-L270 HydrophobicContact CD2-CG 4.37Å; W245-L270 HydrophobicContact CE3-CB 4.37Å; W245-L270 HydrophobicContact CE3-CD2 3.7Å; W245-L270 HydrophobicContact CG-CB 4.2Å; W245-L270 HydrophobicContact CG-CD2 3.72Å; W245-L270 HydrophobicContact CG-CG 4.44Å; W245-L270 HydrophobicContact CH2-CB 4.47Å; W245-L270 HydrophobicContact CZ2-CB 4.01Å; W245-L270 HydrophobicContact CZ3-CD2 4.42Å; V252-L270 HydrophobicContact CG1-CD1 4.3Å; V252-L270 HydrophobicContact CG2-CD2 4.16Å; I257-L270 HydrophobicContact CD1-CD1 4.39Å; I257-L270 HydrophobicContact CG1-CD1 3.67Å; L270-L272 HydrophobicContact CD1-CD2 3.95Å; L270-L272 HydrophobicContact CD1-CG 4.31Å; L270-L272 HydrophobicContact CD2-CD1 3.94Å; L270-L272 HydrophobicContact CD2-CD2 4.03Å; L270-L272 HydrophobicContact CD2-CG 4.11Å; L270-L272 HydrophobicContact CG-CD1 4.11Å; L270-L272 HydrophobicContact CG-CD2 3.93Å; L270-L272 HydrophobicContact CG-CG 3.83Å; L270-Y280 HydrophobicContact CD2-CD1 4.27Å
271	Q	91.3	Very high	86.7	Confident	81 Å²	81	60.1 Å²	60.1	38%	0.379	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	125.8	174.4	-168.4	177.6	29.9	0	0	110.5	V229 G255 S256	V229-Q271 CarbonylContact O-C 3.57Å; V229-Q271 WeakPolarHBondContact O-CA 3.41Å; G255-Q271 CarbonylContact C-O 3.58Å; G255-Q271 WeakPolarHBondContact CA-O 3.32Å; S256-Q271 PolarHBondContact N-O 3.17Å; S256-Q271 PolarHBondContact O-N 3.47Å
272	L	85.8	Confident	86.5	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.021	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	145.3	-171.8	-64.5	164.1	0	0	0	110.9	F228 V229 L231 V252 S254 L270 I274 Y280 I301	F228-L272 CarbonylContact C-O 3.57Å; F228-L272 VanDerWaalsContact CA-O 3.23Å; F228-L272 WeakPolarHBondContact CA-O 3.41Å; V229-L272 PolarHBondContact N-O 3.18Å; V229-L272 PolarHBondContact O-N 3.42Å; L231-L272 HydrophobicContact CD1-CD1 3.87Å; L231-L272 HydrophobicContact CG-CD1 4.25Å; V252-L272 HydrophobicContact CG1-CD2 4.17Å; S254-L272 VanDerWaalsContact O-CD2 3.32Å; S254-L272 WeakPolarHBondContact O-CD2 3.39Å; L270-L272 HydrophobicContact CD1-CD2 3.95Å; L270-L272 HydrophobicContact CD1-CG 4.31Å; L270-L272 HydrophobicContact CD2-CD1 3.94Å; L270-L272 HydrophobicContact CD2-CD2 4.03Å; L270-L272 HydrophobicContact CD2-CG 4.11Å; L270-L272 HydrophobicContact CG-CD1 4.11Å; L270-L272 HydrophobicContact CG-CD2 3.93Å; L270-L272 HydrophobicContact CG-CG 3.83Å; L272-I274 HydrophobicContact CB-CD1 3.69Å; L272-I274 HydrophobicContact CD1-CD1 4.48Å; L272-Y280 HydrophobicContact CD1-CD1 3.66Å; L272-Y280 HydrophobicContact CD1-CD2 4.37Å; L272-Y280 HydrophobicContact CD1-CE1 3.36Å; L272-Y280 HydrophobicContact CD1-CE2 4.14Å; L272-Y280 HydrophobicContact CD1-CG 4.14Å; L272-Y280 HydrophobicContact CD2-CE1 3.88Å; L272-Y280 HydrophobicContact CG-CE1 4.26Å; L272-I301 HydrophobicContact CD1-CD1 3.97Å
273	F	80.3	Confident	86.3	Confident	88 Å²	88	49.1 Å²	49.1	39%	0.386	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	117.9	167.3	-175.1	-105.7	0	0	0	109.3	G226 F228 T275	G226-F273 WeakPolarHBondContact O-CE2 3.2Å; F228-F273 HydrophobicContact CD1-CB 4.05Å; F228-F273 HydrophobicContact CD1-CD2 4.03Å; F228-F273 AromaticContact CD2-CD2 3.97Å; F228-F273 HydrophobicContact CD2-CD2 3.97Å; F228-F273 HydrophobicContact CD2-CE2 4.44Å; F228-F273 HydrophobicContact CE1-CB 3.75Å; F228-F273 AromaticContact CE1-CD2 3.7Å; F228-F273 HydrophobicContact CE1-CD2 3.7Å; F228-F273 HydrophobicContact CE1-CG 4.15Å; F228-F273 AromaticContact CE2-CD2 3.62Å; F228-F273 HydrophobicContact CE2-CD2 3.62Å; F228-F273 AromaticContact CE2-CE2 3.98Å; F228-F273 HydrophobicContact CE2-CE2 3.98Å; F228-F273 HydrophobicContact CG-CD2 4.16Å; F228-F273 HydrophobicContact CZ-CB 4.33Å; F228-F273 AromaticContact CZ-CD2 3.48Å; F228-F273 HydrophobicContact CZ-CD2 3.48Å; F228-F273 VanDerWaalsContact CZ-CD2 3.48Å; F228-F273 HydrophobicContact CZ-CE2 4.15Å; F228-F273 HydrophobicContact CZ-CG 4.25Å; F273-T275 HydrophobicContact CD1-CG2 3.76Å; F273-T275 HydrophobicContact CE1-CG2 3.75Å; F273-T275 PolarHBondContact O-N 2.96Å
274	I	79.1	Confident	86.3	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	108.1	-165.6	-53.4	-53.7	0	0	0	111.4	V223 G226 S227 V229 L272 I301 I303	V223-I274 HydrophobicContact CG2-CB 4.03Å; V223-I274 HydrophobicContact CG2-CG1 4.01Å; V223-I274 HydrophobicContact CG2-CG2 3.78Å; G226-I274 PolarHBondContact N-O 3.23Å; S227-I274 PolarHBondContact O-N 3.36Å; V229-I274 HydrophobicContact CB-CD1 4.34Å; V229-I274 HydrophobicContact CB-CG1 4.16Å; V229-I274 HydrophobicContact CG2-CD1 4.46Å; V229-I274 HydrophobicContact CG2-CG1 3.81Å; L272-I274 HydrophobicContact CB-CD1 3.69Å; L272-I274 HydrophobicContact CD1-CD1 4.48Å; I274-I301 HydrophobicContact CD1-CD1 3.57Å; I274-I301 HydrophobicContact CD1-CG2 4.03Å; I274-I301 HydrophobicContact CG1-CD1 4.44Å; I274-I301 HydrophobicContact CG1-CG2 4.07Å; I274-I301 HydrophobicContact CG2-CG2 3.8Å; I274-I303 HydrophobicContact CG2-CD1 4.5Å; I274-I303 HydrophobicContact CG2-CG1 4.33Å
275	T	71.7	Confident	86.2	Confident	75 Å²	75	37.2 Å²	37.2	46%	0.46	19%	0.19	S	C	.	.	S	Bend	trans	-110.2	-14.1	174.6	56.2	0	0	0	0	113.2	F225 F273	F225-T275 WeakPolarHBondContact CE2-O 3.45Å; F273-T275 HydrophobicContact CD1-CG2 3.76Å; F273-T275 HydrophobicContact CE1-CG2 3.75Å; F273-T275 PolarHBondContact O-N 2.96Å
276	K	72.2	Confident	85.7	Confident	106 Å²	106	35.4 Å²	35.4	46%	0.461	18%	0.178	S	C	.	.	S	Bend	trans	-151.7	155	-179.7	60.9	-177.9	-179	176.2	0	110.4	E247	E247-K276 WeakPolarHBondContact OE1-CE 3.01Å; E247-K276 IonicContact OE1-NZ 2.99Å; E247-K276 PolarHBondContact OE1-NZ 3.34Å
277	P	78.4	Confident	84.3	Confident	78 Å²	78	41.8 Å²	41.8	51%	0.506	21%	0.206	S	C	.	.			trans	-65.3	153	169	29.4	-34.9	0	0	0	110.8	I301	P277-I301 WeakPolarHBondContact CA-O 3.4Å; P277-I301 WeakPolarHBondContact CB-O 3.46Å
278	G	83.4	Confident	82.2	Confident	6 Å²	6	44.4 Å²	44.4	6%	0.062	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	155.2	-179.8	0	0	0	0	0	113.9	I301	G278-I301 PolarHBondContact N-O 2.71Å; G278-I301 VanDerWaalsContact N-O 3.07Å; G278-I301 PolarHBondContact O-N 2.96Å
279	L	85.9	Confident	79.4	Confident	75 Å²	75	47 Å²	47	39%	0.393	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	117.1	173	-177.7	68.3	0	0	0	109.5	E247 N248 A298	E247-L279 CarbonylContact C-O 3.48Å; E247-L279 WeakPolarHBondContact CA-O 3.45Å; N248-L279 PolarHBondContact N-O 2.92Å; N248-L279 PolarHBondContact OD1-N 3.39Å; L279-A298 HydrophobicContact CD1-CB 3.8Å; L279-A298 HydrophobicContact CG-CB 4.34Å
280	Y	88.9	Confident	76.7	Confident	9 Å²	9	50.2 Å²	50.2	4%	0.035	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	122.4	-179.7	-66.7	-92.7	0	0	0	110.3	L231 I246 E247 V252 L270 L272 A298 A299 I301	L231-Y280 HydrophobicContact CD1-CD1 4.25Å; L231-Y280 HydrophobicContact CD1-CD2 4.2Å; L231-Y280 HydrophobicContact CD1-CG 3.69Å; I246-Y280 CarbonylContact O-C 3.49Å; I246-Y280 VanDerWaalsContact O-CA 3.27Å; I246-Y280 WeakPolarHBondContact O-CA 3.37Å; E247-Y280 HydrophobicContact CB-CD1 4.03Å; E247-Y280 HydrophobicContact CB-CE1 3.78Å; E247-Y280 HydrophobicContact CG-CD1 4.22Å; E247-Y280 HydrophobicContact CG-CE1 3.64Å; V252-Y280 HydrophobicContact CG2-CD1 4.38Å; L270-Y280 HydrophobicContact CD2-CD1 4.27Å; L272-Y280 HydrophobicContact CD1-CD1 3.66Å; L272-Y280 HydrophobicContact CD1-CD2 4.37Å; L272-Y280 HydrophobicContact CD1-CE1 3.36Å; L272-Y280 HydrophobicContact CD1-CE2 4.14Å; L272-Y280 HydrophobicContact CD1-CG 4.14Å; L272-Y280 HydrophobicContact CD2-CE1 3.88Å; L272-Y280 HydrophobicContact CG-CE1 4.26Å; Y280-A298 CarbonylContact O-C 3.59Å; Y280-A298 VanDerWaalsContact O-CA 3.22Å; Y280-A298 WeakPolarHBondContact O-CA 3.38Å; Y280-A299 PolarHBondContact N-O 3.49Å; Y280-A299 PolarHBondContact O-N 3.11Å; Y280-I301 HydrophobicContact CD2-CB 4.46Å; Y280-I301 HydrophobicContact CD2-CD1 3.79Å; Y280-I301 HydrophobicContact CD2-CG1 3.89Å; Y280-I301 HydrophobicContact CE2-CB 4.19Å; Y280-I301 HydrophobicContact CE2-CD1 3.62Å; Y280-I301 HydrophobicContact CE2-CG1 3.96Å
281	T	87.7	Confident	74.1	Confident	24 Å²	24	58 Å²	58	15%	0.147	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	125.1	-179.3	-53.2	0	0	0	0	110.1	W245 I246 I283 K296 A297	W245-T281 CarbonylContact C-O 3.52Å; W245-T281 WeakPolarHBondContact CA-O 3.33Å; I246-T281 PolarHBondContact N-O 3.37Å; I246-T281 PolarHBondContact O-N 3.43Å; T281-I283 HydrophobicContact CG2-CG1 4.1Å; T281-K296 HydrophobicContact CG2-CB 4.07Å; T281-A297 CarbonylContact C-O 3.56Å; T281-A297 VanDerWaalsContact CA-O 3.29Å; T281-A297 WeakPolarHBondContact CA-O 3.37Å
282	C	91.1	Very high	71.7	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	137.5	164.5	77.8	0	0	0	0	110.2	C233 I243 W245 K296 A297	C233-C282 HydrophobicContact CB-CB 3.45Å; C233-C282 VanDerWaalsContact CB-CB 3.45Å; C233-C282 WeakPolarHBondContact CB-SG 3.35Å; C233-C282 WeakPolarHBondContact SG-CB 3.44Å; C233-C282 CovalentContact SG-SG 2.05Å; C233-C282 PolarHBondContact SG-SG 3.18Å; I243-C282 HydrophobicContact CG2-CB 4.24Å; W245-C282 HydrophobicContact CD2-CB 4Å; W245-C282 HydrophobicContact CE3-CB 3.77Å; W245-C282 HydrophobicContact CH2-CB 3.8Å; W245-C282 HydrophobicContact CZ2-CB 4.01Å; W245-C282 HydrophobicContact CZ3-CB 3.67Å; C282-K296 VanDerWaalsContact O-CA 3.31Å; C282-K296 WeakPolarHBondContact O-CA 3.33Å; C282-A297 PolarHBondContact N-O 3.38Å; C282-A297 PolarHBondContact O-N 2.92Å; C282-A297 VanDerWaalsContact O-N 3.08Å
283	I	86.7	Confident	69.9	Low	15 Å²	15	59 Å²	59	8%	0.077	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	112.9	179.7	-53.9	-171.3	0	0	0	108.3	I243 T244 I246 T281 T294 A295 K296	I243-I283 CarbonylContact C-O 3.59Å; I243-I283 WeakPolarHBondContact CA-O 3.45Å; T244-I283 PolarHBondContact N-O 3.05Å; T244-I283 PolarHBondContact O-N 3.26Å; I246-I283 HydrophobicContact CD1-CD1 3.34Å; I246-I283 HydrophobicContact CD1-CG1 4.37Å; I246-I283 HydrophobicContact CG1-CD1 3.98Å; T281-I283 HydrophobicContact CG2-CG1 4.1Å; I283-T294 HydrophobicContact CG2-CG2 3.83Å; I283-A295 CarbonylContact C-O 3.44Å; I283-A295 WeakPolarHBondContact CA-O 3.46Å; I283-K296 HydrophobicContact CD1-CD 4.11Å; I283-K296 HydrophobicContact CD1-CG 4.38Å; I283-K296 HydrophobicContact CG1-CD 4.27Å; I283-K296 HydrophobicContact CG1-CG 4.03Å; I283-K296 HydrophobicContact CG2-CG 4.33Å
284	A	86.4	Confident	68.6	Low	0 Å²	0	57 Å²	57	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	119.5	175.3	0	0	0	0	0	110.1	A212 I214 A235 P241 T242 I243 T294 A295	A212-A284 HydrophobicContact CB-CB 4.28Å; A212-A284 WeakPolarHBondContact CB-O 3.38Å; I214-A284 HydrophobicContact CG1-CB 4.23Å; A235-A284 HydrophobicContact CB-CB 3.37Å; P241-A284 HydrophobicContact CB-CB 4.25Å; P241-A284 HydrophobicContact CG-CB 4.47Å; T242-A284 CarbonylContact O-C 3.56Å; T242-A284 WeakPolarHBondContact O-CA 3.4Å; I243-A284 HydrophobicContact CG1-CB 4.27Å; A284-T294 VanDerWaalsContact O-CA 3.25Å; A284-T294 WeakPolarHBondContact O-CA 3.4Å; A284-A295 PolarHBondContact N-O 3.11Å; A284-A295 PolarHBondContact O-N 2.91Å; A284-A295 VanDerWaalsContact O-N 3.11Å
285	T	80.9	Confident	67.5	Low	28 Å²	28	57.9 Å²	57.9	17%	0.172	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	128.9	-173.9	-48.6	0	0	0	0	111.3	P241 T242 S293 T294	P241-T285 CarbonylContact C-O 3.58Å; P241-T285 WeakPolarHBondContact CA-O 3.37Å; P241-T285 WeakPolarHBondContact CB-O 3.46Å; T242-T285 PolarHBondContact N-O 3.11Å; T242-T285 PolarHBondContact O-N 3.13Å; T242-T285 PolarHBondContact OG1-O 2.87Å; T242-T285 VanDerWaalsContact OG1-O 3.13Å; T285-S293 VanDerWaalsContact CA-O 3.29Å; T285-S293 WeakPolarHBondContact CA-O 3.44Å; T285-T294 HydrophobicContact CG2-CG2 4.03Å
286	N	78.6	Confident	67.9	Low	6 Å²	6	61.1 Å²	61.1	3%	0.032	31%	0.311	C	S	.	.			trans	-103.7	171.1	167.9	77.7	18.4	0	0	0	111.1	V210 P239 P241 H288 S293	V210-N286 PolarHBondContact O-ND2 3.26Å; V210-N286 VanDerWaalsContact O-ND2 3.11Å; P239-N286 WeakPolarHBondContact O-CB 3.48Å; P241-N286 HydrophobicContact CB-CB 4.28Å; N286-H288 PolarHBondContact O-N 2.82Å; N286-H288 PolarHBondContact OD1-N 2.91Å; N286-S293 PolarHBondContact N-O 2.79Å; N286-S293 PolarHBondContact O-OG 2.73Å; N286-S293 WeakPolarHBondContact OD1-CB 3.31Å
287	K	64.6	Low	67.6	Low	140 Å²	140	57 Å²	57	61%	0.609	30%	0.296	S	S	*	.	S	Bend	trans	-54.9	1.6	-172.1	73.1	175.4	176.9	-161.5	0	117.1	E209 P239	E209-K287 IonicContact OE1-NZ 3.47Å; P239-K287 HydrophobicContact CG-CD 3.51Å; P239-K287 HydrophobicContact CG-CG 3.74Å
288	H	51.3	Low	67.7	Low	83 Å²	83	55.8 Å²	55.8	38%	0.384	29%	0.293	S	S	.	.	S	Bend	trans	-98.4	57.6	173.4	-67.3	-62.3	0	0	0	111	E209 N286 S293	E209-H288 IonicContact OE1-NE2 3.02Å; E209-H288 IonicContact OE2-CD2 3.54Å; E209-H288 IonicContact OE2-CE1 2.7Å; E209-H288 IonicContact OE2-NE2 2.59Å; E209-H288 PolarHBondContact OE2-NE2 2.96Å; N286-H288 PolarHBondContact O-N 2.82Å; N286-H288 PolarHBondContact OD1-N 2.91Å; H288-S293 VanDerWaalsContact C-OG 3.26Å; H288-S293 VanDerWaalsContact O-CB 3.29Å; H288-S293 WeakPolarHBondContact O-CB 3.41Å; H288-S293 PolarHBondContact O-OG 3.33Å
289	G	35.2	Very low	67.3	Low	54 Å²	54	55.5 Å²	55.5	56%	0.557	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	156.9	-163.2	0	0	0	0	0	119.3	K291	G289-K291 PolarHBondContact O-N 3.47Å
290	E	37.9	Very low	67.3	Low	181 Å²	181	55.3 Å²	55.3	85%	0.846	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	-19.4	157.9	-69.6	-169.5	163.1	0	0	122.8
291	K	38.4	Very low	67	Low	165 Å²	165	54.9 Å²	54.9	72%	0.717	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.7	-28.9	170.2	-80.9	-171	177.2	-178.2	0	117.3	G289	G289-K291 PolarHBondContact O-N 3.47Å
292	F	42.2	Very low	66.6	Low	103 Å²	103	55.6 Å²	55.6	45%	0.452	30%	0.296	S	S	.	.	S	Bend	trans	-132.5	8.3	-167.4	-54.9	-64.2	0	0	0	114.7	F211 A799	F211-F292 WeakPolarHBondContact CD1-O 3.26Å; F292-A799 HydrophobicContact CD1-CB 3.36Å; F292-A799 HydrophobicContact CE1-CB 3.11Å; F292-A799 HydrophobicContact CG-CB 4.27Å; F292-A799 HydrophobicContact CZ-CB 3.83Å
293	S	48	Very low	65.8	Low	2 Å²	2	57.6 Å²	57.6	1%	0.014	31%	0.307	C	S	.	.	S	Bend	trans	-118.3	15	175.3	57.9	0	0	0	0	112.7	A212 T285 N286 H288	A212-S293 WeakPolarHBondContact CB-O 3.12Å; T285-S293 VanDerWaalsContact CA-O 3.29Å; T285-S293 WeakPolarHBondContact CA-O 3.44Å; N286-S293 PolarHBondContact N-O 2.79Å; N286-S293 PolarHBondContact O-OG 2.73Å; N286-S293 WeakPolarHBondContact OD1-CB 3.31Å; H288-S293 VanDerWaalsContact C-OG 3.26Å; H288-S293 VanDerWaalsContact O-CB 3.29Å; H288-S293 WeakPolarHBondContact O-CB 3.41Å; H288-S293 PolarHBondContact O-OG 3.33Å
294	T	52.2	Low	64.3	Low	45 Å²	45	59.7 Å²	59.7	28%	0.276	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	101.9	-173.1	47.2	0	0	0	0	111.3	I283 A284 T285	I283-T294 HydrophobicContact CG2-CG2 3.83Å; A284-T294 VanDerWaalsContact O-CA 3.25Å; A284-T294 WeakPolarHBondContact O-CA 3.4Å; T285-T294 HydrophobicContact CG2-CG2 4.03Å
295	A	56	Low	62.6	Low	20 Å²	20	67 Å²	67	17%	0.165	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	131.9	164.4	0	0	0	0	0	108.5	I214 I283 A284	I214-A295 HydrophobicContact CB-CB 4.29Å; I214-A295 VanDerWaalsContact CD1-C 3.47Å; I214-A295 HydrophobicContact CD1-CB 3.85Å; I214-A295 WeakPolarHBondContact CD1-O 3.35Å; I214-A295 HydrophobicContact CG1-CB 3.66Å; I283-A295 CarbonylContact C-O 3.44Å; I283-A295 WeakPolarHBondContact CA-O 3.46Å; A284-A295 PolarHBondContact N-O 3.11Å; A284-A295 PolarHBondContact O-N 2.91Å; A284-A295 VanDerWaalsContact O-N 3.11Å
296	K	79	Confident	60.9	Low	144 Å²	144	74.6 Å²	74.6	63%	0.626	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.6	138.8	179.1	-55.9	-169.3	-175.6	178.9	0	110.7	T281 C282 I283	T281-K296 HydrophobicContact CG2-CB 4.07Å; C282-K296 VanDerWaalsContact O-CA 3.31Å; C282-K296 WeakPolarHBondContact O-CA 3.33Å; I283-K296 HydrophobicContact CD1-CD 4.11Å; I283-K296 HydrophobicContact CD1-CG 4.38Å; I283-K296 HydrophobicContact CG1-CD 4.27Å; I283-K296 HydrophobicContact CG1-CG 4.03Å; I283-K296 HydrophobicContact CG2-CG 4.33Å
297	A	67.3	Low	58.9	Low	18 Å²	18	78.9 Å²	78.9	15%	0.149	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	140.3	169.2	0	0	0	0	0	109.3	I214 A217 T281 C282	I214-A297 HydrophobicContact CD1-CB 3.74Å; I214-A297 HydrophobicContact CG2-CB 4.41Å; A217-A297 HydrophobicContact CB-CB 3.6Å; T281-A297 CarbonylContact C-O 3.56Å; T281-A297 VanDerWaalsContact CA-O 3.29Å; T281-A297 WeakPolarHBondContact CA-O 3.37Å; C282-A297 PolarHBondContact N-O 3.38Å; C282-A297 PolarHBondContact O-N 2.92Å; C282-A297 VanDerWaalsContact O-N 3.08Å
298	A	79.8	Confident	57.7	Low	54 Å²	54	81.4 Å²	81.4	45%	0.446	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	146.6	-174.2	0	0	0	0	0	112	L279 Y280	L279-A298 HydrophobicContact CD1-CB 3.8Å; L279-A298 HydrophobicContact CG-CB 4.34Å; Y280-A298 CarbonylContact O-C 3.59Å; Y280-A298 VanDerWaalsContact O-CA 3.22Å; Y280-A298 WeakPolarHBondContact O-CA 3.38Å
299	A	76.1	Confident	57.3	Low	0 Å²	0	82 Å²	82	0%	0	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	139.5	173.3	0	0	0	0	0	109.4	P218 E219 L231 Y280	P218-A299 HydrophobicContact CB-CB 3.76Å; P218-A299 HydrophobicContact CG-CB 3.98Å; E219-A299 VanDerWaalsContact O-CB 3.31Å; E219-A299 WeakPolarHBondContact O-CB 3.34Å; L231-A299 HydrophobicContact CD2-CB 4.34Å; Y280-A299 PolarHBondContact N-O 3.49Å; Y280-A299 PolarHBondContact O-N 3.11Å
300	T	84.3	Confident	57.6	Low	71 Å²	71	87.9 Å²	87.9	44%	0.436	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129.7	173.7	-53.8	0	0	0	0	108.8	S220 H221	S220-T300 CarbonylContact C-O 3.56Å; S220-T300 VanDerWaalsContact CA-O 3.25Å; S220-T300 WeakPolarHBondContact CA-O 3.35Å; S220-T300 VanDerWaalsContact CB-O 3.31Å; S220-T300 WeakPolarHBondContact CB-O 3.25Å; S220-T300 PolarHBondContact OG-N 2.65Å; H221-T300 PolarHBondContact N-O 3Å
301	I	83.6	Confident	57.9	Low	0 Å²	0	88.8 Å²	88.8	0%	0	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	118.9	166.2	-58.8	-176	0	0	0	107.4	H221 V223 V229 L231 L272 I274 P277 G278 Y280	H221-I301 WeakPolarHBondContact O-CA 3.49Å; V223-I301 HydrophobicContact CG2-CG2 3.77Å; V229-I301 HydrophobicContact CB-CD1 4.32Å; V229-I301 HydrophobicContact CG1-CD1 3.97Å; L231-I301 HydrophobicContact CD1-CD1 4.33Å; L231-I301 HydrophobicContact CD2-CD1 4.36Å; L272-I301 HydrophobicContact CD1-CD1 3.97Å; I274-I301 HydrophobicContact CD1-CD1 3.57Å; I274-I301 HydrophobicContact CD1-CG2 4.03Å; I274-I301 HydrophobicContact CG1-CD1 4.44Å; I274-I301 HydrophobicContact CG1-CG2 4.07Å; I274-I301 HydrophobicContact CG2-CG2 3.8Å; P277-I301 WeakPolarHBondContact CA-O 3.4Å; P277-I301 WeakPolarHBondContact CB-O 3.46Å; G278-I301 PolarHBondContact N-O 2.71Å; G278-I301 VanDerWaalsContact N-O 3.07Å; G278-I301 PolarHBondContact O-N 2.96Å; Y280-I301 HydrophobicContact CD2-CB 4.46Å; Y280-I301 HydrophobicContact CD2-CD1 3.79Å; Y280-I301 HydrophobicContact CD2-CG1 3.89Å; Y280-I301 HydrophobicContact CE2-CB 4.19Å; Y280-I301 HydrophobicContact CE2-CD1 3.62Å; Y280-I301 HydrophobicContact CE2-CG1 3.96Å
302	S	80.2	Confident	58.3	Low	38 Å²	38	87.7 Å²	87.7	27%	0.266	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	153.9	175	84	0	0	0	0	110.7	H221 N222 V223	H221-S302 PolarHBondContact O-N 3.11Å; N222-S302 WeakPolarHBondContact CA-O 3.41Å; N222-S302 PolarHBondContact OD1-OG 3.19Å; V223-S302 PolarHBondContact N-O 2Å
303	I	73.3	Confident	59.1	Low	42 Å²	42	90.2 Å²	90.2	22%	0.215	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	113.2	179	-59.4	179.5	0	0	0	108	V223 F225 I274	V223-I303 VanDerWaalsContact O-CA 3.27Å; V223-I303 WeakPolarHBondContact O-CA 3.49Å; F225-I303 HydrophobicContact CB-CG2 4.22Å; F225-I303 HydrophobicContact CD2-CD1 4.28Å; I274-I303 HydrophobicContact CG2-CD1 4.5Å; I274-I303 HydrophobicContact CG2-CG1 4.33Å
304	A	55.7	Low	59.6	Low	60 Å²	60	97 Å²	97	50%	0.496	50%	0.502	S	S	.	.			trans	-75.9	-30.7	-168.1	0	0	0	0	0	113.6	N222 V223	N222-A304 HydrophobicContact CB-CB 4.22Å; V223-A304 PolarHBondContact O-N 2.82Å
305	E	51.2	Low	60.5	Low	152 Å²	152	96 Å²	96	71%	0.71	50%	0.501	S	S	*	.			trans	-165.7	133.7	-179.4	-103.1	159	-154.5	0	0	109.3	S307	E305-S307 PolarHBondContact O-N 3.3Å
306	W	43.7	Very low	61.2	Low	189 Å²	189	97.2 Å²	97.2	72%	0.716	50%	0.501	S	S	*	.			trans	-70.7	106.9	160.4	-72.3	64.6	0	0	0	105.5	K308	W306-K308 PolarHBondContact O-N 3.3Å
307	S	38	Very low	61.2	Low	95 Å²	95	91.6 Å²	91.6	66%	0.664	48%	0.48	S	S	*	.			trans	-52.9	114.9	178.3	49.6	0	0	0	0	109.2	E305	E305-S307 PolarHBondContact O-N 3.3Å
308	K	39	Very low	61.6	Low	194 Å²	194	91.1 Å²	91.1	84%	0.843	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-47.7	130.6	170.7	-75.3	179.6	178.6	175.4	0	108.1	W306 Q310	W306-K308 PolarHBondContact O-N 3.3Å; K308-Q310 PolarHBondContact O-N 3.38Å; K308-Q310 VanDerWaalsContact O-N 3.15Å
309	P	42.2	Very low	61.7	Low	95 Å²	95	92 Å²	92	62%	0.617	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-60.6	124.7	174.6	22.4	-28.3	0	0	0	108.2
310	Q	42.3	Very low	62	Low	178 Å²	178	92.9 Å²	92.9	83%	0.832	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-53.2	142.5	165.1	-101.1	175.3	-24.6	0	0	108.3	K308 D312	K308-Q310 PolarHBondContact O-N 3.38Å; K308-Q310 VanDerWaalsContact O-N 3.15Å; Q310-D312 PolarHBondContact O-N 2.93Å
311	K	42.7	Very low	61.7	Low	200 Å²	200	96.8 Å²	96.8	87%	0.87	48%	0.481	S	S	*	.	S	Bend	trans	-65.7	18.5	-168.5	-144.4	177.9	-177.6	-177.8	0	115.1
312	D	48.7	Very low	61.4	Low	141 Å²	141	96.9 Å²	96.9	75%	0.754	48%	0.483	S	S	*	.	S	Bend	trans	-110.1	60.5	-175.8	-68.1	-6	0	0	0	111	Q310 K314	Q310-D312 PolarHBondContact O-N 2.93Å; D312-K314 PolarHBondContact O-N 3.41Å
313	N	58.3	Low	61.3	Low	157 Å²	157	103.2 Å²	103.2	84%	0.84	51%	0.508	S	S	*	.	S	Bend	trans	52.3	48.3	130.5	-118.5	23.9	0	0	0	121
314	K	59.1	Low	61.5	Low	143 Å²	143	103.2 Å²	103.2	62%	0.622	51%	0.51	S	S	*	.			trans	-138.9	15.3	168	-66.3	-171.2	-177.9	179.1	0	116.6	D312 F336 V387	D312-K314 PolarHBondContact O-N 3.41Å; K314-F336 VanDerWaalsContact O-CE2 3.22Å; K314-F336 WeakPolarHBondContact O-CE2 3.28Å; K314-F336 WeakPolarHBondContact O-CZ 3.35Å; K314-V387 HydrophobicContact CD-CG1 4Å
315	G	69.9	Low	62.7	Low	24 Å²	24	100.4 Å²	100.4	25%	0.247	49%	0.486	C	S	.	.			trans	77.1	-179.3	178.1	0	0	0	0	0	115.7	L337 P388	G315-L337 CarbonylContact C-O 3.47Å; G315-L337 WeakPolarHBondContact CA-O 3.42Å; G315-P388 WeakPolarHBondContact O-CG 3.13Å
316	Y	71.7	Confident	64.3	Low	46 Å²	46	98 Å²	98	18%	0.18	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	154.9	179.7	64.2	-79.4	0	0	0	113	A318 L337 T339 P344	Y316-A318 HydrophobicContact CD2-CB 4.04Å; Y316-A318 HydrophobicContact CE2-CB 3.72Å; Y316-L337 HydrophobicContact CD1-CB 4.38Å; Y316-L337 HydrophobicContact CE1-CB 4.01Å; Y316-L337 HydrophobicContact CE1-CD1 4.45Å; Y316-L337 HydrophobicContact CE2-CD1 3.95Å; Y316-L337 PolarHBondContact N-O 3.5Å; Y316-L337 PolarHBondContact O-N 3.15Å; Y316-L337 WeakPolarHBondContact OH-CD1 3.27Å; Y316-T339 WeakPolarHBondContact CE1-O 3.36Å; Y316-P344 HydrophobicContact CE2-CG 4.42Å
317	C	78.3	Confident	65.8	Low	27 Å²	27	93 Å²	93	18%	0.182	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	129.2	169.5	-55.9	0	0	0	0	109.8	L334 V335 C382 P388	C317-L334 HydrophobicContact CB-CD2 3.93Å; C317-V335 WeakPolarHBondContact CA-O 3.36Å; C317-C382 WeakPolarHBondContact CA-SG 3.46Å; C317-C382 HydrophobicContact CB-CB 3.64Å; C317-C382 WeakPolarHBondContact CB-SG 3.39Å; C317-C382 WeakPolarHBondContact SG-CB 3.29Å; C317-C382 CovalentContact SG-SG 2.02Å; C317-C382 PolarHBondContact SG-SG 3.15Å; C317-P388 VanDerWaalsContact SG-CB 3.53Å
318	A	76.8	Confident	67.7	Low	7 Å²	7	89.5 Å²	89.5	6%	0.058	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	154.7	173.5	0	0	0	0	0	110.3	Y316 L334 V335 L337	Y316-A318 HydrophobicContact CD2-CB 4.04Å; Y316-A318 HydrophobicContact CE2-CB 3.72Å; A318-L334 CarbonylContact O-C 3.55Å; A318-L334 WeakPolarHBondContact O-CA 3.38Å; A318-V335 PolarHBondContact N-O 3.16Å; A318-V335 WeakPolarHBondContact O-CG2 3.48Å; A318-V335 PolarHBondContact O-N 3Å; A318-L337 HydrophobicContact CB-CD1 3.83Å; A318-L337 HydrophobicContact CB-CG 4.49Å
319	Q	81.2	Confident	69.7	Low	74 Å²	74	80.8 Å²	80.8	35%	0.346	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	137.2	169.2	-169.3	179.6	9.1	0	0	109.2	R321 D332 Q348	Q319-R321 PolarHBondContact O-N 3.48Å; Q319-D332 PolarHBondContact NE2-OD1 2.99Å; Q319-Q348 PolarHBondContact O-NE2 3.08Å
320	Y	81.1	Confident	71.1	Confident	17 Å²	17	78.6 Å²	78.6	7%	0.067	40%	0.404	C	S	.	.			trans	-71.8	126	169.8	-175.6	-103.4	0	0	0	110.1	G322 C325 N326 L329 A333 V335 Q348 F379	Y320-G322 WeakPolarHBondContact CE1-O 3.41Å; Y320-G322 VanDerWaalsContact CZ-CA 3.45Å; Y320-G322 VanDerWaalsContact OH-C 3.28Å; Y320-G322 WeakPolarHBondContact OH-CA 3.33Å; Y320-G322 PolarHBondContact OH-O 3.4Å; Y320-C325 HydrophobicContact CE1-CB 3.84Å; Y320-C325 HydrophobicContact CE2-CB 4.2Å; Y320-C325 VanDerWaalsContact OH-CB 3.3Å; Y320-C325 WeakPolarHBondContact OH-CB 3.46Å; Y320-C325 PolarHBondContact OH-N 3.2Å; Y320-N326 HydrophobicContact CE1-CB 4.35Å; Y320-L329 HydrophobicContact CD1-CD1 3.7Å; Y320-L329 HydrophobicContact CD2-CD1 3.84Å; Y320-L329 HydrophobicContact CE1-CD1 4.07Å; Y320-L329 HydrophobicContact CE2-CD1 4.24Å; Y320-L329 HydrophobicContact CG-CD1 3.57Å; Y320-A333 PolarHBondContact N-O 2.94Å; Y320-V335 HydrophobicContact CD2-CG2 4.47Å; Y320-Q348 HydrophobicContact CD2-CG 4.33Å; Y320-Q348 HydrophobicContact CE2-CB 4.22Å; Y320-Q348 HydrophobicContact CE2-CG 4.49Å; Y320-F379 HydrophobicContact CD2-CD1 4.37Å; Y320-F379 HydrophobicContact CD2-CD2 4.05Å; Y320-F379 HydrophobicContact CD2-CE1 4.4Å; Y320-F379 HydrophobicContact CD2-CE2 4.04Å; Y320-F379 HydrophobicContact CD2-CG 4.2Å; Y320-F379 HydrophobicContact CD2-CZ 4.23Å; Y320-F379 AromaticContact CE2-CD2 3.78Å; Y320-F379 HydrophobicContact CE2-CD2 3.78Å; Y320-F379 HydrophobicContact CE2-CE1 4.3Å; Y320-F379 AromaticContact CE2-CE2 3.38Å; Y320-F379 HydrophobicContact CE2-CE2 3.38Å; Y320-F379 HydrophobicContact CE2-CG 4.35Å; Y320-F379 AromaticContact CE2-CZ 3.7Å; Y320-F379 HydrophobicContact CE2-CZ 3.7Å
321	R	78.9	Confident	72.4	Confident	153 Å²	153	78.9 Å²	78.9	58%	0.577	40%	0.403	S	S	*	.			trans	-124.4	-5	179.4	-69.2	-169.5	177	-174.2	-0.2	113.8	Q319 E345	Q319-R321 PolarHBondContact O-N 3.48Å; R321-E345 HydrophobicContact CB-CG 4.06Å
322	G	76.8	Confident	73.7	Confident	3 Å²	3	74.6 Å²	74.6	3%	0.031	39%	0.39	C	S	.	.			trans	-64.8	160.5	177.8	0	0	0	0	0	113.9	Y320 E349	Y320-G322 WeakPolarHBondContact CE1-O 3.41Å; Y320-G322 VanDerWaalsContact CZ-CA 3.45Å; Y320-G322 VanDerWaalsContact OH-C 3.28Å; Y320-G322 WeakPolarHBondContact OH-CA 3.33Å; Y320-G322 PolarHBondContact OH-O 3.4Å; G322-E349 WeakPolarHBondContact CA-OE1 3.41Å
323	E	79.1	Confident	75	Confident	170 Å²	170	68.6 Å²	68.6	79%	0.794	36%	0.359	S	S	*	.	S	Bend	trans	-86.4	-37.8	-179.9	-63.6	-169.1	166.1	0	0	111.9	C325 N326 E349	E323-C325 PolarHBondContact O-N 3.38Å; E323-N326 WeakPolarHBondContact O-CB 3.39Å; E323-N326 PolarHBondContact O-N 3.21Å; E323-E349 PolarHBondContact N-OE1 3.38Å
324	V	76.6	Confident	76	Confident	43 Å²	43	64.5 Å²	64.5	26%	0.261	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-39.7	-167.1	-174.6	0	0	0	0	113.1	E349 V352	V324-E349 WeakPolarHBondContact CG2-OE2 3.39Å; V324-V352 HydrophobicContact CB-CB 4.35Å; V324-V352 HydrophobicContact CB-CG1 3.69Å; V324-V352 HydrophobicContact CG1-CG1 3.38Å; V324-V352 HydrophobicContact CG2-CG1 4.24Å
325	C	82.2	Confident	77.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	5.7	-179.3	-62.6	0	0	0	0	113.5	Y320 E323 A327 V328 L329 C375 F379	Y320-C325 HydrophobicContact CE1-CB 3.84Å; Y320-C325 HydrophobicContact CE2-CB 4.2Å; Y320-C325 VanDerWaalsContact OH-CB 3.3Å; Y320-C325 WeakPolarHBondContact OH-CB 3.46Å; Y320-C325 PolarHBondContact OH-N 3.2Å; E323-C325 PolarHBondContact O-N 3.38Å; C325-A327 PolarHBondContact O-N 3.3Å; C325-V328 PolarHBondContact O-N 3.27Å; C325-L329 HydrophobicContact CB-CD1 3.87Å; C325-L329 HydrophobicContact CB-CG 4.14Å; C325-L329 PolarHBondContact O-N 3.21Å; C325-C375 WeakPolarHBondContact CA-SG 3.22Å; C325-C375 HydrophobicContact CB-CB 3.54Å; C325-C375 WeakPolarHBondContact CB-SG 3.44Å; C325-C375 VanDerWaalsContact SG-CA 3.54Å; C325-C375 WeakPolarHBondContact SG-CB 3.38Å; C325-C375 CovalentContact SG-SG 2.03Å; C325-C375 PolarHBondContact SG-SG 2.91Å; C325-F379 HydrophobicContact CB-CD2 4.32Å; C325-F379 HydrophobicContact CB-CE2 4.39Å
326	N	82.9	Confident	77.7	Confident	102 Å²	102	57.9 Å²	57.9	55%	0.545	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-29.7	-176.9	-166.5	15.9	0	0	0	112.6	Y320 E323 V328	Y320-N326 HydrophobicContact CE1-CB 4.35Å; E323-N326 WeakPolarHBondContact O-CB 3.39Å; E323-N326 PolarHBondContact O-N 3.21Å; N326-V328 VanDerWaalsContact C-N 3.25Å; N326-V328 PolarHBondContact O-N 3Å
327	A	76.9	Confident	77.8	Confident	85 Å²	85	55.9 Å²	55.9	70%	0.702	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-10.7	175.9	0	0	0	0	0	113.8	C325	C325-A327 PolarHBondContact O-N 3.3Å
328	V	77.6	Confident	77.2	Confident	21 Å²	21	59.5 Å²	59.5	13%	0.127	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-39.4	-171.9	174.6	0	0	0	0	111.9	C325 N326 E371 C375 N376	C325-V328 PolarHBondContact O-N 3.27Å; N326-V328 VanDerWaalsContact C-N 3.25Å; N326-V328 PolarHBondContact O-N 3Å; V328-E371 HydrophobicContact CG2-CB 4.36Å; V328-C375 HydrophobicContact CB-CB 4.17Å; V328-C375 HydrophobicContact CG1-CB 3.83Å; V328-N376 WeakPolarHBondContact CG1-ND2 3.35Å
329	L	80.7	Confident	76.5	Confident	11 Å²	11	60.8 Å²	60.8	6%	0.058	32%	0.319	C	S	.	.	S	Bend	trans	-85.1	152.2	179.6	-61.6	174.9	0	0	0	110.8	Y320 C325 A333 V335 F379	Y320-L329 HydrophobicContact CD1-CD1 3.7Å; Y320-L329 HydrophobicContact CD2-CD1 3.84Å; Y320-L329 HydrophobicContact CE1-CD1 4.07Å; Y320-L329 HydrophobicContact CE2-CD1 4.24Å; Y320-L329 HydrophobicContact CG-CD1 3.57Å; C325-L329 HydrophobicContact CB-CD1 3.87Å; C325-L329 HydrophobicContact CB-CG 4.14Å; C325-L329 PolarHBondContact O-N 3.21Å; L329-A333 HydrophobicContact CB-CB 4.5Å; L329-V335 HydrophobicContact CD1-CG1 4.21Å; L329-F379 HydrophobicContact CD1-CB 3.95Å; L329-F379 HydrophobicContact CD1-CD2 4.04Å; L329-F379 HydrophobicContact CD1-CG 4.3Å
330	A	72.1	Confident	75.3	Confident	48 Å²	48	62.9 Å²	62.9	40%	0.397	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-63	145.2	175.9	0	0	0	0	0	111	D332 A333	A330-D332 PolarHBondContact O-N 3.35Å; A330-A333 HydrophobicContact CB-CB 4.29Å; A330-A333 WeakPolarHBondContact O-CB 3.31Å; A330-A333 PolarHBondContact O-N 3.24Å
331	K	68	Low	74.2	Confident	185 Å²	185	65.8 Å²	65.8	80%	0.804	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	126.2	174.2	-166.2	177	-177.8	179.6	0	109.1	A333	K331-A333 VanDerWaalsContact C-N 3.33Å
332	D	70.6	Confident	72.8	Confident	110 Å²	110	64 Å²	64	59%	0.588	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	21.9	-175.1	-49.1	-48.5	0	0	0	115.6	Q319 A330 L334	Q319-D332 PolarHBondContact NE2-OD1 2.99Å; A330-D332 PolarHBondContact O-N 3.35Å; D332-L334 PolarHBondContact O-N 3.49Å
333	A	75.7	Confident	72	Confident	14 Å²	14	67.5 Å²	67.5	12%	0.116	39%	0.389	C	S	.	.			trans	-57.7	132.6	175.1	0	0	0	0	0	112.4	Y320 L329 A330 K331	Y320-A333 PolarHBondContact N-O 2.94Å; L329-A333 HydrophobicContact CB-CB 4.5Å; A330-A333 HydrophobicContact CB-CB 4.29Å; A330-A333 WeakPolarHBondContact O-CB 3.31Å; A330-A333 PolarHBondContact O-N 3.24Å; K331-A333 VanDerWaalsContact C-N 3.33Å
334	L	80.6	Confident	71.3	Confident	72 Å²	72	61.7 Å²	61.7	38%	0.377	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	118.1	167.9	-86	152.7	0	0	0	108.9	C317 A318 D332 E381 C382	C317-L334 HydrophobicContact CB-CD2 3.93Å; A318-L334 CarbonylContact O-C 3.55Å; A318-L334 WeakPolarHBondContact O-CA 3.38Å; D332-L334 PolarHBondContact O-N 3.49Å; L334-E381 WeakPolarHBondContact O-CA 3.3Å; L334-C382 HydrophobicContact CB-CB 4.37Å; L334-C382 PolarHBondContact O-N 3.48Å
335	V	81.9	Confident	70.8	Confident	1 Å²	1	64 Å²	64	1%	0.006	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	144.8	-178.1	-59.6	0	0	0	0	110.7	C317 A318 Y320 L329 F379 Q380	C317-V335 WeakPolarHBondContact CA-O 3.36Å; A318-V335 PolarHBondContact N-O 3.16Å; A318-V335 WeakPolarHBondContact O-CG2 3.48Å; A318-V335 PolarHBondContact O-N 3Å; Y320-V335 HydrophobicContact CD2-CG2 4.47Å; L329-V335 HydrophobicContact CD1-CG1 4.21Å; V335-F379 HydrophobicContact CB-CB 3.89Å; V335-F379 HydrophobicContact CB-CD1 4.4Å; V335-F379 HydrophobicContact CG1-CB 3.72Å; V335-F379 HydrophobicContact CG2-CB 4.47Å; V335-F379 HydrophobicContact CG2-CD1 4.16Å; V335-Q380 CarbonylContact C-O 3.39Å; V335-Q380 WeakPolarHBondContact CA-O 3.49Å
336	F	81.1	Confident	70.1	Confident	27 Å²	27	70.8 Å²	70.8	12%	0.118	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	129	179.5	179.3	-94.3	0	0	0	110.9	K314 N338 Q380 C382 P388 P390	K314-F336 VanDerWaalsContact O-CE2 3.22Å; K314-F336 WeakPolarHBondContact O-CE2 3.28Å; K314-F336 WeakPolarHBondContact O-CZ 3.35Å; F336-N338 HydrophobicContact CE1-CB 4.01Å; F336-Q380 PolarHBondContact N-O 2.93Å; F336-C382 HydrophobicContact CB-CB 4.08Å; F336-P388 HydrophobicContact CD2-CB 4.32Å; F336-P388 HydrophobicContact CE2-CB 4.33Å; F336-P388 HydrophobicContact CE2-CG 4.43Å; F336-P390 HydrophobicContact CB-CB 3.86Å; F336-P390 HydrophobicContact CD1-CB 3.79Å; F336-P390 HydrophobicContact CD1-CG 3.99Å; F336-P390 HydrophobicContact CD2-CB 4.28Å; F336-P390 HydrophobicContact CD2-CG 4.42Å; F336-P390 HydrophobicContact CE1-CB 4.35Å; F336-P390 HydrophobicContact CE1-CG 4.03Å; F336-P390 HydrophobicContact CE2-CG 4.46Å; F336-P390 HydrophobicContact CG-CB 3.72Å; F336-P390 HydrophobicContact CG-CG 4.17Å; F336-P390 HydrophobicContact CZ-CG 4.24Å
337	L	75.7	Confident	69.4	Low	3 Å²	3	66.1 Å²	66.1	2%	0.016	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	121.4	176.5	-62.9	177.2	0	0	0	110.1	G315 Y316 A318 T339 P344 Q348 F379	G315-L337 CarbonylContact C-O 3.47Å; G315-L337 WeakPolarHBondContact CA-O 3.42Å; Y316-L337 HydrophobicContact CD1-CB 4.38Å; Y316-L337 HydrophobicContact CE1-CB 4.01Å; Y316-L337 HydrophobicContact CE1-CD1 4.45Å; Y316-L337 HydrophobicContact CE2-CD1 3.95Å; Y316-L337 PolarHBondContact N-O 3.5Å; Y316-L337 PolarHBondContact O-N 3.15Å; Y316-L337 WeakPolarHBondContact OH-CD1 3.27Å; A318-L337 HydrophobicContact CB-CD1 3.83Å; A318-L337 HydrophobicContact CB-CG 4.49Å; L337-T339 VanDerWaalsContact C-N 3.31Å; L337-T339 PolarHBondContact O-N 2.7Å; L337-P344 HydrophobicContact CD1-CB 4.36Å; L337-Q348 HydrophobicContact CD1-CG 4.41Å; L337-Q348 HydrophobicContact CD2-CG 4.19Å; L337-F379 HydrophobicContact CD2-CD1 4.22Å; L337-F379 HydrophobicContact CD2-CE1 4.09Å
338	N	65.4	Low	69.4	Low	104 Å²	104	62.1 Å²	62.1	56%	0.556	35%	0.348	S	S	*	.			trans	-87.1	4.9	-176.1	-165.5	21	0	0	0	113.9	F336	F336-N338 HydrophobicContact CE1-CB 4.01Å
339	T	61.7	Low	69.5	Low	33 Å²	33	62.9 Å²	62.9	20%	0.202	35%	0.35	C	S	.	.	S	Bend	trans	-126.4	139.6	-169.1	43.5	0	0	0	0	111	Y316 L337 Y341	Y316-T339 WeakPolarHBondContact CE1-O 3.36Å; L337-T339 VanDerWaalsContact C-N 3.31Å; L337-T339 PolarHBondContact O-N 2.7Å; T339-Y341 VanDerWaalsContact C-N 3.3Å; T339-Y341 VanDerWaalsContact CB-CD2 3.43Å; T339-Y341 HydrophobicContact CG2-CD2 4.42Å; T339-Y341 HydrophobicContact CG2-CE2 3.73Å; T339-Y341 PolarHBondContact O-N 2.79Å; T339-Y341 WeakPolarHBondContact OG1-CD2 3.41Å; T339-Y341 WeakPolarHBondContact OG1-CE2 3.31Å
340	S	56.7	Low	69.1	Low	118 Å²	118	66.3 Å²	66.3	83%	0.825	37%	0.368	S	S	*	.			trans	-84.1	69.4	177.4	66.1	0	0	0	0	111
341	Y	56.7	Low	69.2	Low	79 Å²	79	64.5 Å²	64.5	31%	0.31	35%	0.352	S	S	.	.			trans	-82.3	147	173.3	-68.1	-71.7	0	0	0	111.3	T339 A347 M426	T339-Y341 VanDerWaalsContact C-N 3.3Å; T339-Y341 VanDerWaalsContact CB-CD2 3.43Å; T339-Y341 HydrophobicContact CG2-CD2 4.42Å; T339-Y341 HydrophobicContact CG2-CE2 3.73Å; T339-Y341 PolarHBondContact O-N 2.79Å; T339-Y341 WeakPolarHBondContact OG1-CD2 3.41Å; T339-Y341 WeakPolarHBondContact OG1-CE2 3.31Å; Y341-A347 HydrophobicContact CD1-CB 4.34Å; Y341-A347 HydrophobicContact CD2-CB 3.18Å; Y341-A347 HydrophobicContact CE2-CB 3.83Å; Y341-A347 HydrophobicContact CG-CB 3.49Å; Y341-A347 VanDerWaalsContact CG-CB 3.49Å; Y341-M426 PolarHBondContact OH-SD 2.85Å
342	A	50.1	Low	69.5	Low	116 Å²	116	55.9 Å²	55.9	96%	0.959	31%	0.314	S	S	*	.	S	Bend	trans	-72.9	-31.2	178.4	0	0	0	0	0	112.2
343	D	60.8	Low	69.6	Low	75 Å²	75	55.1 Å²	55.1	40%	0.401	31%	0.307	S	S	.	.			trans	-120.4	115.2	173.2	-169.2	-21.5	0	0	0	109.6	E345 E346 A347	D343-E345 VanDerWaalsContact C-N 3.25Å; D343-E345 PolarHBondContact O-N 3.31Å; D343-E345 WeakPolarHBondContact OD1-CB 3.37Å; D343-E345 PolarHBondContact OD1-N 3.29Å; D343-E346 HydrophobicContact CB-CB 4.06Å; D343-A347 WeakPolarHBondContact O-CB 3.38Å; D343-A347 PolarHBondContact O-N 3.26Å
344	P	63.1	Low	69.4	Low	49 Å²	49	57.3 Å²	57.3	32%	0.318	32%	0.319	S	S	.	.	H	α-helix	trans	-63.3	-28.1	177.2	-19.9	31.5	0	0	0	113.9	Y316 L337 Q348	Y316-P344 HydrophobicContact CE2-CG 4.42Å; L337-P344 HydrophobicContact CD1-CB 4.36Å; P344-Q348 WeakPolarHBondContact O-CG 3.35Å; P344-Q348 PolarHBondContact O-N 2.96Å
345	E	67.3	Low	68.9	Low	90 Å²	90	54 Å²	54	42%	0.421	30%	0.302	S	S	.	.	H	α-helix	trans	-78.8	-47.4	-174.1	-163.7	167	155.4	0	0	110.7	R321 D343 A347 Q348 E349	R321-E345 HydrophobicContact CB-CG 4.06Å; D343-E345 VanDerWaalsContact C-N 3.25Å; D343-E345 PolarHBondContact O-N 3.31Å; D343-E345 WeakPolarHBondContact OD1-CB 3.37Å; D343-E345 PolarHBondContact OD1-N 3.29Å; E345-A347 PolarHBondContact O-N 3.44Å; E345-Q348 PolarHBondContact O-N 3.1Å; E345-E349 PolarHBondContact O-N 3.06Å
346	E	67.1	Low	68.4	Low	144 Å²	144	56.2 Å²	56.2	67%	0.673	31%	0.31	S	S	*	.	H	α-helix	trans	-58.7	-37.7	173.7	-168.5	179.5	-171.3	0	0	111.6	D343 L350	D343-E346 HydrophobicContact CB-CB 4.06Å; E346-L350 VanDerWaalsContact O-CB 3.31Å; E346-L350 WeakPolarHBondContact O-CB 3.27Å; E346-L350 PolarHBondContact O-N 3.36Å; E346-L350 VanDerWaalsContact O-N 3.11Å
347	A	67.7	Low	67.8	Low	3 Å²	3	59 Å²	59	3%	0.025	33%	0.327	C	S	.	.	H	α-helix	trans	-64.9	-43.2	176.5	0	0	0	0	0	113.5	Y341 D343 E345 L351	Y341-A347 HydrophobicContact CD1-CB 4.34Å; Y341-A347 HydrophobicContact CD2-CB 3.18Å; Y341-A347 HydrophobicContact CE2-CB 3.83Å; Y341-A347 HydrophobicContact CG-CB 3.49Å; Y341-A347 VanDerWaalsContact CG-CB 3.49Å; D343-A347 WeakPolarHBondContact O-CB 3.38Å; D343-A347 PolarHBondContact O-N 3.26Å; E345-A347 PolarHBondContact O-N 3.44Å; A347-L351 WeakPolarHBondContact O-CD1 3.41Å; A347-L351 WeakPolarHBondContact O-CG 3.34Å; A347-L351 PolarHBondContact O-N 3.41Å; A347-L351 VanDerWaalsContact O-N 3.12Å
348	Q	77.6	Confident	67.4	Low	1 Å²	1	63.8 Å²	63.8	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-64.5	-46.1	-178.5	-75.3	169.1	13.7	0	0	110.9	Q319 Y320 L337 P344 E345 L351 V352 F379	Q319-Q348 PolarHBondContact O-NE2 3.08Å; Y320-Q348 HydrophobicContact CD2-CG 4.33Å; Y320-Q348 HydrophobicContact CE2-CB 4.22Å; Y320-Q348 HydrophobicContact CE2-CG 4.49Å; L337-Q348 HydrophobicContact CD1-CG 4.41Å; L337-Q348 HydrophobicContact CD2-CG 4.19Å; P344-Q348 WeakPolarHBondContact O-CG 3.35Å; P344-Q348 PolarHBondContact O-N 2.96Å; E345-Q348 PolarHBondContact O-N 3.1Å; Q348-L351 PolarHBondContact O-N 2.95Å; Q348-V352 WeakPolarHBondContact O-CG2 3.12Å; Q348-V352 PolarHBondContact O-N 3.24Å; Q348-F379 HydrophobicContact CB-CE1 4.12Å; Q348-F379 HydrophobicContact CB-CZ 3.99Å; Q348-F379 HydrophobicContact CG-CE1 3.83Å; Q348-F379 HydrophobicContact CG-CZ 4.21Å; Q348-F379 WeakPolarHBondContact O-CZ 3.44Å
349	E	78.1	Confident	67.4	Low	37 Å²	37	59.5 Å²	59.5	17%	0.173	33%	0.326	C	S	.	.	H	α-helix	trans	-65.3	-43.4	178.7	-76.4	-57.5	131	0	0	112.4	G322 E323 V324 E345 L351 V352 H353	G322-E349 WeakPolarHBondContact CA-OE1 3.41Å; E323-E349 PolarHBondContact N-OE1 3.38Å; V324-E349 WeakPolarHBondContact CG2-OE2 3.39Å; E345-E349 PolarHBondContact O-N 3.06Å; E349-L351 VanDerWaalsContact C-N 3.33Å; E349-L351 PolarHBondContact O-N 2.7Å; E349-V352 PolarHBondContact O-N 2.97Å; E349-H353 WeakPolarHBondContact O-CB 3.23Å; E349-H353 PolarHBondContact O-CD2 3.32Å; E349-H353 PolarHBondContact O-N 3.4Å; E349-H353 IonicContact OE2-CD2 3.59Å; E349-H353 IonicContact OE2-NE2 2.75Å; E349-H353 PolarHBondContact OE2-NE2 3.1Å
350	L	73.3	Confident	67.3	Low	84 Å²	84	66 Å²	66	44%	0.44	35%	0.351	S	S	.	.	H	α-helix	trans	-59.4	-44.2	178.5	-175	63.7	0	0	0	111.8	E346 V352 H353 T354	E346-L350 VanDerWaalsContact O-CB 3.31Å; E346-L350 WeakPolarHBondContact O-CB 3.27Å; E346-L350 PolarHBondContact O-N 3.36Å; E346-L350 VanDerWaalsContact O-N 3.11Å; L350-V352 VanDerWaalsContact C-N 3.35Å; L350-V352 PolarHBondContact O-N 2.86Å; L350-H353 PolarHBondContact O-N 3.21Å; L350-T354 WeakPolarHBondContact O-CB 3.32Å; L350-T354 PolarHBondContact O-N 3.13Å; L350-T354 PolarHBondContact O-OG1 3.44Å
351	L	73.8	Confident	67.6	Low	10 Å²	10	64.6 Å²	64.6	5%	0.052	34%	0.337	C	S	.	.	H	α-helix	trans	-59.5	-43.5	179.5	-75	170.9	0	0	0	112.5	A347 Q348 E349 A355 I378 F379 M426 L428	A347-L351 WeakPolarHBondContact O-CD1 3.41Å; A347-L351 WeakPolarHBondContact O-CG 3.34Å; A347-L351 PolarHBondContact O-N 3.41Å; A347-L351 VanDerWaalsContact O-N 3.12Å; Q348-L351 PolarHBondContact O-N 2.95Å; E349-L351 VanDerWaalsContact C-N 3.33Å; E349-L351 PolarHBondContact O-N 2.7Å; L351-A355 WeakPolarHBondContact O-CB 3.32Å; L351-A355 PolarHBondContact O-N 3.47Å; L351-A355 VanDerWaalsContact O-N 3.15Å; L351-I378 HydrophobicContact CB-CG2 4.27Å; L351-F379 HydrophobicContact CD1-CE1 4.39Å; L351-M426 HydrophobicContact CD2-SD 3.86Å; L351-L428 HydrophobicContact CD2-CD1 3.59Å
352	V	73.9	Confident	68.3	Low	3 Å²	3	61.8 Å²	61.8	2%	0.018	33%	0.328	C	S	.	.	H	α-helix	trans	-74.6	-41.6	-179.4	-174.4	0	0	0	0	111.4	V324 Q348 E349 L350 T354 A355 W356 F379	V324-V352 HydrophobicContact CB-CB 4.35Å; V324-V352 HydrophobicContact CB-CG1 3.69Å; V324-V352 HydrophobicContact CG1-CG1 3.38Å; V324-V352 HydrophobicContact CG2-CG1 4.24Å; Q348-V352 WeakPolarHBondContact O-CG2 3.12Å; Q348-V352 PolarHBondContact O-N 3.24Å; E349-V352 PolarHBondContact O-N 2.97Å; L350-V352 VanDerWaalsContact C-N 3.35Å; L350-V352 PolarHBondContact O-N 2.86Å; V352-T354 VanDerWaalsContact C-N 3.35Å; V352-T354 PolarHBondContact O-N 2.85Å; V352-A355 WeakPolarHBondContact O-CB 3.27Å; V352-A355 PolarHBondContact O-N 2.73Å; V352-W356 WeakPolarHBondContact O-CB 3.34Å; V352-W356 PolarHBondContact O-N 3.11Å; V352-F379 HydrophobicContact CG2-CD2 4.42Å; V352-F379 HydrophobicContact CG2-CE2 3.23Å; V352-F379 HydrophobicContact CG2-CZ 3.56Å
353	H	73.2	Confident	69.5	Low	94 Å²	94	58.1 Å²	58.1	44%	0.435	30%	0.296	S	S	.	.	H	α-helix	trans	-64.3	-40	178.3	-81.6	-58.6	0	0	0	112.3	E349 L350 W356 N357	E349-H353 WeakPolarHBondContact O-CB 3.23Å; E349-H353 PolarHBondContact O-CD2 3.32Å; E349-H353 PolarHBondContact O-N 3.4Å; E349-H353 IonicContact OE2-CD2 3.59Å; E349-H353 IonicContact OE2-NE2 2.75Å; E349-H353 PolarHBondContact OE2-NE2 3.1Å; L350-H353 PolarHBondContact O-N 3.21Å; H353-W356 PolarHBondContact O-N 3.45Å; H353-N357 VanDerWaalsContact O-CB 3.28Å; H353-N357 WeakPolarHBondContact O-CB 3.45Å; H353-N357 VanDerWaalsContact O-CG 3.26Å; H353-N357 PolarHBondContact O-N 3.3Å; H353-N357 PolarHBondContact O-ND2 2.71Å; H353-N357 VanDerWaalsContact O-ND2 3.09Å
354	T	71.4	Confident	70.4	Confident	61 Å²	61	59.6 Å²	59.6	37%	0.374	31%	0.309	S	S	.	.	H	α-helix	trans	-62	-45.1	173.1	-60.7	0	0	0	0	110.9	L350 V352 W356 N357	L350-T354 WeakPolarHBondContact O-CB 3.32Å; L350-T354 PolarHBondContact O-N 3.13Å; L350-T354 PolarHBondContact O-OG1 3.44Å; V352-T354 VanDerWaalsContact C-N 3.35Å; V352-T354 PolarHBondContact O-N 2.85Å; T354-W356 PolarHBondContact O-N 2.85Å; T354-N357 PolarHBondContact O-N 2.84Å
355	A	70.4	Confident	71.1	Confident	2 Å²	2	63.2 Å²	63.2	2%	0.017	33%	0.331	C	S	.	.	H	α-helix	trans	-57.3	-48.7	175.3	0	0	0	0	0	113	L351 V352 E358 L359 I378 L429	L351-A355 WeakPolarHBondContact O-CB 3.32Å; L351-A355 PolarHBondContact O-N 3.47Å; L351-A355 VanDerWaalsContact O-N 3.15Å; V352-A355 WeakPolarHBondContact O-CB 3.27Å; V352-A355 PolarHBondContact O-N 2.73Å; A355-E358 PolarHBondContact O-N 2.85Å; A355-L359 WeakPolarHBondContact O-CD1 2.93Å; A355-I378 HydrophobicContact CB-CD1 3.65Å; A355-L429 HydrophobicContact CB-CD1 3.61Å; A355-L429 HydrophobicContact CB-CD2 3.4Å; A355-L429 HydrophobicContact CB-CG 4.1Å
356	W	72.1	Confident	71.7	Confident	47 Å²	47	59 Å²	59	18%	0.178	31%	0.311	C	S	.	.	H	α-helix	trans	-68.9	-38.1	-177.1	-110.8	119.6	0	0	0	112.8	V352 H353 T354 E358 L359 R367 E371	V352-W356 WeakPolarHBondContact O-CB 3.34Å; V352-W356 PolarHBondContact O-N 3.11Å; H353-W356 PolarHBondContact O-N 3.45Å; T354-W356 PolarHBondContact O-N 2.85Å; W356-E358 PolarHBondContact O-N 3.16Å; W356-L359 HydrophobicContact CE3-CB 4.17Å; W356-L359 HydrophobicContact CZ3-CB 4.4Å; W356-L359 PolarHBondContact O-N 3.37Å; W356-R367 HydrophobicContact CH2-CG 3.79Å; W356-R367 HydrophobicContact CZ2-CG 3.82Å; W356-E371 HydrophobicContact CZ2-CG 3.59Å; W356-E371 WeakPolarHBondContact CZ2-OE1 3.4Å
357	N	68.7	Low	72.2	Confident	87 Å²	87	57.5 Å²	57.5	47%	0.465	30%	0.299	S	S	.	.	H	α-helix	trans	-63	-26.1	179.7	-83.2	-36.7	0	0	0	113.3	H353 T354 K360	H353-N357 VanDerWaalsContact O-CB 3.28Å; H353-N357 WeakPolarHBondContact O-CB 3.45Å; H353-N357 VanDerWaalsContact O-CG 3.26Å; H353-N357 PolarHBondContact O-N 3.3Å; H353-N357 PolarHBondContact O-ND2 2.71Å; H353-N357 VanDerWaalsContact O-ND2 3.09Å; T354-N357 PolarHBondContact O-N 2.84Å; N357-K360 VanDerWaalsContact O-CD 3.24Å; N357-K360 WeakPolarHBondContact O-CD 3.47Å; N357-K360 WeakPolarHBondContact O-CE 3.44Å; N357-K360 VanDerWaalsContact O-CG 3.23Å; N357-K360 WeakPolarHBondContact O-CG 3.26Å
358	E	65.4	Low	72.8	Confident	103 Å²	103	61.2 Å²	61.2	48%	0.481	32%	0.323	S	S	.	.	H	α-helix	trans	-81.8	-19.8	175.1	-66.3	-57.1	140.2	0	0	112.9	A355 W356 Y422	A355-E358 PolarHBondContact O-N 2.85Å; W356-E358 PolarHBondContact O-N 3.16Å; E358-Y422 HydrophobicContact CB-CD1 4.3Å; E358-Y422 HydrophobicContact CB-CE1 3.55Å; E358-Y422 HydrophobicContact CG-CD1 4.43Å; E358-Y422 HydrophobicContact CG-CE1 4.17Å
359	L	65.4	Low	72.8	Confident	13 Å²	13	61.9 Å²	61.9	7%	0.068	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	22.4	-176.9	-71.4	166.4	0	0	0	114.1	A355 W356 V361 V362 L374 M413	A355-L359 WeakPolarHBondContact O-CD1 2.93Å; W356-L359 HydrophobicContact CE3-CB 4.17Å; W356-L359 HydrophobicContact CZ3-CB 4.4Å; W356-L359 PolarHBondContact O-N 3.37Å; L359-V361 PolarHBondContact O-N 3.33Å; L359-V362 HydrophobicContact CB-CG2 4.42Å; L359-V362 PolarHBondContact O-N 2.82Å; L359-L374 HydrophobicContact CD1-CD1 3.12Å; L359-L374 HydrophobicContact CD1-CD2 3.83Å; L359-L374 HydrophobicContact CD1-CG 4.08Å; L359-M413 HydrophobicContact CD2-CG 4.01Å; L359-M413 HydrophobicContact CD2-SD 3.88Å
360	K	60.6	Low	72.7	Confident	169 Å²	169	60.2 Å²	60.2	74%	0.735	32%	0.321	S	S	*	.			trans	-52.7	7.9	-179	-76.8	172.4	-176.8	177.6	0	117.1	N357	N357-K360 VanDerWaalsContact O-CD 3.24Å; N357-K360 WeakPolarHBondContact O-CD 3.47Å; N357-K360 WeakPolarHBondContact O-CE 3.44Å; N357-K360 VanDerWaalsContact O-CG 3.23Å; N357-K360 WeakPolarHBondContact O-CG 3.26Å
361	V	63.9	Low	73	Confident	89 Å²	89	58.7 Å²	58.7	54%	0.539	31%	0.312	S	S	.	.			trans	-125.8	43.4	-178.1	-160.9	0	0	0	0	111.1	L359	L359-V361 PolarHBondContact O-N 3.33Å
362	V	70	Confident	73.3	Confident	20 Å²	20	58.8 Å²	58.8	12%	0.121	31%	0.314	C	S	.	.			trans	-116.2	120.4	171.8	-175.7	0	0	0	0	108.9	L359 C366 A370 F405	L359-V362 HydrophobicContact CB-CG2 4.42Å; L359-V362 PolarHBondContact O-N 2.82Å; V362-C366 HydrophobicContact CG1-CB 3.82Å; V362-A370 HydrophobicContact CG1-CB 4.17Å; V362-F405 HydrophobicContact CG1-CZ 4.34Å; V362-F405 HydrophobicContact CG2-CZ 4.33Å
363	S	75.4	Confident	73.5	Confident	39 Å²	39	58.9 Å²	58.9	27%	0.273	31%	0.314	S	S	.	.			trans	-66.1	155.2	178	85.6	0	0	0	0	110.9	V365 C366 R367	S363-V365 PolarHBondContact O-N 2.88Å; S363-C366 PolarHBondContact O-N 3.39Å; S363-C366 PolarHBondContact OG-SG 2.81Å; S363-R367 PolarHBondContact O-N 2.66Å
364	P	78.9	Confident	73.7	Confident	106 Å²	106	55.3 Å²	55.3	69%	0.688	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-26.6	179.8	-26.1	34.8	0	0	0	114.1
365	V	79.1	Confident	74.2	Confident	126 Å²	126	52.5 Å²	52.5	76%	0.764	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-36.1	179.5	-177.2	0	0	0	0	111.6	S363	S363-V365 PolarHBondContact O-N 2.88Å
366	C	78.8	Confident	74.7	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.007	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-10.3	-175.3	-30.8	0	0	0	0	112.5	V362 S363 A369 A370 F405 C406	V362-C366 HydrophobicContact CG1-CB 3.82Å; S363-C366 PolarHBondContact O-N 3.39Å; S363-C366 PolarHBondContact OG-SG 2.81Å; C366-A369 PolarHBondContact O-N 3.41Å; C366-A370 PolarHBondContact O-N 3.41Å; C366-A370 VanDerWaalsContact O-N 3.16Å; C366-F405 HydrophobicContact CB-CE1 4.49Å; C366-C406 HydrophobicContact CB-CB 3.84Å; C366-C406 WeakPolarHBondContact CB-SG 3.34Å; C366-C406 WeakPolarHBondContact SG-CB 3.27Å; C366-C406 CovalentContact SG-SG 2Å; C366-C406 PolarHBondContact SG-SG 3.15Å
367	R	78.8	Confident	75	Confident	113 Å²	113	52.9 Å²	52.9	43%	0.426	29%	0.285	S	S	.	.	H	α-helix	trans	-56.6	-46.3	-174.8	174.5	175.7	-59.7	-171	0.3	113.9	W356 S363 A369 A370 E371	W356-R367 HydrophobicContact CH2-CG 3.79Å; W356-R367 HydrophobicContact CZ2-CG 3.82Å; S363-R367 PolarHBondContact O-N 2.66Å; R367-A369 VanDerWaalsContact C-N 3.34Å; R367-A369 PolarHBondContact O-N 3.18Å; R367-A370 WeakPolarHBondContact O-CB 3.43Å; R367-A370 PolarHBondContact O-N 2.72Å; R367-A370 VanDerWaalsContact O-N 3.12Å; R367-E371 VanDerWaalsContact CD-OE1 3.32Å; R367-E371 WeakPolarHBondContact CD-OE1 3.45Å; R367-E371 HydrophobicContact CG-CG 4.2Å; R367-E371 WeakPolarHBondContact CG-OE1 3.47Å; R367-E371 WeakPolarHBondContact O-CG 3.24Å; R367-E371 PolarHBondContact O-N 3.28Å
368	P	79.3	Confident	75.4	Confident	81 Å²	81	49.3 Å²	49.3	53%	0.526	27%	0.266	S	S	.	.	H	α-helix	trans	-63.7	-37.5	-178.2	-23.8	35.1	0	0	0	113.5	A370 E371 A372	P368-A370 VanDerWaalsContact C-N 3.34Å; P368-E371 PolarHBondContact O-N 3.09Å; P368-A372 WeakPolarHBondContact O-CB 3.33Å; P368-A372 PolarHBondContact O-N 3.12Å
369	A	78.1	Confident	76.2	Confident	14 Å²	14	44.4 Å²	44.4	12%	0.116	24%	0.243	C	C	.	.	H	α-helix	trans	-67.6	-36.9	175.5	0	0	0	0	0	111.4	C366 R367 L373 V401 F405	C366-A369 PolarHBondContact O-N 3.41Å; R367-A369 VanDerWaalsContact C-N 3.34Å; R367-A369 PolarHBondContact O-N 3.18Å; A369-L373 PolarHBondContact O-N 3.25Å; A369-V401 HydrophobicContact CB-CG1 4.25Å; A369-V401 WeakPolarHBondContact O-CG1 3.3Å; A369-F405 HydrophobicContact CB-CB 4.41Å; A369-F405 HydrophobicContact CB-CD2 4.06Å
370	A	77	Confident	77.1	Confident	2 Å²	2	46 Å²	46	2%	0.017	25%	0.25	C	S	.	.	H	α-helix	trans	-63.2	-49.4	173.4	0	0	0	0	0	112.2	V362 C366 R367 P368 A372 L373 L374 F405	V362-A370 HydrophobicContact CG1-CB 4.17Å; C366-A370 PolarHBondContact O-N 3.41Å; C366-A370 VanDerWaalsContact O-N 3.16Å; R367-A370 WeakPolarHBondContact O-CB 3.43Å; R367-A370 PolarHBondContact O-N 2.72Å; R367-A370 VanDerWaalsContact O-N 3.12Å; P368-A370 VanDerWaalsContact C-N 3.34Å; A370-A372 PolarHBondContact O-N 2.69Å; A370-L373 PolarHBondContact O-N 2.99Å; A370-L374 HydrophobicContact CB-CD1 4.4Å; A370-L374 WeakPolarHBondContact O-CB 3.34Å; A370-L374 VanDerWaalsContact O-CD1 3.26Å; A370-L374 WeakPolarHBondContact O-CD1 3.38Å; A370-L374 WeakPolarHBondContact O-CG 3.4Å; A370-L374 PolarHBondContact O-N 3.36Å; A370-F405 VanDerWaalsContact CA-CE2 3.5Å; A370-F405 HydrophobicContact CB-CD2 4.27Å; A370-F405 HydrophobicContact CB-CE2 3.36Å; A370-F405 HydrophobicContact CB-CZ 4.01Å
371	E	79.1	Confident	78.1	Confident	53 Å²	53	41.6 Å²	41.6	25%	0.248	23%	0.232	C	C	.	.	H	α-helix	trans	-59.9	-46.3	178.6	-71.3	168.6	173.7	0	0	111.1	V328 W356 R367 P368 L373 L374 C375	V328-E371 HydrophobicContact CG2-CB 4.36Å; W356-E371 HydrophobicContact CZ2-CG 3.59Å; W356-E371 WeakPolarHBondContact CZ2-OE1 3.4Å; R367-E371 VanDerWaalsContact CD-OE1 3.32Å; R367-E371 WeakPolarHBondContact CD-OE1 3.45Å; R367-E371 HydrophobicContact CG-CG 4.2Å; R367-E371 WeakPolarHBondContact CG-OE1 3.47Å; R367-E371 WeakPolarHBondContact O-CG 3.24Å; R367-E371 PolarHBondContact O-N 3.28Å; P368-E371 PolarHBondContact O-N 3.09Å; E371-L373 VanDerWaalsContact C-N 3.32Å; E371-L373 PolarHBondContact O-N 3.38Å; E371-L374 PolarHBondContact O-N 3.18Å; E371-C375 WeakPolarHBondContact O-CB 3.48Å; E371-C375 PolarHBondContact O-N 3.02Å; E371-C375 PolarHBondContact O-SG 3.5Å; E371-C375 VanDerWaalsContact O-SG 3.33Å
372	A	79.6	Confident	78.9	Confident	12 Å²	12	37.9 Å²	37.9	10%	0.099	21%	0.21	C	C	.	.	H	α-helix	trans	-56	-45.5	176.9	0	0	0	0	0	112.4	P368 A370 N376	P368-A372 WeakPolarHBondContact O-CB 3.33Å; P368-A372 PolarHBondContact O-N 3.12Å; A370-A372 PolarHBondContact O-N 2.69Å; A372-N376 PolarHBondContact O-N 3.24Å; A372-N376 PolarHBondContact O-ND2 3.22Å
373	L	78.2	Confident	79.1	Confident	5 Å²	5	39.5 Å²	39.5	3%	0.026	22%	0.222	C	C	.	.	H	α-helix	trans	-69.9	-47.5	-179.6	-171.7	63.2	0	0	0	112.3	A369 A370 E371 H377 V401 W410 V431 P432	A369-L373 PolarHBondContact O-N 3.25Å; A370-L373 PolarHBondContact O-N 2.99Å; E371-L373 VanDerWaalsContact C-N 3.32Å; E371-L373 PolarHBondContact O-N 3.38Å; L373-H377 WeakPolarHBondContact O-CB 3.43Å; L373-H377 PolarHBondContact O-N 2.88Å; L373-V401 HydrophobicContact CB-CG1 3.85Å; L373-W410 HydrophobicContact CD2-CH2 3.57Å; L373-W410 HydrophobicContact CD2-CZ3 3.49Å; L373-W410 VanDerWaalsContact CD2-CZ3 3.49Å; L373-V431 HydrophobicContact CD2-CG1 3.71Å; L373-P432 HydrophobicContact CD1-CG 4.09Å
374	L	76.7	Confident	78.5	Confident	18 Å²	18	41.6 Å²	41.6	9%	0.094	24%	0.235	C	C	.	.	H	α-helix	trans	-67.1	-48.4	-175.6	-73.1	154.7	0	0	0	111.6	L359 A370 E371 N376 H377 I378 L429	L359-L374 HydrophobicContact CD1-CD1 3.12Å; L359-L374 HydrophobicContact CD1-CD2 3.83Å; L359-L374 HydrophobicContact CD1-CG 4.08Å; A370-L374 HydrophobicContact CB-CD1 4.4Å; A370-L374 WeakPolarHBondContact O-CB 3.34Å; A370-L374 VanDerWaalsContact O-CD1 3.26Å; A370-L374 WeakPolarHBondContact O-CD1 3.38Å; A370-L374 WeakPolarHBondContact O-CG 3.4Å; A370-L374 PolarHBondContact O-N 3.36Å; E371-L374 PolarHBondContact O-N 3.18Å; L374-N376 PolarHBondContact O-N 3Å; L374-H377 PolarHBondContact O-N 3.48Å; L374-I378 HydrophobicContact CB-CD1 4.35Å; L374-I378 VanDerWaalsContact O-CB 3.32Å; L374-I378 WeakPolarHBondContact O-CB 3.43Å; L374-I378 VanDerWaalsContact O-CG1 3.22Å; L374-I378 WeakPolarHBondContact O-CG1 3.38Å; L374-I378 PolarHBondContact O-N 3.47Å; L374-L429 HydrophobicContact CD2-CD2 3.8Å
375	C	82.1	Confident	77.7	Confident	3 Å²	3	39.2 Å²	39.2	2%	0.02	23%	0.229	C	C	.	.	H	α-helix	trans	-60.8	-44.1	-178.3	-72.9	0	0	0	0	111.9	C325 V328 E371 H377 F379	C325-C375 WeakPolarHBondContact CA-SG 3.22Å; C325-C375 HydrophobicContact CB-CB 3.54Å; C325-C375 WeakPolarHBondContact CB-SG 3.44Å; C325-C375 VanDerWaalsContact SG-CA 3.54Å; C325-C375 WeakPolarHBondContact SG-CB 3.38Å; C325-C375 CovalentContact SG-SG 2.03Å; C325-C375 PolarHBondContact SG-SG 2.91Å; V328-C375 HydrophobicContact CB-CB 4.17Å; V328-C375 HydrophobicContact CG1-CB 3.83Å; E371-C375 WeakPolarHBondContact O-CB 3.48Å; E371-C375 PolarHBondContact O-N 3.02Å; E371-C375 PolarHBondContact O-SG 3.5Å; E371-C375 VanDerWaalsContact O-SG 3.33Å; C375-H377 VanDerWaalsContact C-N 3.33Å; C375-H377 PolarHBondContact O-N 3.44Å; C375-F379 WeakPolarHBondContact O-CA 3.21Å; C375-F379 WeakPolarHBondContact O-CB 3.48Å; C375-F379 PolarHBondContact O-N 3.45Å
376	N	80.9	Confident	76.8	Confident	14 Å²	14	40.7 Å²	40.7	8%	0.075	24%	0.238	C	C	.	.	H	α-helix	trans	-76.7	-20.1	179	-72.3	-86.9	0	0	0	113.6	V328 A372 L374 I393 L450	V328-N376 WeakPolarHBondContact CG1-ND2 3.35Å; A372-N376 PolarHBondContact O-N 3.24Å; A372-N376 PolarHBondContact O-ND2 3.22Å; L374-N376 PolarHBondContact O-N 3Å; N376-I393 HydrophobicContact CB-CD1 4.47Å; N376-L450 HydrophobicContact CB-CD2 3.73Å; N376-L450 WeakPolarHBondContact ND2-CD2 3.45Å; N376-L450 VanDerWaalsContact OD1-CD2 3.22Å; N376-L450 WeakPolarHBondContact OD1-CD2 3.36Å
377	H	78.3	Confident	76.3	Confident	42 Å²	42	44.3 Å²	44.3	19%	0.194	26%	0.26	C	S	.	.	H	α-helix	trans	-82.4	-42.6	174.6	-174.3	60.5	0	0	0	112.3	L373 L374 C375 Q380 S430 P432	L373-H377 WeakPolarHBondContact O-CB 3.43Å; L373-H377 PolarHBondContact O-N 2.88Å; L374-H377 PolarHBondContact O-N 3.48Å; C375-H377 VanDerWaalsContact C-N 3.33Å; C375-H377 PolarHBondContact O-N 3.44Å; H377-Q380 WeakPolarHBondContact O-CG 3.44Å; H377-Q380 PolarHBondContact O-NE2 2.87Å; H377-S430 PolarHBondContact NE2-O 2.95Å; H377-P432 HydrophobicContact CB-CG 4.39Å
378	I	77.9	Confident	75.8	Confident	12 Å²	12	40.2 Å²	40.2	6%	0.062	25%	0.248	C	C	.	.	H	α-helix	trans	-71	-44.6	178	-65.9	167.7	0	0	0	109.9	L351 A355 L374 L429	L351-I378 HydrophobicContact CB-CG2 4.27Å; A355-I378 HydrophobicContact CB-CD1 3.65Å; L374-I378 HydrophobicContact CB-CD1 4.35Å; L374-I378 VanDerWaalsContact O-CB 3.32Å; L374-I378 WeakPolarHBondContact O-CB 3.43Å; L374-I378 VanDerWaalsContact O-CG1 3.22Å; L374-I378 WeakPolarHBondContact O-CG1 3.38Å; L374-I378 PolarHBondContact O-N 3.47Å; I378-L429 HydrophobicContact CD1-CD1 4.17Å; I378-L429 HydrophobicContact CG1-CD1 4.44Å
379	F	82.2	Confident	75.6	Confident	1 Å²	1	40 Å²	40	0%	0.004	25%	0.246	C	C	.	.	S	Bend	trans	-109.9	79.2	179.9	-57.6	-61.1	0	0	0	111	Y320 C325 L329 V335 L337 Q348 L351 V352 C375	Y320-F379 HydrophobicContact CD2-CD1 4.37Å; Y320-F379 HydrophobicContact CD2-CD2 4.05Å; Y320-F379 HydrophobicContact CD2-CE1 4.4Å; Y320-F379 HydrophobicContact CD2-CE2 4.04Å; Y320-F379 HydrophobicContact CD2-CG 4.2Å; Y320-F379 HydrophobicContact CD2-CZ 4.23Å; Y320-F379 AromaticContact CE2-CD2 3.78Å; Y320-F379 HydrophobicContact CE2-CD2 3.78Å; Y320-F379 HydrophobicContact CE2-CE1 4.3Å; Y320-F379 AromaticContact CE2-CE2 3.38Å; Y320-F379 HydrophobicContact CE2-CE2 3.38Å; Y320-F379 HydrophobicContact CE2-CG 4.35Å; Y320-F379 AromaticContact CE2-CZ 3.7Å; Y320-F379 HydrophobicContact CE2-CZ 3.7Å; C325-F379 HydrophobicContact CB-CD2 4.32Å; C325-F379 HydrophobicContact CB-CE2 4.39Å; L329-F379 HydrophobicContact CD1-CB 3.95Å; L329-F379 HydrophobicContact CD1-CD2 4.04Å; L329-F379 HydrophobicContact CD1-CG 4.3Å; V335-F379 HydrophobicContact CB-CB 3.89Å; V335-F379 HydrophobicContact CB-CD1 4.4Å; V335-F379 HydrophobicContact CG1-CB 3.72Å; V335-F379 HydrophobicContact CG2-CB 4.47Å; V335-F379 HydrophobicContact CG2-CD1 4.16Å; L337-F379 HydrophobicContact CD2-CD1 4.22Å; L337-F379 HydrophobicContact CD2-CE1 4.09Å; Q348-F379 HydrophobicContact CB-CE1 4.12Å; Q348-F379 HydrophobicContact CB-CZ 3.99Å; Q348-F379 HydrophobicContact CG-CE1 3.83Å; Q348-F379 HydrophobicContact CG-CZ 4.21Å; Q348-F379 WeakPolarHBondContact O-CZ 3.44Å; L351-F379 HydrophobicContact CD1-CE1 4.39Å; V352-F379 HydrophobicContact CG2-CD2 4.42Å; V352-F379 HydrophobicContact CG2-CE2 3.23Å; V352-F379 HydrophobicContact CG2-CZ 3.56Å; C375-F379 WeakPolarHBondContact O-CA 3.21Å; C375-F379 WeakPolarHBondContact O-CB 3.48Å; C375-F379 PolarHBondContact O-N 3.45Å
380	Q	83.3	Confident	75.7	Confident	47 Å²	47	41.8 Å²	41.8	22%	0.22	26%	0.256	C	S	.	.			trans	-67.1	139.3	175	-66.4	176.1	-3.7	0	0	109.8	V335 F336 H377 P390	V335-Q380 CarbonylContact C-O 3.39Å; V335-Q380 WeakPolarHBondContact CA-O 3.49Å; F336-Q380 PolarHBondContact N-O 2.93Å; H377-Q380 WeakPolarHBondContact O-CG 3.44Å; H377-Q380 PolarHBondContact O-NE2 2.87Å; Q380-P390 HydrophobicContact CB-CB 4Å; Q380-P390 VanDerWaalsContact OE1-CB 3.26Å
381	E	82.4	Confident	76	Confident	76 Å²	76	43.5 Å²	43.5	36%	0.355	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	146	173.5	-78.7	-175.2	-165.3	0	0	110.1	L334 P390 I391 A448	L334-E381 WeakPolarHBondContact O-CA 3.3Å; E381-P390 CarbonylContact O-C 3.48Å; E381-I391 HydrophobicContact CB-CB 4.17Å; E381-I391 HydrophobicContact CB-CD1 4.44Å; E381-I391 WeakPolarHBondContact O-CB 3.41Å; E381-I391 PolarHBondContact O-N 3.03Å; E381-A448 HydrophobicContact CB-CB 4.22Å; E381-A448 HydrophobicContact CG-CB 4.05Å
382	C	80.1	Confident	76.2	Confident	11 Å²	11	42.5 Å²	42.5	7%	0.074	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	128	-173.2	-157.4	0	0	0	0	111.5	C317 L334 F336	C317-C382 WeakPolarHBondContact CA-SG 3.46Å; C317-C382 HydrophobicContact CB-CB 3.64Å; C317-C382 WeakPolarHBondContact CB-SG 3.39Å; C317-C382 WeakPolarHBondContact SG-CB 3.29Å; C317-C382 CovalentContact SG-SG 2.02Å; C317-C382 PolarHBondContact SG-SG 3.15Å; L334-C382 HydrophobicContact CB-CB 4.37Å; L334-C382 PolarHBondContact O-N 3.48Å; F336-C382 HydrophobicContact CB-CB 4.08Å
383	S	74.6	Confident	76.5	Confident	53 Å²	53	42.3 Å²	42.3	37%	0.371	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	121	169.9	-162.6	0	0	0	0	110.1	T389	S383-T389 PolarHBondContact N-O 3.06Å; S383-T389 VanDerWaalsContact N-O 3.12Å
384	P	63.4	Low	76.9	Confident	83 Å²	83	42 Å²	42	54%	0.539	26%	0.258	S	S	.	.			trans	-72.7	130.1	179.5	28.4	-32.2	0	0	0	111.1
385	G	61	Low	77.4	Confident	56 Å²	56	45.8 Å²	45.8	58%	0.577	27%	0.271	S	S	*	.	S	Bend	trans	-168.2	-178.9	178.9	0	0	0	0	0	111.9	V387	G385-V387 PolarHBondContact O-N 3.16Å
386	V	60.1	Low	77.6	Confident	157 Å²	157	47.7 Å²	47.7	95%	0.952	28%	0.28	S	S	*	.	S	Bend	trans	-58.3	-33.4	177.3	179.7	0	0	0	0	111.4
387	V	68.2	Low	77.7	Confident	78 Å²	78	48.9 Å²	48.9	47%	0.473	28%	0.284	S	S	.	.	S	Bend	trans	-122.9	114.6	167.3	-177	0	0	0	0	106.7	K314 G385 T389	K314-V387 HydrophobicContact CD-CG1 4Å; G385-V387 PolarHBondContact O-N 3.16Å; V387-T389 PolarHBondContact O-N 3.44Å
388	P	70	Confident	78.1	Confident	27 Å²	27	46.9 Å²	46.9	18%	0.175	27%	0.274	C	S	.	.			trans	-65.1	134.4	179.2	22.3	-26.9	0	0	0	110	G315 C317 F336	G315-P388 WeakPolarHBondContact O-CG 3.13Å; C317-P388 VanDerWaalsContact SG-CB 3.53Å; F336-P388 HydrophobicContact CD2-CB 4.32Å; F336-P388 HydrophobicContact CE2-CB 4.33Å; F336-P388 HydrophobicContact CE2-CG 4.43Å
389	T	74.9	Confident	78.4	Confident	76 Å²	76	49.1 Å²	49.1	47%	0.466	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	126.3	-179.7	53.9	0	0	0	0	110.7	S383 V387	S383-T389 PolarHBondContact N-O 3.06Å; S383-T389 VanDerWaalsContact N-O 3.12Å; V387-T389 PolarHBondContact O-N 3.44Å
390	P	80	Confident	78.3	Confident	51 Å²	51	50.1 Å²	50.1	33%	0.331	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	142.1	173.8	27.8	-31.1	0	0	0	111.5	F336 Q380 E381	F336-P390 HydrophobicContact CB-CB 3.86Å; F336-P390 HydrophobicContact CD1-CB 3.79Å; F336-P390 HydrophobicContact CD1-CG 3.99Å; F336-P390 HydrophobicContact CD2-CB 4.28Å; F336-P390 HydrophobicContact CD2-CG 4.42Å; F336-P390 HydrophobicContact CE1-CB 4.35Å; F336-P390 HydrophobicContact CE1-CG 4.03Å; F336-P390 HydrophobicContact CE2-CG 4.46Å; F336-P390 HydrophobicContact CG-CB 3.72Å; F336-P390 HydrophobicContact CG-CG 4.17Å; F336-P390 HydrophobicContact CZ-CG 4.24Å; Q380-P390 HydrophobicContact CB-CB 4Å; Q380-P390 VanDerWaalsContact OE1-CB 3.26Å; E381-P390 CarbonylContact O-C 3.48Å
391	I	83.8	Confident	78	Confident	38 Å²	38	48 Å²	48	20%	0.195	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	114.8	177.1	-54.5	173.9	0	0	0	107.7	E381 A448	E381-I391 HydrophobicContact CB-CB 4.17Å; E381-I391 HydrophobicContact CB-CD1 4.44Å; E381-I391 WeakPolarHBondContact O-CB 3.41Å; E381-I391 PolarHBondContact O-N 3.03Å; I391-A448 HydrophobicContact CG2-CB 4.12Å
392	P	83.1	Confident	77.8	Confident	33 Å²	33	47.4 Å²	47.4	21%	0.214	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-74	159.3	-178.7	31.6	-36.1	0	0	0	111.9	L437 P438 C447 A448	P392-L437 HydrophobicContact CB-CD2 4.24Å; P392-P438 HydrophobicContact CG-CG 3.84Å; P392-C447 CarbonylContact O-C 3.54Å; P392-C447 WeakPolarHBondContact O-CA 3.4Å; P392-C447 VanDerWaalsContact O-CB 3.24Å; P392-C447 WeakPolarHBondContact O-CB 3.37Å; P392-A448 PolarHBondContact O-N 3.29Å
393	I	85.1	Confident	77.7	Confident	7 Å²	7	54.3 Å²	54.3	4%	0.036	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-63.8	144.2	170.8	-171.4	179.3	0	0	0	111.7	N376 C398 L437 L450	N376-I393 HydrophobicContact CB-CD1 4.47Å; I393-C398 HydrophobicContact CG2-CB 4.38Å; I393-L437 HydrophobicContact CG2-CD1 3.63Å; I393-L450 HydrophobicContact CD1-CD1 3.57Å; I393-L450 HydrophobicContact CD1-CD2 3.76Å; I393-L450 HydrophobicContact CD1-CG 3.67Å; I393-L450 HydrophobicContact CG1-CD2 4.33Å; I393-L450 HydrophobicContact CG1-CG 4.26Å
394	C	86.9	Confident	77.7	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-66	143	176.2	-64	0	0	0	0	113.1	E396 Y397 C398 M440 C447 A448	C394-E396 VanDerWaalsContact C-N 3.32Å; C394-E396 PolarHBondContact O-N 3.16Å; C394-Y397 HydrophobicContact CB-CD2 3.9Å; C394-Y397 PolarHBondContact O-N 2.93Å; C394-Y397 VanDerWaalsContact O-N 3.15Å; C394-C398 PolarHBondContact O-N 3.4Å; C394-M440 HydrophobicContact CB-CB 4.34Å; C394-C447 WeakPolarHBondContact CA-SG 3.28Å; C394-C447 HydrophobicContact CB-CB 3.89Å; C394-C447 WeakPolarHBondContact CB-SG 3.23Å; C394-C447 WeakPolarHBondContact SG-CB 3.45Å; C394-C447 PolarHBondContact SG-O 2.83Å; C394-C447 CovalentContact SG-SG 2.04Å; C394-C447 PolarHBondContact SG-SG 2.82Å; C394-A448 PolarHBondContact N-O 3.39Å; C394-A448 PolarHBondContact SG-O 3.15Å; C394-A448 VanDerWaalsContact SG-O 3.34Å
395	R	87.6	Confident	78.4	Confident	97 Å²	97	53.2 Å²	53.2	37%	0.366	30%	0.297	S	S	.	.	H	α-helix	trans	-51.2	-46.4	178.5	168.4	166.8	-178.8	-90.9	-0.1	113.1	Y397 C398 L399 C434 L437 P438	R395-Y397 VanDerWaalsContact C-N 3.31Å; R395-Y397 PolarHBondContact O-N 2.96Å; R395-C398 PolarHBondContact O-N 2.99Å; R395-L399 HydrophobicContact CG-CD1 3.94Å; R395-L399 HydrophobicContact CG-CG 4.46Å; R395-L399 WeakPolarHBondContact O-CB 3.5Å; R395-L399 WeakPolarHBondContact O-CG 2.98Å; R395-L399 PolarHBondContact O-N 3.44Å; R395-C434 VanDerWaalsContact CG-O 3.29Å; R395-C434 WeakPolarHBondContact CG-O 3.47Å; R395-L437 HydrophobicContact CB-CB 4.09Å; R395-P438 WeakPolarHBondContact CB-O 3.42Å; R395-P438 PolarHBondContact N-O 2.94Å
396	E	86.6	Confident	79.3	Confident	43 Å²	43	52.1 Å²	52.1	20%	0.201	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-40.5	-177.3	-64.2	72.4	-156.6	0	0	111.5	C394 A400 S439 M440 H441	C394-E396 VanDerWaalsContact C-N 3.32Å; C394-E396 PolarHBondContact O-N 3.16Å; E396-A400 VanDerWaalsContact O-CB 3.31Å; E396-A400 WeakPolarHBondContact O-CB 3.49Å; E396-A400 PolarHBondContact O-N 3.4Å; E396-S439 WeakPolarHBondContact OE1-CA 3.43Å; E396-S439 VanDerWaalsContact OE1-CB 3.24Å; E396-S439 WeakPolarHBondContact OE1-CB 3.44Å; E396-S439 PolarHBondContact OE1-OG 3.5Å; E396-M440 PolarHBondContact OE2-N 3.36Å; E396-H441 IonicContact OE1-CD2 2.82Å
397	Y	83.3	Confident	80	Confident	39 Å²	39	48.2 Å²	48.2	15%	0.153	26%	0.264	C	S	.	.	H	α-helix	trans	-72.1	-39.8	178.3	-76.2	-94.8	0	0	0	111.7	C394 R395 A400 V401 M440 R449 L450 F455	C394-Y397 HydrophobicContact CB-CD2 3.9Å; C394-Y397 PolarHBondContact O-N 2.93Å; C394-Y397 VanDerWaalsContact O-N 3.15Å; R395-Y397 VanDerWaalsContact C-N 3.31Å; R395-Y397 PolarHBondContact O-N 2.96Å; Y397-A400 PolarHBondContact O-N 2.99Å; Y397-V401 VanDerWaalsContact O-CG2 3.31Å; Y397-V401 WeakPolarHBondContact O-CG2 3.44Å; Y397-V401 PolarHBondContact O-N 3.4Å; Y397-M440 HydrophobicContact CE2-SD 4.01Å; Y397-R449 HydrophobicContact CE1-CB 4.43Å; Y397-R449 HydrophobicContact CE2-CB 4.02Å; Y397-R449 HydrophobicContact CE2-CG 3.9Å; Y397-L450 HydrophobicContact CD1-CB 3.71Å; Y397-L450 HydrophobicContact CD1-CD1 4.4Å; Y397-L450 HydrophobicContact CD1-CG 4.05Å; Y397-L450 HydrophobicContact CE1-CB 4.18Å; Y397-L450 HydrophobicContact CG-CG 4.47Å; Y397-F455 AromaticContact CD1-CE2 3.82Å; Y397-F455 HydrophobicContact CD1-CE2 3.82Å; Y397-F455 AromaticContact CD1-CZ 3.63Å; Y397-F455 HydrophobicContact CD1-CZ 3.63Å; Y397-F455 AromaticContact CE1-CE2 3.41Å; Y397-F455 HydrophobicContact CE1-CE2 3.41Å; Y397-F455 VanDerWaalsContact CE1-CE2 3.41Å; Y397-F455 AromaticContact CE1-CZ 3.75Å; Y397-F455 HydrophobicContact CE1-CZ 3.75Å; Y397-F455 HydrophobicContact CG-CZ 4.37Å; Y397-F455 AromaticContact CZ-CE2 3.92Å
398	C	85.3	Confident	80.1	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.1	-47.1	172.9	-173.1	0	0	0	0	111.5	I393 C394 R395 A400 V401 K402 C434 L437	I393-C398 HydrophobicContact CG2-CB 4.38Å; C394-C398 PolarHBondContact O-N 3.4Å; R395-C398 PolarHBondContact O-N 2.99Å; C398-A400 PolarHBondContact O-N 3.39Å; C398-V401 PolarHBondContact O-N 3.07Å; C398-K402 WeakPolarHBondContact O-CB 3.45Å; C398-K402 PolarHBondContact O-N 2.99Å; C398-C434 HydrophobicContact CB-CB 3.64Å; C398-C434 WeakPolarHBondContact CB-SG 3.37Å; C398-C434 PolarHBondContact O-SG 3.23Å; C398-C434 VanDerWaalsContact O-SG 3.37Å; C398-C434 WeakPolarHBondContact SG-CA 3.43Å; C398-C434 WeakPolarHBondContact SG-CB 3.25Å; C398-C434 CovalentContact SG-SG 2.04Å; C398-C434 PolarHBondContact SG-SG 3.45Å; C398-L437 HydrophobicContact CB-CD1 3.61Å; C398-L437 VanDerWaalsContact SG-CD1 3.58Å
399	L	83.9	Confident	80.4	Confident	58 Å²	58	53.9 Å²	53.9	30%	0.304	28%	0.28	S	S	.	.	H	α-helix	trans	-62.8	-42.2	176.7	-73.3	172.6	0	0	0	111.6	R395 V401 K402 E403 C434	R395-L399 HydrophobicContact CG-CD1 3.94Å; R395-L399 HydrophobicContact CG-CG 4.46Å; R395-L399 WeakPolarHBondContact O-CB 3.5Å; R395-L399 WeakPolarHBondContact O-CG 2.98Å; R395-L399 PolarHBondContact O-N 3.44Å; L399-V401 PolarHBondContact O-N 2.95Å; L399-K402 WeakPolarHBondContact O-CB 3.3Å; L399-K402 PolarHBondContact O-N 2.72Å; L399-E403 WeakPolarHBondContact O-CG 3.37Å; L399-E403 PolarHBondContact O-N 3.26Å; L399-C434 HydrophobicContact CD2-CB 3.7Å; L399-C434 HydrophobicContact CG-CB 3.87Å
400	A	80.8	Confident	80.5	Confident	23 Å²	23	50.9 Å²	50.9	19%	0.19	26%	0.26	C	S	.	.	H	α-helix	trans	-67.1	-37.8	-179.8	0	0	0	0	0	112.5	E396 Y397 C398 K402 E403 L404 F455	E396-A400 VanDerWaalsContact O-CB 3.31Å; E396-A400 WeakPolarHBondContact O-CB 3.49Å; E396-A400 PolarHBondContact O-N 3.4Å; Y397-A400 PolarHBondContact O-N 2.99Å; C398-A400 PolarHBondContact O-N 3.39Å; A400-K402 VanDerWaalsContact C-N 3.34Å; A400-E403 PolarHBondContact O-N 3.26Å; A400-L404 WeakPolarHBondContact O-CB 3.36Å; A400-L404 VanDerWaalsContact O-CG 3.25Å; A400-L404 WeakPolarHBondContact O-CG 3.32Å; A400-L404 PolarHBondContact O-N 3.15Å; A400-F455 HydrophobicContact CB-CD1 4.24Å; A400-F455 HydrophobicContact CB-CE1 3.31Å; A400-F455 HydrophobicContact CB-CZ 3.86Å
401	V	77.2	Confident	80	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-65.5	-39.2	172	177.1	0	0	0	0	111.2	A369 L373 Y397 C398 L399 E403 L404 F405 L450 L453	A369-V401 HydrophobicContact CB-CG1 4.25Å; A369-V401 WeakPolarHBondContact O-CG1 3.3Å; L373-V401 HydrophobicContact CB-CG1 3.85Å; Y397-V401 VanDerWaalsContact O-CG2 3.31Å; Y397-V401 WeakPolarHBondContact O-CG2 3.44Å; Y397-V401 PolarHBondContact O-N 3.4Å; C398-V401 PolarHBondContact O-N 3.07Å; L399-V401 PolarHBondContact O-N 2.95Å; V401-E403 VanDerWaalsContact C-N 3.35Å; V401-E403 PolarHBondContact O-N 3.45Å; V401-L404 PolarHBondContact O-N 3.42Å; V401-F405 WeakPolarHBondContact O-CB 3.32Å; V401-F405 PolarHBondContact O-N 2.95Å; V401-L450 HydrophobicContact CG2-CD1 3.67Å; V401-L453 HydrophobicContact CG2-CD1 3.36Å
402	K	78.9	Confident	79.4	Confident	64 Å²	64	54.4 Å²	54.4	28%	0.278	28%	0.278	S	S	.	.	H	α-helix	trans	-59.4	-42.4	173.8	174.4	171.8	-179.7	156.4	0	112.3	C398 L399 A400 F405 W410 E414	C398-K402 WeakPolarHBondContact O-CB 3.45Å; C398-K402 PolarHBondContact O-N 2.99Å; L399-K402 WeakPolarHBondContact O-CB 3.3Å; L399-K402 PolarHBondContact O-N 2.72Å; A400-K402 VanDerWaalsContact C-N 3.34Å; K402-F405 WeakPolarHBondContact O-CB 3.37Å; K402-F405 PolarHBondContact O-N 3.43Å; K402-W410 HydrophobicContact CB-CH2 3.95Å; K402-W410 HydrophobicContact CB-CZ2 4.07Å; K402-W410 HydrophobicContact CB-CZ3 4.26Å; K402-W410 HydrophobicContact CD-CH2 4.23Å; K402-W410 HydrophobicContact CD-CZ2 3.5Å; K402-W410 VanDerWaalsContact CD-CZ2 3.5Å; K402-W410 HydrophobicContact CG-CD2 4.03Å; K402-W410 HydrophobicContact CG-CE3 4.41Å; K402-W410 HydrophobicContact CG-CH2 4Å; K402-W410 HydrophobicContact CG-CZ2 3.6Å; K402-W410 HydrophobicContact CG-CZ3 4.38Å; K402-E414 IonicContact NZ-OE1 2.71Å; K402-E414 PolarHBondContact NZ-OE1 3.08Å
403	E	77.9	Confident	78.7	Confident	157 Å²	157	53.3 Å²	53.3	73%	0.734	27%	0.27	S	S	*	.	H	α-helix	trans	-71.8	-29.2	177.1	-66.9	-65.7	146	0	0	113.1	L399 A400 V401 F405	L399-E403 WeakPolarHBondContact O-CG 3.37Å; L399-E403 PolarHBondContact O-N 3.26Å; A400-E403 PolarHBondContact O-N 3.26Å; V401-E403 VanDerWaalsContact C-N 3.35Å; V401-E403 PolarHBondContact O-N 3.45Å; E403-F405 VanDerWaalsContact C-N 3.33Å
404	L	74.1	Confident	78	Confident	103 Å²	103	55.7 Å²	55.7	54%	0.539	28%	0.281	S	S	.	.	H	α-helix	trans	-79.5	-16.2	174.1	-70.7	169.1	0	0	0	113	A400 V401 L453	A400-L404 WeakPolarHBondContact O-CB 3.36Å; A400-L404 VanDerWaalsContact O-CG 3.25Å; A400-L404 WeakPolarHBondContact O-CG 3.32Å; A400-L404 PolarHBondContact O-N 3.15Å; V401-L404 PolarHBondContact O-N 3.42Å; L404-L453 HydrophobicContact CD1-CD2 3.64Å
405	F	77.3	Confident	77	Confident	10 Å²	10	60.2 Å²	60.2	4%	0.044	30%	0.302	C	S	.	.	S	Bend	trans	-75.6	146.1	176	-154.9	-78.1	0	0	0	110.4	V362 C366 A369 A370 V401 K402 E403 A407 E409 W410 M413	V362-F405 HydrophobicContact CG1-CZ 4.34Å; V362-F405 HydrophobicContact CG2-CZ 4.33Å; C366-F405 HydrophobicContact CB-CE1 4.49Å; A369-F405 HydrophobicContact CB-CB 4.41Å; A369-F405 HydrophobicContact CB-CD2 4.06Å; A370-F405 VanDerWaalsContact CA-CE2 3.5Å; A370-F405 HydrophobicContact CB-CD2 4.27Å; A370-F405 HydrophobicContact CB-CE2 3.36Å; A370-F405 HydrophobicContact CB-CZ 4.01Å; V401-F405 WeakPolarHBondContact O-CB 3.32Å; V401-F405 PolarHBondContact O-N 2.95Å; K402-F405 WeakPolarHBondContact O-CB 3.37Å; K402-F405 PolarHBondContact O-N 3.43Å; E403-F405 VanDerWaalsContact C-N 3.33Å; F405-A407 PolarHBondContact O-N 3.34Å; F405-E409 HydrophobicContact CD1-CB 4.46Å; F405-E409 HydrophobicContact CE1-CB 3.72Å; F405-W410 HydrophobicContact CB-CE3 3.79Å; F405-W410 HydrophobicContact CB-CZ3 4.43Å; F405-W410 HydrophobicContact CD1-CB 3.74Å; F405-W410 AromaticContact CD1-CE3 3.87Å; F405-W410 HydrophobicContact CD1-CE3 3.87Å; F405-W410 AromaticContact CD2-CE3 3.9Å; F405-W410 HydrophobicContact CD2-CE3 3.9Å; F405-W410 HydrophobicContact CD2-CZ3 4.22Å; F405-W410 HydrophobicContact CE1-CB 4.23Å; F405-W410 HydrophobicContact CE1-CE3 4.39Å; F405-W410 HydrophobicContact CE2-CE3 4.36Å; F405-W410 HydrophobicContact CG-CB 4.5Å; F405-W410 AromaticContact CG-CE3 3.62Å; F405-W410 HydrophobicContact CG-CE3 3.62Å; F405-W410 HydrophobicContact CG-CZ3 4.32Å; F405-M413 HydrophobicContact CE2-CE 4.18Å; F405-M413 HydrophobicContact CZ-CE 4.14Å; F405-M413 HydrophobicContact CZ-SD 4.28Å
406	C	80.8	Confident	75.8	Confident	33 Å²	33	59.4 Å²	59.4	22%	0.223	30%	0.301	C	S	.	.			trans	-65.4	121.2	177.1	-55.1	0	0	0	0	111.4	C366 K408 E409 W410	C366-C406 HydrophobicContact CB-CB 3.84Å; C366-C406 WeakPolarHBondContact CB-SG 3.34Å; C366-C406 WeakPolarHBondContact SG-CB 3.27Å; C366-C406 CovalentContact SG-SG 2Å; C366-C406 PolarHBondContact SG-SG 3.15Å; C406-K408 VanDerWaalsContact C-N 3.28Å; C406-K408 PolarHBondContact O-N 2.84Å; C406-K408 VanDerWaalsContact O-N 3.13Å; C406-E409 HydrophobicContact CB-CB 4.42Å; C406-E409 WeakPolarHBondContact CB-OE2 3.48Å; C406-E409 PolarHBondContact O-N 3.47Å; C406-W410 PolarHBondContact O-N 3.17Å
407	A	74.4	Confident	74.5	Confident	74 Å²	74	59 Å²	59	61%	0.612	30%	0.302	S	S	*	.	H	α-helix	trans	-56.4	-34.3	-170.4	0	0	0	0	0	114.8	F405 L411	F405-A407 PolarHBondContact O-N 3.34Å; A407-L411 WeakPolarHBondContact O-CG 3.33Å; A407-L411 PolarHBondContact O-N 3.34Å
408	K	71.1	Confident	73.3	Confident	172 Å²	172	64.8 Å²	64.8	75%	0.748	33%	0.33	S	S	*	.	H	α-helix	trans	-72.1	-43.9	-179.8	-72.4	-177.2	178.2	179.1	0	111.8	C406 L411 V412	C406-K408 VanDerWaalsContact C-N 3.28Å; C406-K408 PolarHBondContact O-N 2.84Å; C406-K408 VanDerWaalsContact O-N 3.13Å; K408-L411 PolarHBondContact O-N 2.88Å; K408-V412 WeakPolarHBondContact O-CG2 3.48Å; K408-V412 PolarHBondContact O-N 3.48Å
409	E	75.4	Confident	71.8	Confident	53 Å²	53	73 Å²	73	25%	0.248	36%	0.361	C	S	.	.	H	α-helix	trans	-70.3	-34.5	177.7	-67.8	84.9	160.5	0	0	111.3	F405 C406 V412 M413	F405-E409 HydrophobicContact CD1-CB 4.46Å; F405-E409 HydrophobicContact CE1-CB 3.72Å; C406-E409 HydrophobicContact CB-CB 4.42Å; C406-E409 WeakPolarHBondContact CB-OE2 3.48Å; C406-E409 PolarHBondContact O-N 3.47Å; E409-V412 PolarHBondContact O-N 3.38Å; E409-M413 PolarHBondContact O-N 2.99Å
410	W	76.2	Confident	70.1	Confident	13 Å²	13	72.3 Å²	72.3	5%	0.049	37%	0.369	C	S	.	.	H	α-helix	trans	-61.9	-45.5	173.7	-176.1	-89.6	0	0	0	112.1	L373 K402 F405 C406 V412 M413 E414 V431	L373-W410 HydrophobicContact CD2-CH2 3.57Å; L373-W410 HydrophobicContact CD2-CZ3 3.49Å; L373-W410 VanDerWaalsContact CD2-CZ3 3.49Å; K402-W410 HydrophobicContact CB-CH2 3.95Å; K402-W410 HydrophobicContact CB-CZ2 4.07Å; K402-W410 HydrophobicContact CB-CZ3 4.26Å; K402-W410 HydrophobicContact CD-CH2 4.23Å; K402-W410 HydrophobicContact CD-CZ2 3.5Å; K402-W410 VanDerWaalsContact CD-CZ2 3.5Å; K402-W410 HydrophobicContact CG-CD2 4.03Å; K402-W410 HydrophobicContact CG-CE3 4.41Å; K402-W410 HydrophobicContact CG-CH2 4Å; K402-W410 HydrophobicContact CG-CZ2 3.6Å; K402-W410 HydrophobicContact CG-CZ3 4.38Å; F405-W410 HydrophobicContact CB-CE3 3.79Å; F405-W410 HydrophobicContact CB-CZ3 4.43Å; F405-W410 HydrophobicContact CD1-CB 3.74Å; F405-W410 AromaticContact CD1-CE3 3.87Å; F405-W410 HydrophobicContact CD1-CE3 3.87Å; F405-W410 AromaticContact CD2-CE3 3.9Å; F405-W410 HydrophobicContact CD2-CE3 3.9Å; F405-W410 HydrophobicContact CD2-CZ3 4.22Å; F405-W410 HydrophobicContact CE1-CB 4.23Å; F405-W410 HydrophobicContact CE1-CE3 4.39Å; F405-W410 HydrophobicContact CE2-CE3 4.36Å; F405-W410 HydrophobicContact CG-CB 4.5Å; F405-W410 AromaticContact CG-CE3 3.62Å; F405-W410 HydrophobicContact CG-CE3 3.62Å; F405-W410 HydrophobicContact CG-CZ3 4.32Å; C406-W410 PolarHBondContact O-N 3.17Å; W410-V412 VanDerWaalsContact C-N 3.3Å; W410-V412 PolarHBondContact O-N 2.91Å; W410-M413 HydrophobicContact CD2-CE 3.91Å; W410-M413 HydrophobicContact CE3-CE 3.24Å; W410-M413 HydrophobicContact CH2-CE 3.89Å; W410-M413 HydrophobicContact CZ2-CE 4.42Å; W410-M413 HydrophobicContact CZ3-CE 3.25Å; W410-M413 WeakPolarHBondContact O-CB 3.42Å; W410-M413 PolarHBondContact O-N 3.22Å; W410-M413 VanDerWaalsContact O-N 3.12Å; W410-E414 PolarHBondContact NE1-OE1 2.78Å; W410-E414 PolarHBondContact O-N 3.24Å; W410-V431 HydrophobicContact CH2-CG1 3.54Å; W410-V431 HydrophobicContact CZ2-CG1 4.03Å; W410-V431 HydrophobicContact CZ3-CG1 4.25Å
411	L	71.4	Confident	68.3	Low	109 Å²	109	77.9 Å²	77.9	57%	0.571	39%	0.394	S	S	*	.	H	α-helix	trans	-60.2	-39.8	176.5	-77.6	165	0	0	0	112.1	A407 K408 M413 E414 E415	A407-L411 WeakPolarHBondContact O-CG 3.33Å; A407-L411 PolarHBondContact O-N 3.34Å; K408-L411 PolarHBondContact O-N 2.88Å; L411-M413 VanDerWaalsContact C-N 3.34Å; L411-E414 PolarHBondContact O-N 2.75Å; L411-E415 VanDerWaalsContact O-CB 3.31Å; L411-E415 WeakPolarHBondContact O-CB 3.47Å; L411-E415 PolarHBondContact O-N 2.82Å
412	V	69.9	Low	67.1	Low	54 Å²	54	80 Å²	80	33%	0.327	40%	0.403	S	S	.	.	H	α-helix	trans	-64.4	-40.2	175	173.8	0	0	0	0	111.1	K408 E409 W410 K416	K408-V412 WeakPolarHBondContact O-CG2 3.48Å; K408-V412 PolarHBondContact O-N 3.48Å; E409-V412 PolarHBondContact O-N 3.38Å; W410-V412 VanDerWaalsContact C-N 3.3Å; W410-V412 PolarHBondContact O-N 2.91Å; V412-K416 HydrophobicContact CG1-CD 4.36Å; V412-K416 WeakPolarHBondContact O-CB 3.27Å; V412-K416 WeakPolarHBondContact O-CG 2.97Å; V412-K416 PolarHBondContact O-N 3Å
413	M	69.1	Low	65.8	Low	10 Å²	10	86.7 Å²	86.7	5%	0.049	43%	0.426	C	S	.	.	H	α-helix	trans	-67	-43.4	177.5	-166.6	178	56.8	0	0	111.9	L359 F405 E409 W410 L411 T417 V431	L359-M413 HydrophobicContact CD2-CG 4.01Å; L359-M413 HydrophobicContact CD2-SD 3.88Å; F405-M413 HydrophobicContact CE2-CE 4.18Å; F405-M413 HydrophobicContact CZ-CE 4.14Å; F405-M413 HydrophobicContact CZ-SD 4.28Å; E409-M413 PolarHBondContact O-N 2.99Å; W410-M413 HydrophobicContact CD2-CE 3.91Å; W410-M413 HydrophobicContact CE3-CE 3.24Å; W410-M413 HydrophobicContact CH2-CE 3.89Å; W410-M413 HydrophobicContact CZ2-CE 4.42Å; W410-M413 HydrophobicContact CZ3-CE 3.25Å; W410-M413 WeakPolarHBondContact O-CB 3.42Å; W410-M413 PolarHBondContact O-N 3.22Å; W410-M413 VanDerWaalsContact O-N 3.12Å; L411-M413 VanDerWaalsContact C-N 3.34Å; M413-T417 WeakPolarHBondContact O-CB 3.44Å; M413-T417 PolarHBondContact O-N 2.83Å; M413-T417 PolarHBondContact O-OG1 2.8Å; M413-V431 HydrophobicContact CE-CB 4.48Å; M413-V431 HydrophobicContact CE-CG1 3.98Å; M413-V431 HydrophobicContact CE-CG2 3.74Å; M413-V431 HydrophobicContact CG-CG2 3.72Å; M413-V431 HydrophobicContact SD-CG2 3.63Å
414	E	70.1	Confident	64.2	Low	57 Å²	57	84 Å²	84	27%	0.266	43%	0.425	S	S	.	.	H	α-helix	trans	-62.7	-44.3	173.2	-83.6	-176.8	169.8	0	0	111.8	K402 W410 L411 K416 T417 H418	K402-E414 IonicContact NZ-OE1 2.71Å; K402-E414 PolarHBondContact NZ-OE1 3.08Å; W410-E414 PolarHBondContact NE1-OE1 2.78Å; W410-E414 PolarHBondContact O-N 3.24Å; L411-E414 PolarHBondContact O-N 2.75Å; E414-K416 PolarHBondContact O-N 3.31Å; E414-T417 WeakPolarHBondContact O-CB 3.45Å; E414-T417 PolarHBondContact O-N 2.87Å; E414-T417 VanDerWaalsContact O-N 3.17Å; E414-H418 PolarHBondContact O-CD2 2.88Å; E414-H418 PolarHBondContact O-N 3.18Å
415	E	66.1	Low	62.8	Low	95 Å²	95	88.4 Å²	88.4	44%	0.444	44%	0.443	S	S	.	.	H	α-helix	trans	-62.2	-41.6	179	-170.4	-176.3	-178.6	0	0	112.1	L411 T417 H418 R419	L411-E415 VanDerWaalsContact O-CB 3.31Å; L411-E415 WeakPolarHBondContact O-CB 3.47Å; L411-E415 PolarHBondContact O-N 2.82Å; E415-T417 VanDerWaalsContact C-N 3.35Å; E415-H418 PolarHBondContact O-N 2.78Å; E415-R419 PolarHBondContact O-N 2.82Å; E415-R419 IonicContact OE1-CZ 3.18Å; E415-R419 IonicContact OE1-NH1 3.41Å; E415-R419 PolarHBondContact OE1-NH1 2.85Å; E415-R419 IonicContact OE1-NH2 2.66Å; E415-R419 PolarHBondContact OE1-NH2 2.84Å
416	K	62.5	Low	61.5	Low	79 Å²	79	91 Å²	91	34%	0.343	46%	0.456	S	S	.	.	H	α-helix	trans	-68.4	-33.2	175.1	-74	-176.6	175.4	-170.9	0	112.6	V412 E414 R419 Y422	V412-K416 HydrophobicContact CG1-CD 4.36Å; V412-K416 WeakPolarHBondContact O-CB 3.27Å; V412-K416 WeakPolarHBondContact O-CG 2.97Å; V412-K416 PolarHBondContact O-N 3Å; E414-K416 PolarHBondContact O-N 3.31Å; K416-R419 PolarHBondContact O-N 3.46Å; K416-Y422 HydrophobicContact CB-CE2 3.92Å
417	T	59.8	Low	60.1	Low	36 Å²	36	97.9 Å²	97.9	22%	0.221	48%	0.484	C	S	.	.	H	α-helix	trans	-66.6	-41	176.1	-56.3	0	0	0	0	111.3	M413 E414 E415 R419	M413-T417 WeakPolarHBondContact O-CB 3.44Å; M413-T417 PolarHBondContact O-N 2.83Å; M413-T417 PolarHBondContact O-OG1 2.8Å; E414-T417 WeakPolarHBondContact O-CB 3.45Å; E414-T417 PolarHBondContact O-N 2.87Å; E414-T417 VanDerWaalsContact O-N 3.17Å; E415-T417 VanDerWaalsContact C-N 3.35Å; T417-R419 PolarHBondContact O-N 2.81Å
418	H	56.7	Low	59.1	Low	160 Å²	160	96.5 Å²	96.5	74%	0.741	47%	0.466	S	S	*	.	H	α-helix	trans	-72	-23.3	178.4	-79.5	-68.6	0	0	0	114.5	E414 E415 G420	E414-H418 PolarHBondContact O-CD2 2.88Å; E414-H418 PolarHBondContact O-N 3.18Å; E415-H418 PolarHBondContact O-N 2.78Å; H418-G420 VanDerWaalsContact C-N 3.34Å
419	R	53.9	Low	58.3	Low	171 Å²	171	89.9 Å²	89.9	65%	0.645	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	3.5	-179.5	-74.2	-173.5	179.4	158	11	115.1	E415 K416 T417 L421	E415-R419 PolarHBondContact O-N 2.82Å; E415-R419 IonicContact OE1-CZ 3.18Å; E415-R419 IonicContact OE1-NH1 3.41Å; E415-R419 PolarHBondContact OE1-NH1 2.85Å; E415-R419 IonicContact OE1-NH2 2.66Å; E415-R419 PolarHBondContact OE1-NH2 2.84Å; K416-R419 PolarHBondContact O-N 3.46Å; T417-R419 PolarHBondContact O-N 2.81Å; R419-L421 HydrophobicContact CB-CD1 4.47Å; R419-L421 PolarHBondContact O-N 2.81Å; R419-L421 VanDerWaalsContact O-N 3.17Å
420	G	48.3	Very low	57.6	Low	45 Å²	45	90.6 Å²	90.6	46%	0.464	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	10.5	171.1	0	0	0	0	0	116.1	H418 Y422 R423	H418-G420 VanDerWaalsContact C-N 3.34Å; G420-Y422 PolarHBondContact O-N 3.16Å; G420-R423 PolarHBondContact O-N 3.31Å
421	L	43.9	Very low	57.1	Low	139 Å²	139	91.2 Å²	91.2	73%	0.728	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-11.5	179.4	-90.3	147.1	0	0	0	114.2	R419 R423	R419-L421 HydrophobicContact CB-CD1 4.47Å; R419-L421 PolarHBondContact O-N 2.81Å; R419-L421 VanDerWaalsContact O-N 3.17Å; L421-R423 VanDerWaalsContact C-N 3.28Å; L421-R423 PolarHBondContact O-N 2.9Å
422	Y	52.6	Low	57.2	Low	46 Å²	46	86.7 Å²	86.7	18%	0.18	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	8.4	174.1	-71.4	-82.2	0	0	0	114.2	E358 K416 G420 L429	E358-Y422 HydrophobicContact CB-CD1 4.3Å; E358-Y422 HydrophobicContact CB-CE1 3.55Å; E358-Y422 HydrophobicContact CG-CD1 4.43Å; E358-Y422 HydrophobicContact CG-CE1 4.17Å; K416-Y422 HydrophobicContact CB-CE2 3.92Å; G420-Y422 PolarHBondContact O-N 3.16Å; Y422-L429 WeakPolarHBondContact CB-O 3.45Å; Y422-L429 HydrophobicContact CD1-CB 4.16Å
423	R	50.3	Low	57.7	Low	204 Å²	204	89 Å²	89	77%	0.77	44%	0.439	S	S	*	.			trans	-105.6	89.1	178.1	-81.5	-170.9	-178.5	-174.4	1.5	111.9	G420 L421	G420-R423 PolarHBondContact O-N 3.31Å; L421-R423 VanDerWaalsContact C-N 3.28Å; L421-R423 PolarHBondContact O-N 2.9Å
424	S	44.3	Very low	58.3	Low	102 Å²	102	88.9 Å²	88.9	71%	0.713	44%	0.439	S	S	*	.	S	Bend	trans	-139.4	112.9	142.2	59.8	0	0	0	0	109.3	M426	S424-M426 PolarHBondContact O-N 3.39Å
425	E	45.7	Very low	58.9	Low	194 Å²	194	90.3 Å²	90.3	91%	0.907	46%	0.455	S	S	*	.	S	Bend	trans	80	-17	159.3	-56.3	-176.9	169.8	0	0	120.8
426	M	50	Low	59.8	Low	66 Å²	66	93 Å²	93	33%	0.325	47%	0.465	S	S	.	.			trans	-121.3	1.7	-178.9	-86	-169.2	-101.4	0	0	118.7	Y341 L351 S424 L428	Y341-M426 PolarHBondContact OH-SD 2.85Å; L351-M426 HydrophobicContact CD2-SD 3.86Å; S424-M426 PolarHBondContact O-N 3.39Å; M426-L428 HydrophobicContact CB-CD1 4.48Å; M426-L428 VanDerWaalsContact O-CB 3.29Å; M426-L428 WeakPolarHBondContact O-CB 3.34Å; M426-L428 VanDerWaalsContact O-CD1 3.23Å; M426-L428 WeakPolarHBondContact O-CD1 3.35Å; M426-L428 VanDerWaalsContact O-CG 3.3Å; M426-L428 WeakPolarHBondContact O-CG 3.26Å; M426-L428 PolarHBondContact O-N 2.8Å
427	H	50.9	Low	60.8	Low	177 Å²	177	90.7 Å²	90.7	82%	0.819	46%	0.457	S	S	*	.			trans	52.5	7	176.3	-72.8	-57.1	0	0	0	118
428	L	52.5	Low	62.1	Low	45 Å²	45	91.1 Å²	91.1	24%	0.236	46%	0.46	C	S	.	.			trans	-106.4	0.7	-155.8	-97.6	149.2	0	0	0	117	L351 M426	L351-L428 HydrophobicContact CD2-CD1 3.59Å; M426-L428 HydrophobicContact CB-CD1 4.48Å; M426-L428 VanDerWaalsContact O-CB 3.29Å; M426-L428 WeakPolarHBondContact O-CB 3.34Å; M426-L428 VanDerWaalsContact O-CD1 3.23Å; M426-L428 WeakPolarHBondContact O-CD1 3.35Å; M426-L428 VanDerWaalsContact O-CG 3.3Å; M426-L428 WeakPolarHBondContact O-CG 3.26Å; M426-L428 PolarHBondContact O-N 2.8Å
429	L	55.3	Low	63.3	Low	33 Å²	33	84.5 Å²	84.5	17%	0.173	43%	0.432	C	S	.	.			trans	-135	85.2	-177.9	-92.9	104.2	0	0	0	114	A355 L374 I378 Y422	A355-L429 HydrophobicContact CB-CD1 3.61Å; A355-L429 HydrophobicContact CB-CD2 3.4Å; A355-L429 HydrophobicContact CB-CG 4.1Å; L374-L429 HydrophobicContact CD2-CD2 3.8Å; I378-L429 HydrophobicContact CD1-CD1 4.17Å; I378-L429 HydrophobicContact CG1-CD1 4.44Å; Y422-L429 WeakPolarHBondContact CB-O 3.45Å; Y422-L429 HydrophobicContact CD1-CB 4.16Å
430	S	60.3	Low	64.6	Low	68 Å²	68	78.4 Å²	78.4	48%	0.476	41%	0.412	S	S	.	.			trans	-116.5	130.7	150.2	59.2	0	0	0	0	107.8	H377	H377-S430 PolarHBondContact NE2-O 2.95Å
431	V	66.5	Low	66	Low	26 Å²	26	83.5 Å²	83.5	16%	0.158	42%	0.423	C	S	.	.			trans	-55	129.5	171.2	-176.4	0	0	0	0	108.4	L373 W410 M413 E433	L373-V431 HydrophobicContact CD2-CG1 3.71Å; W410-V431 HydrophobicContact CH2-CG1 3.54Å; W410-V431 HydrophobicContact CZ2-CG1 4.03Å; W410-V431 HydrophobicContact CZ3-CG1 4.25Å; M413-V431 HydrophobicContact CE-CB 4.48Å; M413-V431 HydrophobicContact CE-CG1 3.98Å; M413-V431 HydrophobicContact CE-CG2 3.74Å; M413-V431 HydrophobicContact CG-CG2 3.72Å; M413-V431 HydrophobicContact SD-CG2 3.63Å; V431-E433 PolarHBondContact O-N 2.83Å
432	P	72.6	Confident	67.4	Low	13 Å²	13	87.9 Å²	87.9	8%	0.084	43%	0.43	C	S	.	.			trans	-63.4	135.4	-174.1	23.5	-32.6	0	0	0	110.8	L373 H377 C434 L437	L373-P432 HydrophobicContact CD1-CG 4.09Å; H377-P432 HydrophobicContact CB-CG 4.39Å; P432-C434 PolarHBondContact O-N 3.3Å; P432-L437 HydrophobicContact CB-CD1 4.3Å
433	E	79.8	Confident	68.3	Low	104 Å²	104	89.1 Å²	89.1	49%	0.486	44%	0.44	S	S	.	.			trans	-69.6	97.5	167.8	-77	-176.7	-132.6	0	0	109	V431 S435 K436	V431-E433 PolarHBondContact O-N 2.83Å; E433-S435 PolarHBondContact O-N 3.01Å; E433-K436 HydrophobicContact CB-CB 4.37Å; E433-K436 HydrophobicContact CB-CD 4.06Å; E433-K436 HydrophobicContact CB-CG 4.2Å; E433-K436 PolarHBondContact O-N 3.35Å; E433-K436 IonicContact OE1-NZ 2.84Å; E433-K436 PolarHBondContact OE1-NZ 3.17Å; E433-K436 VanDerWaalsContact OE2-CD 3.25Å; E433-K436 WeakPolarHBondContact OE2-CD 3.31Å; E433-K436 WeakPolarHBondContact OE2-CE 3.4Å; E433-K436 IonicContact OE2-NZ 2.74Å; E433-K436 PolarHBondContact OE2-NZ 3.19Å
434	C	83.4	Confident	69.1	Low	7 Å²	7	83.1 Å²	83.1	5%	0.047	43%	0.427	C	S	.	.	G	3₁₀ helix	trans	-55.1	-28.6	-174.3	-58.6	0	0	0	0	113.8	R395 C398 L399 P432 K436 L437	R395-C434 VanDerWaalsContact CG-O 3.29Å; R395-C434 WeakPolarHBondContact CG-O 3.47Å; C398-C434 HydrophobicContact CB-CB 3.64Å; C398-C434 WeakPolarHBondContact CB-SG 3.37Å; C398-C434 PolarHBondContact O-SG 3.23Å; C398-C434 VanDerWaalsContact O-SG 3.37Å; C398-C434 WeakPolarHBondContact SG-CA 3.43Å; C398-C434 WeakPolarHBondContact SG-CB 3.25Å; C398-C434 CovalentContact SG-SG 2.04Å; C398-C434 PolarHBondContact SG-SG 3.45Å; L399-C434 HydrophobicContact CD2-CB 3.7Å; L399-C434 HydrophobicContact CG-CB 3.87Å; P432-C434 PolarHBondContact O-N 3.3Å; C434-K436 PolarHBondContact O-N 2.78Å; C434-L437 PolarHBondContact O-N 3.27Å
435	S	82.4	Confident	70.5	Confident	86 Å²	86	83.8 Å²	83.8	60%	0.601	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-66	-22.4	176.3	49.9	0	0	0	0	114.1	E433	E433-S435 PolarHBondContact O-N 3.01Å
436	K	83.4	Confident	72	Confident	151 Å²	151	76.3 Å²	76.3	66%	0.657	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-93.5	-3.8	-179.5	-68.5	-179.1	174.9	155.9	0	113.8	E433 C434	E433-K436 HydrophobicContact CB-CB 4.37Å; E433-K436 HydrophobicContact CB-CD 4.06Å; E433-K436 HydrophobicContact CB-CG 4.2Å; E433-K436 PolarHBondContact O-N 3.35Å; E433-K436 IonicContact OE1-NZ 2.84Å; E433-K436 PolarHBondContact OE1-NZ 3.17Å; E433-K436 VanDerWaalsContact OE2-CD 3.25Å; E433-K436 WeakPolarHBondContact OE2-CD 3.31Å; E433-K436 WeakPolarHBondContact OE2-CE 3.4Å; E433-K436 IonicContact OE2-NZ 2.74Å; E433-K436 PolarHBondContact OE2-NZ 3.19Å; C434-K436 PolarHBondContact O-N 2.78Å
437	L	85.1	Confident	73.6	Confident	31 Å²	31	73.5 Å²	73.5	16%	0.162	39%	0.385	C	S	.	.	S	Bend	trans	-83.5	155.9	-178.5	-66.3	175.1	0	0	0	112.3	P392 I393 R395 C398 P432 C434	P392-L437 HydrophobicContact CB-CD2 4.24Å; I393-L437 HydrophobicContact CG2-CD1 3.63Å; R395-L437 HydrophobicContact CB-CB 4.09Å; C398-L437 HydrophobicContact CB-CD1 3.61Å; C398-L437 VanDerWaalsContact SG-CD1 3.58Å; P432-L437 HydrophobicContact CB-CD1 4.3Å; C434-L437 PolarHBondContact O-N 3.27Å
438	P	85.7	Confident	75	Confident	45 Å²	45	65.6 Å²	65.6	29%	0.292	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-62.5	141.2	176.3	-16.8	29.9	0	0	0	111.3	P392 R395 A446 C447	P392-P438 HydrophobicContact CG-CG 3.84Å; R395-P438 WeakPolarHBondContact CB-O 3.42Å; R395-P438 PolarHBondContact N-O 2.94Å; P438-A446 HydrophobicContact CB-CB 4.09Å; P438-C447 HydrophobicContact CB-CB 4.09Å; P438-C447 HydrophobicContact CG-CB 4.32Å
439	S	82.6	Confident	76.3	Confident	22 Å²	22	69.2 Å²	69.2	15%	0.154	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-92.8	129.5	176.7	170.8	0	0	0	0	110.5	E396 H441 W442	E396-S439 WeakPolarHBondContact OE1-CA 3.43Å; E396-S439 VanDerWaalsContact OE1-CB 3.24Å; E396-S439 WeakPolarHBondContact OE1-CB 3.44Å; E396-S439 PolarHBondContact OE1-OG 3.5Å; S439-H441 PolarHBondContact O-N 3.46Å; S439-H441 VanDerWaalsContact O-N 3.12Å; S439-H441 PolarHBondContact OG-N 3.15Å; S439-W442 PolarHBondContact O-N 3.34Å
440	M	80.6	Confident	77.1	Confident	43 Å²	43	68.2 Å²	68.2	21%	0.212	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-21	179.9	-167.6	-173.6	86.2	0	0	112.9	C394 E396 Y397 W442 R449	C394-M440 HydrophobicContact CB-CB 4.34Å; E396-M440 PolarHBondContact OE2-N 3.36Å; Y397-M440 HydrophobicContact CE2-SD 4.01Å; M440-W442 VanDerWaalsContact C-N 3.33Å; M440-R449 HydrophobicContact SD-CG 3.93Å; M440-R449 PolarHBondContact SD-NE 3.08Å; M440-R449 PolarHBondContact SD-NH2 3.36Å
441	H	79.1	Confident	77	Confident	151 Å²	151	68.5 Å²	68.5	70%	0.699	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-23.1	-179.6	-71.4	-65.6	0	0	0	113.9	E396 S439	E396-H441 IonicContact OE1-CD2 2.82Å; S439-H441 PolarHBondContact O-N 3.46Å; S439-H441 VanDerWaalsContact O-N 3.12Å; S439-H441 PolarHBondContact OG-N 3.15Å
442	W	71.8	Confident	76.6	Confident	231 Å²	231	73.4 Å²	73.4	88%	0.875	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-37.2	-174.5	-62.7	81.1	0	0	0	112.2	S439 M440	S439-W442 PolarHBondContact O-N 3.34Å; M440-W442 VanDerWaalsContact C-N 3.33Å
443	D	72.4	Confident	75.8	Confident	73 Å²	73	75 Å²	75	39%	0.39	38%	0.384	S	S	.	.			trans	-146.9	105.5	172.2	-176.1	-11.1	0	0	0	109.5	T445 A446	D443-T445 PolarHBondContact O-N 3.27Å; D443-T445 VanDerWaalsContact O-N 3.13Å; D443-T445 PolarHBondContact OD1-N 3.49Å; D443-T445 PolarHBondContact OD1-OG1 3Å; D443-A446 HydrophobicContact CB-CB 3.82Å; D443-A446 PolarHBondContact O-N 3.36Å; D443-A446 PolarHBondContact OD1-N 3.08Å
444	P	67.7	Low	74.1	Confident	78 Å²	78	74.8 Å²	74.8	51%	0.506	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-12.7	-179.6	-19.5	31.3	0	0	0	114.5
445	T	72.8	Confident	72.4	Confident	116 Å²	116	79.1 Å²	79.1	71%	0.712	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-10.4	-177.4	64.2	0	0	0	0	113.4	D443 C447	D443-T445 PolarHBondContact O-N 3.27Å; D443-T445 VanDerWaalsContact O-N 3.13Å; D443-T445 PolarHBondContact OD1-N 3.49Å; D443-T445 PolarHBondContact OD1-OG1 3Å; T445-C447 VanDerWaalsContact C-N 3.29Å; T445-C447 PolarHBondContact O-N 2.92Å
446	A	78.1	Confident	70.1	Confident	37 Å²	37	79.9 Å²	79.9	31%	0.306	42%	0.422	S	S	.	.	S	Bend	trans	-77.4	-10.4	-179.2	0	0	0	0	0	114.2	P438 D443	P438-A446 HydrophobicContact CB-CB 4.09Å; D443-A446 HydrophobicContact CB-CB 3.82Å; D443-A446 PolarHBondContact O-N 3.36Å; D443-A446 PolarHBondContact OD1-N 3.08Å
447	C	82.1	Confident	67.7	Low	7 Å²	7	78.2 Å²	78.2	5%	0.047	43%	0.426	C	S	.	.	S	Bend	trans	-151.8	154.5	-177.2	61.6	0	0	0	0	113.2	P392 C394 P438 T445	P392-C447 CarbonylContact O-C 3.54Å; P392-C447 WeakPolarHBondContact O-CA 3.4Å; P392-C447 VanDerWaalsContact O-CB 3.24Å; P392-C447 WeakPolarHBondContact O-CB 3.37Å; C394-C447 WeakPolarHBondContact CA-SG 3.28Å; C394-C447 HydrophobicContact CB-CB 3.89Å; C394-C447 WeakPolarHBondContact CB-SG 3.23Å; C394-C447 WeakPolarHBondContact SG-CB 3.45Å; C394-C447 PolarHBondContact SG-O 2.83Å; C394-C447 CovalentContact SG-SG 2.04Å; C394-C447 PolarHBondContact SG-SG 2.82Å; P438-C447 HydrophobicContact CB-CB 4.09Å; P438-C447 HydrophobicContact CG-CB 4.32Å; T445-C447 VanDerWaalsContact C-N 3.29Å; T445-C447 PolarHBondContact O-N 2.92Å
448	A	81.2	Confident	65	Low	11 Å²	11	86.1 Å²	86.1	9%	0.091	47%	0.465	C	S	.	.	B	Isolated β-bridge	trans	-87.6	144.3	178.6	0	0	0	0	0	111.9	E381 I391 P392 C394	E381-A448 HydrophobicContact CB-CB 4.22Å; E381-A448 HydrophobicContact CG-CB 4.05Å; I391-A448 HydrophobicContact CG2-CB 4.12Å; P392-A448 PolarHBondContact O-N 3.29Å; C394-A448 PolarHBondContact N-O 3.39Å; C394-A448 PolarHBondContact SG-O 3.15Å; C394-A448 VanDerWaalsContact SG-O 3.34Å
449	R	80.1	Confident	62.3	Low	120 Å²	120	89.8 Å²	89.8	45%	0.453	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-98.6	146.1	177.6	-60.3	-179.2	-169.7	-171.2	-5.7	110.1	Y397 M440 P451	Y397-R449 HydrophobicContact CE1-CB 4.43Å; Y397-R449 HydrophobicContact CE2-CB 4.02Å; Y397-R449 HydrophobicContact CE2-CG 3.9Å; M440-R449 HydrophobicContact SD-CG 3.93Å; M440-R449 PolarHBondContact SD-NE 3.08Å; M440-R449 PolarHBondContact SD-NH2 3.36Å; R449-P451 WeakPolarHBondContact O-CD 3.48Å
450	L	71.3	Confident	60	Low	12 Å²	12	94.5 Å²	94.5	6%	0.063	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-81.5	118.1	176.6	-63.5	-179	0	0	0	111.1	N376 I393 Y397 V401 H452 L453	N376-L450 HydrophobicContact CB-CD2 3.73Å; N376-L450 WeakPolarHBondContact ND2-CD2 3.45Å; N376-L450 VanDerWaalsContact OD1-CD2 3.22Å; N376-L450 WeakPolarHBondContact OD1-CD2 3.36Å; I393-L450 HydrophobicContact CD1-CD1 3.57Å; I393-L450 HydrophobicContact CD1-CD2 3.76Å; I393-L450 HydrophobicContact CD1-CG 3.67Å; I393-L450 HydrophobicContact CG1-CD2 4.33Å; I393-L450 HydrophobicContact CG1-CG 4.26Å; Y397-L450 HydrophobicContact CD1-CB 3.71Å; Y397-L450 HydrophobicContact CD1-CD1 4.4Å; Y397-L450 HydrophobicContact CD1-CG 4.05Å; Y397-L450 HydrophobicContact CE1-CB 4.18Å; Y397-L450 HydrophobicContact CG-CG 4.47Å; V401-L450 HydrophobicContact CG2-CD1 3.67Å; L450-H452 VanDerWaalsContact C-N 3.31Å; L450-H452 PolarHBondContact O-N 2.99Å; L450-L453 HydrophobicContact CB-CD1 3.98Å; L450-L453 HydrophobicContact CD1-CD1 3.3Å; L450-L453 HydrophobicContact CG-CD1 4.28Å
451	P	58.8	Low	57.6	Low	75 Å²	75	97.6 Å²	97.6	49%	0.487	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-17.3	-174.1	23.7	-29.6	0	0	0	114.6	R449	R449-P451 WeakPolarHBondContact O-CD 3.48Å
452	H	57.8	Low	55.2	Low	129 Å²	129	100.3 Å²	100.3	60%	0.597	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.7	5.1	-168.1	-70.7	-66.5	0	0	0	116.5	L450	L450-H452 VanDerWaalsContact C-N 3.31Å; L450-H452 PolarHBondContact O-N 2.99Å
453	L	56.2	Low	53.7	Low	45 Å²	45	95.1 Å²	95.1	24%	0.236	55%	0.551	C	S	.	*			trans	-96.9	102.3	175.9	-78.9	151	0	0	0	110.8	V401 L404 L450 F455	V401-L453 HydrophobicContact CG2-CD1 3.36Å; L404-L453 HydrophobicContact CD1-CD2 3.64Å; L450-L453 HydrophobicContact CB-CD1 3.98Å; L450-L453 HydrophobicContact CD1-CD1 3.3Å; L450-L453 HydrophobicContact CG-CD1 4.28Å; L453-F455 HydrophobicContact CB-CE1 4.37Å; L453-F455 HydrophobicContact CB-CZ 4.31Å; L453-F455 PolarHBondContact O-N 2.74Å
454	A	44.7	Very low	51.6	Low	101 Å²	101	97.5 Å²	97.5	84%	0.835	57%	0.574	S	S	*	*			trans	-71.6	102.9	166.8	0	0	0	0	0	109.1
455	F	47.3	Very low	49.9	Very low	98 Å²	98	99.6 Å²	99.6	43%	0.43	59%	0.585	S	S	.	*	P	Polyproline II helix	trans	-74	131.2	171.8	-62.9	-62.1	0	0	0	110.3	Y397 A400 L453	Y397-F455 AromaticContact CD1-CE2 3.82Å; Y397-F455 HydrophobicContact CD1-CE2 3.82Å; Y397-F455 AromaticContact CD1-CZ 3.63Å; Y397-F455 HydrophobicContact CD1-CZ 3.63Å; Y397-F455 AromaticContact CE1-CE2 3.41Å; Y397-F455 HydrophobicContact CE1-CE2 3.41Å; Y397-F455 VanDerWaalsContact CE1-CE2 3.41Å; Y397-F455 AromaticContact CE1-CZ 3.75Å; Y397-F455 HydrophobicContact CE1-CZ 3.75Å; Y397-F455 HydrophobicContact CG-CZ 4.37Å; Y397-F455 AromaticContact CZ-CE2 3.92Å; A400-F455 HydrophobicContact CB-CD1 4.24Å; A400-F455 HydrophobicContact CB-CE1 3.31Å; A400-F455 HydrophobicContact CB-CZ 3.86Å; L453-F455 HydrophobicContact CB-CE1 4.37Å; L453-F455 HydrophobicContact CB-CZ 4.31Å; L453-F455 PolarHBondContact O-N 2.74Å
456	P	34.4	Very low	47.7	Very low	102 Å²	102	101.1 Å²	101.1	66%	0.662	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-68.3	144.5	157.4	27.1	-26.9	0	0	0	108.9	M458	P456-M458 PolarHBondContact O-N 3.4Å
457	P	31.7	Very low	45.3	Very low	115 Å²	115	106.4 Å²	106.4	75%	0.747	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-61.4	126.3	-179.6	23.7	-31.1	0	0	0	110.1	T459	P457-T459 PolarHBondContact O-N 3.17Å
458	M	29.2	Very low	43.8	Very low	197 Å²	197	110.5 Å²	110.5	97%	0.97	64%	0.637	S	S	*	*			trans	-64.6	96	173	-80.8	-171.5	160.9	0	0	109.7	P456	P456-M458 PolarHBondContact O-N 3.4Å
459	T	29.7	Very low	41.3	Very low	122 Å²	122	117.5 Å²	117.5	75%	0.748	67%	0.673	S	S	*	*			trans	-88.6	125.5	161.5	48.7	0	0	0	0	109	P457 S461	P457-T459 PolarHBondContact O-N 3.17Å; T459-S461 PolarHBondContact O-N 3.4Å
460	S	34.1	Very low	38.7	Very low	122 Å²	122	119.4 Å²	119.4	85%	0.853	69%	0.691	S	S	*	*			trans	-72	101.6	175.1	58.3	0	0	0	0	110.6
461	S	30.4	Very low	37.3	Very low	108 Å²	108	123.9 Å²	123.9	76%	0.755	72%	0.721	S	S	*	*			trans	-173.8	122.7	150.7	49.2	0	0	0	0	111.4	T459	T459-S461 PolarHBondContact O-N 3.4Å
462	K	28.5	Very low	35.8	Very low	208 Å²	208	125.2 Å²	125.2	90%	0.904	73%	0.732	S	S	*	*			trans	-70.9	161.8	166.4	-101.5	-177.5	177.8	178.3	0	111.4
463	P	39.7	Very low	34.2	Very low	121 Å²	121	123.9 Å²	123.9	79%	0.786	74%	0.737	S	S	*	*			trans	-97.2	159.9	-160.3	37.9	-33.6	0	0	0	114.1
464	S	28.4	Very low	32.8	Very low	123 Å²	123	126.7 Å²	126.7	86%	0.86	76%	0.76	S	S	*	*			trans	-147	144.4	156	57.4	0	0	0	0	111.5
465	V	30.8	Very low	31.8	Very low	122 Å²	122	127.7 Å²	127.7	74%	0.739	76%	0.762	S	S	*	*			trans	-96.1	141.4	-164.8	169.1	0	0	0	0	111
466	D	28.2	Very low	30.9	Very low	148 Å²	148	127.9 Å²	127.9	79%	0.791	78%	0.775	S	S	*	*				156.9	156.9	126	-94	-39.1	0	0	0	115.7
467	I	26.5	Very low	30.5	Very low	148 Å²	148	127.5 Å²	127.5	76%	0.759	78%	0.775	S	S	*	*			trans	-97.2	-164.7	-155.9	-39.1	176	0	0	0	112.3
468	P	52.2	Low	30.2	Very low	94 Å²	94	131.5 Å²	131.5	61%	0.61	78%	0.781	S	S	*	*				-109.8	174.8	-100.8	35.6	-17.9	0	0	0	115.9
469	N	27.3	Very low	30.1	Very low	157 Å²	157	127 Å²	127	84%	0.84	77%	0.769	S	S	*	*				168.1	141.2	120.3	-85.9	-39.1	0	0	0	115
470	L	26.6	Very low	30.3	Very low	161 Å²	161	127.3 Å²	127.3	84%	0.843	77%	0.77	S	S	*	*			trans	-65.3	179.5	160.8	-102	91.6	0	0	0	111.7
471	P	42.2	Very low	30.4	Very low	106 Å²	106	127 Å²	127	69%	0.688	77%	0.768	S	S	*	*			cis	-142.4	-175.5	5.3	29.8	-4.7	0	0	0	116.3
472	S	25.4	Very low	31.2	Very low	103 Å²	103	127.1 Å²	127.1	72%	0.72	77%	0.766	S	S	*	*			trans	104.2	126.4	132.9	71.9	0	0	0	0	122.5
473	S	25.1	Very low	31.8	Very low	100 Å²	100	123 Å²	123	70%	0.699	76%	0.759	S	S	*	*			trans	71.2	111.5	135.1	63.8	0	0	0	0	122
474	S	26.8	Very low	32	Very low	104 Å²	104	127.5 Å²	127.5	73%	0.727	76%	0.762	S	S	*	*				39.4	126.2	127.7	65.2	0	0	0	0	120.1
475	S	24.2	Very low	33.3	Very low	123 Å²	123	125.9 Å²	125.9	86%	0.86	75%	0.75	S	S	*	*				174.7	155.5	103.2	46.4	0	0	0	0	111.5
476	S	27.7	Very low	34.3	Very low	102 Å²	102	126.7 Å²	126.7	71%	0.713	75%	0.748	S	S	*	*			trans	-70.5	156.2	-170.3	49.8	0	0	0	0	116.3
477	S	26.2	Very low	35.6	Very low	94 Å²	94	124.8 Å²	124.8	66%	0.657	74%	0.741	S	S	*	*				131.5	148	114.7	68	0	0	0	0	117.8
478	F	25.4	Very low	37	Very low	199 Å²	199	122.4 Å²	122.4	87%	0.873	73%	0.733	S	S	*	*			trans	74.6	140.5	170.3	-67.8	-91.1	0	0	0	117.6
479	S	26.9	Very low	37.3	Very low	103 Å²	103	122.1 Å²	122.1	72%	0.72	73%	0.726	S	S	*	*			cis	-173	149	-7.4	41.9	0	0	0	0	111.2
480	V	33.2	Very low	38.8	Very low	128 Å²	128	120.1 Å²	120.1	78%	0.776	71%	0.714	S	S	*	*			trans	-22.4	138.3	165.7	-168.3	0	0	0	0	116.7
481	S	36.2	Very low	40.4	Very low	115 Å²	115	115.7 Å²	115.7	80%	0.804	70%	0.696	S	S	*	*				-175.2	161.1	86.1	-56.9	0	0	0	0	115.8
482	P	48.2	Very low	41.6	Very low	111 Å²	111	115.8 Å²	115.8	72%	0.721	69%	0.69	S	S	*	*			trans	-117.2	148.6	-159.6	38.6	-23.9	0	0	0	115.1
483	T	41.1	Very low	43.5	Very low	121 Å²	121	116.7 Å²	116.7	74%	0.742	68%	0.684	S	S	*	*			trans	-146.5	153.3	152	45.4	0	0	0	0	109.4
484	Y	42.8	Very low	45.5	Very low	216 Å²	216	114.7 Å²	114.7	85%	0.847	67%	0.67	S	S	*	*			trans	91.6	71.5	-179.1	-51.5	-72.9	0	0	0	117.4
485	S	56.6	Low	47.6	Very low	88 Å²	88	113 Å²	113	62%	0.615	66%	0.659	S	S	*	*			trans	-150	53.9	162.1	-175.7	0	0	0	0	113.7
486	M	51	Low	50.1	Low	140 Å²	140	113.4 Å²	113.4	69%	0.69	65%	0.645	S	S	*	*	S	Bend	trans	-138.9	-28.6	169.6	-85.8	-61.6	-169.8	0	0	114.9	I490	M486-I490 WeakPolarHBondContact O-CG1 3.45Å
487	T	55.3	Low	52.4	Low	108 Å²	108	110.9 Å²	110.9	66%	0.663	63%	0.63	S	S	*	*	H	α-helix	trans	-76.7	-32.5	-177.4	43.5	0	0	0	0	113.7	S491	T487-S491 PolarHBondContact O-N 3.35Å
488	V	57.8	Low	54.9	Low	97 Å²	97	111.2 Å²	111.2	59%	0.588	62%	0.623	S	S	*	*	H	α-helix	trans	-73	-37.1	-179.4	180	0	0	0	0	111.6	S491 I492	V488-S491 PolarHBondContact O-N 2.99Å; V488-I492 HydrophobicContact CG1-CD1 3.79Å; V488-I492 VanDerWaalsContact O-CG1 3.32Å; V488-I492 WeakPolarHBondContact O-CG1 3.4Å; V488-I492 PolarHBondContact O-N 3.15Å; V488-I492 VanDerWaalsContact O-N 3.14Å
489	I	57.9	Low	57.5	Low	89 Å²	89	108 Å²	108	46%	0.456	61%	0.609	S	S	.	*	H	α-helix	trans	-69	-39.6	-177.5	-60.4	174.7	0	0	0	110.9	S491 I492 M493	I489-S491 PolarHBondContact O-N 3.31Å; I489-I492 PolarHBondContact O-N 3.4Å; I489-M493 HydrophobicContact CG2-CG 4.4Å; I489-M493 VanDerWaalsContact O-CG 3.26Å; I489-M493 WeakPolarHBondContact O-CG 3.36Å; I489-M493 PolarHBondContact O-N 2.91Å
490	I	59	Low	60.1	Low	115 Å²	115	105.7 Å²	105.7	59%	0.59	59%	0.591	S	S	*	*	H	α-helix	trans	-67.5	-37	178.6	-62.3	170.8	0	0	0	111.2	M486 S494	M486-I490 WeakPolarHBondContact O-CG1 3.45Å; I490-S494 WeakPolarHBondContact O-CB 3.5Å; I490-S494 PolarHBondContact O-N 3.26Å; I490-S494 PolarHBondContact O-OG 3.06Å
491	S	58.9	Low	62.3	Low	68 Å²	68	104.9 Å²	104.9	48%	0.476	58%	0.582	S	S	.	*	H	α-helix	trans	-65.9	-41.4	176.7	-171.6	0	0	0	0	112.4	T487 V488 I489 S494 S495	T487-S491 PolarHBondContact O-N 3.35Å; V488-S491 PolarHBondContact O-N 2.99Å; I489-S491 PolarHBondContact O-N 3.31Å; S491-S494 PolarHBondContact O-OG 3.03Å; S491-S495 WeakPolarHBondContact O-CB 3.41Å; S491-S495 PolarHBondContact O-N 3.35Å; S491-S495 VanDerWaalsContact O-N 3.1Å; S491-S495 PolarHBondContact O-OG 2.74Å
492	I	67.3	Low	64.4	Low	107 Å²	107	104.4 Å²	104.4	55%	0.549	57%	0.569	S	S	.	*	H	α-helix	trans	-68.1	-42.1	178.2	-65.7	168.3	0	0	0	111.1	V488 I489 S495 F496	V488-I492 HydrophobicContact CG1-CD1 3.79Å; V488-I492 VanDerWaalsContact O-CG1 3.32Å; V488-I492 WeakPolarHBondContact O-CG1 3.4Å; V488-I492 PolarHBondContact O-N 3.15Å; V488-I492 VanDerWaalsContact O-N 3.14Å; I489-I492 PolarHBondContact O-N 3.4Å; I492-S495 PolarHBondContact O-N 3.25Å; I492-F496 WeakPolarHBondContact O-CB 3.5Å; I492-F496 PolarHBondContact O-N 3.28Å
493	M	65.6	Low	65.8	Low	123 Å²	123	101.7 Å²	101.7	61%	0.606	55%	0.551	S	S	*	*	H	α-helix	trans	-68.1	-37	179.4	-68.1	-60.7	-70.8	0	0	112.7	I489 A497	I489-M493 HydrophobicContact CG2-CG 4.4Å; I489-M493 VanDerWaalsContact O-CG 3.26Å; I489-M493 WeakPolarHBondContact O-CG 3.36Å; I489-M493 PolarHBondContact O-N 2.91Å; M493-A497 WeakPolarHBondContact O-CB 3.45Å; M493-A497 PolarHBondContact O-N 3.12Å
494	S	68.3	Low	67.7	Low	58 Å²	58	100.7 Å²	100.7	41%	0.406	54%	0.54	S	S	.	.	H	α-helix	trans	-67.9	-39.9	175.6	66.7	0	0	0	0	112.5	I490 S491 A497 I498	I490-S494 WeakPolarHBondContact O-CB 3.5Å; I490-S494 PolarHBondContact O-N 3.26Å; I490-S494 PolarHBondContact O-OG 3.06Å; S491-S494 PolarHBondContact O-OG 3.03Å; S494-A497 PolarHBondContact O-N 3.42Å; S494-I498 VanDerWaalsContact O-CG1 3.3Å; S494-I498 WeakPolarHBondContact O-CG1 3.45Å; S494-I498 PolarHBondContact O-N 2.66Å; S494-I498 VanDerWaalsContact O-N 3.1Å
495	S	70.7	Confident	69.4	Low	69 Å²	69	93.9 Å²	93.9	48%	0.483	52%	0.521	S	S	.	.	H	α-helix	trans	-65.7	-39.2	177	-56.5	0	0	0	0	111.9	S491 I492 I498 F499	S491-S495 WeakPolarHBondContact O-CB 3.41Å; S491-S495 PolarHBondContact O-N 3.35Å; S491-S495 VanDerWaalsContact O-N 3.1Å; S491-S495 PolarHBondContact O-OG 2.74Å; I492-S495 PolarHBondContact O-N 3.25Å; S495-I498 PolarHBondContact O-N 3.49Å; S495-F499 PolarHBondContact O-N 3.18Å; S495-F499 VanDerWaalsContact O-N 3.12Å
496	F	77	Confident	70.4	Confident	131 Å²	131	93.8 Å²	93.8	58%	0.575	52%	0.517	S	S	*	.	H	α-helix	trans	-67.8	-41.1	176.1	-168.6	-102.9	0	0	0	112.1	I492 I498 F499 V500	I492-F496 WeakPolarHBondContact O-CB 3.5Å; I492-F496 PolarHBondContact O-N 3.28Å; F496-I498 VanDerWaalsContact C-N 3.33Å; F496-I498 PolarHBondContact O-N 3.28Å; F496-F499 PolarHBondContact O-N 2.92Å; F496-V500 HydrophobicContact CD1-CG2 4.19Å; F496-V500 HydrophobicContact CE1-CG2 3.91Å; F496-V500 HydrophobicContact CZ-CG2 4.27Å; F496-V500 WeakPolarHBondContact O-CG2 3.42Å; F496-V500 PolarHBondContact O-N 3.02Å
497	A	74.9	Confident	71.7	Confident	48 Å²	48	92.7 Å²	92.7	40%	0.397	51%	0.513	S	S	.	.	H	α-helix	trans	-62.3	-39.2	176.3	0	0	0	0	0	112.5	M493 S494 V500 L501	M493-A497 WeakPolarHBondContact O-CB 3.45Å; M493-A497 PolarHBondContact O-N 3.12Å; S494-A497 PolarHBondContact O-N 3.42Å; A497-V500 PolarHBondContact O-N 3.18Å; A497-L501 WeakPolarHBondContact O-CB 3.42Å; A497-L501 PolarHBondContact O-N 2.91Å
498	I	79.7	Confident	72.9	Confident	101 Å²	101	94.1 Å²	94.1	52%	0.518	51%	0.508	S	S	.	.	H	α-helix	trans	-65.5	-41.1	175.9	-67.2	165.2	0	0	0	110.9	S494 S495 F496 V500 L501 L502	S494-I498 VanDerWaalsContact O-CG1 3.3Å; S494-I498 WeakPolarHBondContact O-CG1 3.45Å; S494-I498 PolarHBondContact O-N 2.66Å; S494-I498 VanDerWaalsContact O-N 3.1Å; S495-I498 PolarHBondContact O-N 3.49Å; F496-I498 VanDerWaalsContact C-N 3.33Å; F496-I498 PolarHBondContact O-N 3.28Å; I498-V500 PolarHBondContact O-N 3.35Å; I498-L501 PolarHBondContact O-N 3.34Å; I498-L502 HydrophobicContact CG2-CD1 3.93Å; I498-L502 HydrophobicContact CG2-CG 4.44Å; I498-L502 WeakPolarHBondContact O-CB 3.31Å; I498-L502 WeakPolarHBondContact O-CG 3.45Å; I498-L502 PolarHBondContact O-N 3Å
499	F	80	Confident	73.6	Confident	131 Å²	131	92.9 Å²	92.9	58%	0.575	50%	0.502	S	S	*	.	H	α-helix	trans	-63.9	-40.7	176.9	-171.4	-97.4	0	0	0	112.3	S495 F496 L502 T503	S495-F499 PolarHBondContact O-N 3.18Å; S495-F499 VanDerWaalsContact O-N 3.12Å; F496-F499 PolarHBondContact O-N 2.92Å; F499-L502 PolarHBondContact O-N 2.75Å; F499-T503 HydrophobicContact CD1-CG2 4.28Å; F499-T503 HydrophobicContact CE1-CG2 3.95Å; F499-T503 HydrophobicContact CZ-CG2 4.21Å; F499-T503 WeakPolarHBondContact O-CG2 3.41Å; F499-T503 PolarHBondContact O-N 3.48Å; F499-T503 PolarHBondContact O-OG1 3.04Å
500	V	81.1	Confident	74.2	Confident	56 Å²	56	92 Å²	92	34%	0.339	50%	0.503	S	S	.	.	H	α-helix	trans	-65.8	-41.2	175	174.7	0	0	0	0	111.2	F496 A497 I498 T503 I504	F496-V500 HydrophobicContact CD1-CG2 4.19Å; F496-V500 HydrophobicContact CE1-CG2 3.91Å; F496-V500 HydrophobicContact CZ-CG2 4.27Å; F496-V500 WeakPolarHBondContact O-CG2 3.42Å; F496-V500 PolarHBondContact O-N 3.02Å; A497-V500 PolarHBondContact O-N 3.18Å; I498-V500 PolarHBondContact O-N 3.35Å; V500-T503 WeakPolarHBondContact CA-OG1 3.32Å; V500-T503 PolarHBondContact O-N 2.65Å; V500-T503 PolarHBondContact O-OG1 2.9Å; V500-I504 HydrophobicContact CG1-CD1 3.75Å; V500-I504 HydrophobicContact CG1-CG1 4.43Å; V500-I504 WeakPolarHBondContact O-CB 3.37Å; V500-I504 VanDerWaalsContact O-CG1 3.24Å; V500-I504 WeakPolarHBondContact O-CG1 3.35Å; V500-I504 PolarHBondContact O-N 3.03Å
501	L	79.1	Confident	74.8	Confident	111 Å²	111	95.8 Å²	95.8	58%	0.581	51%	0.51	S	S	*	.	H	α-helix	trans	-64	-42.2	175.1	-88.2	155.7	0	0	0	112.3	A497 I498 I504 T505	A497-L501 WeakPolarHBondContact O-CB 3.42Å; A497-L501 PolarHBondContact O-N 2.91Å; I498-L501 PolarHBondContact O-N 3.34Å; L501-I504 PolarHBondContact O-N 3.11Å; L501-T505 WeakPolarHBondContact O-CB 3.33Å; L501-T505 PolarHBondContact O-N 2.97Å; L501-T505 PolarHBondContact O-OG1 3.14Å
502	L	79.8	Confident	75.5	Confident	104 Å²	104	100.2 Å²	100.2	55%	0.545	52%	0.516	S	S	.	.	H	α-helix	trans	-65.1	-41.3	177.6	-76.2	168.2	0	0	0	112	I498 F499 T505 T506	I498-L502 HydrophobicContact CG2-CD1 3.93Å; I498-L502 HydrophobicContact CG2-CG 4.44Å; I498-L502 WeakPolarHBondContact O-CB 3.31Å; I498-L502 WeakPolarHBondContact O-CG 3.45Å; I498-L502 PolarHBondContact O-N 3Å; F499-L502 PolarHBondContact O-N 2.75Å; L502-T505 PolarHBondContact O-N 3.47Å; L502-T506 WeakPolarHBondContact O-CB 3.36Å; L502-T506 PolarHBondContact O-N 2.82Å; L502-T506 PolarHBondContact O-OG1 3.31Å
503	T	77.8	Confident	75.3	Confident	55 Å²	55	104.1 Å²	104.1	34%	0.337	52%	0.524	S	S	.	.	H	α-helix	trans	-67.4	-42.4	177.2	49.1	0	0	0	0	112	F499 V500 T505 T506 L507	F499-T503 HydrophobicContact CD1-CG2 4.28Å; F499-T503 HydrophobicContact CE1-CG2 3.95Å; F499-T503 HydrophobicContact CZ-CG2 4.21Å; F499-T503 WeakPolarHBondContact O-CG2 3.41Å; F499-T503 PolarHBondContact O-N 3.48Å; F499-T503 PolarHBondContact O-OG1 3.04Å; V500-T503 WeakPolarHBondContact CA-OG1 3.32Å; V500-T503 PolarHBondContact O-N 2.65Å; V500-T503 PolarHBondContact O-OG1 2.9Å; T503-T505 VanDerWaalsContact C-N 3.35Å; T503-T505 PolarHBondContact O-N 3.33Å; T503-T506 PolarHBondContact O-N 3.27Å; T503-L507 WeakPolarHBondContact O-CB 3.32Å; T503-L507 WeakPolarHBondContact O-CG 3.27Å; T503-L507 PolarHBondContact O-N 2.97Å
504	I	81.1	Confident	75.1	Confident	99 Å²	99	105.4 Å²	105.4	51%	0.508	53%	0.526	S	S	.	.	H	α-helix	trans	-62.3	-42.8	174.1	-68.4	169.3	0	0	0	110.8	V500 L501 T506 L507 Y508	V500-I504 HydrophobicContact CG1-CD1 3.75Å; V500-I504 HydrophobicContact CG1-CG1 4.43Å; V500-I504 WeakPolarHBondContact O-CB 3.37Å; V500-I504 VanDerWaalsContact O-CG1 3.24Å; V500-I504 WeakPolarHBondContact O-CG1 3.35Å; V500-I504 PolarHBondContact O-N 3.03Å; L501-I504 PolarHBondContact O-N 3.11Å; I504-T506 VanDerWaalsContact C-N 3.35Å; I504-T506 PolarHBondContact O-N 3.39Å; I504-L507 PolarHBondContact O-N 3.35Å; I504-Y508 WeakPolarHBondContact O-CB 3.47Å; I504-Y508 PolarHBondContact O-N 3.16Å
505	T	78.3	Confident	74.6	Confident	73 Å²	73	109.4 Å²	109.4	45%	0.448	54%	0.539	S	S	.	.	H	α-helix	trans	-65.5	-40.2	178.5	-49.1	0	0	0	0	111	L501 L502 T503 Y508 C509	L501-T505 WeakPolarHBondContact O-CB 3.33Å; L501-T505 PolarHBondContact O-N 2.97Å; L501-T505 PolarHBondContact O-OG1 3.14Å; L502-T505 PolarHBondContact O-N 3.47Å; T503-T505 VanDerWaalsContact C-N 3.35Å; T503-T505 PolarHBondContact O-N 3.33Å; T505-Y508 PolarHBondContact O-N 3.43Å; T505-C509 WeakPolarHBondContact O-CB 3.37Å; T505-C509 PolarHBondContact O-N 3.34Å; T505-C509 PolarHBondContact O-SG 3.41Å
506	T	78.1	Confident	73.4	Confident	87 Å²	87	114.2 Å²	114.2	53%	0.534	55%	0.546	S	S	.	.	H	α-helix	trans	-65.5	-42.8	176.5	-50.5	0	0	0	0	111.2	L502 T503 I504 C509 C510	L502-T506 WeakPolarHBondContact O-CB 3.36Å; L502-T506 PolarHBondContact O-N 2.82Å; L502-T506 PolarHBondContact O-OG1 3.31Å; T503-T506 PolarHBondContact O-N 3.27Å; I504-T506 VanDerWaalsContact C-N 3.35Å; I504-T506 PolarHBondContact O-N 3.39Å; T506-C509 PolarHBondContact O-N 2.87Å; T506-C510 WeakPolarHBondContact O-CB 3.42Å; T506-C510 PolarHBondContact O-N 2.85Å; T506-C510 PolarHBondContact O-SG 3.18Å; T506-C510 VanDerWaalsContact O-SG 3.33Å
507	L	77.8	Confident	72	Confident	116 Å²	116	115.1 Å²	115.1	61%	0.607	55%	0.55	S	S	*	*	H	α-helix	trans	-65.1	-38.9	174.7	-75.7	168.4	0	0	0	112.1	T503 I504 C510 R511	T503-L507 WeakPolarHBondContact O-CB 3.32Å; T503-L507 WeakPolarHBondContact O-CG 3.27Å; T503-L507 PolarHBondContact O-N 2.97Å; I504-L507 PolarHBondContact O-N 3.35Å; L507-C510 PolarHBondContact O-N 3.34Å; L507-R511 WeakPolarHBondContact O-CB 3.44Å; L507-R511 WeakPolarHBondContact O-CG 3.36Å; L507-R511 PolarHBondContact O-N 3.46Å
508	Y	80.2	Confident	70.7	Confident	139 Å²	139	117.1 Å²	117.1	55%	0.545	55%	0.554	S	S	.	*	H	α-helix	trans	-64.4	-46	173.9	-176.8	-97.9	0	0	0	111.3	I504 T505 C510 R511 R512	I504-Y508 WeakPolarHBondContact O-CB 3.47Å; I504-Y508 PolarHBondContact O-N 3.16Å; T505-Y508 PolarHBondContact O-N 3.43Å; Y508-C510 VanDerWaalsContact C-N 3.34Å; Y508-C510 PolarHBondContact O-N 3.02Å; Y508-R511 PolarHBondContact O-N 2.98Å; Y508-R512 WeakPolarHBondContact O-CB 3.33Å; Y508-R512 PolarHBondContact O-N 3.21Å
509	C	72.3	Confident	68.9	Low	70 Å²	70	119.9 Å²	119.9	47%	0.473	56%	0.562	S	S	.	*	H	α-helix	trans	-61.9	-38.5	174.3	-73.6	0	0	0	0	112.5	T505 T506 R512 R513	T505-C509 WeakPolarHBondContact O-CB 3.37Å; T505-C509 PolarHBondContact O-N 3.34Å; T505-C509 PolarHBondContact O-SG 3.41Å; T506-C509 PolarHBondContact O-N 2.87Å; C509-R512 PolarHBondContact O-N 3.24Å; C509-R513 WeakPolarHBondContact O-CB 3.43Å; C509-R513 PolarHBondContact O-N 3.31Å
510	C	71	Confident	66.9	Low	71 Å²	71	119.9 Å²	119.9	48%	0.48	56%	0.562	S	S	.	*	H	α-helix	trans	-67.7	-43	174.8	-77.4	0	0	0	0	112.2	T506 L507 Y508 R512 R513 K514	T506-C510 WeakPolarHBondContact O-CB 3.42Å; T506-C510 PolarHBondContact O-N 2.85Å; T506-C510 PolarHBondContact O-SG 3.18Å; T506-C510 VanDerWaalsContact O-SG 3.33Å; L507-C510 PolarHBondContact O-N 3.34Å; Y508-C510 VanDerWaalsContact C-N 3.34Å; Y508-C510 PolarHBondContact O-N 3.02Å; C510-R512 VanDerWaalsContact C-N 3.35Å; C510-R513 PolarHBondContact O-N 3.5Å; C510-K514 WeakPolarHBondContact O-CB 3.4Å; C510-K514 PolarHBondContact O-N 2.82Å
511	R	72.8	Confident	64.9	Low	194 Å²	194	127.1 Å²	127.1	73%	0.732	58%	0.583	S	S	*	*	H	α-helix	trans	-64.6	-39.1	173.6	-75.8	-179.1	99.8	138.1	1.4	111.6	L507 Y508 K514 Q515	L507-R511 WeakPolarHBondContact O-CB 3.44Å; L507-R511 WeakPolarHBondContact O-CG 3.36Å; L507-R511 PolarHBondContact O-N 3.46Å; Y508-R511 PolarHBondContact O-N 2.98Å; R511-K514 PolarHBondContact O-N 2.9Å; R511-Q515 WeakPolarHBondContact O-CB 3.4Å; R511-Q515 PolarHBondContact O-N 2.75Å
512	R	72.1	Confident	63	Low	161 Å²	161	129.6 Å²	129.6	61%	0.608	59%	0.592	S	S	*	*	H	α-helix	trans	-69.6	-36.8	176.4	-144.8	179.7	-178.1	-171.8	1.1	111.8	Y508 C509 C510 W516	Y508-R512 WeakPolarHBondContact O-CB 3.33Å; Y508-R512 PolarHBondContact O-N 3.21Å; C509-R512 PolarHBondContact O-N 3.24Å; C510-R512 VanDerWaalsContact C-N 3.35Å; R512-W516 WeakPolarHBondContact O-CB 3.42Å; R512-W516 PolarHBondContact O-N 2.95Å
513	R	63.3	Low	60.8	Low	190 Å²	190	129.8 Å²	129.8	72%	0.717	60%	0.602	S	S	*	*	H	α-helix	trans	-63.9	-38.4	168.9	-94.5	-178.1	171.4	169.7	-1.4	112.3	C509 C510 W516 K517	C509-R513 WeakPolarHBondContact O-CB 3.43Å; C509-R513 PolarHBondContact O-N 3.31Å; C510-R513 PolarHBondContact O-N 3.5Å; R513-W516 PolarHBondContact O-N 3.22Å; R513-K517 WeakPolarHBondContact O-CB 2.95Å; R513-K517 WeakPolarHBondContact O-CG 3.22Å; R513-K517 PolarHBondContact O-N 2.88Å
514	K	61.3	Low	58.7	Low	149 Å²	149	130.5 Å²	130.5	65%	0.648	61%	0.614	S	S	*	*	H	α-helix	trans	-69.7	-42.6	176.6	-166.2	174.3	-178.3	177.2	0	111.6	C510 R511 K517 N518	C510-K514 WeakPolarHBondContact O-CB 3.4Å; C510-K514 PolarHBondContact O-N 2.82Å; R511-K514 PolarHBondContact O-N 2.9Å; K514-K517 PolarHBondContact O-N 2.9Å; K514-N518 PolarHBondContact O-N 2.77Å
515	Q	59.1	Low	56.7	Low	143 Å²	143	129.9 Å²	129.9	67%	0.668	62%	0.623	S	S	*	*	H	α-helix	trans	-65.8	-37.2	171.9	-82.5	-174.9	-18.8	0	0	112.3	R511 N518 K519	R511-Q515 WeakPolarHBondContact O-CB 3.4Å; R511-Q515 PolarHBondContact O-N 2.75Å; Q515-N518 PolarHBondContact O-N 3.09Å; Q515-K519 WeakPolarHBondContact O-CB 3.44Å; Q515-K519 PolarHBondContact O-N 2.82Å
516	W	44.8	Very low	54.9	Low	169 Å²	169	132.5 Å²	132.5	64%	0.64	64%	0.639	S	S	*	*	H	α-helix	trans	-68.2	-36.8	174.3	-164.3	76.5	0	0	0	112	R512 R513 K520	R512-W516 WeakPolarHBondContact O-CB 3.42Å; R512-W516 PolarHBondContact O-N 2.95Å; R513-W516 PolarHBondContact O-N 3.22Å; W516-K520 HydrophobicContact CH2-CD 4.36Å; W516-K520 HydrophobicContact CZ3-CD 4.33Å; W516-K520 VanDerWaalsContact O-CB 3.23Å; W516-K520 WeakPolarHBondContact O-CB 3.12Å; W516-K520 PolarHBondContact O-N 2.87Å
517	K	47.8	Very low	52.5	Low	151 Å²	151	133.9 Å²	133.9	66%	0.657	65%	0.647	S	S	*	*	H	α-helix	trans	-64.8	-39.2	170.3	-81.7	-175.2	176.5	-173.7	0	112.4	R513 K514 R521	R513-K517 WeakPolarHBondContact O-CB 2.95Å; R513-K517 WeakPolarHBondContact O-CG 3.22Å; R513-K517 PolarHBondContact O-N 2.88Å; K514-K517 PolarHBondContact O-N 2.9Å; K517-R521 WeakPolarHBondContact O-CB 2.96Å; K517-R521 PolarHBondContact O-N 2.89Å; K517-R521 VanDerWaalsContact O-N 3.12Å
518	N	48.3	Very low	50.1	Low	89 Å²	89	134.6 Å²	134.6	48%	0.476	65%	0.651	S	S	.	*	H	α-helix	trans	-70.6	-41.2	176.3	-77.4	4.6	0	0	0	112.2	K514 Q515 K520 R521 E522	K514-N518 PolarHBondContact O-N 2.77Å; Q515-N518 PolarHBondContact O-N 3.09Å; N518-K520 VanDerWaalsContact C-N 3.35Å; N518-K520 PolarHBondContact O-N 2.8Å; N518-R521 VanDerWaalsContact O-CB 3.29Å; N518-R521 WeakPolarHBondContact O-CB 3.3Å; N518-R521 PolarHBondContact O-N 2.85Å; N518-R521 VanDerWaalsContact O-N 3.09Å; N518-E522 PolarHBondContact O-N 2.86Å
519	K	41.7	Very low	48	Very low	160 Å²	160	132 Å²	132	70%	0.696	65%	0.649	S	S	*	*	H	α-helix	trans	-70.7	-28.7	177.2	-139.4	175	-173	-179.2	0	112.8	Q515 R521	Q515-K519 WeakPolarHBondContact O-CB 3.44Å; Q515-K519 PolarHBondContact O-N 2.82Å; K519-R521 VanDerWaalsContact C-N 3.33Å
520	K	38.1	Very low	45.8	Very low	130 Å²	130	133.9 Å²	133.9	57%	0.565	66%	0.659	S	S	*	*	H	α-helix	trans	-76.4	-18.8	170.2	-158.2	177.1	-174.4	-178.2	0	112.7	W516 N518 A524	W516-K520 HydrophobicContact CH2-CD 4.36Å; W516-K520 HydrophobicContact CZ3-CD 4.33Å; W516-K520 VanDerWaalsContact O-CB 3.23Å; W516-K520 WeakPolarHBondContact O-CB 3.12Å; W516-K520 PolarHBondContact O-N 2.87Å; N518-K520 VanDerWaalsContact C-N 3.35Å; N518-K520 PolarHBondContact O-N 2.8Å; K520-A524 WeakPolarHBondContact O-CB 3.27Å; K520-A524 PolarHBondContact O-N 2.81Å
521	R	37.5	Very low	43.7	Very low	208 Å²	208	137.7 Å²	137.7	79%	0.785	67%	0.674	S	S	*	*	H	α-helix	trans	-77.3	-29.2	173.7	-127.1	174.7	173	-178.9	-4.5	112.3	K517 N518 K519	K517-R521 WeakPolarHBondContact O-CB 2.96Å; K517-R521 PolarHBondContact O-N 2.89Å; K517-R521 VanDerWaalsContact O-N 3.12Å; N518-R521 VanDerWaalsContact O-CB 3.29Å; N518-R521 WeakPolarHBondContact O-CB 3.3Å; N518-R521 PolarHBondContact O-N 2.85Å; N518-R521 VanDerWaalsContact O-N 3.09Å; K519-R521 VanDerWaalsContact C-N 3.33Å
522	E	39.3	Very low	41.5	Very low	163 Å²	163	133.5 Å²	133.5	76%	0.762	67%	0.672	S	S	*	*	H	α-helix	trans	-87.7	-15.9	177.9	-77.1	174.5	164.2	0	0	114.3	N518	N518-E522 PolarHBondContact O-N 2.86Å
523	S	35.2	Very low	39.4	Very low	109 Å²	109	130.6 Å²	130.6	76%	0.762	68%	0.676	S	S	*	*	S	Bend	trans	-113.8	5.1	179.4	-51.2	0	0	0	0	114.9
524	A	33.6	Very low	38.1	Very low	70 Å²	70	127.7 Å²	127.7	58%	0.579	67%	0.671	S	S	*	*			trans	-112.5	19.5	175.4	0	0	0	0	0	113.1	K520 V526	K520-A524 WeakPolarHBondContact O-CB 3.27Å; K520-A524 PolarHBondContact O-N 2.81Å; A524-V526 VanDerWaalsContact C-N 3.35Å; A524-V526 PolarHBondContact O-N 2.97Å; A524-V526 VanDerWaalsContact O-N 3.15Å
525	A	38.5	Very low	37	Very low	85 Å²	85	122.5 Å²	122.5	70%	0.702	65%	0.65	S	S	*	*			trans	-77.5	91.6	161.7	0	0	0	0	0	107.5
526	V	40.2	Very low	36	Very low	128 Å²	128	120.7 Å²	120.7	78%	0.776	64%	0.644	S	S	*	*	S	Bend	trans	160.4	121.6	153.4	159.4	0	0	0	0	108.2	A524	A524-V526 VanDerWaalsContact C-N 3.35Å; A524-V526 PolarHBondContact O-N 2.97Å; A524-V526 VanDerWaalsContact O-N 3.15Å
527	T	27.9	Very low	35.8	Very low	116 Å²	116	113.7 Å²	113.7	71%	0.712	62%	0.619	S	S	*	*			trans	84.1	98.1	171.1	-14.1	0	0	0	0	118.1
528	L	27.3	Very low	35.2	Very low	132 Å²	132	112.3 Å²	112.3	69%	0.691	62%	0.619	S	S	*	*				170.7	145	112.6	-110.8	114.7	0	0	0	109.6	I128	I128-L528 HydrophobicContact CD1-CD2 3.73Å; I128-L528 HydrophobicContact CD1-CG 4.24Å
529	T	36.8	Very low	34.8	Very low	83 Å²	83	118.9 Å²	118.9	51%	0.509	64%	0.637	S	S	.	*			trans	-69.7	139.3	-174.5	63.6	0	0	0	0	113.2	I128	I128-T529 HydrophobicContact CD1-CG2 3.51Å; I128-T529 WeakPolarHBondContact CD1-OG1 3.48Å; I128-T529 HydrophobicContact CG1-CG2 3.44Å; I128-T529 VanDerWaalsContact CG1-CG2 3.44Å; I128-T529 WeakPolarHBondContact CG1-OG1 3.36Å
530	T	25	Very low	34.8	Very low	111 Å²	111	115 Å²	115	68%	0.681	62%	0.624	S	S	*	*			trans	-147.4	107.7	169.5	43.1	0	0	0	0	106.1
531	L	27.5	Very low	34.8	Very low	150 Å²	150	115 Å²	115	79%	0.785	63%	0.626	S	S	*	*	S	Bend	trans	52.5	175.8	-173.9	-81.4	100	0	0	0	112.1	S533	L531-S533 PolarHBondContact O-N 3Å
532	P	25.7	Very low	35.1	Very low	107 Å²	107	108 Å²	108	70%	0.695	61%	0.607	S	S	*	*	S	Bend	trans	-51.3	131	144.2	-10.7	26	0	0	0	104.8	E534	P532-E534 PolarHBondContact O-N 2.86Å; P532-E534 VanDerWaalsContact O-N 3.1Å
533	S	29	Very low	35.6	Very low	100 Å²	100	100.4 Å²	100.4	70%	0.699	57%	0.572	S	S	*	*	S	Bend	trans	-32.7	125.8	167	-53.7	0	0	0	0	108.4	L531 L535	L531-S533 PolarHBondContact O-N 3Å; S533-L535 PolarHBondContact O-N 3.42Å
534	E	36.1	Very low	36.3	Very low	129 Å²	129	98.8 Å²	98.8	60%	0.603	56%	0.559	S	S	*	*	S	Bend	trans	3.6	104.4	175.2	-69.7	174.3	142.4	0	0	111.1	P532 L536	P532-E534 PolarHBondContact O-N 2.86Å; P532-E534 VanDerWaalsContact O-N 3.1Å; E534-L536 WeakPolarHBondContact O-CA 3.41Å; E534-L536 PolarHBondContact O-N 3.44Å
535	L	37	Very low	37	Very low	39 Å²	39	98 Å²	98	20%	0.204	54%	0.544	C	S	.	.	S	Bend	trans	-17.5	100.8	173.9	-167.3	143.8	0	0	0	108.3	S533 L537 I756 I758 I766 I804	S533-L535 PolarHBondContact O-N 3.42Å; L535-L537 HydrophobicContact CB-CD1 4.38Å; L535-L537 HydrophobicContact CD2-CD1 3.58Å; L535-L537 HydrophobicContact CD2-CD2 4.28Å; L535-L537 HydrophobicContact CD2-CG 3.65Å; L535-L537 WeakPolarHBondContact O-CA 3.39Å; L535-L537 WeakPolarHBondContact O-CB 3.35Å; L535-L537 WeakPolarHBondContact O-CG 2.76Å; L535-L537 PolarHBondContact O-N 3.01Å; L535-I756 HydrophobicContact CD2-CD1 3.69Å; L535-I758 HydrophobicContact CD1-CD1 4.38Å; L535-I766 HydrophobicContact CD1-CG2 4.22Å; L535-I766 WeakPolarHBondContact CG-O 3.45Å; L535-I804 HydrophobicContact CD1-CD1 4.02Å
536	L	38.8	Very low	37.4	Very low	105 Å²	105	96.6 Å²	96.6	55%	0.55	52%	0.521	S	S	.	.	S	Bend	trans	-57.9	70.3	-150.7	-125.2	162.6	0	0	0	111.6	E534 D538 N769	E534-L536 WeakPolarHBondContact O-CA 3.41Å; E534-L536 PolarHBondContact O-N 3.44Å; L536-D538 HydrophobicContact CD2-CB 4.2Å; L536-D538 PolarHBondContact O-N 3.41Å; L536-N769 VanDerWaalsContact O-CB 3.31Å; L536-N769 WeakPolarHBondContact O-CB 3.3Å; L536-N769 VanDerWaalsContact O-CG 3.3Å; L536-N769 PolarHBondContact O-ND2 2.92Å; L536-N769 VanDerWaalsContact O-ND2 3.08Å
537	L	39.8	Very low	37.6	Very low	22 Å²	22	97.2 Å²	97.2	12%	0.115	52%	0.515	C	S	.	.			trans	-95.5	23.6	-176.5	-78.9	160.9	0	0	0	108.5	L535 R539 I756	L535-L537 HydrophobicContact CB-CD1 4.38Å; L535-L537 HydrophobicContact CD2-CD1 3.58Å; L535-L537 HydrophobicContact CD2-CD2 4.28Å; L535-L537 HydrophobicContact CD2-CG 3.65Å; L535-L537 WeakPolarHBondContact O-CA 3.39Å; L535-L537 WeakPolarHBondContact O-CB 3.35Å; L535-L537 WeakPolarHBondContact O-CG 2.76Å; L535-L537 PolarHBondContact O-N 3.01Å; L537-R539 VanDerWaalsContact C-N 3.28Å; L537-R539 PolarHBondContact O-N 3.42Å; L537-I756 HydrophobicContact CD1-CD1 3.83Å; L537-I756 HydrophobicContact CD1-CG1 4.3Å; L537-I756 HydrophobicContact CD1-CG2 4.37Å; L537-I756 HydrophobicContact CD2-CD1 4.32Å; L537-I756 HydrophobicContact CD2-CG2 3.66Å
538	D	35.5	Very low	38.5	Very low	123 Å²	123	101.8 Å²	101.8	66%	0.658	52%	0.519	S	S	*	.	S	Bend	trans	-61	99.9	163.8	-82.1	-29.1	0	0	0	107	L536	L536-D538 HydrophobicContact CD2-CB 4.2Å; L536-D538 PolarHBondContact O-N 3.41Å
539	R	40.3	Very low	39.4	Very low	227 Å²	227	98 Å²	98	86%	0.857	50%	0.498	S	S	*	.	S	Bend	trans	37.2	111.6	179.5	-64.9	-173.5	-176.3	-167	-0.4	114	L537 H541	L537-R539 VanDerWaalsContact C-N 3.28Å; L537-R539 PolarHBondContact O-N 3.42Å; R539-H541 PolarHBondContact O-N 3.25Å
540	L	40.8	Very low	39.8	Very low	79 Å²	79	99 Å²	99	41%	0.414	51%	0.507	S	S	.	.			trans	-38.9	119.7	162.5	-69.9	169.7	0	0	0	109.6	P542 Y771	L540-P542 VanDerWaalsContact O-N 3.14Å; L540-Y771 HydrophobicContact CD2-CD2 4.34Å; L540-Y771 HydrophobicContact CD2-CE2 3.6Å
541	H	38.3	Very low	40.9	Very low	130 Å²	130	100.5 Å²	100.5	60%	0.602	51%	0.51	S	S	*	.			trans	-51.1	127.9	171.8	-76	-67.3	0	0	0	107.2	R539 N543 R716	R539-H541 PolarHBondContact O-N 3.25Å; H541-N543 PolarHBondContact O-N 3.15Å; H541-R716 PolarHBondContact O-NH1 3.37Å; H541-R716 PolarHBondContact O-NH2 3.42Å
542	P	44	Very low	41.8	Very low	61 Å²	61	100.4 Å²	100.4	40%	0.396	51%	0.509	S	S	.	.			trans	-53.8	133.6	177.1	-18.6	27	0	0	0	108.2	L540 Y546 Q547	L540-P542 VanDerWaalsContact O-N 3.14Å; P542-Y546 HydrophobicContact CB-CD2 4.32Å; P542-Q547 HydrophobicContact CB-CG 4.05Å; P542-Q547 HydrophobicContact CG-CG 4.37Å
543	N	50.4	Low	43	Very low	3 Å²	3	101.6 Å²	101.6	2%	0.016	51%	0.509	C	S	.	.			trans	-40.7	129.9	164.6	-171.2	-37.9	0	0	0	108.2	H541 M545 Y546 F713 V714	H541-N543 PolarHBondContact O-N 3.15Å; N543-M545 PolarHBondContact O-N 3.27Å; N543-M545 PolarHBondContact OD1-N 2.98Å; N543-Y546 HydrophobicContact CB-CD2 3.32Å; N543-Y546 HydrophobicContact CB-CE2 3.52Å; N543-Y546 HydrophobicContact CB-CG 4.38Å; N543-Y546 WeakPolarHBondContact O-CA 3.29Å; N543-Y546 VanDerWaalsContact O-CB 3.31Å; N543-Y546 WeakPolarHBondContact O-CB 3.45Å; N543-Y546 PolarHBondContact O-N 2.94Å; N543-F713 WeakPolarHBondContact ND2-CD2 3.4Å; N543-F713 WeakPolarHBondContact ND2-CE2 3.47Å; N543-V714 PolarHBondContact ND2-N 3.17Å; N543-V714 PolarHBondContact ND2-O 3.35Å
544	P	49.8	Very low	44.7	Very low	75 Å²	75	98.4 Å²	98.4	49%	0.487	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-25.4	-174.8	-28.8	33.9	0	0	0	114.1	Q547	P544-Q547 PolarHBondContact O-N 3.29Å
545	M	47.6	Very low	46.4	Very low	54 Å²	54	97 Å²	97	27%	0.266	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-36.2	172.8	-161	171.8	176	0	0	113.1	N543 Q547 R548 L621 E624	N543-M545 PolarHBondContact O-N 3.27Å; N543-M545 PolarHBondContact OD1-N 2.98Å; M545-Q547 VanDerWaalsContact C-N 3.29Å; M545-Q547 PolarHBondContact O-N 3.22Å; M545-R548 PolarHBondContact O-N 2.89Å; M545-L621 HydrophobicContact CB-CD2 3.92Å; M545-L621 HydrophobicContact CE-CD2 3.86Å; M545-L621 HydrophobicContact CG-CD2 3.51Å; M545-L621 HydrophobicContact SD-CD2 3.34Å; M545-L621 WeakPolarHBondContact SD-CD2 3.21Å; M545-E624 HydrophobicContact CE-CB 3.98Å; M545-E624 HydrophobicContact CE-CG 3.87Å
546	Y	47.6	Very low	48.2	Very low	55 Å²	55	98.9 Å²	98.9	22%	0.216	49%	0.493	C	S	.	.	G	3₁₀ helix	trans	-62.2	-33	175.6	-71.3	-64.3	0	0	0	112.9	P542 N543 R548 M549 R617 L621 F736	P542-Y546 HydrophobicContact CB-CD2 4.32Å; N543-Y546 HydrophobicContact CB-CD2 3.32Å; N543-Y546 HydrophobicContact CB-CE2 3.52Å; N543-Y546 HydrophobicContact CB-CG 4.38Å; N543-Y546 WeakPolarHBondContact O-CA 3.29Å; N543-Y546 VanDerWaalsContact O-CB 3.31Å; N543-Y546 WeakPolarHBondContact O-CB 3.45Å; N543-Y546 PolarHBondContact O-N 2.94Å; Y546-R548 PolarHBondContact O-N 2.99Å; Y546-M549 PolarHBondContact O-N 3.12Å; Y546-R617 HydrophobicContact CD1-CB 3.85Å; Y546-R617 HydrophobicContact CD1-CG 4.22Å; Y546-R617 HydrophobicContact CE1-CB 3.73Å; Y546-L621 HydrophobicContact CD1-CD1 3.8Å; Y546-L621 HydrophobicContact CD1-CG 4.48Å; Y546-L621 HydrophobicContact CE1-CD1 3.14Å; Y546-L621 HydrophobicContact CE1-CG 4.14Å; Y546-L621 HydrophobicContact CE2-CD1 4.08Å; Y546-L621 WeakPolarHBondContact OH-CD1 3.39Å; Y546-F736 VanDerWaalsContact OH-CE1 3.27Å; Y546-F736 WeakPolarHBondContact OH-CE1 3.23Å
547	Q	44.4	Very low	50.1	Low	141 Å²	141	94.8 Å²	94.8	66%	0.659	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-74.4	-13.9	-177.4	-65.3	-177.7	-12.2	0	0	113.3	P542 P544 M545	P542-Q547 HydrophobicContact CB-CG 4.05Å; P542-Q547 HydrophobicContact CG-CG 4.37Å; P544-Q547 PolarHBondContact O-N 3.29Å; M545-Q547 VanDerWaalsContact C-N 3.29Å; M545-Q547 PolarHBondContact O-N 3.22Å
548	R	46.3	Very low	52	Low	211 Å²	211	97.4 Å²	97.4	80%	0.796	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-97.4	-3.4	-179	-67.2	-178.6	178.5	-178.7	-2.7	113.4	M545 Y546 P550	M545-R548 PolarHBondContact O-N 2.89Å; Y546-R548 PolarHBondContact O-N 2.99Å; R548-P550 WeakPolarHBondContact O-CD 3.46Å
549	M	47.5	Very low	54.3	Low	52 Å²	52	95.8 Å²	95.8	26%	0.256	48%	0.484	S	S	.	.			trans	-102.2	113.4	-170.3	-131.1	165.5	-169.8	0	0	111.1	Y546 N554 A620	Y546-M549 PolarHBondContact O-N 3.12Å; M549-N554 WeakPolarHBondContact CE-ND2 3.44Å; M549-A620 HydrophobicContact CE-CB 3.42Å; M549-A620 VanDerWaalsContact CE-CB 3.42Å; M549-A620 HydrophobicContact SD-CB 3.52Å; M549-A620 VanDerWaalsContact SD-CB 3.52Å
550	P	44.4	Very low	56.7	Low	106 Å²	106	87 Å²	87	69%	0.688	45%	0.453	S	S	*	.			trans	-68.2	145.3	176.4	9.5	-4.2	0	0	0	111.5	R548 L552	R548-P550 WeakPolarHBondContact O-CD 3.46Å; P550-L552 PolarHBondContact O-N 3.16Å
551	L	47.6	Very low	59.1	Low	141 Å²	141	86.3 Å²	86.3	74%	0.738	45%	0.448	S	S	*	.	S	Bend	trans	-72.4	17.2	177.7	-72.1	165.7	0	0	0	114
552	L	48.1	Very low	61.8	Low	149 Å²	149	80.8 Å²	80.8	78%	0.78	42%	0.422	S	S	*	.	S	Bend	trans	-118.1	130.2	-178.7	-100.6	144	0	0	0	110	P550 N554	P550-L552 PolarHBondContact O-N 3.16Å; L552-N554 PolarHBondContact O-N 2.89Å
553	L	50.8	Low	64.1	Low	131 Å²	131	81.3 Å²	81.3	69%	0.686	43%	0.425	S	S	*	.			trans	15.1	89	168.7	-144.7	76.5	0	0	0	115.5	P555 L558	L553-P555 WeakPolarHBondContact O-CD 3.38Å; L553-L558 HydrophobicContact CD1-CD1 4.02Å; L553-L558 HydrophobicContact CD1-CD2 4.24Å; L553-L558 HydrophobicContact CD1-CG 4.36Å; L553-L558 HydrophobicContact CD2-CD1 3.42Å; L553-L558 VanDerWaalsContact CD2-CD1 3.42Å; L553-L558 HydrophobicContact CG-CD1 3.46Å; L553-L558 VanDerWaalsContact CG-CD1 3.46Å; L553-L558 HydrophobicContact CG-CG 4.11Å
554	N	64.8	Low	66	Low	34 Å²	34	84 Å²	84	18%	0.182	44%	0.435	C	S	.	.			trans	-68.4	113.4	170.6	-178	-19.7	0	0	0	109.1	M549 L552 K556 L557 L558	M549-N554 WeakPolarHBondContact CE-ND2 3.44Å; L552-N554 PolarHBondContact O-N 2.89Å; N554-K556 PolarHBondContact O-N 3.36Å; N554-K556 VanDerWaalsContact O-N 3.15Å; N554-K556 VanDerWaalsContact OD1-CB 3.24Å; N554-K556 WeakPolarHBondContact OD1-CB 3.01Å; N554-K556 PolarHBondContact OD1-N 3.29Å; N554-L557 HydrophobicContact CB-CB 4.16Å; N554-L557 HydrophobicContact CB-CD1 3.91Å; N554-L557 HydrophobicContact CB-CG 3.85Å; N554-L557 PolarHBondContact O-N 3.45Å; N554-L558 PolarHBondContact O-N 3.06Å
555	P	71.1	Confident	68	Low	100 Å²	100	87.9 Å²	87.9	65%	0.649	45%	0.452	S	S	*	.	H	α-helix	trans	-59.7	-28	-178.3	-22.1	34	0	0	0	113	L553 L558 S559	L553-P555 WeakPolarHBondContact O-CD 3.38Å; P555-L558 PolarHBondContact O-N 3.29Å; P555-S559 PolarHBondContact O-N 3.3Å
556	K	75.3	Confident	70.2	Confident	78 Å²	78	89.2 Å²	89.2	34%	0.339	46%	0.46	S	S	.	.	H	α-helix	trans	-71.8	-36.9	177.9	-154.4	171.1	-165.8	-169.4	0	112.1	N554 L558 S559 L560 A623 E624	N554-K556 PolarHBondContact O-N 3.36Å; N554-K556 VanDerWaalsContact O-N 3.15Å; N554-K556 VanDerWaalsContact OD1-CB 3.24Å; N554-K556 WeakPolarHBondContact OD1-CB 3.01Å; N554-K556 PolarHBondContact OD1-N 3.29Å; K556-L558 VanDerWaalsContact C-N 3.34Å; K556-S559 WeakPolarHBondContact CA-OG 3.45Å; K556-S559 PolarHBondContact O-N 2.81Å; K556-S559 PolarHBondContact O-OG 2.98Å; K556-L560 WeakPolarHBondContact O-CG 3.38Å; K556-L560 PolarHBondContact O-N 3.45Å; K556-A623 HydrophobicContact CD-CB 4.28Å; K556-A623 WeakPolarHBondContact CD-O 3.18Å; K556-A623 WeakPolarHBondContact CE-O 3.31Å; K556-A623 HydrophobicContact CG-CB 4.34Å; K556-A623 PolarHBondContact NZ-O 3.44Å; K556-E624 WeakPolarHBondContact CD-OE1 3.31Å; K556-E624 IonicContact NZ-OE1 2.85Å; K556-E624 IonicContact NZ-OE2 3.78Å; K556-E624 PolarHBondContact NZ-OE2 2.79Å
557	L	77.1	Confident	72.5	Confident	19 Å²	19	87.9 Å²	87.9	10%	0.099	46%	0.456	C	S	.	.	H	α-helix	trans	-66.3	-39.1	173	-66.6	-177.5	0	0	0	111.6	N554 S559 L560 E561 A619 A620 A623 V636	N554-L557 HydrophobicContact CB-CB 4.16Å; N554-L557 HydrophobicContact CB-CD1 3.91Å; N554-L557 HydrophobicContact CB-CG 3.85Å; N554-L557 PolarHBondContact O-N 3.45Å; L557-S559 VanDerWaalsContact C-N 3.32Å; L557-S559 PolarHBondContact O-N 3.22Å; L557-L560 CarbonylContact O-C 3.49Å; L557-L560 PolarHBondContact O-N 3.3Å; L557-L560 VanDerWaalsContact O-N 3.12Å; L557-E561 PolarHBondContact O-N 3.28Å; L557-A619 HydrophobicContact CD1-CB 4.15Å; L557-A619 HydrophobicContact CD2-CB 3.81Å; L557-A620 HydrophobicContact CD1-CB 4.03Å; L557-A623 HydrophobicContact CD2-CB 3.98Å; L557-V636 HydrophobicContact CD2-CG2 4.04Å
558	L	79.7	Confident	75	Confident	76 Å²	76	85.8 Å²	85.8	40%	0.398	45%	0.447	S	S	.	.	H	α-helix	trans	-64.6	-36.6	173.9	-71.4	-179.9	0	0	0	112.7	L553 N554 P555 K556 L560 E561	L553-L558 HydrophobicContact CD1-CD1 4.02Å; L553-L558 HydrophobicContact CD1-CD2 4.24Å; L553-L558 HydrophobicContact CD1-CG 4.36Å; L553-L558 HydrophobicContact CD2-CD1 3.42Å; L553-L558 VanDerWaalsContact CD2-CD1 3.42Å; L553-L558 HydrophobicContact CG-CD1 3.46Å; L553-L558 VanDerWaalsContact CG-CD1 3.46Å; L553-L558 HydrophobicContact CG-CG 4.11Å; N554-L558 PolarHBondContact O-N 3.06Å; P555-L558 PolarHBondContact O-N 3.29Å; K556-L558 VanDerWaalsContact C-N 3.34Å; L558-L560 PolarHBondContact O-N 3.13Å; L558-E561 VanDerWaalsContact O-CB 3.3Å; L558-E561 WeakPolarHBondContact O-CB 3.4Å; L558-E561 PolarHBondContact O-N 3.33Å; L558-E561 VanDerWaalsContact O-N 3.15Å
559	S	85.4	Confident	77.3	Confident	90 Å²	90	81.3 Å²	81.3	63%	0.629	43%	0.431	S	S	*	.	H	α-helix	trans	-67.5	-19.3	174.4	69.3	0	0	0	0	113.5	P555 K556 L557	P555-S559 PolarHBondContact O-N 3.3Å; K556-S559 WeakPolarHBondContact CA-OG 3.45Å; K556-S559 PolarHBondContact O-N 2.81Å; K556-S559 PolarHBondContact O-OG 2.98Å; L557-S559 VanDerWaalsContact C-N 3.32Å; L557-S559 PolarHBondContact O-N 3.22Å
560	L	89.7	Confident	79.5	Confident	43 Å²	43	81.2 Å²	81.2	23%	0.225	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	6	175.6	-67	171.6	0	0	0	112.3	K556 L557 L558 Y562 A623 L633 G635 V636	K556-L560 WeakPolarHBondContact O-CG 3.38Å; K556-L560 PolarHBondContact O-N 3.45Å; L557-L560 CarbonylContact O-C 3.49Å; L557-L560 PolarHBondContact O-N 3.3Å; L557-L560 VanDerWaalsContact O-N 3.12Å; L558-L560 PolarHBondContact O-N 3.13Å; L560-Y562 PolarHBondContact O-N 2.99Å; L560-A623 HydrophobicContact CD1-CB 3.76Å; L560-L633 HydrophobicContact CD1-CD2 4.08Å; L560-L633 HydrophobicContact CD1-CG 4.42Å; L560-G635 CarbonylContact O-C 3.59Å; L560-G635 VanDerWaalsContact O-CA 3.31Å; L560-G635 WeakPolarHBondContact O-CA 3.15Å; L560-V636 HydrophobicContact CB-CB 4.43Å; L560-V636 HydrophobicContact CB-CG2 4.05Å; L560-V636 PolarHBondContact O-N 3.38Å
561	E	91.8	Very high	81.5	Confident	64 Å²	64	81.6 Å²	81.6	30%	0.299	42%	0.42	S	S	.	.	B	Isolated β-bridge	trans	-61.9	126.3	-177.3	-169.8	69.6	-168.1	0	0	111	L557 L558 V636 A638 V639	L557-E561 PolarHBondContact O-N 3.28Å; L558-E561 VanDerWaalsContact O-CB 3.3Å; L558-E561 WeakPolarHBondContact O-CB 3.4Å; L558-E561 PolarHBondContact O-N 3.33Å; L558-E561 VanDerWaalsContact O-N 3.15Å; E561-V636 CarbonylContact C-O 3.5Å; E561-V636 VanDerWaalsContact CA-O 3.24Å; E561-V636 WeakPolarHBondContact CA-O 3.27Å; E561-A638 PolarHBondContact OE1-N 3.07Å; E561-A638 VanDerWaalsContact OE1-N 3.1Å; E561-A638 VanDerWaalsContact OE2-CB 3.3Å; E561-A638 WeakPolarHBondContact OE2-CB 3.08Å; E561-A638 PolarHBondContact OE2-N 3.29Å; E561-V639 HydrophobicContact CG-CG2 4.45Å; E561-V639 WeakPolarHBondContact OE1-CB 3.23Å; E561-V639 PolarHBondContact OE1-N 2.85Å
562	Y	94.2	Very high	83.3	Confident	13 Å²	13	78.9 Å²	78.9	5%	0.051	41%	0.407	C	S	.	.			trans	-120.5	135.4	179.3	-174.7	-97.6	0	0	0	110.4	L560 R564 N566 I567 A586 P587 L589 V636 C637 L646	L560-Y562 PolarHBondContact O-N 2.99Å; Y562-R564 PolarHBondContact O-N 3.23Å; Y562-N566 HydrophobicContact CE1-CB 3.96Å; Y562-N566 WeakPolarHBondContact OH-CB 3.36Å; Y562-I567 HydrophobicContact CD1-CD1 4.31Å; Y562-I567 HydrophobicContact CD1-CG1 3.85Å; Y562-I567 HydrophobicContact CE1-CG1 3.64Å; Y562-A586 HydrophobicContact CE1-CB 4.19Å; Y562-A586 HydrophobicContact CE2-CB 4.49Å; Y562-A586 VanDerWaalsContact OH-C 3.29Å; Y562-A586 WeakPolarHBondContact OH-CA 3.13Å; Y562-P587 WeakPolarHBondContact OH-CD 3.21Å; Y562-P587 PolarHBondContact OH-O 2.83Å; Y562-L589 HydrophobicContact CD2-CB 4.36Å; Y562-L589 HydrophobicContact CD2-CD1 3.51Å; Y562-L589 HydrophobicContact CE2-CB 3.95Å; Y562-L589 HydrophobicContact CE2-CD1 3.99Å; Y562-L589 HydrophobicContact CG-CD1 4.08Å; Y562-V636 PolarHBondContact N-O 2.88Å; Y562-C637 PolarHBondContact O-SG 3.39Å; Y562-L646 HydrophobicContact CD1-CD2 3.66Å; Y562-L646 HydrophobicContact CE1-CD2 4.14Å; Y562-L646 HydrophobicContact CG-CD2 4Å
563	P	92.5	Very high	84.8	Confident	73 Å²	73	75.3 Å²	75.3	47%	0.474	39%	0.388	S	S	.	.			trans	-62.5	111.8	179.2	-21.6	32.9	0	0	0	112.2	N565 N566	P563-N565 PolarHBondContact O-N 3.35Å; P563-N565 VanDerWaalsContact O-N 3.13Å; P563-N566 HydrophobicContact CB-CB 4.42Å; P563-N566 WeakPolarHBondContact O-CB 3.41Å; P563-N566 PolarHBondContact O-N 2.89Å
564	R	91.1	Very high	85.9	Confident	59 Å²	59	70.4 Å²	70.4	22%	0.223	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-52.4	-39.2	-178.4	-172.5	-174.5	-65.3	102.8	9.2	113.3	Y562 N566 I567 C637 V639 G640 K641 P642	Y562-R564 PolarHBondContact O-N 3.23Å; R564-N566 PolarHBondContact O-N 2.93Å; R564-I567 WeakPolarHBondContact O-CB 3.25Å; R564-I567 WeakPolarHBondContact O-CG1 3.1Å; R564-I567 PolarHBondContact O-N 2.85Å; R564-I567 VanDerWaalsContact O-N 3.12Å; R564-C637 HydrophobicContact CB-CB 4.26Å; R564-V639 PolarHBondContact NH1-O 2.92Å; R564-V639 VanDerWaalsContact NH1-O 3.16Å; R564-V639 PolarHBondContact NH2-O 3.21Å; R564-G640 PolarHBondContact NH2-O 3.15Å; R564-G640 VanDerWaalsContact NH2-O 3.08Å; R564-K641 PolarHBondContact NH1-O 2.88Å; R564-P642 PolarHBondContact NE-O 2.77Å; R564-P642 PolarHBondContact NH2-O 2.67Å
565	N	91.1	Very high	86.1	Confident	157 Å²	157	73.2 Å²	73.2	84%	0.84	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-68.9	-14.7	-177.2	-64.3	-13.1	0	0	0	113.6	P563	P563-N565 PolarHBondContact O-N 3.35Å; P563-N565 VanDerWaalsContact O-N 3.13Å
566	N	94.4	Very high	85.7	Confident	81 Å²	81	69 Å²	69	43%	0.433	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-87.5	-7.7	176.2	-66.3	6.3	0	0	0	112.2	Y562 P563 R564 E568 P587	Y562-N566 HydrophobicContact CE1-CB 3.96Å; Y562-N566 WeakPolarHBondContact OH-CB 3.36Å; P563-N566 HydrophobicContact CB-CB 4.42Å; P563-N566 WeakPolarHBondContact O-CB 3.41Å; P563-N566 PolarHBondContact O-N 2.89Å; R564-N566 PolarHBondContact O-N 2.93Å; N566-E568 PolarHBondContact O-N 3.39Å; N566-P587 WeakPolarHBondContact O-CD 3.46Å
567	I	95.9	Very high	85.1	Confident	27 Å²	27	67.8 Å²	67.8	14%	0.138	36%	0.36	C	S	.	.			trans	-74.1	114.4	178.7	-58.7	175.8	0	0	0	109.2	Y562 R564 F582 A584 V600 L646	Y562-I567 HydrophobicContact CD1-CD1 4.31Å; Y562-I567 HydrophobicContact CD1-CG1 3.85Å; Y562-I567 HydrophobicContact CE1-CG1 3.64Å; R564-I567 WeakPolarHBondContact O-CB 3.25Å; R564-I567 WeakPolarHBondContact O-CG1 3.1Å; R564-I567 PolarHBondContact O-N 2.85Å; R564-I567 VanDerWaalsContact O-N 3.12Å; I567-F582 HydrophobicContact CG2-CE2 4.1Å; I567-A584 HydrophobicContact CG2-CB 3.55Å; I567-V600 HydrophobicContact CG2-CG2 4.03Å; I567-L646 HydrophobicContact CD1-CD1 3.99Å; I567-L646 HydrophobicContact CD1-CD2 4.27Å; I567-L646 HydrophobicContact CD1-CG 4.41Å; I567-L646 HydrophobicContact CG1-CD2 4.38Å
568	E	95.9	Very high	84.6	Confident	98 Å²	98	68.2 Å²	68.2	46%	0.458	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	106.6	177.9	-61.8	177.9	-176.2	0	0	110.3	N566 A584 R585 P587	N566-E568 PolarHBondContact O-N 3.39Å; E568-A584 CarbonylContact O-C 3.53Å; E568-A584 WeakPolarHBondContact O-CA 3.38Å; E568-A584 VanDerWaalsContact O-CB 3.27Å; E568-A584 WeakPolarHBondContact O-CB 3.46Å; E568-R585 HydrophobicContact CB-CB 4.13Å; E568-R585 PolarHBondContact N-O 2.88Å; E568-R585 PolarHBondContact O-N 3.43Å; E568-P587 HydrophobicContact CG-CG 4.46Å
569	Y	95.2	Very high	84.4	Confident	117 Å²	117	64.6 Å²	64.6	46%	0.459	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	139	177.7	172.9	-91.3	0	0	0	112.5	R571 D572 F582	Y569-R571 WeakPolarHBondContact OH-CA 3.39Å; Y569-D572 PolarHBondContact OH-N 3.48Å; Y569-D572 PolarHBondContact OH-OD2 3.03Å; Y569-F582 HydrophobicContact CD2-CB 4.01Å; Y569-F582 AromaticContact CD2-CD2 3.53Å; Y569-F582 HydrophobicContact CD2-CD2 3.53Å; Y569-F582 HydrophobicContact CD2-CE2 4.11Å; Y569-F582 AromaticContact CD2-CG 3.84Å; Y569-F582 HydrophobicContact CD2-CG 3.84Å; Y569-F582 HydrophobicContact CE2-CB 3.72Å; Y569-F582 HydrophobicContact CE2-CD2 4.15Å; Y569-F582 HydrophobicContact CE2-CG 4.03Å
570	V	93.7	Very high	84.4	Confident	49 Å²	49	65.6 Å²	65.6	30%	0.297	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	-62.9	174.4	178.7	0	0	0	0	111.1	Q583 R585	V570-Q583 WeakPolarHBondContact CA-O 3.29Å; V570-Q583 HydrophobicContact CB-CB 4.18Å; V570-Q583 HydrophobicContact CB-CG 4.1Å; V570-Q583 WeakPolarHBondContact CB-O 3.32Å; V570-Q583 HydrophobicContact CG1-CG 4.35Å; V570-Q583 PolarHBondContact N-O 3.26Å; V570-R585 HydrophobicContact CG2-CG 4.1Å
571	R	86.6	Confident	84.3	Confident	114 Å²	114	64 Å²	64	43%	0.43	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	155	-179.4	65.8	179.5	-176.8	97	-1	111.4	Y569 F582 Q583 Y649	Y569-R571 WeakPolarHBondContact OH-CA 3.39Å; R571-F582 CarbonylContact O-C 3.53Å; R571-F582 WeakPolarHBondContact O-CA 3.36Å; R571-F582 WeakPolarHBondContact O-CB 3.2Å; R571-Q583 HydrophobicContact CG-CB 3.98Å; R571-Q583 PolarHBondContact N-O 3.34Å; R571-Q583 PolarHBondContact O-N 3.48Å; R571-Y649 PolarHBondContact NH2-OH 3.27Å
572	D	84.7	Confident	84.2	Confident	84 Å²	84	61.2 Å²	61.2	45%	0.449	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	142.7	169.5	-67.4	-46.5	0	0	0	111.2	Y569	Y569-D572 PolarHBondContact OH-N 3.48Å; Y569-D572 PolarHBondContact OH-OD2 3.03Å
573	I	80.3	Confident	84.1	Confident	74 Å²	74	61.6 Å²	61.6	38%	0.379	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	-37.5	176.2	-57.8	169.9	0	0	0	109.7	V581 Q583 A599 Y649	I573-V581 HydrophobicContact CB-CG1 4.41Å; I573-V581 HydrophobicContact CD1-CG1 4.42Å; I573-V581 PolarHBondContact N-O 3.36Å; I573-Q583 HydrophobicContact CD1-CB 3.9Å; I573-Q583 HydrophobicContact CG1-CB 4.09Å; I573-A599 HydrophobicContact CD1-CB 4.34Å; I573-Y649 HydrophobicContact CD1-CD2 4.24Å; I573-Y649 HydrophobicContact CD1-CE2 3.83Å
574	G	73.3	Confident	84.3	Confident	28 Å²	28	58.1 Å²	58.1	29%	0.289	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	178	-178.6	177.6	0	0	0	0	0	113.3	V581	G574-V581 PolarHBondContact N-O 3.39Å; G574-V581 VanDerWaalsContact N-O 3.11Å; G574-V581 PolarHBondContact O-N 2.95Å; G574-V581 VanDerWaalsContact O-O 3.13Å
575	E	68.8	Low	84.6	Confident	94 Å²	94	59.8 Å²	59.8	44%	0.439	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	122.8	175.1	-164.3	-177.5	174.7	0	0	110	K604	E575-K604 WeakPolarHBondContact OE1-CE 3.4Å; E575-K604 IonicContact OE1-NZ 3.98Å; E575-K604 PolarHBondContact OE1-NZ 2.8Å
576	G	64	Low	84.8	Confident	11 Å²	11	52.3 Å²	52.3	11%	0.113	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	-177.7	176.9	0	0	0	0	0	113.6	F578 G579 G737	G576-F578 PolarHBondContact O-N 2.94Å; G576-G579 PolarHBondContact N-O 3.25Å; G576-G579 PolarHBondContact O-N 3.42Å; G576-G737 CarbonylContact C-O 3.52Å; G576-G737 WeakPolarHBondContact CA-O 3.05Å
577	A	61.7	Low	84.9	Confident	53 Å²	53	50.2 Å²	50.2	44%	0.438	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-29.5	-177.7	0	0	0	0	0	114	G737	A577-G737 PolarHBondContact N-O 2.86Å
578	F	67.3	Low	84.8	Confident	27 Å²	27	51.7 Å²	51.7	12%	0.118	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-20.2	-179.6	-64.8	-74.2	0	0	0	113.7	G576 L603 K604 M611 D614 F615 E618	G576-F578 PolarHBondContact O-N 2.94Å; F578-L603 HydrophobicContact CB-CD1 4.06Å; F578-L603 HydrophobicContact CD1-CD1 4.15Å; F578-K604 PolarHBondContact O-N 3.34Å; F578-K604 VanDerWaalsContact O-N 3.14Å; F578-M611 HydrophobicContact CD1-CG 3.54Å; F578-M611 HydrophobicContact CD1-SD 4.42Å; F578-M611 HydrophobicContact CE1-CG 3.97Å; F578-D614 HydrophobicContact CE1-CB 3.67Å; F578-D614 HydrophobicContact CZ-CB 3.9Å; F578-F615 HydrophobicContact CB-CD2 3.84Å; F578-F615 HydrophobicContact CB-CE2 4.15Å; F578-F615 HydrophobicContact CD1-CB 4.16Å; F578-F615 HydrophobicContact CD1-CD2 4Å; F578-F615 HydrophobicContact CD2-CD2 4.2Å; F578-F615 HydrophobicContact CE1-CB 4.32Å; F578-F615 AromaticContact CG-CD2 3.75Å; F578-F615 HydrophobicContact CG-CD2 3.75Å; F578-F615 HydrophobicContact CG-CE2 4.44Å; F578-E618 WeakPolarHBondContact CE2-OE2 3.49Å
579	G	75.2	Confident	84.7	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148	-165.5	-170.1	0	0	0	0	0	113	G576 M602	G576-G579 PolarHBondContact N-O 3.25Å; G576-G579 PolarHBondContact O-N 3.42Å; G579-M602 CarbonylContact C-O 3.54Å; G579-M602 WeakPolarHBondContact CA-O 3.05Å
580	R	84.5	Confident	84.5	Confident	111 Å²	111	44.3 Å²	44.3	42%	0.419	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	151.7	-175	66.1	174.3	-176.4	170.1	0.1	112.9	F582 M602	R580-F582 HydrophobicContact CG-CD1 4.19Å; R580-M602 HydrophobicContact CG-CB 4.32Å; R580-M602 PolarHBondContact N-O 2.95Å; R580-M602 PolarHBondContact O-N 3.49Å
581	V	87.9	Confident	84.2	Confident	8 Å²	8	48.2 Å²	48.2	5%	0.048	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	128.3	169.4	-178.4	0	0	0	0	109.4	I573 G574 V600 K601 L738	I573-V581 HydrophobicContact CB-CG1 4.41Å; I573-V581 HydrophobicContact CD1-CG1 4.42Å; I573-V581 PolarHBondContact N-O 3.36Å; G574-V581 PolarHBondContact N-O 3.39Å; G574-V581 VanDerWaalsContact N-O 3.11Å; G574-V581 PolarHBondContact O-N 2.95Å; G574-V581 VanDerWaalsContact O-O 3.13Å; V581-V600 VanDerWaalsContact CA-O 3.3Å; V581-V600 WeakPolarHBondContact CA-O 3.36Å; V581-K601 HydrophobicContact CG2-CB 4.1Å; V581-K601 HydrophobicContact CG2-CG 3.91Å; V581-L738 HydrophobicContact CB-CD1 4.47Å; V581-L738 HydrophobicContact CB-CD2 4.46Å; V581-L738 HydrophobicContact CG1-CD1 4.34Å; V581-L738 HydrophobicContact CG2-CD1 3.75Å; V581-L738 HydrophobicContact CG2-CD2 3.22Å; V581-L738 HydrophobicContact CG2-CG 4.09Å
582	F	89.3	Confident	84.5	Confident	6 Å²	6	51.4 Å²	51.4	3%	0.026	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	153.6	-178	60.2	-90	0	0	0	111.7	I567 Y569 R571 R580 A584 V600 M602	I567-F582 HydrophobicContact CG2-CE2 4.1Å; Y569-F582 HydrophobicContact CD2-CB 4.01Å; Y569-F582 AromaticContact CD2-CD2 3.53Å; Y569-F582 HydrophobicContact CD2-CD2 3.53Å; Y569-F582 HydrophobicContact CD2-CE2 4.11Å; Y569-F582 AromaticContact CD2-CG 3.84Å; Y569-F582 HydrophobicContact CD2-CG 3.84Å; Y569-F582 HydrophobicContact CE2-CB 3.72Å; Y569-F582 HydrophobicContact CE2-CD2 4.15Å; Y569-F582 HydrophobicContact CE2-CG 4.03Å; R571-F582 CarbonylContact O-C 3.53Å; R571-F582 WeakPolarHBondContact O-CA 3.36Å; R571-F582 WeakPolarHBondContact O-CB 3.2Å; R580-F582 HydrophobicContact CG-CD1 4.19Å; F582-A584 HydrophobicContact CD2-CB 4.06Å; F582-A584 HydrophobicContact CE2-CB 3.9Å; F582-V600 HydrophobicContact CD1-CB 4.34Å; F582-V600 HydrophobicContact CD2-CB 4.01Å; F582-V600 HydrophobicContact CD2-CG2 4.3Å; F582-V600 HydrophobicContact CE1-CB 3.95Å; F582-V600 HydrophobicContact CE1-CG1 3.88Å; F582-V600 HydrophobicContact CE2-CB 3.61Å; F582-V600 HydrophobicContact CE2-CG1 4Å; F582-V600 HydrophobicContact CE2-CG2 3.82Å; F582-V600 HydrophobicContact CG-CB 4.37Å; F582-V600 HydrophobicContact CZ-CB 3.57Å; F582-V600 HydrophobicContact CZ-CG1 3.48Å; F582-V600 VanDerWaalsContact CZ-CG1 3.48Å; F582-V600 HydrophobicContact CZ-CG2 4.19Å; F582-V600 PolarHBondContact N-O 3.49Å; F582-V600 PolarHBondContact O-N 3.33Å; F582-M602 HydrophobicContact CE1-CB 3.98Å; F582-M602 HydrophobicContact CE1-CE 3.63Å; F582-M602 HydrophobicContact CE1-SD 4.09Å; F582-M602 HydrophobicContact CZ-CE 3.67Å
583	Q	93.6	Very high	84.8	Confident	21 Å²	21	50.5 Å²	50.5	10%	0.098	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	135.8	170.4	-172.5	177.2	3.2	0	0	109	V570 R571 I573 M597 Y649	V570-Q583 WeakPolarHBondContact CA-O 3.29Å; V570-Q583 HydrophobicContact CB-CB 4.18Å; V570-Q583 HydrophobicContact CB-CG 4.1Å; V570-Q583 WeakPolarHBondContact CB-O 3.32Å; V570-Q583 HydrophobicContact CG1-CG 4.35Å; V570-Q583 PolarHBondContact N-O 3.26Å; R571-Q583 HydrophobicContact CG-CB 3.98Å; R571-Q583 PolarHBondContact N-O 3.34Å; R571-Q583 PolarHBondContact O-N 3.48Å; I573-Q583 HydrophobicContact CD1-CB 3.9Å; I573-Q583 HydrophobicContact CG1-CB 4.09Å; Q583-M597 HydrophobicContact CG-CG 4.33Å; Q583-M597 HydrophobicContact CG-SD 3.51Å; Q583-M597 VanDerWaalsContact CG-SD 3.51Å; Q583-M597 PolarHBondContact NE2-SD 3.28Å; Q583-Y649 HydrophobicContact CB-CE2 4.2Å; Q583-Y649 HydrophobicContact CG-CD2 4.04Å; Q583-Y649 HydrophobicContact CG-CE2 3.77Å; Q583-Y649 PolarHBondContact OE1-OH 3.2Å
584	A	95.8	Very high	85.3	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	157.9	176	0	0	0	0	0	112.2	I567 E568 F582 V598 V600	I567-A584 HydrophobicContact CG2-CB 3.55Å; E568-A584 CarbonylContact O-C 3.53Å; E568-A584 WeakPolarHBondContact O-CA 3.38Å; E568-A584 VanDerWaalsContact O-CB 3.27Å; E568-A584 WeakPolarHBondContact O-CB 3.46Å; F582-A584 HydrophobicContact CD2-CB 4.06Å; F582-A584 HydrophobicContact CE2-CB 3.9Å; A584-V598 HydrophobicContact CB-CG2 4.09Å; A584-V598 PolarHBondContact N-O 2Å; A584-V598 WeakPolarHBondContact O-CG2 3.41Å; A584-V598 PolarHBondContact O-N 2.83Å; A584-V600 HydrophobicContact CB-CG2 3.57Å
585	R	96.7	Very high	86.3	Confident	94 Å²	94	55 Å²	55	36%	0.355	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	135.4	162.7	-55.6	-179	177.8	92.8	2.6	108.5	E568 V570 P587 F595 M597	E568-R585 HydrophobicContact CB-CB 4.13Å; E568-R585 PolarHBondContact N-O 2.88Å; E568-R585 PolarHBondContact O-N 3.43Å; V570-R585 HydrophobicContact CG2-CG 4.1Å; R585-P587 WeakPolarHBondContact O-CD 3.43Å; R585-F595 HydrophobicContact CB-CB 4.29Å; R585-F595 HydrophobicContact CB-CD2 3.68Å; R585-F595 HydrophobicContact CB-CE2 4.33Å; R585-F595 HydrophobicContact CB-CG 4.12Å; R585-F595 HydrophobicContact CG-CD2 3.64Å; R585-F595 HydrophobicContact CG-CE2 3.76Å; R585-F595 HydrophobicContact CG-CG 4.37Å; R585-M597 HydrophobicContact CG-CE 3.93Å; R585-M597 HydrophobicContact CG-SD 4.46Å
586	A	96.9	Very high	87.5	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	90.4	175.6	0	0	0	0	0	109.2	Y562 G588 L589 T596 V598 L646	Y562-A586 HydrophobicContact CE1-CB 4.19Å; Y562-A586 HydrophobicContact CE2-CB 4.49Å; Y562-A586 VanDerWaalsContact OH-C 3.29Å; Y562-A586 WeakPolarHBondContact OH-CA 3.13Å; A586-G588 PolarHBondContact O-N 2.95Å; A586-L589 HydrophobicContact CB-CB 3.79Å; A586-L589 HydrophobicContact CB-CD2 3.8Å; A586-L589 HydrophobicContact CB-CG 4.37Å; A586-L589 WeakPolarHBondContact O-CB 3.45Å; A586-L589 PolarHBondContact O-N 3.15Å; A586-T596 PolarHBondContact N-O 2.92Å; A586-T596 PolarHBondContact O-N 2.94Å; A586-V598 HydrophobicContact CB-CG1 4.22Å; A586-V598 HydrophobicContact CB-CG2 3.95Å; A586-L646 HydrophobicContact CB-CD2 4.06Å
587	P	96.4	Very high	89	Confident	38 Å²	38	52.9 Å²	52.9	25%	0.247	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	133.4	176.9	-23.7	35.2	0	0	0	112	Y562 N566 E568 R585 L589 F595	Y562-P587 WeakPolarHBondContact OH-CD 3.21Å; Y562-P587 PolarHBondContact OH-O 2.83Å; N566-P587 WeakPolarHBondContact O-CD 3.46Å; E568-P587 HydrophobicContact CG-CG 4.46Å; R585-P587 WeakPolarHBondContact O-CD 3.43Å; P587-L589 PolarHBondContact O-N 2.94Å; P587-L589 VanDerWaalsContact O-N 3.17Å; P587-F595 HydrophobicContact CB-CB 4.49Å; P587-F595 HydrophobicContact CG-CB 4.38Å
588	G	92.5	Very high	90.6	Very high	58 Å²	58	50.3 Å²	50.3	60%	0.598	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	16.1	178.1	0	0	0	0	0	115.5	A586 P594	A586-G588 PolarHBondContact O-N 2.95Å; G588-P594 PolarHBondContact N-O 3.22Å
589	L	93.4	Very high	91.9	Very high	24 Å²	24	49.9 Å²	49.9	13%	0.126	26%	0.263	C	S	.	.	S	Bend	trans	-66.6	-44.7	174	-178.9	66	0	0	0	111.1	Y562 A586 P587 T596 V598 L634 L646	Y562-L589 HydrophobicContact CD2-CB 4.36Å; Y562-L589 HydrophobicContact CD2-CD1 3.51Å; Y562-L589 HydrophobicContact CE2-CB 3.95Å; Y562-L589 HydrophobicContact CE2-CD1 3.99Å; Y562-L589 HydrophobicContact CG-CD1 4.08Å; A586-L589 HydrophobicContact CB-CB 3.79Å; A586-L589 HydrophobicContact CB-CD2 3.8Å; A586-L589 HydrophobicContact CB-CG 4.37Å; A586-L589 WeakPolarHBondContact O-CB 3.45Å; A586-L589 PolarHBondContact O-N 3.15Å; P587-L589 PolarHBondContact O-N 2.94Å; P587-L589 VanDerWaalsContact O-N 3.17Å; L589-T596 HydrophobicContact CD2-CG2 4.26Å; L589-V598 HydrophobicContact CD2-CG1 3.49Å; L589-V598 VanDerWaalsContact CD2-CG1 3.49Å; L589-L634 HydrophobicContact CD2-CB 3.81Å; L589-L634 HydrophobicContact CD2-CD1 4.2Å; L589-L634 HydrophobicContact CG-CB 4.41Å; L589-L646 HydrophobicContact CD1-CD2 4.4Å; L589-L646 HydrophobicContact CD2-CD2 4.21Å
590	L	91.1	Very high	92.7	Very high	36 Å²	36	49.9 Å²	49.9	19%	0.188	26%	0.262	C	S	.	.	S	Bend	trans	-109.7	127.5	171.3	-62.5	176.9	0	0	0	109.3	Y592 E593 T596	L590-Y592 HydrophobicContact CB-CD1 4.37Å; L590-Y592 HydrophobicContact CB-CE1 3.92Å; L590-Y592 HydrophobicContact CB-CE2 4.25Å; L590-Y592 HydrophobicContact CD1-CE1 4.44Å; L590-Y592 HydrophobicContact CD1-CE2 4.4Å; L590-Y592 VanDerWaalsContact CD1-OH 3.26Å; L590-Y592 WeakPolarHBondContact CD1-OH 3.33Å; L590-Y592 PolarHBondContact O-N 3.4Å; L590-E593 HydrophobicContact CB-CG 3.96Å; L590-E593 PolarHBondContact O-N 2.81Å; L590-T596 HydrophobicContact CD1-CG2 3.85Å; L590-T596 HydrophobicContact CG-CG2 4.35Å; L590-T596 WeakPolarHBondContact CG-OG1 3.43Å; L590-T596 PolarHBondContact N-OG1 2.94Å
591	P	88.8	Confident	93	Very high	130 Å²	130	44.9 Å²	44.9	84%	0.844	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-18.2	-170.5	-24.9	33.3	0	0	0	115.7
592	Y	91.7	Very high	93	Very high	181 Å²	181	45.7 Å²	45.7	71%	0.71	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-1.9	-172.1	54.9	-102.8	0	0	0	114	L590	L590-Y592 HydrophobicContact CB-CD1 4.37Å; L590-Y592 HydrophobicContact CB-CE1 3.92Å; L590-Y592 HydrophobicContact CB-CE2 4.25Å; L590-Y592 HydrophobicContact CD1-CE1 4.44Å; L590-Y592 HydrophobicContact CD1-CE2 4.4Å; L590-Y592 VanDerWaalsContact CD1-OH 3.26Å; L590-Y592 WeakPolarHBondContact CD1-OH 3.33Å; L590-Y592 PolarHBondContact O-N 3.4Å
593	E	91.9	Very high	92.9	Very high	66 Å²	66	45.8 Å²	45.8	31%	0.308	25%	0.248	S	C	.	.	S	Bend	trans	-136.1	150	179.7	59	-176.1	-163.1	0	0	111.2	L590 F595 T596	L590-E593 HydrophobicContact CB-CG 3.96Å; L590-E593 PolarHBondContact O-N 2.81Å; E593-F595 VanDerWaalsContact C-N 3.32Å; E593-F595 PolarHBondContact O-N 2.89Å; E593-T596 WeakPolarHBondContact OE1-CA 3.34Å; E593-T596 WeakPolarHBondContact OE1-CB 3.4Å; E593-T596 WeakPolarHBondContact OE1-CG2 3.24Å; E593-T596 PolarHBondContact OE1-OG1 2.81Å
594	P	90.4	Very high	92.4	Very high	109 Å²	109	48.7 Å²	48.7	71%	0.708	26%	0.26	S	S	*	.	S	Bend	trans	-64.1	-38.2	-174.6	24.4	-34.1	0	0	0	112.5	G588	G588-P594 PolarHBondContact N-O 3.22Å
595	F	93.9	Very high	91.7	Very high	86 Å²	86	54.7 Å²	54.7	38%	0.377	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	149	170.5	65.7	-91.6	0	0	0	109.3	R585 P587 E593 M597	R585-F595 HydrophobicContact CB-CB 4.29Å; R585-F595 HydrophobicContact CB-CD2 3.68Å; R585-F595 HydrophobicContact CB-CE2 4.33Å; R585-F595 HydrophobicContact CB-CG 4.12Å; R585-F595 HydrophobicContact CG-CD2 3.64Å; R585-F595 HydrophobicContact CG-CE2 3.76Å; R585-F595 HydrophobicContact CG-CG 4.37Å; P587-F595 HydrophobicContact CB-CB 4.49Å; P587-F595 HydrophobicContact CG-CB 4.38Å; E593-F595 VanDerWaalsContact C-N 3.32Å; E593-F595 PolarHBondContact O-N 2.89Å; F595-M597 HydrophobicContact CE2-CE 4.2Å
596	T	95.6	Very high	90.9	Very high	8 Å²	8	57.5 Å²	57.5	5%	0.049	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	133.7	173.2	-50.6	0	0	0	0	109.3	A586 L589 L590 E593 V598 L634	A586-T596 PolarHBondContact N-O 2.92Å; A586-T596 PolarHBondContact O-N 2.94Å; L589-T596 HydrophobicContact CD2-CG2 4.26Å; L590-T596 HydrophobicContact CD1-CG2 3.85Å; L590-T596 HydrophobicContact CG-CG2 4.35Å; L590-T596 WeakPolarHBondContact CG-OG1 3.43Å; L590-T596 PolarHBondContact N-OG1 2.94Å; E593-T596 WeakPolarHBondContact OE1-CA 3.34Å; E593-T596 WeakPolarHBondContact OE1-CB 3.4Å; E593-T596 WeakPolarHBondContact OE1-CG2 3.24Å; E593-T596 PolarHBondContact OE1-OG1 2.81Å; T596-V598 HydrophobicContact CG2-CG1 3.94Å; T596-L634 HydrophobicContact CG2-CD1 3.93Å
597	M	94.5	Very high	90	Very high	53 Å²	53	58.3 Å²	58.3	26%	0.261	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	125	168.9	-169.4	60.8	65.6	0	0	109.2	Q583 R585 F595 Y649	Q583-M597 HydrophobicContact CG-CG 4.33Å; Q583-M597 HydrophobicContact CG-SD 3.51Å; Q583-M597 VanDerWaalsContact CG-SD 3.51Å; Q583-M597 PolarHBondContact NE2-SD 3.28Å; R585-M597 HydrophobicContact CG-CE 3.93Å; R585-M597 HydrophobicContact CG-SD 4.46Å; F595-M597 HydrophobicContact CE2-CE 4.2Å; M597-Y649 HydrophobicContact CB-CD1 4.45Å; M597-Y649 HydrophobicContact CG-CD1 3.55Å; M597-Y649 HydrophobicContact CG-CD2 4.48Å; M597-Y649 HydrophobicContact CG-CE1 4.27Å; M597-Y649 HydrophobicContact CG-CG 3.67Å; M597-Y649 WeakPolarHBondContact O-CB 3.19Å
598	V	95.9	Very high	89.1	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	151.4	-175	-64.6	0	0	0	0	112.4	A584 A586 L589 T596 V600 L634 L646 F647	A584-V598 HydrophobicContact CB-CG2 4.09Å; A584-V598 PolarHBondContact N-O 2Å; A584-V598 WeakPolarHBondContact O-CG2 3.41Å; A584-V598 PolarHBondContact O-N 2.83Å; A586-V598 HydrophobicContact CB-CG1 4.22Å; A586-V598 HydrophobicContact CB-CG2 3.95Å; L589-V598 HydrophobicContact CD2-CG1 3.49Å; L589-V598 VanDerWaalsContact CD2-CG1 3.49Å; T596-V598 HydrophobicContact CG2-CG1 3.94Å; V598-V600 HydrophobicContact CG2-CG2 3.71Å; V598-L634 HydrophobicContact CG1-CD1 4.09Å; V598-L646 HydrophobicContact CB-CB 4.42Å; V598-L646 HydrophobicContact CG1-CB 4.46Å; V598-L646 HydrophobicContact CG2-CD2 4.34Å; V598-L646 HydrophobicContact CG2-CG 4.41Å; V598-F647 CarbonylContact C-O 3.39Å; V598-F647 VanDerWaalsContact CA-O 3.25Å; V598-F647 WeakPolarHBondContact CA-O 3.45Å; V598-F647 VanDerWaalsContact CB-O 3.3Å; V598-F647 WeakPolarHBondContact CB-O 3.49Å
599	A	93.8	Very high	88.3	Confident	18 Å²	18	60.4 Å²	60.4	15%	0.149	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	114.4	162.6	0	0	0	0	0	108.5	I573 F647 Y649	I573-A599 HydrophobicContact CD1-CB 4.34Å; A599-F647 HydrophobicContact CB-CB 4.46Å; A599-F647 PolarHBondContact N-O 3.2Å; A599-F647 PolarHBondContact O-N 2.91Å; A599-Y649 HydrophobicContact CB-CD2 4.43Å
600	V	92.8	Very high	87.1	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	115.8	-178.6	-171.7	0	0	0	0	109.3	I567 V581 F582 A584 V598 C644 L645 L646	I567-V600 HydrophobicContact CG2-CG2 4.03Å; V581-V600 VanDerWaalsContact CA-O 3.3Å; V581-V600 WeakPolarHBondContact CA-O 3.36Å; F582-V600 HydrophobicContact CD1-CB 4.34Å; F582-V600 HydrophobicContact CD2-CB 4.01Å; F582-V600 HydrophobicContact CD2-CG2 4.3Å; F582-V600 HydrophobicContact CE1-CB 3.95Å; F582-V600 HydrophobicContact CE1-CG1 3.88Å; F582-V600 HydrophobicContact CE2-CB 3.61Å; F582-V600 HydrophobicContact CE2-CG1 4Å; F582-V600 HydrophobicContact CE2-CG2 3.82Å; F582-V600 HydrophobicContact CG-CB 4.37Å; F582-V600 HydrophobicContact CZ-CB 3.57Å; F582-V600 HydrophobicContact CZ-CG1 3.48Å; F582-V600 VanDerWaalsContact CZ-CG1 3.48Å; F582-V600 HydrophobicContact CZ-CG2 4.19Å; F582-V600 PolarHBondContact N-O 3.49Å; F582-V600 PolarHBondContact O-N 3.33Å; A584-V600 HydrophobicContact CB-CG2 3.57Å; V598-V600 HydrophobicContact CG2-CG2 3.71Å; V600-C644 HydrophobicContact CG1-CB 3.95Å; V600-L645 CarbonylContact C-O 3.55Å; V600-L645 WeakPolarHBondContact CA-O 3.47Å; V600-L646 HydrophobicContact CG2-CG 4.29Å
601	K	90	Very high	86.2	Confident	6 Å²	6	66.3 Å²	66.3	3%	0.026	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	120.8	170.6	-173.1	178.6	175.8	-176.5	0	108.8	V581 F615 E618 C644 L645 F647 F736 L738	V581-K601 HydrophobicContact CG2-CB 4.1Å; V581-K601 HydrophobicContact CG2-CG 3.91Å; K601-F615 HydrophobicContact CD-CE2 4.18Å; K601-F615 HydrophobicContact CG-CE2 4.01Å; K601-F615 HydrophobicContact CG-CZ 4.46Å; K601-E618 IonicContact NZ-OE1 3.98Å; K601-E618 PolarHBondContact NZ-OE1 3.22Å; K601-E618 IonicContact NZ-OE2 3.36Å; K601-E618 PolarHBondContact NZ-OE2 3.22Å; K601-C644 CarbonylContact O-C 3.39Å; K601-C644 WeakPolarHBondContact O-CA 3.49Å; K601-L645 HydrophobicContact CB-CB 4.45Å; K601-L645 PolarHBondContact N-O 3.14Å; K601-L645 PolarHBondContact O-N 3.25Å; K601-F647 HydrophobicContact CB-CD2 4.49Å; K601-F647 HydrophobicContact CB-CE2 4.16Å; K601-F647 HydrophobicContact CD-CE2 4.37Å; K601-F736 PolarHBondContact NZ-O 3.09Å; K601-L738 HydrophobicContact CD-CD2 4.24Å; K601-L738 HydrophobicContact CG-CD2 4.49Å
602	M	88.2	Confident	85.7	Confident	26 Å²	26	62.6 Å²	62.6	13%	0.128	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	129.6	-172.8	-178.7	179.9	-80.2	0	0	111	G579 R580 F582 P642 C644	G579-M602 CarbonylContact C-O 3.54Å; G579-M602 WeakPolarHBondContact CA-O 3.05Å; R580-M602 HydrophobicContact CG-CB 4.32Å; R580-M602 PolarHBondContact N-O 2.95Å; R580-M602 PolarHBondContact O-N 3.49Å; F582-M602 HydrophobicContact CE1-CB 3.98Å; F582-M602 HydrophobicContact CE1-CE 3.63Å; F582-M602 HydrophobicContact CE1-SD 4.09Å; F582-M602 HydrophobicContact CZ-CE 3.67Å; M602-P642 HydrophobicContact CE-CG 4.07Å; M602-P642 HydrophobicContact CG-CB 3.93Å; M602-P642 HydrophobicContact CG-CG 3.95Å; M602-P642 HydrophobicContact SD-CB 4.37Å; M602-P642 HydrophobicContact SD-CG 3.79Å; M602-C644 VanDerWaalsContact CE-SG 3.57Å
603	L	86.3	Confident	84.8	Confident	7 Å²	7	54.9 Å²	54.9	4%	0.037	30%	0.299	C	S	.	.			trans	-75.5	137.1	174.8	-175	68.3	0	0	0	110.5	F578 A607 M611 Q612 F615 P642 M643	F578-L603 HydrophobicContact CB-CD1 4.06Å; F578-L603 HydrophobicContact CD1-CD1 4.15Å; L603-A607 HydrophobicContact CD1-CB 3.73Å; L603-A607 HydrophobicContact CD2-CB 4.13Å; L603-A607 HydrophobicContact CG-CB 3.75Å; L603-M611 HydrophobicContact CD1-CG 3.97Å; L603-M611 HydrophobicContact CD1-SD 4.32Å; L603-Q612 HydrophobicContact CD2-CB 3.95Å; L603-Q612 HydrophobicContact CD2-CG 3.94Å; L603-F615 HydrophobicContact CB-CD1 4.16Å; L603-F615 HydrophobicContact CB-CD2 4.4Å; L603-F615 HydrophobicContact CB-CE1 4.13Å; L603-F615 HydrophobicContact CB-CE2 4.36Å; L603-F615 HydrophobicContact CB-CG 4.29Å; L603-F615 HydrophobicContact CB-CZ 4.22Å; L603-F615 HydrophobicContact CD1-CB 4.11Å; L603-F615 HydrophobicContact CD1-CD2 4.17Å; L603-F615 HydrophobicContact CD1-CG 4.11Å; L603-F615 HydrophobicContact CD2-CB 4.38Å; L603-F615 HydrophobicContact CD2-CD1 4.37Å; L603-F615 HydrophobicContact CD2-CG 4.42Å; L603-P642 VanDerWaalsContact O-CB 3.25Å; L603-P642 WeakPolarHBondContact O-CB 3.3Å; L603-M643 HydrophobicContact CB-CB 4.18Å; L603-M643 HydrophobicContact CD2-CB 4.29Å; L603-M643 PolarHBondContact N-O 3.49Å
604	K	83.7	Confident	83.8	Confident	82 Å²	82	55.2 Å²	55.2	36%	0.357	30%	0.303	S	S	.	.			trans	-57.7	142.1	174.6	-64.9	-175.9	-176.1	-165.3	0	111.3	E575 F578 E606 A607	E575-K604 WeakPolarHBondContact OE1-CE 3.4Å; E575-K604 IonicContact OE1-NZ 3.98Å; E575-K604 PolarHBondContact OE1-NZ 2.8Å; F578-K604 PolarHBondContact O-N 3.34Å; F578-K604 VanDerWaalsContact O-N 3.14Å; K604-E606 VanDerWaalsContact C-N 3.26Å; K604-E606 PolarHBondContact O-N 3.49Å; K604-A607 HydrophobicContact CB-CB 4.39Å; K604-A607 WeakPolarHBondContact O-CB 3.47Å; K604-A607 PolarHBondContact O-N 3.3Å; K604-A607 VanDerWaalsContact O-N 3.13Å
605	E	80.4	Confident	83.3	Confident	127 Å²	127	50 Å²	50	59%	0.593	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-35.6	-177.6	-72.6	-170.8	174	0	0	112.1	A607 K641 P642	E605-A607 VanDerWaalsContact C-N 3.29Å; E605-A607 PolarHBondContact O-N 3.32Å; E605-K641 PolarHBondContact O-NZ 3.13Å; E605-P642 HydrophobicContact CG-CB 4.09Å; E605-P642 HydrophobicContact CG-CG 4.46Å
606	E	80.5	Confident	82.6	Confident	153 Å²	153	49.3 Å²	49.3	72%	0.715	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	8.4	176.5	70.6	-80.2	-173.1	0	0	114.2	K604	K604-E606 VanDerWaalsContact C-N 3.26Å; K604-E606 PolarHBondContact O-N 3.49Å
607	A	79.1	Confident	81.6	Confident	17 Å²	17	52 Å²	52	14%	0.14	28%	0.276	C	S	.	.			trans	-59.3	142.4	179	0	0	0	0	0	112.3	L603 K604 E605 M611	L603-A607 HydrophobicContact CD1-CB 3.73Å; L603-A607 HydrophobicContact CD2-CB 4.13Å; L603-A607 HydrophobicContact CG-CB 3.75Å; K604-A607 HydrophobicContact CB-CB 4.39Å; K604-A607 WeakPolarHBondContact O-CB 3.47Å; K604-A607 PolarHBondContact O-N 3.3Å; K604-A607 VanDerWaalsContact O-N 3.13Å; E605-A607 VanDerWaalsContact C-N 3.29Å; E605-A607 PolarHBondContact O-N 3.32Å; A607-M611 HydrophobicContact CB-CB 4.36Å; A607-M611 HydrophobicContact CB-CG 4.28Å; A607-M611 HydrophobicContact CB-SD 3.9Å
608	S	77.7	Confident	80.9	Confident	63 Å²	63	49.7 Å²	49.7	44%	0.441	27%	0.265	S	S	.	.			trans	-66.6	158.6	176.9	70.4	0	0	0	0	111.7	D610 M611 Q612	S608-D610 PolarHBondContact O-N 2.9Å; S608-M611 PolarHBondContact O-N 3.27Å; S608-M611 VanDerWaalsContact O-N 3.13Å; S608-M611 WeakPolarHBondContact OG-CB 3.49Å; S608-M611 PolarHBondContact OG-N 2.8Å; S608-Q612 PolarHBondContact O-N 3.2Å
609	A	74.8	Confident	80.2	Confident	77 Å²	77	49.7 Å²	49.7	64%	0.636	27%	0.265	S	S	*	.	H	α-helix	trans	-57.5	-36.4	176.2	0	0	0	0	0	112.3	Q612 A613	A609-Q612 PolarHBondContact O-N 3.43Å; A609-A613 WeakPolarHBondContact O-CB 3.28Å; A609-A613 PolarHBondContact O-N 3.06Å
610	D	69	Low	79.6	Confident	124 Å²	124	49.1 Å²	49.1	66%	0.663	26%	0.26	S	S	*	.	H	α-helix	trans	-65.6	-44.3	176.4	-64.2	-36.7	0	0	0	111.6	S608 Q612 A613 D614	S608-D610 PolarHBondContact O-N 2.9Å; D610-Q612 VanDerWaalsContact C-N 3.35Å; D610-Q612 PolarHBondContact O-N 2.89Å; D610-A613 PolarHBondContact O-N 3.37Å; D610-D614 PolarHBondContact O-N 3.05Å
611	M	71.3	Confident	78.9	Confident	59 Å²	59	49.1 Å²	49.1	29%	0.291	26%	0.26	S	S	.	.	H	α-helix	trans	-66.2	-38.2	178.5	-173.4	177.9	-74.4	0	0	111.7	F578 L603 A607 S608 D614 F615	F578-M611 HydrophobicContact CD1-CG 3.54Å; F578-M611 HydrophobicContact CD1-SD 4.42Å; F578-M611 HydrophobicContact CE1-CG 3.97Å; L603-M611 HydrophobicContact CD1-CG 3.97Å; L603-M611 HydrophobicContact CD1-SD 4.32Å; A607-M611 HydrophobicContact CB-CB 4.36Å; A607-M611 HydrophobicContact CB-CG 4.28Å; A607-M611 HydrophobicContact CB-SD 3.9Å; S608-M611 PolarHBondContact O-N 3.27Å; S608-M611 VanDerWaalsContact O-N 3.13Å; S608-M611 WeakPolarHBondContact OG-CB 3.49Å; S608-M611 PolarHBondContact OG-N 2.8Å; M611-D614 PolarHBondContact O-N 3.37Å; M611-F615 WeakPolarHBondContact O-CB 3.33Å; M611-F615 PolarHBondContact O-N 3.07Å
612	Q	77.6	Confident	78.7	Confident	53 Å²	53	49 Å²	49	25%	0.248	26%	0.26	C	S	.	.	H	α-helix	trans	-63.8	-40.9	172.5	-174.7	176.6	-10.5	0	0	111.6	L603 S608 A609 D610 F615 Q616 M643	L603-Q612 HydrophobicContact CD2-CB 3.95Å; L603-Q612 HydrophobicContact CD2-CG 3.94Å; S608-Q612 PolarHBondContact O-N 3.2Å; A609-Q612 PolarHBondContact O-N 3.43Å; D610-Q612 VanDerWaalsContact C-N 3.35Å; D610-Q612 PolarHBondContact O-N 2.89Å; Q612-F615 PolarHBondContact O-N 2.87Å; Q612-Q616 WeakPolarHBondContact O-CG 3.4Å; Q612-Q616 PolarHBondContact O-N 2.7Å; Q612-M643 HydrophobicContact CG-SD 3.91Å
613	A	73.1	Confident	78.6	Confident	18 Å²	18	48.3 Å²	48.3	15%	0.149	26%	0.258	C	S	.	.	H	α-helix	trans	-67.7	-38	177.3	0	0	0	0	0	112.2	A609 D610 Q616 R617	A609-A613 WeakPolarHBondContact O-CB 3.28Å; A609-A613 PolarHBondContact O-N 3.06Å; D610-A613 PolarHBondContact O-N 3.37Å; A613-Q616 PolarHBondContact O-N 3.22Å; A613-R617 WeakPolarHBondContact O-CB 3.27Å; A613-R617 WeakPolarHBondContact O-CG 3.43Å; A613-R617 PolarHBondContact O-N 2.79Å; A613-R617 PolarHBondContact O-NH1 2.66Å
614	D	72.4	Confident	78.5	Confident	74 Å²	74	51.3 Å²	51.3	40%	0.396	27%	0.272	S	S	.	.	H	α-helix	trans	-62.7	-45	172	-82.8	-34	0	0	0	111.6	F578 D610 M611 Q616 R617 E618	F578-D614 HydrophobicContact CE1-CB 3.67Å; F578-D614 HydrophobicContact CZ-CB 3.9Å; D610-D614 PolarHBondContact O-N 3.05Å; M611-D614 PolarHBondContact O-N 3.37Å; D614-Q616 VanDerWaalsContact C-N 3.34Å; D614-Q616 PolarHBondContact O-N 3.22Å; D614-R617 VanDerWaalsContact CG-NH2 3.32Å; D614-R617 PolarHBondContact O-N 2.68Å; D614-R617 IonicContact OD1-CZ 3.36Å; D614-R617 IonicContact OD1-NE 2.77Å; D614-R617 PolarHBondContact OD1-NE 3.43Å; D614-R617 IonicContact OD1-NH2 3.44Å; D614-R617 PolarHBondContact OD1-NH2 3.02Å; D614-R617 IonicContact OD2-NH2 3.55Å; D614-E618 WeakPolarHBondContact O-CB 3.27Å; D614-E618 PolarHBondContact O-N 3.11Å
615	F	79.6	Confident	78.7	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.8	-39.7	177.5	-166.2	-100.7	0	0	0	112.7	F578 K601 L603 M611 Q612 E618 A619 M643 L645	F578-F615 HydrophobicContact CB-CD2 3.84Å; F578-F615 HydrophobicContact CB-CE2 4.15Å; F578-F615 HydrophobicContact CD1-CB 4.16Å; F578-F615 HydrophobicContact CD1-CD2 4Å; F578-F615 HydrophobicContact CD2-CD2 4.2Å; F578-F615 HydrophobicContact CE1-CB 4.32Å; F578-F615 AromaticContact CG-CD2 3.75Å; F578-F615 HydrophobicContact CG-CD2 3.75Å; F578-F615 HydrophobicContact CG-CE2 4.44Å; K601-F615 HydrophobicContact CD-CE2 4.18Å; K601-F615 HydrophobicContact CG-CE2 4.01Å; K601-F615 HydrophobicContact CG-CZ 4.46Å; L603-F615 HydrophobicContact CB-CD1 4.16Å; L603-F615 HydrophobicContact CB-CD2 4.4Å; L603-F615 HydrophobicContact CB-CE1 4.13Å; L603-F615 HydrophobicContact CB-CE2 4.36Å; L603-F615 HydrophobicContact CB-CG 4.29Å; L603-F615 HydrophobicContact CB-CZ 4.22Å; L603-F615 HydrophobicContact CD1-CB 4.11Å; L603-F615 HydrophobicContact CD1-CD2 4.17Å; L603-F615 HydrophobicContact CD1-CG 4.11Å; L603-F615 HydrophobicContact CD2-CB 4.38Å; L603-F615 HydrophobicContact CD2-CD1 4.37Å; L603-F615 HydrophobicContact CD2-CG 4.42Å; M611-F615 WeakPolarHBondContact O-CB 3.33Å; M611-F615 PolarHBondContact O-N 3.07Å; Q612-F615 PolarHBondContact O-N 2.87Å; F615-E618 WeakPolarHBondContact O-CB 3.32Å; F615-E618 PolarHBondContact O-N 3.42Å; F615-A619 PolarHBondContact O-N 3.05Å; F615-M643 HydrophobicContact CD1-CB 4.01Å; F615-M643 HydrophobicContact CD1-CE 4.29Å; F615-M643 HydrophobicContact CE1-CB 3.81Å; F615-L645 HydrophobicContact CE1-CD1 4Å; F615-L645 HydrophobicContact CE1-CD2 4.18Å; F615-L645 HydrophobicContact CE1-CG 3.67Å; F615-L645 HydrophobicContact CE2-CD1 4.08Å; F615-L645 HydrophobicContact CE2-CG 4.38Å; F615-L645 HydrophobicContact CZ-CB 4.44Å; F615-L645 HydrophobicContact CZ-CD1 3.76Å; F615-L645 HydrophobicContact CZ-CG 3.57Å
616	Q	78.7	Confident	79.2	Confident	70 Å²	70	46.7 Å²	46.7	33%	0.327	26%	0.255	S	S	.	.	H	α-helix	trans	-67.3	-42	174.3	-76.8	176.7	-13.5	0	0	112.6	Q612 A613 D614 E618 A619 A620 M643	Q612-Q616 WeakPolarHBondContact O-CG 3.4Å; Q612-Q616 PolarHBondContact O-N 2.7Å; A613-Q616 PolarHBondContact O-N 3.22Å; D614-Q616 VanDerWaalsContact C-N 3.34Å; D614-Q616 PolarHBondContact O-N 3.22Å; Q616-E618 VanDerWaalsContact C-N 3.29Å; Q616-E618 PolarHBondContact O-N 3.19Å; Q616-A619 PolarHBondContact O-N 3.11Å; Q616-A620 VanDerWaalsContact O-CB 3.27Å; Q616-A620 WeakPolarHBondContact O-CB 3.37Å; Q616-A620 PolarHBondContact O-N 3.49Å; Q616-M643 HydrophobicContact CG-CE 3.49Å; Q616-M643 VanDerWaalsContact CG-CE 3.49Å; Q616-M643 HydrophobicContact CG-SD 3.95Å
617	R	75.2	Confident	79.9	Confident	66 Å²	66	40.8 Å²	40.8	25%	0.249	23%	0.228	C	C	.	.	H	α-helix	trans	-61.8	-40.3	175.1	-77.9	-173.8	-72.5	-87.5	9.1	111.4	Y546 A613 D614 A620 L621	Y546-R617 HydrophobicContact CD1-CB 3.85Å; Y546-R617 HydrophobicContact CD1-CG 4.22Å; Y546-R617 HydrophobicContact CE1-CB 3.73Å; A613-R617 WeakPolarHBondContact O-CB 3.27Å; A613-R617 WeakPolarHBondContact O-CG 3.43Å; A613-R617 PolarHBondContact O-N 2.79Å; A613-R617 PolarHBondContact O-NH1 2.66Å; D614-R617 VanDerWaalsContact CG-NH2 3.32Å; D614-R617 PolarHBondContact O-N 2.68Å; D614-R617 IonicContact OD1-CZ 3.36Å; D614-R617 IonicContact OD1-NE 2.77Å; D614-R617 PolarHBondContact OD1-NE 3.43Å; D614-R617 IonicContact OD1-NH2 3.44Å; D614-R617 PolarHBondContact OD1-NH2 3.02Å; D614-R617 IonicContact OD2-NH2 3.55Å; R617-A620 PolarHBondContact O-N 2.93Å; R617-L621 WeakPolarHBondContact O-CG 3.09Å; R617-L621 PolarHBondContact O-N 3.29Å; R617-L621 VanDerWaalsContact O-N 3.1Å
618	E	78.6	Confident	80.6	Confident	3 Å²	3	44.2 Å²	44.2	1%	0.014	25%	0.249	C	C	.	.	H	α-helix	trans	-58.5	-52.9	174.7	-163.4	-167.5	127.3	0	0	111.6	F578 K601 D614 F615 Q616 A620 L621 M622 F736	F578-E618 WeakPolarHBondContact CE2-OE2 3.49Å; K601-E618 IonicContact NZ-OE1 3.98Å; K601-E618 PolarHBondContact NZ-OE1 3.22Å; K601-E618 IonicContact NZ-OE2 3.36Å; K601-E618 PolarHBondContact NZ-OE2 3.22Å; D614-E618 WeakPolarHBondContact O-CB 3.27Å; D614-E618 PolarHBondContact O-N 3.11Å; F615-E618 WeakPolarHBondContact O-CB 3.32Å; F615-E618 PolarHBondContact O-N 3.42Å; Q616-E618 VanDerWaalsContact C-N 3.29Å; Q616-E618 PolarHBondContact O-N 3.19Å; E618-A620 VanDerWaalsContact C-N 3.28Å; E618-A620 PolarHBondContact O-N 3.49Å; E618-L621 PolarHBondContact O-N 2.79Å; E618-M622 WeakPolarHBondContact O-CG 3.37Å; E618-M622 PolarHBondContact O-N 3.19Å; E618-F736 VanDerWaalsContact CD-CD2 3.43Å; E618-F736 HydrophobicContact CG-CB 3.78Å; E618-F736 HydrophobicContact CG-CD1 3.94Å; E618-F736 HydrophobicContact CG-CD2 3.1Å; E618-F736 HydrophobicContact CG-CE1 4.29Å; E618-F736 HydrophobicContact CG-CE2 3.51Å; E618-F736 HydrophobicContact CG-CG 3.33Å; E618-F736 HydrophobicContact CG-CZ 4.09Å; E618-F736 VanDerWaalsContact OE1-CB 3.27Å; E618-F736 WeakPolarHBondContact OE1-CB 3.26Å; E618-F736 WeakPolarHBondContact OE2-CB 3.29Å
619	A	82.3	Confident	81.6	Confident	1 Å²	1	42 Å²	42	1%	0.008	23%	0.232	C	C	.	.	H	α-helix	trans	-55.4	-46.1	177.1	0	0	0	0	0	111.7	L557 F615 Q616 L621 M622 A623 L645	L557-A619 HydrophobicContact CD1-CB 4.15Å; L557-A619 HydrophobicContact CD2-CB 3.81Å; F615-A619 PolarHBondContact O-N 3.05Å; Q616-A619 PolarHBondContact O-N 3.11Å; A619-L621 VanDerWaalsContact C-N 3.31Å; A619-L621 PolarHBondContact O-N 3.43Å; A619-M622 PolarHBondContact O-N 2.74Å; A619-A623 WeakPolarHBondContact O-CB 3.42Å; A619-A623 PolarHBondContact O-N 3.17Å; A619-L645 HydrophobicContact CB-CD1 3.97Å; A619-L645 HydrophobicContact CB-CD2 3.36Å; A619-L645 HydrophobicContact CB-CG 4.32Å
620	A	80.7	Confident	82.5	Confident	6 Å²	6	38.6 Å²	38.6	5%	0.05	20%	0.203	C	C	.	.	H	α-helix	trans	-62.5	-37.9	-177	0	0	0	0	0	112.1	M549 L557 Q616 R617 E618	M549-A620 HydrophobicContact CE-CB 3.42Å; M549-A620 VanDerWaalsContact CE-CB 3.42Å; M549-A620 HydrophobicContact SD-CB 3.52Å; M549-A620 VanDerWaalsContact SD-CB 3.52Å; L557-A620 HydrophobicContact CD1-CB 4.03Å; Q616-A620 VanDerWaalsContact O-CB 3.27Å; Q616-A620 WeakPolarHBondContact O-CB 3.37Å; Q616-A620 PolarHBondContact O-N 3.49Å; R617-A620 PolarHBondContact O-N 2.93Å; E618-A620 VanDerWaalsContact C-N 3.28Å; E618-A620 PolarHBondContact O-N 3.49Å
621	L	78.6	Confident	83.7	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-69	-48.8	173.6	-70.9	171.3	0	0	0	111.9	M545 Y546 R617 E618 A619 A623 E624 F713 F736	M545-L621 HydrophobicContact CB-CD2 3.92Å; M545-L621 HydrophobicContact CE-CD2 3.86Å; M545-L621 HydrophobicContact CG-CD2 3.51Å; M545-L621 HydrophobicContact SD-CD2 3.34Å; M545-L621 WeakPolarHBondContact SD-CD2 3.21Å; Y546-L621 HydrophobicContact CD1-CD1 3.8Å; Y546-L621 HydrophobicContact CD1-CG 4.48Å; Y546-L621 HydrophobicContact CE1-CD1 3.14Å; Y546-L621 HydrophobicContact CE1-CG 4.14Å; Y546-L621 HydrophobicContact CE2-CD1 4.08Å; Y546-L621 WeakPolarHBondContact OH-CD1 3.39Å; R617-L621 WeakPolarHBondContact O-CG 3.09Å; R617-L621 PolarHBondContact O-N 3.29Å; R617-L621 VanDerWaalsContact O-N 3.1Å; E618-L621 PolarHBondContact O-N 2.79Å; A619-L621 VanDerWaalsContact C-N 3.31Å; A619-L621 PolarHBondContact O-N 3.43Å; L621-A623 PolarHBondContact O-N 2.87Å; L621-E624 WeakPolarHBondContact O-CB 3.43Å; L621-E624 PolarHBondContact O-N 3.49Å; L621-F713 HydrophobicContact CD1-CE2 4.09Å; L621-F736 HydrophobicContact CD1-CZ 4.28Å
622	M	85	Confident	84.7	Confident	4 Å²	4	33.9 Å²	33.9	2%	0.02	18%	0.176	C	C	.	.	H	α-helix	trans	-62.6	-30.4	-178.1	-67.5	-57.7	-67.9	0	0	112.3	E618 A619 E624 F625 V631 L633 F647 D735 F736	E618-M622 WeakPolarHBondContact O-CG 3.37Å; E618-M622 PolarHBondContact O-N 3.19Å; A619-M622 PolarHBondContact O-N 2.74Å; M622-E624 PolarHBondContact O-N 3.01Å; M622-F625 PolarHBondContact O-N 2.71Å; M622-F625 HydrophobicContact SD-CD2 3.81Å; M622-F625 HydrophobicContact SD-CE2 4.07Å; M622-V631 WeakPolarHBondContact CE-O 3.05Å; M622-L633 HydrophobicContact CB-CB 4.07Å; M622-L633 HydrophobicContact CB-CD2 4.13Å; M622-F647 HydrophobicContact CB-CE1 4.19Å; M622-F647 HydrophobicContact CE-CD1 4.43Å; M622-F647 HydrophobicContact CE-CE1 3.78Å; M622-F647 HydrophobicContact CG-CE1 4.09Å; M622-F647 HydrophobicContact CG-CZ 4.36Å; M622-D735 HydrophobicContact SD-CB 4.36Å; M622-F736 HydrophobicContact CG-CD2 4.46Å; M622-F736 HydrophobicContact CG-CE2 4.17Å; M622-F736 HydrophobicContact SD-CD2 4.36Å; M622-F736 HydrophobicContact SD-CE2 3.94Å
623	A	85.4	Confident	85.5	Confident	11 Å²	11	31.7 Å²	31.7	9%	0.091	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-19.4	173.3	0	0	0	0	0	113.8	K556 L557 L560 A619 L621 L633	K556-A623 HydrophobicContact CD-CB 4.28Å; K556-A623 WeakPolarHBondContact CD-O 3.18Å; K556-A623 WeakPolarHBondContact CE-O 3.31Å; K556-A623 HydrophobicContact CG-CB 4.34Å; K556-A623 PolarHBondContact NZ-O 3.44Å; L557-A623 HydrophobicContact CD2-CB 3.98Å; L560-A623 HydrophobicContact CD1-CB 3.76Å; A619-A623 WeakPolarHBondContact O-CB 3.42Å; A619-A623 PolarHBondContact O-N 3.17Å; L621-A623 PolarHBondContact O-N 2.87Å; A623-L633 HydrophobicContact CB-CD2 4.11Å
624	E	84	Confident	86.4	Confident	69 Å²	69	32.3 Å²	32.3	32%	0.322	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-13.2	176.7	-61.7	-54.1	152.8	0	0	113.7	M545 K556 L621 M622	M545-E624 HydrophobicContact CE-CB 3.98Å; M545-E624 HydrophobicContact CE-CG 3.87Å; K556-E624 WeakPolarHBondContact CD-OE1 3.31Å; K556-E624 IonicContact NZ-OE1 2.85Å; K556-E624 IonicContact NZ-OE2 3.78Å; K556-E624 PolarHBondContact NZ-OE2 2.79Å; L621-E624 WeakPolarHBondContact O-CB 3.43Å; L621-E624 PolarHBondContact O-N 3.49Å; M622-E624 PolarHBondContact O-N 3.01Å
625	F	88.3	Confident	87.4	Confident	12 Å²	12	28.8 Å²	28.8	5%	0.053	15%	0.148	C	C	.	.			trans	-91.3	127.8	-178.3	-57.4	-33.6	0	0	0	111.8	M622 I630 Y707 L708 F713	M622-F625 PolarHBondContact O-N 2.71Å; M622-F625 HydrophobicContact SD-CD2 3.81Å; M622-F625 HydrophobicContact SD-CE2 4.07Å; F625-I630 HydrophobicContact CB-CG2 4.21Å; F625-I630 HydrophobicContact CD2-CG2 4.41Å; F625-Y707 HydrophobicContact CB-CE1 4.34Å; F625-Y707 HydrophobicContact CD1-CE1 4.08Å; F625-L708 HydrophobicContact CD1-CD2 4.22Å; F625-L708 HydrophobicContact CD2-CD2 4.33Å; F625-L708 HydrophobicContact CE1-CD2 3.9Å; F625-L708 HydrophobicContact CE2-CD2 4.02Å; F625-L708 HydrophobicContact CG-CD2 4.44Å; F625-L708 HydrophobicContact CZ-CD2 3.8Å; F625-F713 HydrophobicContact CE1-CD2 4.48Å; F625-F713 HydrophobicContact CE2-CD2 4.42Å; F625-F713 HydrophobicContact CE2-CE2 4.27Å; F625-F713 HydrophobicContact CE2-CZ 4.33Å; F625-F713 HydrophobicContact CZ-CB 4.34Å; F625-F713 HydrophobicContact CZ-CD1 4.25Å; F625-F713 AromaticContact CZ-CD2 3.59Å; F625-F713 HydrophobicContact CZ-CD2 3.59Å; F625-F713 HydrophobicContact CZ-CE1 4.46Å; F625-F713 AromaticContact CZ-CE2 3.86Å; F625-F713 HydrophobicContact CZ-CE2 3.86Å; F625-F713 AromaticContact CZ-CG 3.79Å; F625-F713 HydrophobicContact CZ-CG 3.79Å; F625-F713 HydrophobicContact CZ-CZ 4.28Å
626	D	91.2	Very high	88	Confident	101 Å²	101	28.9 Å²	28.9	54%	0.54	15%	0.148	S	C	.	.			trans	-142.4	95.3	172.9	-162.4	4.2	0	0	0	108.3	K632 Y707	D626-K632 VanDerWaalsContact CG-NZ 3.28Å; D626-K632 IonicContact OD1-NZ 2.62Å; D626-K632 PolarHBondContact OD1-NZ 3.33Å; D626-K632 IonicContact OD2-NZ 3.21Å; D626-K632 PolarHBondContact OD2-NZ 3.49Å; D626-Y707 PolarHBondContact N-OH 3.21Å; D626-Y707 WeakPolarHBondContact O-CE2 3.44Å; D626-Y707 PolarHBondContact O-OH 3.11Å
627	N	94.7	Very high	88.6	Confident	29 Å²	29	25.5 Å²	25.5	16%	0.155	13%	0.132	C	C	.	.			trans	-151.5	141.1	-179.1	-175.7	-89.2	0	0	0	109.7	N629 I630 Y707	N627-N629 PolarHBondContact O-N 2.94Å; N627-N629 VanDerWaalsContact O-N 3.13Å; N627-N629 PolarHBondContact OD1-N 3.32Å; N627-I630 HydrophobicContact CB-CB 4.23Å; N627-I630 HydrophobicContact CB-CD1 4.14Å; N627-I630 HydrophobicContact CB-CG1 4.02Å; N627-I630 PolarHBondContact O-N 3.03Å; N627-I630 VanDerWaalsContact O-O 3.13Å; N627-Y707 HydrophobicContact CB-CD1 3.78Å; N627-Y707 HydrophobicContact CB-CD2 3.74Å; N627-Y707 HydrophobicContact CB-CE1 3.88Å; N627-Y707 HydrophobicContact CB-CE2 3.79Å; N627-Y707 HydrophobicContact CB-CG 3.69Å; N627-Y707 WeakPolarHBondContact ND2-CB 3.45Å; N627-Y707 WeakPolarHBondContact ND2-CD2 3.4Å
628	P	95.5	Very high	88.9	Confident	88 Å²	88	24 Å²	24	57%	0.571	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-20.5	-179.5	24.6	-36.5	0	0	0	114.5	K732	P628-K732 WeakPolarHBondContact O-CD 3.37Å; P628-K732 WeakPolarHBondContact O-CE 3.19Å
629	N	97.1	Very high	88.9	Confident	16 Å²	16	28.5 Å²	28.5	9%	0.086	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	21.5	-179.5	-61.2	109.1	0	0	0	113	N627 Q700 V731 K732 I733	N627-N629 PolarHBondContact O-N 2.94Å; N627-N629 VanDerWaalsContact O-N 3.13Å; N627-N629 PolarHBondContact OD1-N 3.32Å; N629-Q700 WeakPolarHBondContact CB-O 3.14Å; N629-Q700 WeakPolarHBondContact ND2-CB 3.36Å; N629-Q700 PolarHBondContact ND2-OE1 2.77Å; N629-V731 PolarHBondContact ND2-O 2.86Å; N629-K732 WeakPolarHBondContact O-CA 3.37Å; N629-I733 PolarHBondContact O-N 2.94Å
630	I	94.9	Very high	88.7	Confident	6 Å²	6	30.8 Å²	30.8	3%	0.031	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-128.7	135.3	170.7	-58.1	-173.9	0	0	0	108.2	F625 N627 K632 Y707 L708 I733	F625-I630 HydrophobicContact CB-CG2 4.21Å; F625-I630 HydrophobicContact CD2-CG2 4.41Å; N627-I630 HydrophobicContact CB-CB 4.23Å; N627-I630 HydrophobicContact CB-CD1 4.14Å; N627-I630 HydrophobicContact CB-CG1 4.02Å; N627-I630 PolarHBondContact O-N 3.03Å; N627-I630 VanDerWaalsContact O-O 3.13Å; I630-K632 PolarHBondContact O-N 3.41Å; I630-Y707 HydrophobicContact CD1-CD1 3.41Å; I630-Y707 VanDerWaalsContact CD1-CD1 3.41Å; I630-Y707 HydrophobicContact CD1-CE1 3.92Å; I630-Y707 HydrophobicContact CD1-CG 4.34Å; I630-L708 HydrophobicContact CD1-CD1 4.12Å; I630-L708 HydrophobicContact CD1-CD2 3.46Å; I630-L708 VanDerWaalsContact CD1-CD2 3.46Å; I630-L708 HydrophobicContact CD1-CG 3.51Å; I630-I733 WeakPolarHBondContact CA-O 3.49Å
631	V	93.9	Very high	88.8	Confident	7 Å²	7	36.3 Å²	36.3	4%	0.042	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-62.2	119.9	178.9	176.8	0	0	0	0	109.6	M622 F647 E648 M650 L724 K732 I733 A734	M622-V631 WeakPolarHBondContact CE-O 3.05Å; V631-F647 HydrophobicContact CG1-CB 3.91Å; V631-F647 HydrophobicContact CG1-CD1 3.99Å; V631-F647 HydrophobicContact CG1-CG 4.28Å; V631-E648 WeakPolarHBondContact CA-OE1 3.44Å; V631-E648 HydrophobicContact CG1-CG 3.88Å; V631-M650 HydrophobicContact CG2-CG 4.38Å; V631-L724 HydrophobicContact CG2-CD1 4.07Å; V631-K732 HydrophobicContact CG2-CB 3.75Å; V631-I733 PolarHBondContact N-O 3.42Å; V631-A734 HydrophobicContact CB-CB 4.42Å; V631-A734 HydrophobicContact CG2-CB 3.81Å
632	K	92.9	Very high	89.1	Confident	77 Å²	77	37.2 Å²	37.2	34%	0.335	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-81.2	133.2	-175.4	-166.5	166.2	-174.8	156	0	111.6	D626 I630 L634 F647 E648	D626-K632 VanDerWaalsContact CG-NZ 3.28Å; D626-K632 IonicContact OD1-NZ 2.62Å; D626-K632 PolarHBondContact OD1-NZ 3.33Å; D626-K632 IonicContact OD2-NZ 3.21Å; D626-K632 PolarHBondContact OD2-NZ 3.49Å; I630-K632 PolarHBondContact O-N 3.41Å; K632-L634 HydrophobicContact CB-CD2 4.32Å; K632-L634 HydrophobicContact CD-CD2 4.19Å; K632-L634 HydrophobicContact CG-CD2 4.05Å; K632-F647 WeakPolarHBondContact O-CA 3.35Å; K632-E648 HydrophobicContact CB-CG 4.44Å; K632-E648 WeakPolarHBondContact CB-OE1 3.42Å; K632-E648 PolarHBondContact N-OE1 3.37Å; K632-E648 PolarHBondContact O-N 3.45Å; K632-E648 VanDerWaalsContact O-N 3.08Å
633	L	92.5	Very high	89.2	Confident	8 Å²	8	37.3 Å²	37.3	4%	0.042	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	116.8	165.7	-178.2	67.3	0	0	0	108.7	L560 M622 A623 G635 V636 L645 F647	L560-L633 HydrophobicContact CD1-CD2 4.08Å; L560-L633 HydrophobicContact CD1-CG 4.42Å; M622-L633 HydrophobicContact CB-CB 4.07Å; M622-L633 HydrophobicContact CB-CD2 4.13Å; A623-L633 HydrophobicContact CB-CD2 4.11Å; L633-G635 WeakPolarHBondContact CD1-O 3.37Å; L633-V636 HydrophobicContact CD1-CG2 4.27Å; L633-V636 HydrophobicContact CD2-CG2 3.83Å; L633-V636 HydrophobicContact CG-CG2 4.27Å; L633-L645 HydrophobicContact CD1-CB 3.92Å; L633-L645 HydrophobicContact CD1-CD2 4.36Å; L633-F647 HydrophobicContact CB-CD1 4.27Å; L633-F647 HydrophobicContact CB-CE1 4.09Å; L633-F647 HydrophobicContact CD1-CD1 4.11Å; L633-F647 HydrophobicContact CD1-CE1 3.82Å; L633-F647 HydrophobicContact CD1-CE2 4.43Å; L633-F647 HydrophobicContact CD1-CZ 4.01Å
634	L	93.9	Very high	89.5	Confident	31 Å²	31	36.8 Å²	36.8	16%	0.162	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-30.8	-176.9	-59	179.2	0	0	0	112.4	L589 T596 V598 K632 L646 E648	L589-L634 HydrophobicContact CD2-CB 3.81Å; L589-L634 HydrophobicContact CD2-CD1 4.2Å; L589-L634 HydrophobicContact CG-CB 4.41Å; T596-L634 HydrophobicContact CG2-CD1 3.93Å; V598-L634 HydrophobicContact CG1-CD1 4.09Å; K632-L634 HydrophobicContact CB-CD2 4.32Å; K632-L634 HydrophobicContact CD-CD2 4.19Å; K632-L634 HydrophobicContact CG-CD2 4.05Å; L634-L646 PolarHBondContact N-O 2.8Å; L634-E648 HydrophobicContact CD1-CB 4Å; L634-E648 HydrophobicContact CG-CB 4.41Å
635	G	92.8	Very high	89.8	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	165.5	-178.5	0	0	0	0	0	113.4	L560 L633 L646	L560-G635 CarbonylContact O-C 3.59Å; L560-G635 VanDerWaalsContact O-CA 3.31Å; L560-G635 WeakPolarHBondContact O-CA 3.15Å; L633-G635 WeakPolarHBondContact CD1-O 3.37Å; G635-L646 PolarHBondContact N-O 2.88Å; G635-L646 VanDerWaalsContact N-O 3.16Å; G635-L646 PolarHBondContact O-N 3.42Å
636	V	91.9	Very high	90.1	Very high	1 Å²	1	33 Å²	33	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	142.1	-177	-180	0	0	0	0	109.1	L557 L560 E561 Y562 L633 A638 C644 L645	L557-V636 HydrophobicContact CD2-CG2 4.04Å; L560-V636 HydrophobicContact CB-CB 4.43Å; L560-V636 HydrophobicContact CB-CG2 4.05Å; L560-V636 PolarHBondContact O-N 3.38Å; E561-V636 CarbonylContact C-O 3.5Å; E561-V636 VanDerWaalsContact CA-O 3.24Å; E561-V636 WeakPolarHBondContact CA-O 3.27Å; Y562-V636 PolarHBondContact N-O 2.88Å; L633-V636 HydrophobicContact CD1-CG2 4.27Å; L633-V636 HydrophobicContact CD2-CG2 3.83Å; L633-V636 HydrophobicContact CG-CG2 4.27Å; V636-A638 HydrophobicContact CG1-CB 3.88Å; V636-C644 CarbonylContact C-O 3.26Å; V636-C644 WeakPolarHBondContact CA-O 3.3Å; V636-L645 HydrophobicContact CB-CD2 4.37Å; V636-L645 HydrophobicContact CG1-CD2 3.9Å; V636-L645 HydrophobicContact CG2-CD2 3.87Å
637	C	90.6	Very high	90.2	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	83.7	165.3	-54.1	0	0	0	0	107.7	Y562 R564 M643 C644	Y562-C637 PolarHBondContact O-SG 3.39Å; R564-C637 HydrophobicContact CB-CB 4.26Å; C637-M643 WeakPolarHBondContact O-CA 3.33Å; C637-C644 HydrophobicContact CB-CB 3.81Å; C637-C644 PolarHBondContact N-O 3.11Å; C637-C644 PolarHBondContact O-N 3.19Å
638	A	81.4	Confident	90.1	Very high	33 Å²	33	29.5 Å²	29.5	27%	0.273	17%	0.171	S	C	.	.			trans	-87.9	-23.9	-177.8	0	0	0	0	0	112.1	E561 V636 M643	E561-A638 PolarHBondContact OE1-N 3.07Å; E561-A638 VanDerWaalsContact OE1-N 3.1Å; E561-A638 VanDerWaalsContact OE2-CB 3.3Å; E561-A638 WeakPolarHBondContact OE2-CB 3.08Å; E561-A638 PolarHBondContact OE2-N 3.29Å; V636-A638 HydrophobicContact CG1-CB 3.88Å; A638-M643 HydrophobicContact CB-CE 4.32Å
639	V	80	Confident	90	Very high	99 Å²	99	27.7 Å²	27.7	60%	0.6	15%	0.153	S	C	*	.	S	Bend	trans	-84.8	122.5	-178.7	-175.9	0	0	0	0	110.9	E561 R564	E561-V639 HydrophobicContact CG-CG2 4.45Å; E561-V639 WeakPolarHBondContact OE1-CB 3.23Å; E561-V639 PolarHBondContact OE1-N 2.85Å; R564-V639 PolarHBondContact NH1-O 2.92Å; R564-V639 VanDerWaalsContact NH1-O 3.16Å; R564-V639 PolarHBondContact NH2-O 3.21Å
640	G	76.6	Confident	89.9	Confident	48 Å²	48	27.6 Å²	27.6	50%	0.495	15%	0.152	S	C	.	.	S	Bend	trans	74.4	-177.1	-177.1	0	0	0	0	0	113.9	R564	R564-G640 PolarHBondContact NH2-O 3.15Å; R564-G640 VanDerWaalsContact NH2-O 3.08Å
641	K	82.6	Confident	89.6	Confident	123 Å²	123	29.3 Å²	29.3	54%	0.535	17%	0.167	S	C	.	.	S	Bend	trans	-111.8	153	177.8	-70	-172.1	172.2	-164.8	0	111.1	R564 E605	R564-K641 PolarHBondContact NH1-O 2.88Å; E605-K641 PolarHBondContact O-NZ 3.13Å
642	P	86.5	Confident	89.4	Confident	18 Å²	18	35.5 Å²	35.5	12%	0.117	19%	0.191	C	C	.	.	S	Bend	cis	-76	150.2	-10	29.7	-33.8	0	0	0	112.6	R564 M602 L603 E605	R564-P642 PolarHBondContact NE-O 2.77Å; R564-P642 PolarHBondContact NH2-O 2.67Å; M602-P642 HydrophobicContact CE-CG 4.07Å; M602-P642 HydrophobicContact CG-CB 3.93Å; M602-P642 HydrophobicContact CG-CG 3.95Å; M602-P642 HydrophobicContact SD-CB 4.37Å; M602-P642 HydrophobicContact SD-CG 3.79Å; L603-P642 VanDerWaalsContact O-CB 3.25Å; L603-P642 WeakPolarHBondContact O-CB 3.3Å; E605-P642 HydrophobicContact CG-CB 4.09Å; E605-P642 HydrophobicContact CG-CG 4.46Å
643	M	86.6	Confident	89.3	Confident	7 Å²	7	33.2 Å²	33.2	3%	0.034	19%	0.19	C	C	.	.			trans	-71.1	138.7	175.1	-69.9	-172	63	0	0	110.9	L603 Q612 F615 Q616 C637 A638	L603-M643 HydrophobicContact CB-CB 4.18Å; L603-M643 HydrophobicContact CD2-CB 4.29Å; L603-M643 PolarHBondContact N-O 3.49Å; Q612-M643 HydrophobicContact CG-SD 3.91Å; F615-M643 HydrophobicContact CD1-CB 4.01Å; F615-M643 HydrophobicContact CD1-CE 4.29Å; F615-M643 HydrophobicContact CE1-CB 3.81Å; Q616-M643 HydrophobicContact CG-CE 3.49Å; Q616-M643 VanDerWaalsContact CG-CE 3.49Å; Q616-M643 HydrophobicContact CG-SD 3.95Å; C637-M643 WeakPolarHBondContact O-CA 3.33Å; A638-M643 HydrophobicContact CB-CE 4.32Å
644	C	91	Very high	89.2	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	145.7	-179.3	-52.4	0	0	0	0	111.6	V600 K601 M602 V636 C637 L646	V600-C644 HydrophobicContact CG1-CB 3.95Å; K601-C644 CarbonylContact O-C 3.39Å; K601-C644 WeakPolarHBondContact O-CA 3.49Å; M602-C644 VanDerWaalsContact CE-SG 3.57Å; V636-C644 CarbonylContact C-O 3.26Å; V636-C644 WeakPolarHBondContact CA-O 3.3Å; C637-C644 HydrophobicContact CB-CB 3.81Å; C637-C644 PolarHBondContact N-O 3.11Å; C637-C644 PolarHBondContact O-N 3.19Å; C644-L646 HydrophobicContact CB-CD1 4.25Å
645	L	91.1	Very high	89.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	127.7	168.8	-56	178	0	0	0	108.5	V600 K601 F615 A619 L633 V636 F647	V600-L645 CarbonylContact C-O 3.55Å; V600-L645 WeakPolarHBondContact CA-O 3.47Å; K601-L645 HydrophobicContact CB-CB 4.45Å; K601-L645 PolarHBondContact N-O 3.14Å; K601-L645 PolarHBondContact O-N 3.25Å; F615-L645 HydrophobicContact CE1-CD1 4Å; F615-L645 HydrophobicContact CE1-CD2 4.18Å; F615-L645 HydrophobicContact CE1-CG 3.67Å; F615-L645 HydrophobicContact CE2-CD1 4.08Å; F615-L645 HydrophobicContact CE2-CG 4.38Å; F615-L645 HydrophobicContact CZ-CB 4.44Å; F615-L645 HydrophobicContact CZ-CD1 3.76Å; F615-L645 HydrophobicContact CZ-CG 3.57Å; A619-L645 HydrophobicContact CB-CD1 3.97Å; A619-L645 HydrophobicContact CB-CD2 3.36Å; A619-L645 HydrophobicContact CB-CG 4.32Å; L633-L645 HydrophobicContact CD1-CB 3.92Å; L633-L645 HydrophobicContact CD1-CD2 4.36Å; V636-L645 HydrophobicContact CB-CD2 4.37Å; V636-L645 HydrophobicContact CG1-CD2 3.9Å; V636-L645 HydrophobicContact CG2-CD2 3.87Å; L645-F647 HydrophobicContact CB-CD2 4.24Å; L645-F647 HydrophobicContact CB-CE2 3.55Å; L645-F647 HydrophobicContact CB-CZ 4.05Å; L645-F647 HydrophobicContact CD1-CE2 4.2Å; L645-F647 HydrophobicContact CD1-CZ 4.11Å
646	L	94.3	Very high	89.3	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	105.9	-178.2	-70.2	69.9	0	0	0	107.9	Y562 I567 A586 L589 V598 V600 L634 G635 C644	Y562-L646 HydrophobicContact CD1-CD2 3.66Å; Y562-L646 HydrophobicContact CE1-CD2 4.14Å; Y562-L646 HydrophobicContact CG-CD2 4Å; I567-L646 HydrophobicContact CD1-CD1 3.99Å; I567-L646 HydrophobicContact CD1-CD2 4.27Å; I567-L646 HydrophobicContact CD1-CG 4.41Å; I567-L646 HydrophobicContact CG1-CD2 4.38Å; A586-L646 HydrophobicContact CB-CD2 4.06Å; L589-L646 HydrophobicContact CD1-CD2 4.4Å; L589-L646 HydrophobicContact CD2-CD2 4.21Å; V598-L646 HydrophobicContact CB-CB 4.42Å; V598-L646 HydrophobicContact CG1-CB 4.46Å; V598-L646 HydrophobicContact CG2-CD2 4.34Å; V598-L646 HydrophobicContact CG2-CG 4.41Å; V600-L646 HydrophobicContact CG2-CG 4.29Å; L634-L646 PolarHBondContact N-O 2.8Å; G635-L646 PolarHBondContact N-O 2.88Å; G635-L646 VanDerWaalsContact N-O 3.16Å; G635-L646 PolarHBondContact O-N 3.42Å; C644-L646 HydrophobicContact CB-CD1 4.25Å
647	F	93.8	Very high	89.1	Confident	18 Å²	18	38.4 Å²	38.4	8%	0.079	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	157.8	175.8	-64.8	-82.3	0	0	0	110.8	V598 A599 K601 M622 V631 K632 L633 L645	V598-F647 CarbonylContact C-O 3.39Å; V598-F647 VanDerWaalsContact CA-O 3.25Å; V598-F647 WeakPolarHBondContact CA-O 3.45Å; V598-F647 VanDerWaalsContact CB-O 3.3Å; V598-F647 WeakPolarHBondContact CB-O 3.49Å; A599-F647 HydrophobicContact CB-CB 4.46Å; A599-F647 PolarHBondContact N-O 3.2Å; A599-F647 PolarHBondContact O-N 2.91Å; K601-F647 HydrophobicContact CB-CD2 4.49Å; K601-F647 HydrophobicContact CB-CE2 4.16Å; K601-F647 HydrophobicContact CD-CE2 4.37Å; M622-F647 HydrophobicContact CB-CE1 4.19Å; M622-F647 HydrophobicContact CE-CD1 4.43Å; M622-F647 HydrophobicContact CE-CE1 3.78Å; M622-F647 HydrophobicContact CG-CE1 4.09Å; M622-F647 HydrophobicContact CG-CZ 4.36Å; V631-F647 HydrophobicContact CG1-CB 3.91Å; V631-F647 HydrophobicContact CG1-CD1 3.99Å; V631-F647 HydrophobicContact CG1-CG 4.28Å; K632-F647 WeakPolarHBondContact O-CA 3.35Å; L633-F647 HydrophobicContact CB-CD1 4.27Å; L633-F647 HydrophobicContact CB-CE1 4.09Å; L633-F647 HydrophobicContact CD1-CD1 4.11Å; L633-F647 HydrophobicContact CD1-CE1 3.82Å; L633-F647 HydrophobicContact CD1-CE2 4.43Å; L633-F647 HydrophobicContact CD1-CZ 4.01Å; L645-F647 HydrophobicContact CB-CD2 4.24Å; L645-F647 HydrophobicContact CB-CE2 3.55Å; L645-F647 HydrophobicContact CB-CZ 4.05Å; L645-F647 HydrophobicContact CD1-CE2 4.2Å; L645-F647 HydrophobicContact CD1-CZ 4.11Å
648	E	93	Very high	89.2	Confident	39 Å²	39	39.4 Å²	39.4	18%	0.182	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	140.7	166	65	178.7	134.2	0	0	111.1	V631 K632 L634 M650 K732	V631-E648 WeakPolarHBondContact CA-OE1 3.44Å; V631-E648 HydrophobicContact CG1-CG 3.88Å; K632-E648 HydrophobicContact CB-CG 4.44Å; K632-E648 WeakPolarHBondContact CB-OE1 3.42Å; K632-E648 PolarHBondContact N-OE1 3.37Å; K632-E648 PolarHBondContact O-N 3.45Å; K632-E648 VanDerWaalsContact O-N 3.08Å; L634-E648 HydrophobicContact CD1-CB 4Å; L634-E648 HydrophobicContact CG-CB 4.41Å; E648-M650 HydrophobicContact CG-SD 4.42Å; E648-K732 VanDerWaalsContact OE1-CD 3.28Å; E648-K732 WeakPolarHBondContact OE1-CD 3.35Å; E648-K732 IonicContact OE1-NZ 3.85Å; E648-K732 PolarHBondContact OE1-NZ 3.49Å; E648-K732 WeakPolarHBondContact OE2-CE 3.23Å; E648-K732 IonicContact OE2-NZ 3.79Å; E648-K732 PolarHBondContact OE2-NZ 3.31Å
649	Y	93.6	Very high	89.7	Confident	51 Å²	51	37.9 Å²	37.9	20%	0.2	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-86.7	125.9	-178.4	179.4	-105.8	0	0	0	111.5	R571 I573 Q583 M597 A599 A651	R571-Y649 PolarHBondContact NH2-OH 3.27Å; I573-Y649 HydrophobicContact CD1-CD2 4.24Å; I573-Y649 HydrophobicContact CD1-CE2 3.83Å; Q583-Y649 HydrophobicContact CB-CE2 4.2Å; Q583-Y649 HydrophobicContact CG-CD2 4.04Å; Q583-Y649 HydrophobicContact CG-CE2 3.77Å; Q583-Y649 PolarHBondContact OE1-OH 3.2Å; M597-Y649 HydrophobicContact CB-CD1 4.45Å; M597-Y649 HydrophobicContact CG-CD1 3.55Å; M597-Y649 HydrophobicContact CG-CD2 4.48Å; M597-Y649 HydrophobicContact CG-CE1 4.27Å; M597-Y649 HydrophobicContact CG-CG 3.67Å; M597-Y649 WeakPolarHBondContact O-CB 3.19Å; A599-Y649 HydrophobicContact CB-CD2 4.43Å; Y649-A651 HydrophobicContact CD1-CB 4.41Å; Y649-A651 HydrophobicContact CE1-CB 3.92Å
650	M	93.5	Very high	90.2	Very high	14 Å²	14	38.5 Å²	38.5	7%	0.069	20%	0.196	C	C	.	.			trans	-103.9	102.9	179.7	-60.2	-64.4	-72.2	0	0	109.5	V631 E648 Y652 G653 L724 V725 K732	V631-M650 HydrophobicContact CG2-CG 4.38Å; E648-M650 HydrophobicContact CG-SD 4.42Å; M650-Y652 VanDerWaalsContact C-N 3.33Å; M650-Y652 PolarHBondContact O-N 3.25Å; M650-G653 PolarHBondContact O-N 3.23Å; M650-L724 HydrophobicContact CB-CB 3.58Å; M650-L724 HydrophobicContact CB-CD1 4.01Å; M650-L724 HydrophobicContact CB-CG 4.39Å; M650-L724 HydrophobicContact CE-CB 4.12Å; M650-L724 VanDerWaalsContact CE-O 3.27Å; M650-L724 WeakPolarHBondContact CE-O 3.37Å; M650-L724 HydrophobicContact CG-CB 3.6Å; M650-L724 HydrophobicContact CG-CD1 3.82Å; M650-L724 HydrophobicContact CG-CG 4.37Å; M650-V725 CarbonylContact C-O 3.59Å; M650-K732 HydrophobicContact CE-CB 3.84Å; M650-K732 HydrophobicContact CE-CD 3.95Å; M650-K732 HydrophobicContact CE-CG 3.6Å; M650-K732 HydrophobicContact SD-CD 3.95Å; M650-K732 HydrophobicContact SD-CG 4.28Å
651	A	89.2	Confident	90.7	Very high	41 Å²	41	39.5 Å²	39.5	34%	0.339	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-26.1	-161.6	0	0	0	0	0	116	Y649 V725	Y649-A651 HydrophobicContact CD1-CB 4.41Å; Y649-A651 HydrophobicContact CE1-CB 3.92Å; A651-V725 PolarHBondContact N-O 2.82Å
652	Y	90.6	Very high	90.8	Very high	137 Å²	137	34.8 Å²	34.8	54%	0.537	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98	8.7	-175.7	-68.9	-87.1	0	0	0	113.5	M650 F658 V725 G726	M650-Y652 VanDerWaalsContact C-N 3.33Å; M650-Y652 PolarHBondContact O-N 3.25Å; Y652-F658 HydrophobicContact CD1-CE2 4.39Å; Y652-V725 WeakPolarHBondContact CB-O 3.45Å; Y652-V725 HydrophobicContact CG-CG1 4.44Å; Y652-V725 PolarHBondContact N-O 3.37Å; Y652-G726 VanDerWaalsContact CD2-O 3.3Å; Y652-G726 WeakPolarHBondContact CD2-O 3.37Å
653	G	89.9	Confident	90.7	Very high	30 Å²	30	35.2 Å²	35.2	31%	0.309	18%	0.179	S	C	.	.			trans	74.2	-150.6	176.8	0	0	0	0	0	112.7	M650 L724 V725	M650-G653 PolarHBondContact O-N 3.23Å; G653-L724 CarbonylContact O-C 3.56Å; G653-L724 WeakPolarHBondContact O-CA 3.38Å; G653-V725 PolarHBondContact O-N 3.24Å
654	D	90.9	Very high	89.9	Confident	21 Å²	21	37.8 Å²	37.8	11%	0.112	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-82.5	151.6	-178.4	80.2	71.8	0	0	0	112.9	N656 E657 F658 C723 L724 Y743	D654-N656 VanDerWaalsContact C-N 3.27Å; D654-N656 PolarHBondContact O-N 2.79Å; D654-N656 WeakPolarHBondContact OD1-CA 3.25Å; D654-N656 WeakPolarHBondContact OD1-CB 3.38Å; D654-N656 PolarHBondContact OD1-N 3.5Å; D654-E657 PolarHBondContact O-N 3.08Å; D654-E657 PolarHBondContact OD1-N 3.07Å; D654-F658 WeakPolarHBondContact O-CB 3.43Å; D654-F658 PolarHBondContact O-N 3.08Å; D654-F658 VanDerWaalsContact O-N 3.11Å; D654-C723 CarbonylContact C-O 3.57Å; D654-C723 WeakPolarHBondContact CA-O 3.32Å; D654-L724 HydrophobicContact CB-CD2 4.07Å; D654-Y743 VanDerWaalsContact CG-OH 3.25Å; D654-Y743 PolarHBondContact OD1-OH 3.36Å; D654-Y743 VanDerWaalsContact OD1-OH 3.04Å; D654-Y743 PolarHBondContact OD2-OH 3.48Å
655	L	94.8	Very high	88.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-67.2	-27	-174.9	178.4	65.2	0	0	0	112.2	F658 L659 I697 T720 C723 V725 V731	L655-F658 HydrophobicContact CD1-CD1 4.16Å; L655-L659 HydrophobicContact CD1-CD1 4.27Å; L655-L659 HydrophobicContact CD1-CD2 4.47Å; L655-L659 HydrophobicContact CD1-CG 4.02Å; L655-L659 HydrophobicContact CG-CD1 3.93Å; L655-L659 HydrophobicContact CG-CG 4.19Å; L655-L659 WeakPolarHBondContact O-CB 3.15Å; L655-L659 WeakPolarHBondContact O-CD1 3.17Å; L655-L659 WeakPolarHBondContact O-CG 3.18Å; L655-L659 PolarHBondContact O-N 3.45Å; L655-I697 HydrophobicContact CD1-CD1 4.34Å; L655-I697 HydrophobicContact CD1-CG2 3.9Å; L655-I697 HydrophobicContact CD2-CG2 3.74Å; L655-I697 HydrophobicContact CG-CG2 4.44Å; L655-T720 WeakPolarHBondContact CB-O 3.3Å; L655-T720 HydrophobicContact CD2-CG2 3.98Å; L655-T720 HydrophobicContact CG-CG2 4.32Å; L655-T720 PolarHBondContact N-O 3.1Å; L655-C723 HydrophobicContact CB-CB 3.86Å; L655-C723 HydrophobicContact CD2-CB 3.91Å; L655-C723 PolarHBondContact N-O 2.54Å; L655-V725 HydrophobicContact CB-CG2 3.95Å; L655-V725 HydrophobicContact CD1-CG2 3.7Å; L655-V725 HydrophobicContact CG-CG2 4.45Å; L655-V731 HydrophobicContact CD1-CG2 4.39Å; L655-V731 HydrophobicContact CD2-CG1 4.03Å
656	N	92.8	Very high	86.3	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.011	25%	0.252	C	S	.	.	H	α-helix	trans	-67.1	-48.9	179.2	-166.8	-89.5	0	0	0	110.7	D654 L659 R660 T720 R721 E786 G791	D654-N656 VanDerWaalsContact C-N 3.27Å; D654-N656 PolarHBondContact O-N 2.79Å; D654-N656 WeakPolarHBondContact OD1-CA 3.25Å; D654-N656 WeakPolarHBondContact OD1-CB 3.38Å; D654-N656 PolarHBondContact OD1-N 3.5Å; N656-L659 PolarHBondContact O-N 2.79Å; N656-R660 WeakPolarHBondContact O-CG 3.41Å; N656-R660 PolarHBondContact O-N 3.2Å; N656-R660 VanDerWaalsContact O-N 3.15Å; N656-R660 PolarHBondContact OD1-NE 3.42Å; N656-R660 VanDerWaalsContact OD1-NE 3.15Å; N656-R660 PolarHBondContact OD1-NH2 3.29Å; N656-T720 WeakPolarHBondContact CB-OG1 3.15Å; N656-T720 PolarHBondContact ND2-OG1 3.12Å; N656-R721 HydrophobicContact CB-CB 4.34Å; N656-E786 PolarHBondContact ND2-OE1 2.81Å; N656-G791 PolarHBondContact ND2-O 3.13Å
657	E	88.8	Confident	83.8	Confident	125 Å²	125	54.6 Å²	54.6	58%	0.584	29%	0.289	S	S	*	.	H	α-helix	trans	-63.8	-43	176.6	-170.7	174.8	-174	0	0	111.4	D654 L659 R660 S661	D654-E657 PolarHBondContact O-N 3.08Å; D654-E657 PolarHBondContact OD1-N 3.07Å; E657-L659 PolarHBondContact O-N 3.19Å; E657-R660 PolarHBondContact O-N 2.79Å; E657-S661 PolarHBondContact O-N 3.3Å
658	F	92.8	Very high	80.8	Confident	22 Å²	22	59.3 Å²	59.3	10%	0.096	32%	0.323	C	S	.	.	H	α-helix	trans	-56.1	-50	175.1	-179	-98.6	0	0	0	112	Y652 D654 L655 R660 S661 M662 L689 V725 M729	Y652-F658 HydrophobicContact CD1-CE2 4.39Å; D654-F658 WeakPolarHBondContact O-CB 3.43Å; D654-F658 PolarHBondContact O-N 3.08Å; D654-F658 VanDerWaalsContact O-N 3.11Å; L655-F658 HydrophobicContact CD1-CD1 4.16Å; F658-R660 VanDerWaalsContact C-N 3.34Å; F658-R660 PolarHBondContact O-N 2.58Å; F658-S661 PolarHBondContact O-N 2.71Å; F658-S661 PolarHBondContact O-OG 2.98Å; F658-M662 HydrophobicContact CE1-CG 4.28Å; F658-M662 HydrophobicContact CE2-CG 4.43Å; F658-M662 HydrophobicContact CZ-CG 4.18Å; F658-M662 WeakPolarHBondContact O-CG 3.27Å; F658-M662 PolarHBondContact O-N 2.82Å; F658-L689 HydrophobicContact CE1-CD1 4.26Å; F658-L689 HydrophobicContact CE1-CD2 4.34Å; F658-V725 HydrophobicContact CB-CG2 4.04Å; F658-V725 HydrophobicContact CD1-CG1 4.5Å; F658-V725 HydrophobicContact CD1-CG2 4.21Å; F658-V725 HydrophobicContact CD2-CG1 4.25Å; F658-V725 HydrophobicContact CE2-CG1 4.31Å; F658-V725 HydrophobicContact CG-CB 4.48Å; F658-V725 HydrophobicContact CG-CG1 4.35Å; F658-V725 HydrophobicContact CG-CG2 4.05Å; F658-V725 HydrophobicContact CZ-CG1 4.46Å; F658-M729 HydrophobicContact CZ-CG 4.19Å; F658-M729 HydrophobicContact CZ-SD 4.39Å
659	L	92.4	Very high	77.7	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-59.7	-41.7	178.5	-73.9	167.5	0	0	0	112.6	L655 N656 E657 M662 S663 L689 I697 T720 I787	L655-L659 HydrophobicContact CD1-CD1 4.27Å; L655-L659 HydrophobicContact CD1-CD2 4.47Å; L655-L659 HydrophobicContact CD1-CG 4.02Å; L655-L659 HydrophobicContact CG-CD1 3.93Å; L655-L659 HydrophobicContact CG-CG 4.19Å; L655-L659 WeakPolarHBondContact O-CB 3.15Å; L655-L659 WeakPolarHBondContact O-CD1 3.17Å; L655-L659 WeakPolarHBondContact O-CG 3.18Å; L655-L659 PolarHBondContact O-N 3.45Å; N656-L659 PolarHBondContact O-N 2.79Å; E657-L659 PolarHBondContact O-N 3.19Å; L659-M662 CarbonylContact O-C 3.5Å; L659-M662 PolarHBondContact O-N 3.49Å; L659-S663 PolarHBondContact O-N 3.4Å; L659-L689 HydrophobicContact CD2-CD1 3.73Å; L659-I697 HydrophobicContact CD2-CD1 4.44Å; L659-T720 HydrophobicContact CD1-CG2 3.98Å; L659-I787 HydrophobicContact CD1-CG1 4.18Å; L659-I787 HydrophobicContact CD2-CG2 4.44Å
660	R	89.3	Confident	74.7	Confident	112 Å²	112	67.9 Å²	67.9	42%	0.423	38%	0.381	S	S	.	.	H	α-helix	trans	-64.8	-41.6	178.2	-72.6	177.4	179.5	179.8	6.8	112	N656 E657 F658 M662 S663 Y790 G791	N656-R660 WeakPolarHBondContact O-CG 3.41Å; N656-R660 PolarHBondContact O-N 3.2Å; N656-R660 VanDerWaalsContact O-N 3.15Å; N656-R660 PolarHBondContact OD1-NE 3.42Å; N656-R660 VanDerWaalsContact OD1-NE 3.15Å; N656-R660 PolarHBondContact OD1-NH2 3.29Å; E657-R660 PolarHBondContact O-N 2.79Å; F658-R660 VanDerWaalsContact C-N 3.34Å; F658-R660 PolarHBondContact O-N 2.58Å; R660-M662 PolarHBondContact O-N 2.77Å; R660-S663 WeakPolarHBondContact O-CB 3.43Å; R660-S663 PolarHBondContact O-N 3.01Å; R660-S663 PolarHBondContact O-OG 3.03Å; R660-Y790 WeakPolarHBondContact CA-O 3.39Å; R660-Y790 VanDerWaalsContact CG-O 3.31Å; R660-Y790 WeakPolarHBondContact CG-O 3.24Å; R660-Y790 PolarHBondContact N-O 3.09Å; R660-G791 PolarHBondContact NE-O 2.95Å; R660-G791 PolarHBondContact NH2-O 3.29Å
661	S	86.4	Confident	71.7	Confident	69 Å²	69	71.8 Å²	71.8	48%	0.483	41%	0.409	S	S	.	.	H	α-helix	trans	-62.6	-29.5	177.4	75.9	0	0	0	0	112.7	E657 F658	E657-S661 PolarHBondContact O-N 3.3Å; F658-S661 PolarHBondContact O-N 2.71Å; F658-S661 PolarHBondContact O-OG 2.98Å
662	M	86.4	Confident	69.2	Low	25 Å²	25	78.3 Å²	78.3	12%	0.123	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	14.3	-179.8	-59.9	-66.4	-72.1	0	0	113.4	F658 L659 R660 P686 P687 P688 L689 Y790	F658-M662 HydrophobicContact CE1-CG 4.28Å; F658-M662 HydrophobicContact CE2-CG 4.43Å; F658-M662 HydrophobicContact CZ-CG 4.18Å; F658-M662 WeakPolarHBondContact O-CG 3.27Å; F658-M662 PolarHBondContact O-N 2.82Å; L659-M662 CarbonylContact O-C 3.5Å; L659-M662 PolarHBondContact O-N 3.49Å; R660-M662 PolarHBondContact O-N 2.77Å; M662-P686 HydrophobicContact CE-CB 4.13Å; M662-P686 HydrophobicContact CE-CG 4.41Å; M662-P686 HydrophobicContact SD-CB 4.07Å; M662-P686 HydrophobicContact SD-CG 3.69Å; M662-P687 VanDerWaalsContact CE-O 3.22Å; M662-P687 WeakPolarHBondContact CE-O 3.44Å; M662-P688 VanDerWaalsContact O-CA 3.29Å; M662-P688 WeakPolarHBondContact O-CA 3.2Å; M662-L689 HydrophobicContact CB-CD1 4.11Å; M662-L689 HydrophobicContact CB-CD2 4.5Å; M662-L689 HydrophobicContact CB-CG 3.8Å; M662-L689 HydrophobicContact CE-CD2 3.81Å; M662-L689 HydrophobicContact CE-CG 4.21Å; M662-L689 HydrophobicContact CG-CD2 4.43Å; M662-L689 HydrophobicContact CG-CG 4.23Å; M662-Y790 WeakPolarHBondContact O-CE1 3.3Å
663	S	83.3	Confident	66.6	Low	26 Å²	26	76 Å²	76	18%	0.182	44%	0.436	C	S	.	.			trans	-74	147.7	-178.4	88.9	0	0	0	0	112.8	L659 R660 H665 T666	L659-S663 PolarHBondContact O-N 3.4Å; R660-S663 WeakPolarHBondContact O-CB 3.43Å; R660-S663 PolarHBondContact O-N 3.01Å; R660-S663 PolarHBondContact O-OG 3.03Å; S663-H665 PolarHBondContact O-N 3.47Å; S663-H665 VanDerWaalsContact O-N 3.17Å; S663-H665 PolarHBondContact OG-N 2.9Å; S663-T666 PolarHBondContact O-N 3.33Å; S663-T666 PolarHBondContact O-OG1 2.78Å; S663-T666 PolarHBondContact OG-N 3.49Å; S663-T666 PolarHBondContact OG-OG1 3.26Å
664	P	70	Confident	63.7	Low	62 Å²	62	81.5 Å²	81.5	40%	0.403	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-62	-20.1	174.2	-22.6	32.4	0	0	0	114.5	P688 Y790	P664-P688 HydrophobicContact CB-CB 4.45Å; P664-P688 HydrophobicContact CG-CB 3.89Å; P664-P688 HydrophobicContact CG-CG 4.43Å; P664-Y790 HydrophobicContact CG-CE2 3.99Å
665	H	57.6	Low	61.1	Low	142 Å²	142	87.7 Å²	87.7	66%	0.657	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-91	-3.9	-174.8	-63.6	-60.3	0	0	0	114.3	S663 V667 C668	S663-H665 PolarHBondContact O-N 3.47Å; S663-H665 VanDerWaalsContact O-N 3.17Å; S663-H665 PolarHBondContact OG-N 2.9Å; H665-V667 PolarHBondContact O-N 3.23Å; H665-C668 PolarHBondContact O-N 3.13Å; H665-C668 VanDerWaalsContact O-N 3.15Å
666	T	49.1	Very low	58.3	Low	81 Å²	81	92.8 Å²	92.8	50%	0.497	53%	0.527	S	S	.	.	G	3₁₀ helix	trans	-61.2	-17.9	178	-43.4	0	0	0	0	112.4	S663	S663-T666 PolarHBondContact O-N 3.33Å; S663-T666 PolarHBondContact O-OG1 2.78Å; S663-T666 PolarHBondContact OG-N 3.49Å; S663-T666 PolarHBondContact OG-OG1 3.26Å
667	V	40.7	Very low	55.6	Low	129 Å²	129	101 Å²	101	78%	0.782	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-79.9	-15.8	179.5	-170.1	0	0	0	0	113.6	H665	H665-V667 PolarHBondContact O-N 3.23Å
668	C	32.1	Very low	52.9	Low	117 Å²	117	106.2 Å²	106.2	79%	0.791	58%	0.582	S	S	*	*	S	Bend	trans	-111	5.5	-173.4	-80.8	0	0	0	0	115.8	H665	H665-C668 PolarHBondContact O-N 3.13Å; H665-C668 VanDerWaalsContact O-N 3.15Å
669	S	28	Very low	50.1	Low	104 Å²	104	109.9 Å²	109.9	73%	0.727	62%	0.616	S	S	*	*			trans	-109.6	65.1	176.7	-61.5	0	0	0	0	111.6
670	L	30	Very low	47.4	Very low	166 Å²	166	118.4 Å²	118.4	87%	0.869	66%	0.656	S	S	*	*			trans	-115.5	96.3	157.7	-71.9	173.1	0	0	0	107.8
671	S	30.4	Very low	44.7	Very low	96 Å²	96	119.3 Å²	119.3	67%	0.671	67%	0.674	S	S	*	*			trans	-70.3	140.8	164.2	50.5	0	0	0	0	109.8	S673	S671-S673 PolarHBondContact O-N 2.92Å
672	H	36.8	Very low	42.5	Very low	178 Å²	178	121.9 Å²	121.9	82%	0.824	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	28.6	-173.7	-105	-75.7	0	0	0	116.7
673	S	35.2	Very low	40.1	Very low	89 Å²	89	125.1 Å²	125.1	62%	0.622	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	-4.8	-173.9	56.7	0	0	0	0	116.8	S671	S671-S673 PolarHBondContact O-N 2.92Å
674	D	30.5	Very low	38.3	Very low	146 Å²	146	130 Å²	130	78%	0.781	75%	0.748	S	S	*	*			trans	-118.2	39.4	177.5	-78.4	-35.1	0	0	0	113.8	S676	D674-S676 VanDerWaalsContact C-N 3.31Å; D674-S676 PolarHBondContact O-N 2.88Å
675	L	35.2	Very low	37.6	Very low	150 Å²	150	130 Å²	130	79%	0.785	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	64.2	166.8	-90.8	155.3	0	0	0	110.7
676	S	36.7	Very low	38.1	Very low	107 Å²	107	127.6 Å²	127.6	75%	0.748	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-151.5	-1.1	159.8	69.6	0	0	0	0	116.8	D674	D674-S676 VanDerWaalsContact C-N 3.31Å; D674-S676 PolarHBondContact O-N 2.88Å
677	M	36.2	Very low	39.4	Very low	176 Å²	176	128.6 Å²	128.6	87%	0.867	76%	0.764	S	S	*	*	S	Bend	trans	-146.3	57.5	172.2	-72.3	-160.9	-147.6	0	0	114.7
678	R	31.1	Very low	41.6	Very low	234 Å²	234	125.6 Å²	125.6	88%	0.883	75%	0.747	S	S	*	*			trans	-176.8	75.7	147.6	-114.8	165.4	171.8	155.7	-3.4	110.9
679	A	33.9	Very low	44.3	Very low	99 Å²	99	120.2 Å²	120.2	82%	0.818	71%	0.71	S	S	*	*			trans	-77.1	133.2	148.9	0	0	0	0	0	106.8
680	Q	37.4	Very low	47.3	Very low	178 Å²	178	117.8 Å²	117.8	83%	0.832	69%	0.693	S	S	*	*			trans	89.8	84.4	-174.4	-50.9	-172.1	-5.2	0	0	115
681	V	31.7	Very low	50.1	Low	132 Å²	132	112.3 Å²	112.3	80%	0.8	67%	0.668	S	S	*	*				-169.5	111.9	106.3	171.3	0	0	0	0	106.9
682	S	39.4	Very low	52.9	Low	123 Å²	123	109.3 Å²	109.3	86%	0.86	65%	0.649	S	S	*	*			trans	-86.2	101.5	170.1	44.7	0	0	0	0	109.4
683	S	35.7	Very low	55.6	Low	93 Å²	93	104 Å²	104	65%	0.65	62%	0.624	S	S	*	*			trans	-137.4	130.1	158.5	-71	0	0	0	0	108.6	G685	S683-G685 PolarHBondContact O-N 2.94Å
684	P	47.1	Very low	58.4	Low	129 Å²	129	100.2 Å²	100.2	84%	0.838	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-59.4	133.4	168.4	24.9	-29.6	0	0	0	108.2
685	G	55.6	Low	61.5	Low	61 Å²	61	93.5 Å²	93.5	63%	0.629	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-57.1	163.7	174.9	0	0	0	0	0	111.7	S683	S683-G685 PolarHBondContact O-N 2.94Å
686	P	66.6	Low	64.3	Low	91 Å²	91	88.1 Å²	88.1	59%	0.591	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-56.1	144.9	177.6	24.8	-33.2	0	0	0	110.6	M662	M662-P686 HydrophobicContact CE-CB 4.13Å; M662-P686 HydrophobicContact CE-CG 4.41Å; M662-P686 HydrophobicContact SD-CB 4.07Å; M662-P686 HydrophobicContact SD-CG 3.69Å
687	P	77.7	Confident	67.2	Low	103 Å²	103	83.1 Å²	83.1	67%	0.669	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-59.7	152.6	177.4	27	-34.5	0	0	0	110.6	M662	M662-P687 VanDerWaalsContact CE-O 3.22Å; M662-P687 WeakPolarHBondContact CE-O 3.44Å
688	P	86.3	Confident	70.1	Confident	65 Å²	65	74.8 Å²	74.8	42%	0.422	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-61.9	152.3	177	27.9	-34.8	0	0	0	110.9	M662 P664 S690	M662-P688 VanDerWaalsContact O-CA 3.29Å; M662-P688 WeakPolarHBondContact O-CA 3.2Å; P664-P688 HydrophobicContact CB-CB 4.45Å; P664-P688 HydrophobicContact CG-CB 3.89Å; P664-P688 HydrophobicContact CG-CG 4.43Å; P688-S690 PolarHBondContact O-N 2.86Å
689	L	88.8	Confident	73.2	Confident	5 Å²	5	67 Å²	67	3%	0.026	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-58.6	131.8	178.9	-65.6	170.5	0	0	0	110.8	F658 L659 M662 E693 Q694 I697 M729 Y790	F658-L689 HydrophobicContact CE1-CD1 4.26Å; F658-L689 HydrophobicContact CE1-CD2 4.34Å; L659-L689 HydrophobicContact CD2-CD1 3.73Å; M662-L689 HydrophobicContact CB-CD1 4.11Å; M662-L689 HydrophobicContact CB-CD2 4.5Å; M662-L689 HydrophobicContact CB-CG 3.8Å; M662-L689 HydrophobicContact CE-CD2 3.81Å; M662-L689 HydrophobicContact CE-CG 4.21Å; M662-L689 HydrophobicContact CG-CD2 4.43Å; M662-L689 HydrophobicContact CG-CG 4.23Å; L689-E693 HydrophobicContact CD2-CB 4.17Å; L689-Q694 HydrophobicContact CB-CG 4.01Å; L689-I697 HydrophobicContact CD1-CD1 4Å; L689-M729 HydrophobicContact CD2-SD 4.19Å; L689-Y790 HydrophobicContact CB-CE1 4.15Å; L689-Y790 PolarHBondContact O-OH 2.87Å
690	S	90.8	Very high	76.3	Confident	52 Å²	52	63.1 Å²	63.1	36%	0.364	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-71.6	160.3	170.7	67.7	0	0	0	0	111.5	P688 A692 E693 Q694	P688-S690 PolarHBondContact O-N 2.86Å; S690-A692 PolarHBondContact O-N 2.9Å; S690-E693 WeakPolarHBondContact CB-OE2 3.49Å; S690-E693 PolarHBondContact N-OE2 2.76Å; S690-E693 PolarHBondContact O-N 2.83Å; S690-E693 VanDerWaalsContact O-N 3.16Å; S690-E693 WeakPolarHBondContact OG-CG 3.09Å; S690-E693 PolarHBondContact OG-N 3.19Å; S690-E693 PolarHBondContact OG-OE2 2.53Å; S690-Q694 WeakPolarHBondContact O-CG 3.48Å; S690-Q694 PolarHBondContact O-N 2.96Å
691	C	88.2	Confident	79.2	Confident	51 Å²	51	54.6 Å²	54.6	35%	0.345	36%	0.355	S	S	.	.	H	α-helix	trans	-58.4	-34.5	175.2	-175.2	0	0	0	0	112.2	Q694 L695	C691-Q694 PolarHBondContact O-N 2.79Å; C691-L695 WeakPolarHBondContact O-CB 3.22Å; C691-L695 VanDerWaalsContact O-CG 3.26Å; C691-L695 WeakPolarHBondContact O-CG 3.26Å; C691-L695 PolarHBondContact O-N 3.08Å
692	A	89.6	Confident	82.4	Confident	33 Å²	33	48.3 Å²	48.3	27%	0.273	32%	0.317	S	S	.	.	H	α-helix	trans	-66.4	-42.5	178.1	0	0	0	0	0	111.6	S690 L695 C696 A855	S690-A692 PolarHBondContact O-N 2.9Å; A692-L695 PolarHBondContact O-N 3.4Å; A692-C696 WeakPolarHBondContact O-CB 3.36Å; A692-C696 PolarHBondContact O-N 2.92Å; A692-A855 HydrophobicContact CB-CB 4.24Å
693	E	93.3	Very high	85.1	Confident	66 Å²	66	43.2 Å²	43.2	31%	0.308	28%	0.282	S	S	.	.	H	α-helix	trans	-66.1	-42.1	176	-69.1	162.5	132.4	0	0	111.5	L689 S690 L695 C696 I697 M729	L689-E693 HydrophobicContact CD2-CB 4.17Å; S690-E693 WeakPolarHBondContact CB-OE2 3.49Å; S690-E693 PolarHBondContact N-OE2 2.76Å; S690-E693 PolarHBondContact O-N 2.83Å; S690-E693 VanDerWaalsContact O-N 3.16Å; S690-E693 WeakPolarHBondContact OG-CG 3.09Å; S690-E693 PolarHBondContact OG-N 3.19Å; S690-E693 PolarHBondContact OG-OE2 2.53Å; E693-L695 PolarHBondContact O-N 3.37Å; E693-C696 WeakPolarHBondContact O-CB 3.24Å; E693-C696 PolarHBondContact O-N 2.91Å; E693-C696 VanDerWaalsContact O-N 3.17Å; E693-I697 WeakPolarHBondContact O-CG1 3.27Å; E693-I697 PolarHBondContact O-N 2.88Å; E693-M729 HydrophobicContact CG-CE 4.04Å
694	Q	95	Very high	88	Confident	11 Å²	11	38.8 Å²	38.8	5%	0.051	25%	0.251	C	S	.	.	H	α-helix	trans	-61.4	-42.1	174.5	-70.2	174.4	-59.8	0	0	112.2	L689 S690 C691 C696 I697 A698 I787 F788	L689-Q694 HydrophobicContact CB-CG 4.01Å; S690-Q694 WeakPolarHBondContact O-CG 3.48Å; S690-Q694 PolarHBondContact O-N 2.96Å; C691-Q694 PolarHBondContact O-N 2.79Å; Q694-C696 VanDerWaalsContact C-N 3.34Å; Q694-I697 PolarHBondContact O-N 3.47Å; Q694-A698 WeakPolarHBondContact O-CB 3.35Å; Q694-A698 PolarHBondContact O-N 3.06Å; Q694-I787 HydrophobicContact CB-CG2 3.82Å; Q694-I787 HydrophobicContact CG-CG2 4.13Å; Q694-I787 PolarHBondContact NE2-O 3.06Å; Q694-F788 HydrophobicContact CB-CE1 4.03Å; Q694-F788 HydrophobicContact CB-CE2 3.88Å; Q694-F788 HydrophobicContact CB-CZ 3.6Å
695	L	94.4	Very high	90.4	Very high	5 Å²	5	32.7 Å²	32.7	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-65.2	-37.6	173.6	-73.8	170.7	0	0	0	111.8	C691 A692 E693 A698 R699 F788 L823 L848 M851 A855	C691-L695 WeakPolarHBondContact O-CB 3.22Å; C691-L695 VanDerWaalsContact O-CG 3.26Å; C691-L695 WeakPolarHBondContact O-CG 3.26Å; C691-L695 PolarHBondContact O-N 3.08Å; A692-L695 PolarHBondContact O-N 3.4Å; E693-L695 PolarHBondContact O-N 3.37Å; L695-A698 PolarHBondContact O-N 2.84Å; L695-R699 VanDerWaalsContact O-CB 3.32Å; L695-R699 WeakPolarHBondContact O-CB 3.11Å; L695-R699 PolarHBondContact O-N 2.83Å; L695-F788 HydrophobicContact CD2-CZ 4.1Å; L695-F788 HydrophobicContact CG-CZ 4.18Å; L695-L823 HydrophobicContact CD2-CD1 4.16Å; L695-L823 HydrophobicContact CD2-CD2 4.27Å; L695-L848 HydrophobicContact CD2-CD2 4.1Å; L695-M851 HydrophobicContact CD1-CB 4.26Å; L695-M851 HydrophobicContact CD2-CB 4.31Å; L695-M851 HydrophobicContact CD2-CE 4.22Å; L695-A855 HydrophobicContact CD1-CB 4.16Å
696	C	94.3	Very high	92.4	Very high	36 Å²	36	30.3 Å²	30.3	24%	0.243	19%	0.186	C	C	.	.	H	α-helix	trans	-63.7	-44.6	175.9	-173.1	0	0	0	0	111.6	A692 E693 Q694 R699 Q700	A692-C696 WeakPolarHBondContact O-CB 3.36Å; A692-C696 PolarHBondContact O-N 2.92Å; E693-C696 WeakPolarHBondContact O-CB 3.24Å; E693-C696 PolarHBondContact O-N 2.91Å; E693-C696 VanDerWaalsContact O-N 3.17Å; Q694-C696 VanDerWaalsContact C-N 3.34Å; C696-R699 PolarHBondContact O-N 2.73Å; C696-Q700 WeakPolarHBondContact O-CG 3.42Å; C696-Q700 PolarHBondContact O-N 2.96Å
697	I	97.2	Very high	93.8	Very high	3 Å²	3	27 Å²	27	2%	0.015	16%	0.162	C	C	.	.	H	α-helix	trans	-57.5	-50.6	173.1	-69.5	167.6	0	0	0	110.1	L655 L659 L689 E693 Q694 R699 Q700 V701 V731 I787	L655-I697 HydrophobicContact CD1-CD1 4.34Å; L655-I697 HydrophobicContact CD1-CG2 3.9Å; L655-I697 HydrophobicContact CD2-CG2 3.74Å; L655-I697 HydrophobicContact CG-CG2 4.44Å; L659-I697 HydrophobicContact CD2-CD1 4.44Å; L689-I697 HydrophobicContact CD1-CD1 4Å; E693-I697 WeakPolarHBondContact O-CG1 3.27Å; E693-I697 PolarHBondContact O-N 2.88Å; Q694-I697 PolarHBondContact O-N 3.47Å; I697-R699 VanDerWaalsContact C-N 3.35Å; I697-R699 PolarHBondContact O-N 3.35Å; I697-Q700 PolarHBondContact O-N 2.84Å; I697-V701 PolarHBondContact O-N 3.36Å; I697-V701 VanDerWaalsContact O-N 3.14Å; I697-V731 HydrophobicContact CB-CG2 4.43Å; I697-V731 HydrophobicContact CG1-CG2 4.06Å; I697-V731 HydrophobicContact CG2-CG2 4.17Å; I697-I787 HydrophobicContact CG2-CD1 3.74Å; I697-I787 HydrophobicContact CG2-CG1 3.96Å; I697-I787 HydrophobicContact CG2-CG2 4.41Å
698	A	97.8	Very high	94.4	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-56.5	-47.6	178.2	0	0	0	0	0	112	Q694 L695 Q700 V701 A702 Y780 L784 I787 L848	Q694-A698 WeakPolarHBondContact O-CB 3.35Å; Q694-A698 PolarHBondContact O-N 3.06Å; L695-A698 PolarHBondContact O-N 2.84Å; A698-Q700 VanDerWaalsContact C-N 3.35Å; A698-Q700 PolarHBondContact O-N 2.87Å; A698-V701 PolarHBondContact O-N 3.45Å; A698-A702 PolarHBondContact O-N 3.02Å; A698-Y780 PolarHBondContact O-OH 3.1Å; A698-L784 HydrophobicContact CB-CD2 3.46Å; A698-L784 VanDerWaalsContact CB-CD2 3.46Å; A698-I787 HydrophobicContact CB-CD1 4.11Å; A698-L848 HydrophobicContact CB-CD1 4.18Å; A698-L848 HydrophobicContact CB-CD2 4.2Å
699	R	97.6	Very high	94.6	Very high	70 Å²	70	20.7 Å²	20.7	26%	0.264	12%	0.121	S	C	.	.	H	α-helix	trans	-59.7	-42.5	179.4	-177.3	-172.4	61.9	75.9	5.9	112.2	L695 C696 I697 A702 A703 H845 L848	L695-R699 VanDerWaalsContact O-CB 3.32Å; L695-R699 WeakPolarHBondContact O-CB 3.11Å; L695-R699 PolarHBondContact O-N 2.83Å; C696-R699 PolarHBondContact O-N 2.73Å; I697-R699 VanDerWaalsContact C-N 3.35Å; I697-R699 PolarHBondContact O-N 3.35Å; R699-A702 PolarHBondContact O-N 2.64Å; R699-A703 PolarHBondContact O-N 3.4Å; R699-H845 PolarHBondContact O-ND1 2.87Å; R699-L848 HydrophobicContact CB-CB 4.13Å; R699-L848 HydrophobicContact CG-CB 4.44Å
700	Q	98.1	Very high	94.7	Very high	18 Å²	18	26.5 Å²	26.5	8%	0.084	15%	0.148	C	C	.	.	H	α-helix	trans	-63.5	-44.8	178.3	-75.4	-174.1	83.4	0	0	112.1	N629 C696 I697 A698 A702 A703 G704 M729 V731	N629-Q700 WeakPolarHBondContact CB-O 3.14Å; N629-Q700 WeakPolarHBondContact ND2-CB 3.36Å; N629-Q700 PolarHBondContact ND2-OE1 2.77Å; C696-Q700 WeakPolarHBondContact O-CG 3.42Å; C696-Q700 PolarHBondContact O-N 2.96Å; I697-Q700 PolarHBondContact O-N 2.84Å; A698-Q700 VanDerWaalsContact C-N 3.35Å; A698-Q700 PolarHBondContact O-N 2.87Å; Q700-A702 VanDerWaalsContact C-N 3.35Å; Q700-A702 PolarHBondContact O-N 2.91Å; Q700-A703 WeakPolarHBondContact O-CB 3.2Å; Q700-A703 PolarHBondContact O-N 3.22Å; Q700-G704 PolarHBondContact O-N 2.76Å; Q700-G704 VanDerWaalsContact O-N 3.15Å; Q700-M729 PolarHBondContact NE2-O 2.85Å; Q700-V731 HydrophobicContact CB-CB 4.16Å
701	V	98.1	Very high	94.5	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.3	-40.3	175	-178.9	0	0	0	0	110.9	I697 A698 A703 G704 M705 L718 V731 I733 Y780 V783	I697-V701 PolarHBondContact O-N 3.36Å; I697-V701 VanDerWaalsContact O-N 3.14Å; A698-V701 PolarHBondContact O-N 3.45Å; V701-A703 VanDerWaalsContact C-N 3.3Å; V701-A703 PolarHBondContact O-N 3.22Å; V701-G704 PolarHBondContact O-N 3.14Å; V701-M705 PolarHBondContact O-N 2.76Å; V701-L718 HydrophobicContact CG1-CD1 4.35Å; V701-V731 HydrophobicContact CG2-CG1 3.69Å; V701-I733 HydrophobicContact CG1-CD1 4.21Å; V701-I733 HydrophobicContact CG1-CG1 4.32Å; V701-Y780 HydrophobicContact CB-CE2 3.94Å; V701-Y780 HydrophobicContact CG1-CD2 3.95Å; V701-Y780 HydrophobicContact CG1-CE2 3.73Å; V701-V783 HydrophobicContact CG1-CG1 4.39Å
702	A	98.2	Very high	94.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.5	-37.8	174.7	0	0	0	0	0	112.6	A698 R699 Q700 M705 A706 Y780 I844 H845 L848	A698-A702 PolarHBondContact O-N 3.02Å; R699-A702 PolarHBondContact O-N 2.64Å; Q700-A702 VanDerWaalsContact C-N 3.35Å; Q700-A702 PolarHBondContact O-N 2.91Å; A702-M705 PolarHBondContact O-N 3.29Å; A702-A706 WeakPolarHBondContact O-CB 3.45Å; A702-A706 PolarHBondContact O-N 2.96Å; A702-Y780 HydrophobicContact CB-CE2 4.08Å; A702-Y780 WeakPolarHBondContact CB-OH 3.36Å; A702-I844 HydrophobicContact CB-CG2 4.02Å; A702-H845 HydrophobicContact CB-CB 4.08Å; A702-L848 HydrophobicContact CB-CD1 3.97Å
703	A	97.8	Very high	93.9	Very high	16 Å²	16	33 Å²	33	13%	0.132	16%	0.155	C	C	.	.	H	α-helix	trans	-63.3	-45.9	177.8	0	0	0	0	0	111.8	R699 Q700 V701 A706 Y707	R699-A703 PolarHBondContact O-N 3.4Å; Q700-A703 WeakPolarHBondContact O-CB 3.2Å; Q700-A703 PolarHBondContact O-N 3.22Å; V701-A703 VanDerWaalsContact C-N 3.3Å; V701-A703 PolarHBondContact O-N 3.22Å; A703-A706 PolarHBondContact O-N 3.48Å; A703-Y707 PolarHBondContact O-N 3.26Å; A703-Y707 VanDerWaalsContact O-N 3.15Å
704	G	96.8	Very high	93.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.7	-44.5	175.5	0	0	0	0	0	112.2	Q700 V701 A706 Y707 L708	Q700-G704 PolarHBondContact O-N 2.76Å; Q700-G704 VanDerWaalsContact O-N 3.15Å; V701-G704 PolarHBondContact O-N 3.14Å; G704-A706 PolarHBondContact O-N 3.45Å; G704-Y707 WeakPolarHBondContact O-CB 3.39Å; G704-Y707 PolarHBondContact O-N 3.33Å; G704-L708 PolarHBondContact O-N 3Å
705	M	97.4	Very high	93.2	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-69	-32.8	178	-72.5	-52.8	-56.1	0	0	113.7	V701 A702 Y707 L708 S709 H715 L718 I733 D776 F841	V701-M705 PolarHBondContact O-N 2.76Å; A702-M705 PolarHBondContact O-N 3.29Å; M705-Y707 VanDerWaalsContact C-N 3.33Å; M705-L708 HydrophobicContact CE-CD1 4.45Å; M705-L708 PolarHBondContact O-N 2.84Å; M705-L708 HydrophobicContact SD-CD1 3.89Å; M705-S709 VanDerWaalsContact O-CB 3.24Å; M705-S709 WeakPolarHBondContact O-CB 3.4Å; M705-S709 PolarHBondContact O-N 2.86Å; M705-H715 HydrophobicContact CE-CB 4.17Å; M705-H715 HydrophobicContact SD-CB 4.41Å; M705-L718 HydrophobicContact CE-CD2 4.19Å; M705-L718 HydrophobicContact CG-CD1 4.26Å; M705-L718 HydrophobicContact CG-CD2 3.73Å; M705-L718 HydrophobicContact SD-CD1 3.84Å; M705-L718 HydrophobicContact SD-CD2 3.78Å; M705-L718 HydrophobicContact SD-CG 4.35Å; M705-I733 HydrophobicContact CB-CD1 4.38Å; M705-I733 HydrophobicContact CG-CD1 3.54Å; M705-I733 HydrophobicContact SD-CD1 3.55Å; M705-I733 VanDerWaalsContact SD-CD1 3.55Å; M705-D776 HydrophobicContact CE-CB 3.63Å; M705-F841 HydrophobicContact CB-CB 4.49Å; M705-F841 HydrophobicContact CB-CD1 3.4Å; M705-F841 VanDerWaalsContact CB-CD1 3.4Å; M705-F841 HydrophobicContact CB-CD2 3.89Å; M705-F841 HydrophobicContact CB-CE1 3.35Å; M705-F841 HydrophobicContact CB-CE2 3.84Å; M705-F841 HydrophobicContact CB-CG 3.68Å; M705-F841 HydrophobicContact CB-CZ 3.58Å; M705-F841 HydrophobicContact CE-CE2 3.68Å; M705-F841 HydrophobicContact CE-CZ 3.73Å; M705-F841 HydrophobicContact CG-CD1 4.3Å; M705-F841 HydrophobicContact CG-CE1 3.76Å; M705-F841 HydrophobicContact CG-CE2 4.41Å; M705-F841 HydrophobicContact CG-CZ 3.82Å
706	A	96.8	Very high	92.8	Very high	10 Å²	10	32.4 Å²	32.4	8%	0.083	15%	0.151	C	C	.	.	H	α-helix	trans	-61.2	-44.7	172.4	0	0	0	0	0	110.9	A702 A703 G704 L708 S709 E710 F841	A702-A706 WeakPolarHBondContact O-CB 3.45Å; A702-A706 PolarHBondContact O-N 2.96Å; A703-A706 PolarHBondContact O-N 3.48Å; G704-A706 PolarHBondContact O-N 3.45Å; A706-L708 PolarHBondContact O-N 2.94Å; A706-S709 WeakPolarHBondContact O-CB 3.41Å; A706-S709 PolarHBondContact O-N 3.26Å; A706-E710 WeakPolarHBondContact O-CG 3.34Å; A706-E710 PolarHBondContact O-N 2.89Å; A706-F841 HydrophobicContact CB-CB 3.92Å
707	Y	96.2	Very high	92.5	Very high	23 Å²	23	32 Å²	32	9%	0.09	15%	0.146	C	C	.	.	H	α-helix	trans	-61.3	-43.1	175.8	175.9	-86.1	0	0	0	113.2	F625 D626 N627 I630 A703 G704 M705 R711	F625-Y707 HydrophobicContact CB-CE1 4.34Å; F625-Y707 HydrophobicContact CD1-CE1 4.08Å; D626-Y707 PolarHBondContact N-OH 3.21Å; D626-Y707 WeakPolarHBondContact O-CE2 3.44Å; D626-Y707 PolarHBondContact O-OH 3.11Å; N627-Y707 HydrophobicContact CB-CD1 3.78Å; N627-Y707 HydrophobicContact CB-CD2 3.74Å; N627-Y707 HydrophobicContact CB-CE1 3.88Å; N627-Y707 HydrophobicContact CB-CE2 3.79Å; N627-Y707 HydrophobicContact CB-CG 3.69Å; N627-Y707 WeakPolarHBondContact ND2-CB 3.45Å; N627-Y707 WeakPolarHBondContact ND2-CD2 3.4Å; I630-Y707 HydrophobicContact CD1-CD1 3.41Å; I630-Y707 VanDerWaalsContact CD1-CD1 3.41Å; I630-Y707 HydrophobicContact CD1-CE1 3.92Å; I630-Y707 HydrophobicContact CD1-CG 4.34Å; A703-Y707 PolarHBondContact O-N 3.26Å; A703-Y707 VanDerWaalsContact O-N 3.15Å; G704-Y707 WeakPolarHBondContact O-CB 3.39Å; G704-Y707 PolarHBondContact O-N 3.33Å; M705-Y707 VanDerWaalsContact C-N 3.33Å; Y707-R711 PolarHBondContact O-N 3.12Å; Y707-R711 VanDerWaalsContact OH-CZ 3.25Å; Y707-R711 PolarHBondContact OH-NE 3.26Å; Y707-R711 VanDerWaalsContact OH-NE 3.11Å; Y707-R711 PolarHBondContact OH-NH2 3.11Å
708	L	90.8	Very high	92.4	Very high	5 Å²	5	31.8 Å²	31.8	3%	0.026	15%	0.145	C	C	.	.	H	α-helix	trans	-64.9	-43.4	176.2	-71.8	178.5	0	0	0	111.6	F625 I630 G704 M705 A706 E710 R711 K712 F713	F625-L708 HydrophobicContact CD1-CD2 4.22Å; F625-L708 HydrophobicContact CD2-CD2 4.33Å; F625-L708 HydrophobicContact CE1-CD2 3.9Å; F625-L708 HydrophobicContact CE2-CD2 4.02Å; F625-L708 HydrophobicContact CG-CD2 4.44Å; F625-L708 HydrophobicContact CZ-CD2 3.8Å; I630-L708 HydrophobicContact CD1-CD1 4.12Å; I630-L708 HydrophobicContact CD1-CD2 3.46Å; I630-L708 VanDerWaalsContact CD1-CD2 3.46Å; I630-L708 HydrophobicContact CD1-CG 3.51Å; G704-L708 PolarHBondContact O-N 3Å; M705-L708 HydrophobicContact CE-CD1 4.45Å; M705-L708 PolarHBondContact O-N 2.84Å; M705-L708 HydrophobicContact SD-CD1 3.89Å; A706-L708 PolarHBondContact O-N 2.94Å; L708-E710 PolarHBondContact O-N 3.27Å; L708-R711 CarbonylContact O-C 3.53Å; L708-R711 PolarHBondContact O-N 3.28Å; L708-R711 VanDerWaalsContact O-N 3.13Å; L708-K712 PolarHBondContact O-N 3.16Å; L708-F713 HydrophobicContact CB-CB 4.25Å; L708-F713 HydrophobicContact CB-CD1 4.25Å; L708-F713 HydrophobicContact CD1-CD1 4.05Å; L708-F713 HydrophobicContact CD1-CE1 4.45Å; L708-F713 HydrophobicContact CD2-CB 4.18Å; L708-F713 HydrophobicContact CD2-CD1 3.71Å; L708-F713 HydrophobicContact CD2-CE1 4.4Å; L708-F713 HydrophobicContact CD2-CG 4.11Å; L708-F713 HydrophobicContact CG-CD1 4.21Å; L708-F713 WeakPolarHBondContact O-CB 3.4Å; L708-F713 PolarHBondContact O-N 2.65Å
709	S	90	Very high	92.2	Very high	29 Å²	29	31.8 Å²	31.8	20%	0.203	15%	0.145	C	C	.	.	H	α-helix	trans	-59.2	-45.2	178.2	173.8	0	0	0	0	112.5	M705 A706 R711 K712 T773	M705-S709 VanDerWaalsContact O-CB 3.24Å; M705-S709 WeakPolarHBondContact O-CB 3.4Å; M705-S709 PolarHBondContact O-N 2.86Å; A706-S709 WeakPolarHBondContact O-CB 3.41Å; A706-S709 PolarHBondContact O-N 3.26Å; S709-R711 PolarHBondContact O-N 2.81Å; S709-K712 WeakPolarHBondContact O-CA 3.46Å; S709-K712 PolarHBondContact O-N 2.81Å; S709-T773 WeakPolarHBondContact OG-CG2 3.35Å
710	E	91.1	Very high	92.1	Very high	127 Å²	127	28.5 Å²	28.5	59%	0.593	13%	0.132	S	C	*	.	H	α-helix	trans	-59.6	-31.2	176.9	-75	175	-176.8	0	0	112.5	A706 L708 K712	A706-E710 WeakPolarHBondContact O-CG 3.34Å; A706-E710 PolarHBondContact O-N 2.89Å; L708-E710 PolarHBondContact O-N 3.27Å; E710-K712 VanDerWaalsContact C-N 3.26Å; E710-K712 PolarHBondContact O-N 2.87Å
711	R	87.1	Confident	91.8	Very high	110 Å²	110	28 Å²	28	42%	0.415	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	5.2	175.9	-74.2	165.6	174.7	64.8	4.5	113.6	Y707 L708 S709 F713	Y707-R711 PolarHBondContact O-N 3.12Å; Y707-R711 VanDerWaalsContact OH-CZ 3.25Å; Y707-R711 PolarHBondContact OH-NE 3.26Å; Y707-R711 VanDerWaalsContact OH-NE 3.11Å; Y707-R711 PolarHBondContact OH-NH2 3.11Å; L708-R711 CarbonylContact O-C 3.53Å; L708-R711 PolarHBondContact O-N 3.28Å; L708-R711 VanDerWaalsContact O-N 3.13Å; S709-R711 PolarHBondContact O-N 2.81Å; R711-F713 PolarHBondContact O-N 3.27Å
712	K	82.7	Confident	91.5	Very high	162 Å²	162	28.6 Å²	28.6	70%	0.704	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.9	29.2	-177.3	-52.3	179.1	-179.6	-179.6	0	112.5	L708 S709 E710	L708-K712 PolarHBondContact O-N 3.16Å; S709-K712 WeakPolarHBondContact O-CA 3.46Å; S709-K712 PolarHBondContact O-N 2.81Å; E710-K712 VanDerWaalsContact C-N 3.26Å; E710-K712 PolarHBondContact O-N 2.87Å
713	F	82.6	Confident	91.3	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.009	13%	0.133	C	C	.	.			trans	-89.7	133.6	174.2	-171.6	-93.5	0	0	0	109.6	N543 L621 F625 L708 R711 D735 F736	N543-F713 WeakPolarHBondContact ND2-CD2 3.4Å; N543-F713 WeakPolarHBondContact ND2-CE2 3.47Å; L621-F713 HydrophobicContact CD1-CE2 4.09Å; F625-F713 HydrophobicContact CE1-CD2 4.48Å; F625-F713 HydrophobicContact CE2-CD2 4.42Å; F625-F713 HydrophobicContact CE2-CE2 4.27Å; F625-F713 HydrophobicContact CE2-CZ 4.33Å; F625-F713 HydrophobicContact CZ-CB 4.34Å; F625-F713 HydrophobicContact CZ-CD1 4.25Å; F625-F713 AromaticContact CZ-CD2 3.59Å; F625-F713 HydrophobicContact CZ-CD2 3.59Å; F625-F713 HydrophobicContact CZ-CE1 4.46Å; F625-F713 AromaticContact CZ-CE2 3.86Å; F625-F713 HydrophobicContact CZ-CE2 3.86Å; F625-F713 AromaticContact CZ-CG 3.79Å; F625-F713 HydrophobicContact CZ-CG 3.79Å; F625-F713 HydrophobicContact CZ-CZ 4.28Å; L708-F713 HydrophobicContact CB-CB 4.25Å; L708-F713 HydrophobicContact CB-CD1 4.25Å; L708-F713 HydrophobicContact CD1-CD1 4.05Å; L708-F713 HydrophobicContact CD1-CE1 4.45Å; L708-F713 HydrophobicContact CD2-CB 4.18Å; L708-F713 HydrophobicContact CD2-CD1 3.71Å; L708-F713 HydrophobicContact CD2-CE1 4.4Å; L708-F713 HydrophobicContact CD2-CG 4.11Å; L708-F713 HydrophobicContact CG-CD1 4.21Å; L708-F713 WeakPolarHBondContact O-CB 3.4Å; L708-F713 PolarHBondContact O-N 2.65Å; R711-F713 PolarHBondContact O-N 3.27Å; F713-D735 WeakPolarHBondContact CZ-OD2 3.43Å; F713-F736 HydrophobicContact CZ-CZ 4.18Å
714	V	84.4	Confident	91.1	Very high	13 Å²	13	30.1 Å²	30.1	8%	0.079	14%	0.139	C	C	.	.			trans	-115	120.8	176.4	-174.5	0	0	0	0	107.9	N543 R716 T772 D776	N543-V714 PolarHBondContact ND2-N 3.17Å; N543-V714 PolarHBondContact ND2-O 3.35Å; V714-R716 HydrophobicContact CB-CG 4.42Å; V714-R716 HydrophobicContact CG1-CG 3.83Å; V714-T772 WeakPolarHBondContact CG1-O 3.26Å; V714-D776 VanDerWaalsContact CA-OD2 3.3Å; V714-D776 WeakPolarHBondContact CA-OD2 3.46Å; V714-D776 WeakPolarHBondContact CG1-OD2 3.49Å
715	H	88.6	Confident	91.1	Very high	9 Å²	9	30.1 Å²	30.1	4%	0.042	14%	0.139	C	C	.	.			trans	-75.8	-41.2	-173.3	-172.4	-35.7	0	0	0	112.6	M705 D717 I733 A734 D776	M705-H715 HydrophobicContact CE-CB 4.17Å; M705-H715 HydrophobicContact SD-CB 4.41Å; H715-D717 PolarHBondContact O-N 3.06Å; H715-I733 VanDerWaalsContact CD2-CG2 3.45Å; H715-I733 WeakPolarHBondContact CD2-CG2 3.42Å; H715-I733 WeakPolarHBondContact NE2-CG2 3.42Å; H715-A734 PolarHBondContact NE2-O 3.47Å; H715-D776 PolarHBondContact N-OD1 3.22Å; H715-D776 PolarHBondContact N-OD2 2.83Å
716	R	85.9	Confident	90.8	Very high	47 Å²	47	30.3 Å²	30.3	18%	0.177	14%	0.141	C	C	.	.	S	Bend	trans	70	-15.9	174.3	-48.7	174.4	175.8	-168.5	-9	117.7	H541 V714 Y771 D776	H541-R716 PolarHBondContact O-NH1 3.37Å; H541-R716 PolarHBondContact O-NH2 3.42Å; V714-R716 HydrophobicContact CB-CG 4.42Å; V714-R716 HydrophobicContact CG1-CG 3.83Å; R716-Y771 HydrophobicContact CB-CD1 3.91Å; R716-Y771 HydrophobicContact CB-CE1 4.13Å; R716-Y771 HydrophobicContact CG-CD1 3.78Å; R716-Y771 HydrophobicContact CG-CE1 4.43Å; R716-Y771 HydrophobicContact CG-CG 4.11Å; R716-D776 PolarHBondContact N-OD1 2.77Å
717	D	88.6	Confident	90.5	Very high	26 Å²	26	36.6 Å²	36.6	14%	0.139	17%	0.169	C	C	.	.			trans	-137.3	42.1	176.2	-168.1	15.7	0	0	0	110.2	H715 A719 R721 N722 Y747 P757	H715-D717 PolarHBondContact O-N 3.06Å; D717-A719 PolarHBondContact O-N 3.47Å; D717-R721 IonicContact OD1-CZ 3.24Å; D717-R721 IonicContact OD1-NH2 3.76Å; D717-R721 PolarHBondContact OD1-NH2 2.65Å; D717-N722 PolarHBondContact O-ND2 2.8Å; D717-N722 PolarHBondContact OD2-ND2 3.4Å; D717-N722 VanDerWaalsContact OD2-ND2 3.17Å; D717-Y747 PolarHBondContact OD1-OH 2.82Å; D717-Y747 PolarHBondContact OD2-OH 3.22Å; D717-P757 HydrophobicContact CB-CG 4.36Å; D717-P757 VanDerWaalsContact OD1-CB 3.32Å; D717-P757 WeakPolarHBondContact OD1-CB 3.31Å; D717-P757 VanDerWaalsContact OD1-CG 3.29Å; D717-P757 WeakPolarHBondContact OD1-CG 3.49Å
718	L	93.8	Very high	90.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.203	C	C	.	.			trans	-70.2	118	176.7	-178.3	66.6	0	0	0	109.9	V701 M705 I733 W760 A779 Y780 V783	V701-L718 HydrophobicContact CG1-CD1 4.35Å; M705-L718 HydrophobicContact CE-CD2 4.19Å; M705-L718 HydrophobicContact CG-CD1 4.26Å; M705-L718 HydrophobicContact CG-CD2 3.73Å; M705-L718 HydrophobicContact SD-CD1 3.84Å; M705-L718 HydrophobicContact SD-CD2 3.78Å; M705-L718 HydrophobicContact SD-CG 4.35Å; L718-I733 HydrophobicContact CD1-CD1 4.44Å; L718-I733 HydrophobicContact CD1-CG2 4.47Å; L718-W760 VanDerWaalsContact O-CD1 3.27Å; L718-A779 HydrophobicContact CB-CB 4.04Å; L718-Y780 HydrophobicContact CD2-CD2 4.25Å; L718-V783 HydrophobicContact CG-CG2 4.15Å
719	A	95	Very high	90.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.217	C	C	.	.	S	Bend	trans	-157.5	162.9	178.7	0	0	0	0	0	109.5	D717 R721 N722 C723 W760	D717-A719 PolarHBondContact O-N 3.47Å; A719-R721 VanDerWaalsContact C-N 3.25Å; A719-R721 HydrophobicContact CB-CG 3.89Å; A719-R721 PolarHBondContact O-N 3.3Å; A719-N722 PolarHBondContact O-N 3.44Å; A719-C723 PolarHBondContact O-N 2.87Å; A719-W760 HydrophobicContact CB-CD2 4.17Å; A719-W760 HydrophobicContact CB-CG 4.21Å; A719-W760 HydrophobicContact CB-CZ2 4.35Å
720	T	95.2	Very high	90.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-61.3	-33	178	58.7	0	0	0	0	112.7	L655 N656 L659 N722 C723 V783 E786 I787	L655-T720 WeakPolarHBondContact CB-O 3.3Å; L655-T720 HydrophobicContact CD2-CG2 3.98Å; L655-T720 HydrophobicContact CG-CG2 4.32Å; L655-T720 PolarHBondContact N-O 3.1Å; N656-T720 WeakPolarHBondContact CB-OG1 3.15Å; N656-T720 PolarHBondContact ND2-OG1 3.12Å; L659-T720 HydrophobicContact CD1-CG2 3.98Å; T720-N722 PolarHBondContact O-N 2.99Å; T720-N722 VanDerWaalsContact O-N 3.13Å; T720-C723 PolarHBondContact O-N 2.93Å; T720-V783 HydrophobicContact CG2-CG1 4.01Å; T720-E786 HydrophobicContact CG2-CB 3.65Å; T720-E786 HydrophobicContact CG2-CG 4.38Å; T720-E786 PolarHBondContact N-OE2 3.31Å; T720-E786 VanDerWaalsContact OG1-CD 3.3Å; T720-E786 PolarHBondContact OG1-OE1 2.83Å; T720-I787 HydrophobicContact CG2-CG1 4.32Å
721	R	90.6	Very high	90.9	Very high	7 Å²	7	40.6 Å²	40.6	3%	0.026	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-61.6	-17.7	173	65.9	176.5	176.8	-79.7	-16.8	115	N656 D717 A719 Y743 D746 Y747 W760	N656-R721 HydrophobicContact CB-CB 4.34Å; D717-R721 IonicContact OD1-CZ 3.24Å; D717-R721 IonicContact OD1-NH2 3.76Å; D717-R721 PolarHBondContact OD1-NH2 2.65Å; A719-R721 VanDerWaalsContact C-N 3.25Å; A719-R721 HydrophobicContact CB-CG 3.89Å; A719-R721 PolarHBondContact O-N 3.3Å; R721-Y743 HydrophobicContact CB-CD2 3.8Å; R721-Y743 HydrophobicContact CB-CE2 3.78Å; R721-Y743 HydrophobicContact CB-CG 4.2Å; R721-Y743 HydrophobicContact CG-CD2 4.48Å; R721-D746 IonicContact CZ-OD2 3.5Å; R721-D746 IonicContact NH1-OD2 2.77Å; R721-D746 PolarHBondContact NH1-OD2 3.34Å; R721-Y747 PolarHBondContact NE-OH 2.62Å; R721-W760 VanDerWaalsContact NH1-CZ2 3.27Å
722	N	91.5	Very high	91.3	Very high	14 Å²	14	36.7 Å²	36.7	8%	0.075	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-107.8	12.8	176.9	-68.7	-28.7	0	0	0	111.6	D717 A719 T720 A734 S739	D717-N722 PolarHBondContact O-ND2 2.8Å; D717-N722 PolarHBondContact OD2-ND2 3.4Å; D717-N722 VanDerWaalsContact OD2-ND2 3.17Å; A719-N722 PolarHBondContact O-N 3.44Å; T720-N722 PolarHBondContact O-N 2.99Å; T720-N722 VanDerWaalsContact O-N 3.13Å; N722-A734 PolarHBondContact O-N 3.12Å; N722-A734 VanDerWaalsContact O-O 3.05Å; N722-S739 WeakPolarHBondContact OD1-CB 3.42Å; N722-S739 PolarHBondContact OD1-OG 3.47Å
723	C	94.8	Very high	91.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	141.4	166.6	-61	0	0	0	0	108.2	D654 L655 A719 T720 V731 K732	D654-C723 CarbonylContact C-O 3.57Å; D654-C723 WeakPolarHBondContact CA-O 3.32Å; L655-C723 HydrophobicContact CB-CB 3.86Å; L655-C723 HydrophobicContact CD2-CB 3.91Å; L655-C723 PolarHBondContact N-O 2.54Å; A719-C723 PolarHBondContact O-N 2.87Å; T720-C723 PolarHBondContact O-N 2.93Å; C723-V731 HydrophobicContact CB-CG1 4.09Å; C723-K732 CarbonylContact C-O 3.53Å; C723-K732 WeakPolarHBondContact CA-O 3.45Å
724	L	94.1	Very high	92	Very high	47 Å²	47	29.9 Å²	29.9	25%	0.246	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	149.1	179.5	-60.8	-178.6	0	0	0	110.9	V631 M650 G653 D654 V731 K732 A734	V631-L724 HydrophobicContact CG2-CD1 4.07Å; M650-L724 HydrophobicContact CB-CB 3.58Å; M650-L724 HydrophobicContact CB-CD1 4.01Å; M650-L724 HydrophobicContact CB-CG 4.39Å; M650-L724 HydrophobicContact CE-CB 4.12Å; M650-L724 VanDerWaalsContact CE-O 3.27Å; M650-L724 WeakPolarHBondContact CE-O 3.37Å; M650-L724 HydrophobicContact CG-CB 3.6Å; M650-L724 HydrophobicContact CG-CD1 3.82Å; M650-L724 HydrophobicContact CG-CG 4.37Å; G653-L724 CarbonylContact O-C 3.56Å; G653-L724 WeakPolarHBondContact O-CA 3.38Å; D654-L724 HydrophobicContact CB-CD2 4.07Å; L724-V731 WeakPolarHBondContact O-CA 3.47Å; L724-K732 PolarHBondContact N-O 3.42Å; L724-K732 PolarHBondContact O-N 3.37Å; L724-A734 HydrophobicContact CD1-CB 3.93Å; L724-A734 HydrophobicContact CG-CB 3.92Å
725	V	95.8	Very high	91.3	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.006	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122.5	-177.7	-172.4	0	0	0	0	109.9	M650 A651 Y652 G653 L655 F658 V731	M650-V725 CarbonylContact C-O 3.59Å; A651-V725 PolarHBondContact N-O 2.82Å; Y652-V725 WeakPolarHBondContact CB-O 3.45Å; Y652-V725 HydrophobicContact CG-CG1 4.44Å; Y652-V725 PolarHBondContact N-O 3.37Å; G653-V725 PolarHBondContact O-N 3.24Å; L655-V725 HydrophobicContact CB-CG2 3.95Å; L655-V725 HydrophobicContact CD1-CG2 3.7Å; L655-V725 HydrophobicContact CG-CG2 4.45Å; F658-V725 HydrophobicContact CB-CG2 4.04Å; F658-V725 HydrophobicContact CD1-CG1 4.5Å; F658-V725 HydrophobicContact CD1-CG2 4.21Å; F658-V725 HydrophobicContact CD2-CG1 4.25Å; F658-V725 HydrophobicContact CE2-CG1 4.31Å; F658-V725 HydrophobicContact CG-CB 4.48Å; F658-V725 HydrophobicContact CG-CG1 4.35Å; F658-V725 HydrophobicContact CG-CG2 4.05Å; F658-V725 HydrophobicContact CZ-CG1 4.46Å; V725-V731 HydrophobicContact CG2-CG2 4.48Å
726	G	92.3	Very high	89.7	Confident	5 Å²	5	32 Å²	32	5%	0.052	16%	0.164	C	C	.	.			trans	-100	-173.4	177.6	0	0	0	0	0	111.4	Y652 M729 V730	Y652-G726 VanDerWaalsContact CD2-O 3.3Å; Y652-G726 WeakPolarHBondContact CD2-O 3.37Å; G726-M729 PolarHBondContact O-N 3.47Å; G726-V730 PolarHBondContact N-O 2.9Å
727	E	89.4	Confident	88	Confident	141 Å²	141	30.5 Å²	30.5	66%	0.659	16%	0.162	S	C	*	.	G	3₁₀ helix	trans	-58.1	152.1	171.7	-63.8	-178.2	-177.4	0	0	111.2	M729 V730	E727-M729 PolarHBondContact O-N 3.33Å; E727-V730 WeakPolarHBondContact O-CG2 3.2Å; E727-V730 PolarHBondContact O-N 3.44Å
728	N	90.4	Very high	85.8	Confident	152 Å²	152	32.5 Å²	32.5	81%	0.813	17%	0.173	S	C	*	.	G	3₁₀ helix	trans	56.6	30.6	-178.1	-54.4	-34.5	0	0	0	114.6	V730	N728-V730 PolarHBondContact O-N 3.35Å
729	M	91.7	Very high	83.7	Confident	65 Å²	65	32.8 Å²	32.8	32%	0.32	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	54.8	31.6	-177.7	-62	-175.8	-72.8	0	0	113.5	F658 L689 E693 Q700 G726 E727 V731	F658-M729 HydrophobicContact CZ-CG 4.19Å; F658-M729 HydrophobicContact CZ-SD 4.39Å; L689-M729 HydrophobicContact CD2-SD 4.19Å; E693-M729 HydrophobicContact CG-CE 4.04Å; Q700-M729 PolarHBondContact NE2-O 2.85Å; G726-M729 PolarHBondContact O-N 3.47Å; E727-M729 PolarHBondContact O-N 3.33Å; M729-V731 PolarHBondContact O-N 3.4Å
730	V	96.4	Very high	81.7	Confident	50 Å²	50	37.8 Å²	37.8	30%	0.303	19%	0.194	S	C	.	.			trans	-68.5	121.5	169.8	174.6	0	0	0	0	108.3	G726 E727 N728 K732	G726-V730 PolarHBondContact N-O 2.9Å; E727-V730 WeakPolarHBondContact O-CG2 3.2Å; E727-V730 PolarHBondContact O-N 3.44Å; N728-V730 PolarHBondContact O-N 3.35Å; V730-K732 HydrophobicContact CG1-CG 4.05Å
731	V	97.5	Very high	79.6	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	125.9	179.7	-178.7	0	0	0	0	109.3	N629 L655 I697 Q700 V701 C723 L724 V725 M729	N629-V731 PolarHBondContact ND2-O 2.86Å; L655-V731 HydrophobicContact CD1-CG2 4.39Å; L655-V731 HydrophobicContact CD2-CG1 4.03Å; I697-V731 HydrophobicContact CB-CG2 4.43Å; I697-V731 HydrophobicContact CG1-CG2 4.06Å; I697-V731 HydrophobicContact CG2-CG2 4.17Å; Q700-V731 HydrophobicContact CB-CB 4.16Å; V701-V731 HydrophobicContact CG2-CG1 3.69Å; C723-V731 HydrophobicContact CB-CG1 4.09Å; L724-V731 WeakPolarHBondContact O-CA 3.47Å; V725-V731 HydrophobicContact CG2-CG2 4.48Å; M729-V731 PolarHBondContact O-N 3.4Å
732	K	96.7	Very high	77.5	Confident	28 Å²	28	48.4 Å²	48.4	12%	0.122	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	139.5	178.3	-54.7	-167	179.9	-162.5	0	111.1	P628 N629 V631 E648 M650 C723 L724 V730	P628-K732 WeakPolarHBondContact O-CD 3.37Å; P628-K732 WeakPolarHBondContact O-CE 3.19Å; N629-K732 WeakPolarHBondContact O-CA 3.37Å; V631-K732 HydrophobicContact CG2-CB 3.75Å; E648-K732 VanDerWaalsContact OE1-CD 3.28Å; E648-K732 WeakPolarHBondContact OE1-CD 3.35Å; E648-K732 IonicContact OE1-NZ 3.85Å; E648-K732 PolarHBondContact OE1-NZ 3.49Å; E648-K732 WeakPolarHBondContact OE2-CE 3.23Å; E648-K732 IonicContact OE2-NZ 3.79Å; E648-K732 PolarHBondContact OE2-NZ 3.31Å; M650-K732 HydrophobicContact CE-CB 3.84Å; M650-K732 HydrophobicContact CE-CD 3.95Å; M650-K732 HydrophobicContact CE-CG 3.6Å; M650-K732 HydrophobicContact SD-CD 3.95Å; M650-K732 HydrophobicContact SD-CG 4.28Å; C723-K732 CarbonylContact C-O 3.53Å; C723-K732 WeakPolarHBondContact CA-O 3.45Å; L724-K732 PolarHBondContact N-O 3.42Å; L724-K732 PolarHBondContact O-N 3.37Å; V730-K732 HydrophobicContact CG1-CG 4.05Å
733	I	94.6	Very high	75.6	Confident	3 Å²	3	49 Å²	49	2%	0.015	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	128.5	172.3	-56.8	178.9	0	0	0	108	N629 I630 V631 V701 M705 H715 L718	N629-I733 PolarHBondContact O-N 2.94Å; I630-I733 WeakPolarHBondContact CA-O 3.49Å; V631-I733 PolarHBondContact N-O 3.42Å; V701-I733 HydrophobicContact CG1-CD1 4.21Å; V701-I733 HydrophobicContact CG1-CG1 4.32Å; M705-I733 HydrophobicContact CB-CD1 4.38Å; M705-I733 HydrophobicContact CG-CD1 3.54Å; M705-I733 HydrophobicContact SD-CD1 3.55Å; M705-I733 VanDerWaalsContact SD-CD1 3.55Å; H715-I733 VanDerWaalsContact CD2-CG2 3.45Å; H715-I733 WeakPolarHBondContact CD2-CG2 3.42Å; H715-I733 WeakPolarHBondContact NE2-CG2 3.42Å; L718-I733 HydrophobicContact CD1-CD1 4.44Å; L718-I733 HydrophobicContact CD1-CG2 4.47Å
734	A	85.5	Confident	73.6	Confident	18 Å²	18	52 Å²	52	15%	0.149	27%	0.272	C	S	.	.			trans	-111.3	152.3	173.3	0	0	0	0	0	109.2	V631 H715 N722 L724	V631-A734 HydrophobicContact CB-CB 4.42Å; V631-A734 HydrophobicContact CG2-CB 3.81Å; H715-A734 PolarHBondContact NE2-O 3.47Å; N722-A734 PolarHBondContact O-N 3.12Å; N722-A734 VanDerWaalsContact O-O 3.05Å; L724-A734 HydrophobicContact CD1-CB 3.93Å; L724-A734 HydrophobicContact CG-CB 3.92Å
735	D	70.1	Confident	71.3	Confident	34 Å²	34	53 Å²	53	18%	0.182	29%	0.287	C	S	.	.			trans	-124	151.6	175.7	-160.6	-5.7	0	0	0	110.9	M622 F713	M622-D735 HydrophobicContact SD-CB 4.36Å; F713-D735 WeakPolarHBondContact CZ-OD2 3.43Å
736	F	53.1	Low	69.4	Low	33 Å²	33	53.3 Å²	53.3	15%	0.145	29%	0.288	C	S	.	.	S	Bend	trans	83.7	93.9	160	-48.2	-75.3	0	0	0	120	Y546 K601 E618 L621 M622 F713 L738	Y546-F736 VanDerWaalsContact OH-CE1 3.27Å; Y546-F736 WeakPolarHBondContact OH-CE1 3.23Å; K601-F736 PolarHBondContact NZ-O 3.09Å; E618-F736 VanDerWaalsContact CD-CD2 3.43Å; E618-F736 HydrophobicContact CG-CB 3.78Å; E618-F736 HydrophobicContact CG-CD1 3.94Å; E618-F736 HydrophobicContact CG-CD2 3.1Å; E618-F736 HydrophobicContact CG-CE1 4.29Å; E618-F736 HydrophobicContact CG-CE2 3.51Å; E618-F736 HydrophobicContact CG-CG 3.33Å; E618-F736 HydrophobicContact CG-CZ 4.09Å; E618-F736 VanDerWaalsContact OE1-CB 3.27Å; E618-F736 WeakPolarHBondContact OE1-CB 3.26Å; E618-F736 WeakPolarHBondContact OE2-CB 3.29Å; L621-F736 HydrophobicContact CD1-CZ 4.28Å; M622-F736 HydrophobicContact CG-CD2 4.46Å; M622-F736 HydrophobicContact CG-CE2 4.17Å; M622-F736 HydrophobicContact SD-CD2 4.36Å; M622-F736 HydrophobicContact SD-CE2 3.94Å; F713-F736 HydrophobicContact CZ-CZ 4.18Å; F736-L738 PolarHBondContact O-N 2.93Å
737	G	52.2	Low	67.9	Low	15 Å²	15	53.5 Å²	53.5	16%	0.155	29%	0.288	C	S	.	.	S	Bend	trans	85.1	4.6	139.3	0	0	0	0	0	117.1	G576 A577	G576-G737 CarbonylContact C-O 3.52Å; G576-G737 WeakPolarHBondContact CA-O 3.05Å; A577-G737 PolarHBondContact N-O 2.86Å
738	L	42	Very low	65.9	Low	68 Å²	68	49.3 Å²	49.3	36%	0.356	27%	0.266	S	S	.	.	S	Bend	trans	-89	-32.3	-178	-53.7	-174.6	0	0	0	113.4	V581 K601 F736 R740	V581-L738 HydrophobicContact CB-CD1 4.47Å; V581-L738 HydrophobicContact CB-CD2 4.46Å; V581-L738 HydrophobicContact CG1-CD1 4.34Å; V581-L738 HydrophobicContact CG2-CD1 3.75Å; V581-L738 HydrophobicContact CG2-CD2 3.22Å; V581-L738 HydrophobicContact CG2-CG 4.09Å; K601-L738 HydrophobicContact CD-CD2 4.24Å; K601-L738 HydrophobicContact CG-CD2 4.49Å; F736-L738 PolarHBondContact O-N 2.93Å; L738-R740 PolarHBondContact O-N 3.33Å
739	S	48.9	Very low	64.2	Low	7 Å²	7	48 Å²	48	5%	0.049	25%	0.254	C	S	.	.	H	α-helix	trans	-81.4	-14.8	-169.5	49.9	0	0	0	0	115	N722 N741 Y743 Y747	N722-S739 WeakPolarHBondContact OD1-CB 3.42Å; N722-S739 PolarHBondContact OD1-OG 3.47Å; S739-N741 VanDerWaalsContact C-N 3.27Å; S739-N741 PolarHBondContact O-N 2.93Å; S739-Y743 PolarHBondContact O-N 2.87Å; S739-Y747 PolarHBondContact OG-OH 3.36Å
740	R	53.7	Low	61.7	Low	105 Å²	105	47 Å²	47	40%	0.396	26%	0.255	S	S	.	.	H	α-helix	trans	-64	-25.5	-171.3	-66.8	-175.4	-178.5	-172.5	0.5	114.7	L738 Y747	L738-R740 PolarHBondContact O-N 3.33Å; R740-Y747 HydrophobicContact CG-CE1 4.32Å; R740-Y747 HydrophobicContact CG-CE2 4.35Å
741	N	49.8	Very low	59.1	Low	111 Å²	111	48.5 Å²	48.5	59%	0.594	26%	0.262	S	S	*	.	H	α-helix	trans	-87.7	-48.4	-178.5	-154.8	-10.3	0	0	0	111.5	S739	S739-N741 VanDerWaalsContact C-N 3.27Å; S739-N741 PolarHBondContact O-N 2.93Å
742	I	47.8	Very low	56.3	Low	118 Å²	118	57.5 Å²	57.5	61%	0.605	30%	0.303	S	S	*	.	H	α-helix	trans	-68.1	-43	-179.1	-58.5	172.5	0	0	0	111.2
743	Y	51.8	Low	53.6	Low	28 Å²	28	62.8 Å²	62.8	11%	0.11	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	37.4	-177.8	-62.2	-80.6	0	0	0	112.5	D654 R721 S739 A745 D746 Y747	D654-Y743 VanDerWaalsContact CG-OH 3.25Å; D654-Y743 PolarHBondContact OD1-OH 3.36Å; D654-Y743 VanDerWaalsContact OD1-OH 3.04Å; D654-Y743 PolarHBondContact OD2-OH 3.48Å; R721-Y743 HydrophobicContact CB-CD2 3.8Å; R721-Y743 HydrophobicContact CB-CE2 3.78Å; R721-Y743 HydrophobicContact CB-CG 4.2Å; R721-Y743 HydrophobicContact CG-CD2 4.48Å; S739-Y743 PolarHBondContact O-N 2.87Å; Y743-A745 PolarHBondContact O-N 2.88Å; Y743-D746 WeakPolarHBondContact O-CB 3.4Å; Y743-D746 PolarHBondContact O-N 2.98Å; Y743-Y747 WeakPolarHBondContact O-CD2 3.19Å
744	S	52.7	Low	51.7	Low	63 Å²	63	66 Å²	66	44%	0.441	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-57.4	-23.8	-175	63.1	0	0	0	0	114.6	D746 Y747	S744-D746 VanDerWaalsContact C-N 3.28Å; S744-D746 PolarHBondContact O-N 3.15Å; S744-Y747 PolarHBondContact O-N 3.5Å
745	A	45.8	Very low	50.7	Low	66 Å²	66	65.9 Å²	65.9	55%	0.545	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-72.4	-14.6	175.3	0	0	0	0	0	114.5	Y743 H800	Y743-A745 PolarHBondContact O-N 2.88Å; A745-H800 PolarHBondContact O-CE1 3.27Å; A745-H800 PolarHBondContact O-NE2 2.79Å
746	D	54.4	Low	50.9	Low	8 Å²	8	64.7 Å²	64.7	4%	0.043	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-88	-8.4	176.8	-73.1	-12.4	0	0	0	113	R721 Y743 S744 W760 Q793	R721-D746 IonicContact CZ-OD2 3.5Å; R721-D746 IonicContact NH1-OD2 2.77Å; R721-D746 PolarHBondContact NH1-OD2 3.34Å; Y743-D746 WeakPolarHBondContact O-CB 3.4Å; Y743-D746 PolarHBondContact O-N 2.98Å; S744-D746 VanDerWaalsContact C-N 3.28Å; S744-D746 PolarHBondContact O-N 3.15Å; D746-W760 HydrophobicContact CB-CH2 4.07Å; D746-W760 HydrophobicContact CB-CZ3 3.77Å; D746-Q793 PolarHBondContact OD1-NE2 3.27Å
747	Y	62	Low	52.4	Low	10 Å²	10	63.6 Å²	63.6	4%	0.039	34%	0.339	C	S	.	.			trans	-111.8	127.5	-177.3	-64.8	-90.7	0	0	0	111.5	D717 R721 S739 R740 Y743 S744 A755 I756 P757	D717-Y747 PolarHBondContact OD1-OH 2.82Å; D717-Y747 PolarHBondContact OD2-OH 3.22Å; R721-Y747 PolarHBondContact NE-OH 2.62Å; S739-Y747 PolarHBondContact OG-OH 3.36Å; R740-Y747 HydrophobicContact CG-CE1 4.32Å; R740-Y747 HydrophobicContact CG-CE2 4.35Å; Y743-Y747 WeakPolarHBondContact O-CD2 3.19Å; S744-Y747 PolarHBondContact O-N 3.5Å; Y747-A755 HydrophobicContact CD1-CB 4.24Å; Y747-A755 HydrophobicContact CG-CB 4.33Å; Y747-I756 WeakPolarHBondContact CA-O 3.37Å; Y747-P757 HydrophobicContact CD1-CB 4.23Å; Y747-P757 HydrophobicContact CE1-CB 3.99Å; Y747-P757 HydrophobicContact CE1-CG 4.48Å
748	Y	46.8	Very low	54	Low	52 Å²	52	62.9 Å²	62.9	20%	0.204	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	131.9	166.3	176.4	-103.4	0	0	0	109.6	A750 A755 I756 I758 H800 E801	Y748-A750 HydrophobicContact CE1-CB 3.92Å; Y748-A755 CarbonylContact O-C 3.49Å; Y748-A755 WeakPolarHBondContact O-CA 3.15Å; Y748-I756 HydrophobicContact CD1-CD1 4.22Å; Y748-I756 HydrophobicContact CD1-CG1 4.1Å; Y748-I756 PolarHBondContact N-O 3.5Å; Y748-I756 PolarHBondContact O-N 2.96Å; Y748-I758 HydrophobicContact CD1-CG1 4.34Å; Y748-I758 HydrophobicContact CG-CG1 4.11Å; Y748-H800 HydrophobicContact CD2-CB 3.83Å; Y748-H800 HydrophobicContact CG-CB 4.33Å; Y748-E801 WeakPolarHBondContact CE2-OE1 3.4Å
749	K	55.3	Low	56.4	Low	126 Å²	126	60.1 Å²	60.1	55%	0.548	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	110.1	177	-64.2	-174.3	-178.2	-176.6	0	109.5	A755	K749-A755 HydrophobicContact CG-CB 4.03Å
750	A	37.8	Very low	58.6	Low	42 Å²	42	60 Å²	60	35%	0.347	32%	0.315	S	S	.	.	S	Bend	trans	-79.5	-37.3	171.1	0	0	0	0	0	111.4	Y748	Y748-A750 HydrophobicContact CE1-CB 3.92Å
751	N	42.3	Very low	60.3	Low	83 Å²	83	55.1 Å²	55.1	44%	0.444	30%	0.297	S	S	.	.	S	Bend	trans	-138.4	171.5	179.3	-73.7	-30.8	0	0	0	110.5	N753 D754	N751-N753 PolarHBondContact O-N 3.48Å; N751-N753 VanDerWaalsContact O-N 3.08Å; N751-D754 PolarHBondContact O-N 2.93Å
752	E	38.8	Very low	62.3	Low	189 Å²	189	50 Å²	50	88%	0.883	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-22.8	-176.4	-75.3	-178	168.6	0	0	114.6
753	N	40.1	Very low	63.9	Low	139 Å²	139	45.2 Å²	45.2	74%	0.743	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112	-10.9	-173	-69.1	-19.6	0	0	0	115.7	N751	N751-N753 PolarHBondContact O-N 3.48Å; N751-N753 VanDerWaalsContact O-N 3.08Å
754	D	54.1	Low	65.3	Low	72 Å²	72	44.5 Å²	44.5	39%	0.385	24%	0.244	S	C	.	.			trans	-118.8	81.6	-169.5	-64.5	-46.3	0	0	0	111.5	N751	N751-D754 PolarHBondContact O-N 2.93Å
755	A	65	Low	66.8	Low	14 Å²	14	41.7 Å²	41.7	12%	0.116	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.9	174.3	0	0	0	0	0	110	Y747 Y748 K749	Y747-A755 HydrophobicContact CD1-CB 4.24Å; Y747-A755 HydrophobicContact CG-CB 4.33Å; Y748-A755 CarbonylContact O-C 3.49Å; Y748-A755 WeakPolarHBondContact O-CA 3.15Å; K749-A755 HydrophobicContact CG-CB 4.03Å
756	I	73.6	Confident	68.1	Low	10 Å²	10	38.6 Å²	38.6	5%	0.051	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	141.3	-178.3	53.2	158.3	0	0	0	113.5	L535 L537 Y747 Y748 I758 M761	L535-I756 HydrophobicContact CD2-CD1 3.69Å; L537-I756 HydrophobicContact CD1-CD1 3.83Å; L537-I756 HydrophobicContact CD1-CG1 4.3Å; L537-I756 HydrophobicContact CD1-CG2 4.37Å; L537-I756 HydrophobicContact CD2-CD1 4.32Å; L537-I756 HydrophobicContact CD2-CG2 3.66Å; Y747-I756 WeakPolarHBondContact CA-O 3.37Å; Y748-I756 HydrophobicContact CD1-CD1 4.22Å; Y748-I756 HydrophobicContact CD1-CG1 4.1Å; Y748-I756 PolarHBondContact N-O 3.5Å; Y748-I756 PolarHBondContact O-N 2.96Å; I756-I758 VanDerWaalsContact C-N 3.32Å; I756-I758 HydrophobicContact CD1-CD1 3.5Å; I756-I758 VanDerWaalsContact CD1-CD1 3.5Å; I756-I758 HydrophobicContact CD1-CG1 3.9Å; I756-I758 HydrophobicContact CG1-CD1 4.31Å; I756-I758 HydrophobicContact CG1-CG1 4.17Å; I756-I758 PolarHBondContact O-N 3.44Å; I756-M761 HydrophobicContact CB-SD 4.02Å; I756-M761 HydrophobicContact CD1-CE 4.35Å; I756-M761 HydrophobicContact CD1-SD 4.06Å
757	P	85.9	Confident	68.8	Low	9 Å²	9	41.4 Å²	41.4	6%	0.058	21%	0.21	C	C	.	.			trans	-84.7	64.8	-173.2	36.8	-39.5	0	0	0	112.4	D717 Y747 R759 W760 M761	D717-P757 HydrophobicContact CB-CG 4.36Å; D717-P757 VanDerWaalsContact OD1-CB 3.32Å; D717-P757 WeakPolarHBondContact OD1-CB 3.31Å; D717-P757 VanDerWaalsContact OD1-CG 3.29Å; D717-P757 WeakPolarHBondContact OD1-CG 3.49Å; Y747-P757 HydrophobicContact CD1-CB 4.23Å; Y747-P757 HydrophobicContact CE1-CB 3.99Å; Y747-P757 HydrophobicContact CE1-CG 4.48Å; P757-R759 PolarHBondContact O-N 3.13Å; P757-W760 HydrophobicContact CB-CE3 4.26Å; P757-W760 PolarHBondContact O-N 2.89Å; P757-M761 HydrophobicContact CG-CG 4.29Å; P757-M761 HydrophobicContact CG-SD 4.47Å; P757-M761 WeakPolarHBondContact O-CG 3.48Å; P757-M761 PolarHBondContact O-N 3.13Å
758	I	85.1	Confident	69.1	Low	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-46.9	-38.5	-170.9	-77.8	-66.9	0	0	0	114.5	L535 Y748 I756 W760 M761 I766 H800 V803 I804	L535-I758 HydrophobicContact CD1-CD1 4.38Å; Y748-I758 HydrophobicContact CD1-CG1 4.34Å; Y748-I758 HydrophobicContact CG-CG1 4.11Å; I756-I758 VanDerWaalsContact C-N 3.32Å; I756-I758 HydrophobicContact CD1-CD1 3.5Å; I756-I758 VanDerWaalsContact CD1-CD1 3.5Å; I756-I758 HydrophobicContact CD1-CG1 3.9Å; I756-I758 HydrophobicContact CG1-CD1 4.31Å; I756-I758 HydrophobicContact CG1-CG1 4.17Å; I756-I758 PolarHBondContact O-N 3.44Å; I758-W760 PolarHBondContact O-N 3.48Å; I758-M761 HydrophobicContact CD1-SD 4.18Å; I758-M761 PolarHBondContact O-N 3.37Å; I758-M761 VanDerWaalsContact O-N 3.15Å; I758-I766 HydrophobicContact CD1-CG1 4.14Å; I758-I766 HydrophobicContact CD1-CG2 4.38Å; I758-H800 HydrophobicContact CG2-CB 4.29Å; I758-V803 HydrophobicContact CG2-CB 4.25Å; I758-V803 HydrophobicContact CG2-CG1 4.09Å; I758-I804 HydrophobicContact CD1-CD1 3.8Å; I758-I804 HydrophobicContact CD1-CG1 3.86Å; I758-I804 HydrophobicContact CG1-CD1 4.27Å; I758-I804 HydrophobicContact CG1-CG1 4.41Å; I758-I804 HydrophobicContact CG2-CD1 4.33Å; I758-I804 HydrophobicContact CG2-CG1 3.7Å
759	R	91.9	Very high	70	Confident	10 Å²	10	48.1 Å²	48.1	4%	0.038	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-69.3	-18.3	-176.5	-60.2	169.3	-176.3	-80.7	-5.3	114	P757 P794 Y795 M798 V803	P757-R759 PolarHBondContact O-N 3.13Å; R759-P794 HydrophobicContact CB-CB 4.36Å; R759-P794 WeakPolarHBondContact CD-O 3.45Å; R759-P794 PolarHBondContact NH1-O 3.19Å; R759-Y795 HydrophobicContact CB-CD2 4.21Å; R759-Y795 HydrophobicContact CG-CD2 4.41Å; R759-Y795 PolarHBondContact NH1-O 3.45Å; R759-M798 PolarHBondContact NH1-O 3.35Å; R759-M798 PolarHBondContact NH2-O 3.48Å; R759-V803 HydrophobicContact CG-CG1 4.34Å; R759-V803 HydrophobicContact CG-CG2 4.33Å
760	W	95.1	Very high	70.9	Confident	4 Å²	4	49.4 Å²	49.4	2%	0.015	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-102.4	-6.2	175.5	-69.7	-100.9	0	0	0	112.5	L718 A719 R721 D746 P757 I758 A779 V782 E786 P794	L718-W760 VanDerWaalsContact O-CD1 3.27Å; A719-W760 HydrophobicContact CB-CD2 4.17Å; A719-W760 HydrophobicContact CB-CG 4.21Å; A719-W760 HydrophobicContact CB-CZ2 4.35Å; R721-W760 VanDerWaalsContact NH1-CZ2 3.27Å; D746-W760 HydrophobicContact CB-CH2 4.07Å; D746-W760 HydrophobicContact CB-CZ3 3.77Å; P757-W760 HydrophobicContact CB-CE3 4.26Å; P757-W760 PolarHBondContact O-N 2.89Å; I758-W760 PolarHBondContact O-N 3.48Å; W760-A779 HydrophobicContact CB-CB 4.33Å; W760-A779 WeakPolarHBondContact O-CA 3.25Å; W760-A779 WeakPolarHBondContact O-CB 3.34Å; W760-V782 HydrophobicContact CD2-CG1 4.37Å; W760-V782 HydrophobicContact CG-CB 4.37Å; W760-V782 HydrophobicContact CG-CG1 4.06Å; W760-E786 HydrophobicContact CZ2-CG 4.47Å; W760-E786 WeakPolarHBondContact CZ2-OE1 3.46Å; W760-E786 PolarHBondContact NE1-OE2 2.83Å; W760-P794 HydrophobicContact CH2-CG 4.07Å; W760-P794 HydrophobicContact CZ2-CG 3.62Å
761	M	90.9	Very high	73	Confident	4 Å²	4	49 Å²	49	2%	0.02	23%	0.229	C	C	.	.			trans	-86.7	138	-173.5	-70.7	175.2	62	0	0	112.2	I756 P757 I758 I766 Y771 W778	I756-M761 HydrophobicContact CB-SD 4.02Å; I756-M761 HydrophobicContact CD1-CE 4.35Å; I756-M761 HydrophobicContact CD1-SD 4.06Å; P757-M761 HydrophobicContact CG-CG 4.29Å; P757-M761 HydrophobicContact CG-SD 4.47Å; P757-M761 WeakPolarHBondContact O-CG 3.48Å; P757-M761 PolarHBondContact O-N 3.13Å; I758-M761 HydrophobicContact CD1-SD 4.18Å; I758-M761 PolarHBondContact O-N 3.37Å; I758-M761 VanDerWaalsContact O-N 3.15Å; M761-I766 HydrophobicContact CB-CD1 4.01Å; M761-I766 HydrophobicContact CB-CG1 3.58Å; M761-I766 HydrophobicContact CE-CG1 4.05Å; M761-I766 WeakPolarHBondContact O-CD1 3.46Å; M761-Y771 HydrophobicContact CE-CE1 4.37Å; M761-Y771 VanDerWaalsContact CE-OH 3.23Å; M761-Y771 WeakPolarHBondContact CE-OH 3.37Å; M761-W778 PolarHBondContact O-NE1 3.02Å
762	P	91.7	Very high	75	Confident	4 Å²	4	46.4 Å²	46.4	3%	0.026	22%	0.216	C	C	.	.			trans	-75.2	163.2	170.9	33.8	-38.8	0	0	0	112	E764 S765 I766 W778	P762-E764 VanDerWaalsContact C-N 3.28Å; P762-E764 VanDerWaalsContact CB-OE1 3.31Å; P762-E764 WeakPolarHBondContact CB-OE1 3.27Å; P762-E764 WeakPolarHBondContact CB-OE2 3.43Å; P762-E764 WeakPolarHBondContact CG-OE1 3.24Å; P762-E764 PolarHBondContact O-N 2.91Å; P762-S765 WeakPolarHBondContact CG-OG 3.35Å; P762-S765 PolarHBondContact O-N 3.28Å; P762-S765 VanDerWaalsContact O-N 3.11Å; P762-I766 WeakPolarHBondContact O-CG1 3.31Å; P762-I766 PolarHBondContact O-N 2.96Å; P762-W778 HydrophobicContact CB-CB 3.66Å; P762-W778 HydrophobicContact CB-CD2 3.56Å; P762-W778 HydrophobicContact CB-CE3 3.87Å; P762-W778 HydrophobicContact CB-CG 3.46Å; P762-W778 VanDerWaalsContact CB-CG 3.46Å; P762-W778 HydrophobicContact CG-CB 4.24Å; P762-W778 HydrophobicContact CG-CG 4.34Å
763	P	81.5	Confident	77.5	Confident	17 Å²	17	38.6 Å²	38.6	11%	0.11	18%	0.181	C	C	.	.	H	α-helix	trans	-56.8	-37.5	179.6	22.3	-33.8	0	0	0	113	S765 I766 F767 W778 V807	P763-S765 VanDerWaalsContact C-N 3.33Å; P763-S765 PolarHBondContact O-N 2.75Å; P763-I766 PolarHBondContact O-N 3.38Å; P763-F767 HydrophobicContact CB-CD2 3.93Å; P763-F767 HydrophobicContact CB-CE2 3.95Å; P763-F767 WeakPolarHBondContact O-CB 3.43Å; P763-F767 WeakPolarHBondContact O-CD2 3.45Å; P763-F767 PolarHBondContact O-N 3.05Å; P763-W778 HydrophobicContact CG-CH2 4.39Å; P763-W778 HydrophobicContact CG-CZ3 4.19Å; P763-V807 HydrophobicContact CB-CG1 4.39Å
764	E	81.4	Confident	80.1	Confident	13 Å²	13	35.5 Å²	35.5	6%	0.061	16%	0.163	C	C	.	.	H	α-helix	trans	-69.1	-29.6	179.9	73.8	-74.9	174.2	0	0	114.2	P762 Y768 N769 R770 S775 P835 R838	P762-E764 VanDerWaalsContact C-N 3.28Å; P762-E764 VanDerWaalsContact CB-OE1 3.31Å; P762-E764 WeakPolarHBondContact CB-OE1 3.27Å; P762-E764 WeakPolarHBondContact CB-OE2 3.43Å; P762-E764 WeakPolarHBondContact CG-OE1 3.24Å; P762-E764 PolarHBondContact O-N 2.91Å; E764-Y768 HydrophobicContact CB-CD2 4.3Å; E764-Y768 CarbonylContact O-C 3.07Å; E764-Y768 WeakPolarHBondContact O-CA 3.37Å; E764-Y768 WeakPolarHBondContact O-CB 3.42Å; E764-Y768 PolarHBondContact O-N 2.89Å; E764-Y768 VanDerWaalsContact O-N 3.07Å; E764-N769 PolarHBondContact O-N 3.23Å; E764-R770 HydrophobicContact CB-CB 4.33Å; E764-R770 HydrophobicContact CG-CB 4.24Å; E764-R770 HydrophobicContact CG-CG 4.46Å; E764-R770 PolarHBondContact O-N 3.42Å; E764-S775 PolarHBondContact OE1-OG 2.97Å; E764-P835 HydrophobicContact CG-CG 4.05Å; E764-R838 IonicContact OE1-CZ 3.27Å; E764-R838 IonicContact OE1-NH1 2.64Å; E764-R838 PolarHBondContact OE1-NH1 3.49Å; E764-R838 IonicContact OE1-NH2 3.6Å; E764-R838 IonicContact OE2-CZ 2.76Å; E764-R838 IonicContact OE2-NH1 2.79Å; E764-R838 IonicContact OE2-NH2 2.76Å; E764-R838 PolarHBondContact OE2-NH2 3.38Å
765	S	82.7	Confident	81.9	Confident	3 Å²	3	32.2 Å²	32.2	2%	0.021	15%	0.145	C	C	.	.	H	α-helix	trans	-75.5	-41	173.6	-54.3	0	0	0	0	111	P762 P763 N769 R770	P762-S765 WeakPolarHBondContact CG-OG 3.35Å; P762-S765 PolarHBondContact O-N 3.28Å; P762-S765 VanDerWaalsContact O-N 3.11Å; P763-S765 VanDerWaalsContact C-N 3.33Å; P763-S765 PolarHBondContact O-N 2.75Å; S765-N769 WeakPolarHBondContact O-CA 3.46Å; S765-N769 PolarHBondContact O-N 3.39Å; S765-R770 VanDerWaalsContact CA-O 3.25Å; S765-R770 WeakPolarHBondContact CA-O 3.2Å; S765-R770 WeakPolarHBondContact CB-O 3.14Å; S765-R770 PolarHBondContact N-O 3.1Å; S765-R770 PolarHBondContact OG-O 3.39Å
766	I	74.1	Confident	83.4	Confident	2 Å²	2	31.7 Å²	31.7	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-65.5	-46.4	179.1	-63.5	172.4	0	0	0	111.5	L535 I758 M761 P762 P763 I804	L535-I766 HydrophobicContact CD1-CG2 4.22Å; L535-I766 WeakPolarHBondContact CG-O 3.45Å; I758-I766 HydrophobicContact CD1-CG1 4.14Å; I758-I766 HydrophobicContact CD1-CG2 4.38Å; M761-I766 HydrophobicContact CB-CD1 4.01Å; M761-I766 HydrophobicContact CB-CG1 3.58Å; M761-I766 HydrophobicContact CE-CG1 4.05Å; M761-I766 WeakPolarHBondContact O-CD1 3.46Å; P762-I766 WeakPolarHBondContact O-CG1 3.31Å; P762-I766 PolarHBondContact O-N 2.96Å; P763-I766 PolarHBondContact O-N 3.38Å; I766-I804 HydrophobicContact CG2-CB 4.5Å; I766-I804 HydrophobicContact CG2-CG1 4.02Å; I766-I804 HydrophobicContact CG2-CG2 3.94Å
767	F	69.1	Low	84.6	Confident	67 Å²	67	31.3 Å²	31.3	29%	0.294	14%	0.139	S	C	.	.	H	α-helix	trans	-98.1	-22.6	-169.3	-59.2	-59.7	0	0	0	114.4	P763 I804 R808	P763-F767 HydrophobicContact CB-CD2 3.93Å; P763-F767 HydrophobicContact CB-CE2 3.95Å; P763-F767 WeakPolarHBondContact O-CB 3.43Å; P763-F767 WeakPolarHBondContact O-CD2 3.45Å; P763-F767 PolarHBondContact O-N 3.05Å; F767-I804 HydrophobicContact CE1-CG2 3.59Å; F767-I804 HydrophobicContact CZ-CG2 3.69Å; F767-R808 HydrophobicContact CE1-CB 4.44Å; F767-R808 HydrophobicContact CE1-CG 4.27Å; F767-R808 HydrophobicContact CE2-CB 3.73Å; F767-R808 HydrophobicContact CE2-CG 3.76Å; F767-R808 HydrophobicContact CZ-CB 3.49Å; F767-R808 VanDerWaalsContact CZ-CB 3.49Å; F767-R808 HydrophobicContact CZ-CG 3.65Å
768	Y	67.1	Low	85.2	Confident	183 Å²	183	31.2 Å²	31.2	72%	0.718	14%	0.137	S	C	*	.	H	α-helix	trans	-130.3	9.4	-172.7	-49	-65.2	0	0	0	113.5	E764 R770	E764-Y768 HydrophobicContact CB-CD2 4.3Å; E764-Y768 CarbonylContact O-C 3.07Å; E764-Y768 WeakPolarHBondContact O-CA 3.37Å; E764-Y768 WeakPolarHBondContact O-CB 3.42Å; E764-Y768 PolarHBondContact O-N 2.89Å; E764-Y768 VanDerWaalsContact O-N 3.07Å; Y768-R770 PolarHBondContact O-N 3.48Å
769	N	67.3	Low	85.8	Confident	19 Å²	19	31.5 Å²	31.5	10%	0.102	14%	0.139	C	C	.	.			trans	51.2	32.5	-179.4	-166	22.6	0	0	0	112.8	L536 E764 S765 Y771	L536-N769 VanDerWaalsContact O-CB 3.31Å; L536-N769 WeakPolarHBondContact O-CB 3.3Å; L536-N769 VanDerWaalsContact O-CG 3.3Å; L536-N769 PolarHBondContact O-ND2 2.92Å; L536-N769 VanDerWaalsContact O-ND2 3.08Å; E764-N769 PolarHBondContact O-N 3.23Å; S765-N769 WeakPolarHBondContact O-CA 3.46Å; S765-N769 PolarHBondContact O-N 3.39Å; N769-Y771 VanDerWaalsContact OD1-CE2 3.31Å; N769-Y771 WeakPolarHBondContact OD1-CE2 3.47Å
770	R	73.1	Confident	86.1	Confident	154 Å²	154	31 Å²	31	58%	0.581	14%	0.137	S	C	*	.			trans	-99.3	121.1	-177.7	-174.9	173.6	177.9	166.5	-1	109.6	E764 S765 Y768 T772 S775	E764-R770 HydrophobicContact CB-CB 4.33Å; E764-R770 HydrophobicContact CG-CB 4.24Å; E764-R770 HydrophobicContact CG-CG 4.46Å; E764-R770 PolarHBondContact O-N 3.42Å; S765-R770 VanDerWaalsContact CA-O 3.25Å; S765-R770 WeakPolarHBondContact CA-O 3.2Å; S765-R770 WeakPolarHBondContact CB-O 3.14Å; S765-R770 PolarHBondContact N-O 3.1Å; S765-R770 PolarHBondContact OG-O 3.39Å; Y768-R770 PolarHBondContact O-N 3.48Å; R770-T772 HydrophobicContact CG-CG2 4.21Å; R770-S775 PolarHBondContact O-OG 3.46Å
771	Y	81.8	Confident	86.2	Confident	32 Å²	32	30.8 Å²	30.8	13%	0.125	14%	0.137	C	C	.	.			trans	-121.7	118.3	177.4	-66.3	-90.9	0	0	0	109.8	L540 R716 M761 N769	L540-Y771 HydrophobicContact CD2-CD2 4.34Å; L540-Y771 HydrophobicContact CD2-CE2 3.6Å; R716-Y771 HydrophobicContact CB-CD1 3.91Å; R716-Y771 HydrophobicContact CB-CE1 4.13Å; R716-Y771 HydrophobicContact CG-CD1 3.78Å; R716-Y771 HydrophobicContact CG-CE1 4.43Å; R716-Y771 HydrophobicContact CG-CG 4.11Å; M761-Y771 HydrophobicContact CE-CE1 4.37Å; M761-Y771 VanDerWaalsContact CE-OH 3.23Å; M761-Y771 WeakPolarHBondContact CE-OH 3.37Å; N769-Y771 VanDerWaalsContact OD1-CE2 3.31Å; N769-Y771 WeakPolarHBondContact OD1-CE2 3.47Å
772	T	85.6	Confident	86.6	Confident	29 Å²	29	30.6 Å²	30.6	18%	0.178	14%	0.136	C	C	.	.			trans	-134.3	175.2	175.9	67.2	0	0	0	0	110.1	V714 R770 E774 S775 D776	V714-T772 WeakPolarHBondContact CG1-O 3.26Å; R770-T772 HydrophobicContact CG-CG2 4.21Å; T772-E774 WeakPolarHBondContact CB-OE2 3.48Å; T772-E774 PolarHBondContact O-N 2.81Å; T772-E774 PolarHBondContact OG1-N 3.25Å; T772-E774 PolarHBondContact OG1-OE2 2.79Å; T772-S775 PolarHBondContact N-OG 3.16Å; T772-S775 VanDerWaalsContact N-OG 3.11Å; T772-S775 WeakPolarHBondContact O-CA 3.49Å; T772-S775 WeakPolarHBondContact O-CB 3.24Å; T772-S775 PolarHBondContact O-N 2.94Å; T772-D776 PolarHBondContact O-N 3.07Å
773	T	90.3	Very high	86.9	Confident	25 Å²	25	30.4 Å²	30.4	15%	0.153	14%	0.135	C	C	.	.	H	α-helix	trans	-55.9	-38.3	172.2	-62.1	0	0	0	0	111.3	S709 S775 D776 V777 F841	S709-T773 WeakPolarHBondContact OG-CG2 3.35Å; T773-S775 PolarHBondContact O-N 2.74Å; T773-D776 WeakPolarHBondContact O-CB 3.38Å; T773-D776 PolarHBondContact O-N 3.13Å; T773-V777 WeakPolarHBondContact O-CG2 3.38Å; T773-V777 PolarHBondContact O-N 3.28Å; T773-F841 HydrophobicContact CG2-CD2 3.79Å; T773-F841 HydrophobicContact CG2-CE2 3.99Å
774	E	94.4	Very high	87.7	Confident	75 Å²	75	29.6 Å²	29.6	35%	0.35	13%	0.129	S	C	.	.	H	α-helix	trans	-64.3	-26.8	176.4	-57.8	75	-163.6	0	0	111.8	T772 V777 W778 P835 R838	T772-E774 WeakPolarHBondContact CB-OE2 3.48Å; T772-E774 PolarHBondContact O-N 2.81Å; T772-E774 PolarHBondContact OG1-N 3.25Å; T772-E774 PolarHBondContact OG1-OE2 2.79Å; E774-V777 PolarHBondContact O-N 2.81Å; E774-W778 PolarHBondContact O-N 2.91Å; E774-P835 HydrophobicContact CB-CB 3.75Å; E774-P835 HydrophobicContact CG-CB 4.28Å; E774-P835 WeakPolarHBondContact CG-O 3.02Å; E774-R838 VanDerWaalsContact O-CD 3.28Å; E774-R838 WeakPolarHBondContact O-CD 3.28Å; E774-R838 PolarHBondContact O-NH1 3.32Å
775	S	93	Very high	88.5	Confident	3 Å²	3	30 Å²	30	2%	0.021	13%	0.13	C	C	.	.	H	α-helix	trans	-69.6	-39.6	171.2	-52.7	0	0	0	0	111.9	E764 R770 T772 T773 V777 W778 A779	E764-S775 PolarHBondContact OE1-OG 2.97Å; R770-S775 PolarHBondContact O-OG 3.46Å; T772-S775 PolarHBondContact N-OG 3.16Å; T772-S775 VanDerWaalsContact N-OG 3.11Å; T772-S775 WeakPolarHBondContact O-CA 3.49Å; T772-S775 WeakPolarHBondContact O-CB 3.24Å; T772-S775 PolarHBondContact O-N 2.94Å; T773-S775 PolarHBondContact O-N 2.74Å; S775-V777 VanDerWaalsContact C-N 3.3Å; S775-V777 PolarHBondContact O-N 2.78Å; S775-W778 WeakPolarHBondContact O-CB 3.32Å; S775-W778 PolarHBondContact O-N 3.21Å; S775-A779 PolarHBondContact O-N 3.42Å
776	D	95.9	Very high	89.2	Confident	3 Å²	3	29.9 Å²	29.9	2%	0.016	13%	0.129	C	C	.	.	H	α-helix	trans	-67.8	-30.4	172.3	-69.2	-28.4	0	0	0	112	M705 V714 H715 R716 T772 T773 W778 A779 Y780 F841	M705-D776 HydrophobicContact CE-CB 3.63Å; V714-D776 VanDerWaalsContact CA-OD2 3.3Å; V714-D776 WeakPolarHBondContact CA-OD2 3.46Å; V714-D776 WeakPolarHBondContact CG1-OD2 3.49Å; H715-D776 PolarHBondContact N-OD1 3.22Å; H715-D776 PolarHBondContact N-OD2 2.83Å; R716-D776 PolarHBondContact N-OD1 2.77Å; T772-D776 PolarHBondContact O-N 3.07Å; T773-D776 WeakPolarHBondContact O-CB 3.38Å; T773-D776 PolarHBondContact O-N 3.13Å; D776-W778 VanDerWaalsContact C-N 3.29Å; D776-W778 PolarHBondContact O-N 3.48Å; D776-A779 WeakPolarHBondContact O-CB 3.47Å; D776-A779 PolarHBondContact O-N 3.1Å; D776-Y780 WeakPolarHBondContact O-CB 3.44Å; D776-Y780 PolarHBondContact O-N 3.41Å; D776-F841 HydrophobicContact CB-CE2 3.9Å; D776-F841 HydrophobicContact CB-CZ 3.98Å
777	V	98.3	Very high	90.3	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.012	13%	0.129	C	C	.	.	H	α-helix	trans	-61.4	-39.2	173.4	170.6	0	0	0	0	111.2	T773 E774 S775 Y780 G781 C830 R838 P839 F841 I844	T773-V777 WeakPolarHBondContact O-CG2 3.38Å; T773-V777 PolarHBondContact O-N 3.28Å; E774-V777 PolarHBondContact O-N 2.81Å; S775-V777 VanDerWaalsContact C-N 3.3Å; S775-V777 PolarHBondContact O-N 2.78Å; V777-Y780 WeakPolarHBondContact O-CB 3.36Å; V777-Y780 PolarHBondContact O-N 2.98Å; V777-G781 PolarHBondContact O-N 3.37Å; V777-C830 HydrophobicContact CG1-CB 4.03Å; V777-C830 WeakPolarHBondContact O-CB 3.48Å; V777-R838 HydrophobicContact CB-CB 4.46Å; V777-R838 HydrophobicContact CG1-CB 3.86Å; V777-P839 HydrophobicContact CG1-CG 4.48Å; V777-P839 WeakPolarHBondContact CG1-O 3.44Å; V777-P839 WeakPolarHBondContact CG2-O 3.3Å; V777-F841 HydrophobicContact CB-CZ 4.42Å; V777-F841 HydrophobicContact CG2-CD2 3.86Å; V777-F841 HydrophobicContact CG2-CE1 4.3Å; V777-F841 HydrophobicContact CG2-CE2 3.59Å; V777-F841 HydrophobicContact CG2-CG 4.32Å; V777-F841 HydrophobicContact CG2-CZ 3.84Å; V777-I844 HydrophobicContact CG1-CD1 3.85Å; V777-I844 HydrophobicContact CG2-CD1 4.34Å
778	W	98.3	Very high	91.5	Very high	6 Å²	6	26.9 Å²	26.9	2%	0.023	12%	0.116	C	C	.	.	H	α-helix	trans	-61.1	-48.6	173	177.7	-72.8	0	0	0	111.5	M761 P762 P763 E774 S775 D776 Y780 G781 V782 V807 W831	M761-W778 PolarHBondContact O-NE1 3.02Å; P762-W778 HydrophobicContact CB-CB 3.66Å; P762-W778 HydrophobicContact CB-CD2 3.56Å; P762-W778 HydrophobicContact CB-CE3 3.87Å; P762-W778 HydrophobicContact CB-CG 3.46Å; P762-W778 VanDerWaalsContact CB-CG 3.46Å; P762-W778 HydrophobicContact CG-CB 4.24Å; P762-W778 HydrophobicContact CG-CG 4.34Å; P763-W778 HydrophobicContact CG-CH2 4.39Å; P763-W778 HydrophobicContact CG-CZ3 4.19Å; E774-W778 PolarHBondContact O-N 2.91Å; S775-W778 WeakPolarHBondContact O-CB 3.32Å; S775-W778 PolarHBondContact O-N 3.21Å; D776-W778 VanDerWaalsContact C-N 3.29Å; D776-W778 PolarHBondContact O-N 3.48Å; W778-Y780 PolarHBondContact O-N 3.4Å; W778-G781 WeakPolarHBondContact O-CA 3.33Å; W778-G781 PolarHBondContact O-N 3.44Å; W778-V782 PolarHBondContact O-N 3.4Å; W778-V807 HydrophobicContact CH2-CG1 3.79Å; W778-V807 HydrophobicContact CZ2-CG1 3.5Å; W778-V807 HydrophobicContact CZ2-CG2 4.33Å; W778-W831 AromaticContact CD2-CD1 3.66Å; W778-W831 HydrophobicContact CD2-CG 4.45Å; W778-W831 AromaticContact CE2-CD1 3.71Å; W778-W831 HydrophobicContact CE3-CB 4.16Å; W778-W831 AromaticContact CG-CD1 3.91Å; W778-W831 HydrophobicContact CH2-CB 4.08Å; W778-W831 HydrophobicContact CZ2-CB 4.47Å; W778-W831 HydrophobicContact CZ2-CG 4.49Å; W778-W831 HydrophobicContact CZ3-CB 3.93Å; W778-W831 VanDerWaalsContact CZ3-O 3.25Å; W778-W831 WeakPolarHBondContact CZ3-O 3.43Å; W778-W831 AromaticContact NE1-CD1 4Å; W778-W831 PolarHBondContact O-NE1 2.81Å
779	A	97.8	Very high	92.6	Very high	6 Å²	6	18.8 Å²	18.8	5%	0.05	9%	0.086	C	C	.	.	H	α-helix	trans	-59.7	-38.2	177.6	0	0	0	0	0	111.3	L718 W760 S775 D776 G781 V782 V783	L718-A779 HydrophobicContact CB-CB 4.04Å; W760-A779 HydrophobicContact CB-CB 4.33Å; W760-A779 WeakPolarHBondContact O-CA 3.25Å; W760-A779 WeakPolarHBondContact O-CB 3.34Å; S775-A779 PolarHBondContact O-N 3.42Å; D776-A779 WeakPolarHBondContact O-CB 3.47Å; D776-A779 PolarHBondContact O-N 3.1Å; A779-G781 VanDerWaalsContact C-N 3.34Å; A779-G781 PolarHBondContact O-N 3.03Å; A779-V782 CarbonylContact O-C 3.46Å; A779-V782 WeakPolarHBondContact O-CA 3.38Å; A779-V782 WeakPolarHBondContact O-CB 3.49Å; A779-V782 PolarHBondContact O-N 3.14Å; A779-V783 PolarHBondContact O-N 2.9Å
780	Y	98.6	Very high	93.8	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-62.7	-37.8	174	-176.9	-96.1	0	0	0	112.8	A698 V701 A702 L718 D776 V777 W778 V782 V783 L784 F841 I844 L848	A698-Y780 PolarHBondContact O-OH 3.1Å; V701-Y780 HydrophobicContact CB-CE2 3.94Å; V701-Y780 HydrophobicContact CG1-CD2 3.95Å; V701-Y780 HydrophobicContact CG1-CE2 3.73Å; A702-Y780 HydrophobicContact CB-CE2 4.08Å; A702-Y780 WeakPolarHBondContact CB-OH 3.36Å; L718-Y780 HydrophobicContact CD2-CD2 4.25Å; D776-Y780 WeakPolarHBondContact O-CB 3.44Å; D776-Y780 PolarHBondContact O-N 3.41Å; V777-Y780 WeakPolarHBondContact O-CB 3.36Å; V777-Y780 PolarHBondContact O-N 2.98Å; W778-Y780 PolarHBondContact O-N 3.4Å; Y780-V782 PolarHBondContact O-N 2.83Å; Y780-V783 WeakPolarHBondContact O-CB 3.38Å; Y780-V783 PolarHBondContact O-N 3.48Å; Y780-V783 VanDerWaalsContact O-N 3.12Å; Y780-L784 HydrophobicContact CD1-CD1 4.21Å; Y780-L784 HydrophobicContact CD1-CG 4.15Å; Y780-L784 HydrophobicContact CE1-CD1 3.73Å; Y780-L784 HydrophobicContact CE1-CD2 3.82Å; Y780-L784 HydrophobicContact CE1-CG 3.64Å; Y780-L784 WeakPolarHBondContact O-CG 3.49Å; Y780-L784 PolarHBondContact O-N 2.9Å; Y780-L784 WeakPolarHBondContact OH-CD2 3.23Å; Y780-F841 HydrophobicContact CD1-CE1 4.25Å; Y780-F841 AromaticContact CD2-CE1 3.94Å; Y780-F841 HydrophobicContact CD2-CE1 3.94Å; Y780-F841 AromaticContact CG-CE1 3.65Å; Y780-F841 HydrophobicContact CG-CE1 3.65Å; Y780-F841 HydrophobicContact CG-CZ 4.49Å; Y780-I844 HydrophobicContact CD1-CD1 4.12Å; Y780-I844 HydrophobicContact CD1-CG2 3.97Å; Y780-I844 HydrophobicContact CE1-CG2 3.32Å; Y780-L848 HydrophobicContact CE1-CD1 4.37Å; Y780-L848 WeakPolarHBondContact OH-CD1 3.49Å
781	G	98.3	Very high	94.5	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-57.4	-38.2	170.4	0	0	0	0	0	112.4	V777 W778 A779 L784 W785 W831	V777-G781 PolarHBondContact O-N 3.37Å; W778-G781 WeakPolarHBondContact O-CA 3.33Å; W778-G781 PolarHBondContact O-N 3.44Å; A779-G781 VanDerWaalsContact C-N 3.34Å; A779-G781 PolarHBondContact O-N 3.03Å; G781-L784 PolarHBondContact O-N 3.05Å; G781-W785 PolarHBondContact O-N 3.03Å; G781-W831 VanDerWaalsContact C-CZ2 3.44Å; G781-W831 WeakPolarHBondContact O-CZ2 3.43Å
782	V	98.3	Very high	94.7	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-69.8	-39.5	173.8	-173.9	0	0	0	0	111.5	W760 W778 A779 Y780 L784 W785 E786 P794 L813 W831	W760-V782 HydrophobicContact CD2-CG1 4.37Å; W760-V782 HydrophobicContact CG-CB 4.37Å; W760-V782 HydrophobicContact CG-CG1 4.06Å; W778-V782 PolarHBondContact O-N 3.4Å; A779-V782 CarbonylContact O-C 3.46Å; A779-V782 WeakPolarHBondContact O-CA 3.38Å; A779-V782 WeakPolarHBondContact O-CB 3.49Å; A779-V782 PolarHBondContact O-N 3.14Å; Y780-V782 PolarHBondContact O-N 2.83Å; V782-L784 VanDerWaalsContact C-N 3.32Å; V782-L784 PolarHBondContact O-N 3.32Å; V782-W785 CarbonylContact O-C 3.41Å; V782-W785 WeakPolarHBondContact O-CA 3.47Å; V782-W785 WeakPolarHBondContact O-CB 3.38Å; V782-W785 PolarHBondContact O-N 2.62Å; V782-E786 WeakPolarHBondContact O-CG 3.34Å; V782-E786 PolarHBondContact O-N 3.5Å; V782-P794 HydrophobicContact CG1-CB 3.76Å; V782-P794 HydrophobicContact CG1-CG 3.4Å; V782-L813 HydrophobicContact CG1-CD1 4.31Å; V782-L813 HydrophobicContact CG2-CD1 4.47Å; V782-W831 HydrophobicContact CG2-CZ2 4.27Å
783	V	98.3	Very high	94.8	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-59.1	-42.1	173.2	169.1	0	0	0	0	111.9	V701 L718 T720 A779 Y780 W785 E786 I787	V701-V783 HydrophobicContact CG1-CG1 4.39Å; L718-V783 HydrophobicContact CG-CG2 4.15Å; T720-V783 HydrophobicContact CG2-CG1 4.01Å; A779-V783 PolarHBondContact O-N 2.9Å; Y780-V783 WeakPolarHBondContact O-CB 3.38Å; Y780-V783 PolarHBondContact O-N 3.48Å; Y780-V783 VanDerWaalsContact O-N 3.12Å; V783-W785 VanDerWaalsContact C-N 3.3Å; V783-W785 PolarHBondContact O-N 2.97Å; V783-E786 PolarHBondContact O-N 3.41Å; V783-I787 HydrophobicContact CG1-CD1 3.84Å; V783-I787 HydrophobicContact CG1-CG1 4.41Å; V783-I787 VanDerWaalsContact O-CG1 3.29Å; V783-I787 WeakPolarHBondContact O-CG1 3.4Å; V783-I787 PolarHBondContact O-N 2.86Å
784	L	98.1	Very high	94.7	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-59.1	-43.7	173.1	-69.1	-179.7	0	0	0	111.3	A698 Y780 G781 V782 E786 I787 F788 L823 L826 M827	A698-L784 HydrophobicContact CB-CD2 3.46Å; A698-L784 VanDerWaalsContact CB-CD2 3.46Å; Y780-L784 HydrophobicContact CD1-CD1 4.21Å; Y780-L784 HydrophobicContact CD1-CG 4.15Å; Y780-L784 HydrophobicContact CE1-CD1 3.73Å; Y780-L784 HydrophobicContact CE1-CD2 3.82Å; Y780-L784 HydrophobicContact CE1-CG 3.64Å; Y780-L784 WeakPolarHBondContact O-CG 3.49Å; Y780-L784 PolarHBondContact O-N 2.9Å; Y780-L784 WeakPolarHBondContact OH-CD2 3.23Å; G781-L784 PolarHBondContact O-N 3.05Å; V782-L784 VanDerWaalsContact C-N 3.32Å; V782-L784 PolarHBondContact O-N 3.32Å; L784-E786 VanDerWaalsContact C-N 3.34Å; L784-E786 PolarHBondContact O-N 3Å; L784-I787 PolarHBondContact O-N 3.47Å; L784-F788 WeakPolarHBondContact O-CD2 3.33Å; L784-F788 PolarHBondContact O-N 3.31Å; L784-F788 VanDerWaalsContact O-N 3.16Å; L784-L823 HydrophobicContact CD1-CD1 4.33Å; L784-L823 HydrophobicContact CD2-CD1 4.45Å; L784-L826 HydrophobicContact CD1-CD2 4.2Å; L784-L826 HydrophobicContact CD1-CG 4.39Å; L784-M827 HydrophobicContact CB-CE 3.7Å; L784-M827 HydrophobicContact CB-CG 3.87Å; L784-M827 HydrophobicContact CB-SD 4.17Å; L784-M827 HydrophobicContact CD1-CG 3.96Å
785	W	98.1	Very high	94.2	Very high	21 Å²	21	12.2 Å²	12.2	8%	0.08	6%	0.06	C	C	.	.	H	α-helix	trans	-61.6	-41.7	176.1	-174.4	94.9	0	0	0	111.9	G781 V782 V783 F788 S789 L792 P794 L813 S814 P816 M827 W831	G781-W785 PolarHBondContact O-N 3.03Å; V782-W785 CarbonylContact O-C 3.41Å; V782-W785 WeakPolarHBondContact O-CA 3.47Å; V782-W785 WeakPolarHBondContact O-CB 3.38Å; V782-W785 PolarHBondContact O-N 2.62Å; V783-W785 VanDerWaalsContact C-N 3.3Å; V783-W785 PolarHBondContact O-N 2.97Å; W785-F788 PolarHBondContact O-N 2.89Å; W785-S789 WeakPolarHBondContact O-CB 3.38Å; W785-S789 PolarHBondContact O-N 2.98Å; W785-S789 PolarHBondContact O-OG 2.87Å; W785-L792 HydrophobicContact CH2-CB 4.14Å; W785-L792 HydrophobicContact CZ3-CB 4.23Å; W785-L792 WeakPolarHBondContact CZ3-O 3.48Å; W785-P794 HydrophobicContact CE3-CB 4.2Å; W785-P794 HydrophobicContact CE3-CG 4.09Å; W785-P794 VanDerWaalsContact CZ3-CA 3.48Å; W785-P794 HydrophobicContact CZ3-CB 4.15Å; W785-P794 HydrophobicContact CZ3-CG 4.11Å; W785-L813 HydrophobicContact CB-CD1 4.12Å; W785-L813 HydrophobicContact CD2-CD1 3.91Å; W785-L813 HydrophobicContact CD2-CD2 4.47Å; W785-L813 HydrophobicContact CE3-CD1 4.38Å; W785-L813 HydrophobicContact CG-CB 4.26Å; W785-L813 HydrophobicContact CG-CD1 3.75Å; W785-L813 HydrophobicContact CG-CG 4.5Å; W785-L813 HydrophobicContact CZ2-CD2 4.34Å; W785-S814 PolarHBondContact NE1-O 3.13Å; W785-P816 HydrophobicContact CG-CG 4.08Å; W785-M827 HydrophobicContact CB-SD 4.05Å; W785-W831 HydrophobicContact CB-CH2 4.19Å; W785-W831 HydrophobicContact CB-CZ2 4.26Å
786	E	97.3	Very high	93	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-63	-44.8	176.5	-69.5	-179	89.2	0	0	112.5	N656 T720 W760 V782 V783 L784 F788 S789 Y790 G791 P794	N656-E786 PolarHBondContact ND2-OE1 2.81Å; T720-E786 HydrophobicContact CG2-CB 3.65Å; T720-E786 HydrophobicContact CG2-CG 4.38Å; T720-E786 PolarHBondContact N-OE2 3.31Å; T720-E786 VanDerWaalsContact OG1-CD 3.3Å; T720-E786 PolarHBondContact OG1-OE1 2.83Å; W760-E786 HydrophobicContact CZ2-CG 4.47Å; W760-E786 WeakPolarHBondContact CZ2-OE1 3.46Å; W760-E786 PolarHBondContact NE1-OE2 2.83Å; V782-E786 WeakPolarHBondContact O-CG 3.34Å; V782-E786 PolarHBondContact O-N 3.5Å; V783-E786 PolarHBondContact O-N 3.41Å; L784-E786 VanDerWaalsContact C-N 3.34Å; L784-E786 PolarHBondContact O-N 3Å; E786-F788 VanDerWaalsContact C-N 3.3Å; E786-F788 PolarHBondContact O-N 3.37Å; E786-S789 CarbonylContact O-C 3.52Å; E786-S789 PolarHBondContact O-N 2.86Å; E786-S789 VanDerWaalsContact O-N 3.15Å; E786-Y790 PolarHBondContact O-N 3.3Å; E786-Y790 VanDerWaalsContact O-N 3.08Å; E786-G791 PolarHBondContact O-N 2.82Å; E786-P794 HydrophobicContact CG-CG 3.95Å
787	I	96.4	Very high	91.3	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-57.9	-45	178.1	-68.5	161.6	0	0	0	110.7	L659 Q694 I697 A698 T720 V783 L784 S789 Y790	L659-I787 HydrophobicContact CD1-CG1 4.18Å; L659-I787 HydrophobicContact CD2-CG2 4.44Å; Q694-I787 HydrophobicContact CB-CG2 3.82Å; Q694-I787 HydrophobicContact CG-CG2 4.13Å; Q694-I787 PolarHBondContact NE2-O 3.06Å; I697-I787 HydrophobicContact CG2-CD1 3.74Å; I697-I787 HydrophobicContact CG2-CG1 3.96Å; I697-I787 HydrophobicContact CG2-CG2 4.41Å; A698-I787 HydrophobicContact CB-CD1 4.11Å; T720-I787 HydrophobicContact CG2-CG1 4.32Å; V783-I787 HydrophobicContact CG1-CD1 3.84Å; V783-I787 HydrophobicContact CG1-CG1 4.41Å; V783-I787 VanDerWaalsContact O-CG1 3.29Å; V783-I787 WeakPolarHBondContact O-CG1 3.4Å; V783-I787 PolarHBondContact O-N 2.86Å; L784-I787 PolarHBondContact O-N 3.47Å; I787-S789 VanDerWaalsContact C-N 3.29Å; I787-S789 PolarHBondContact O-N 2.83Å; I787-Y790 PolarHBondContact O-N 2.83Å
788	F	94.6	Very high	89.5	Confident	5 Å²	5	26.7 Å²	26.7	2%	0.022	14%	0.14	C	C	.	.	H	α-helix	trans	-84.1	-5	-178.5	-77.3	-96.5	0	0	0	113.7	Q694 L695 L784 W785 E786 P816 C819 P820 L823 M827	Q694-F788 HydrophobicContact CB-CE1 4.03Å; Q694-F788 HydrophobicContact CB-CE2 3.88Å; Q694-F788 HydrophobicContact CB-CZ 3.6Å; L695-F788 HydrophobicContact CD2-CZ 4.1Å; L695-F788 HydrophobicContact CG-CZ 4.18Å; L784-F788 WeakPolarHBondContact O-CD2 3.33Å; L784-F788 PolarHBondContact O-N 3.31Å; L784-F788 VanDerWaalsContact O-N 3.16Å; W785-F788 PolarHBondContact O-N 2.89Å; E786-F788 VanDerWaalsContact C-N 3.3Å; E786-F788 PolarHBondContact O-N 3.37Å; F788-P816 HydrophobicContact CB-CB 4.11Å; F788-P816 HydrophobicContact CB-CG 4.07Å; F788-P816 WeakPolarHBondContact O-CB 3.38Å; F788-C819 HydrophobicContact CB-CB 4.37Å; F788-C819 HydrophobicContact CD1-CB 4.21Å; F788-P820 HydrophobicContact CE1-CG 4.5Å; F788-L823 HydrophobicContact CD1-CD2 4.06Å; F788-L823 HydrophobicContact CD2-CD2 3.44Å; F788-L823 VanDerWaalsContact CD2-CD2 3.44Å; F788-L823 HydrophobicContact CE1-CD2 3.71Å; F788-L823 HydrophobicContact CE2-CD2 3.06Å; F788-L823 HydrophobicContact CG-CD2 3.94Å; F788-L823 HydrophobicContact CZ-CD2 3.2Å; F788-M827 HydrophobicContact CD2-CE 4.49Å
789	S	91.3	Very high	88.1	Confident	13 Å²	13	26.9 Å²	26.9	9%	0.091	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	18.2	172.3	-49.1	0	0	0	0	111.9	W785 E786 I787 G791 L792 P816	W785-S789 WeakPolarHBondContact O-CB 3.38Å; W785-S789 PolarHBondContact O-N 2.98Å; W785-S789 PolarHBondContact O-OG 2.87Å; E786-S789 CarbonylContact O-C 3.52Å; E786-S789 PolarHBondContact O-N 2.86Å; E786-S789 VanDerWaalsContact O-N 3.15Å; I787-S789 VanDerWaalsContact C-N 3.29Å; I787-S789 PolarHBondContact O-N 2.83Å; S789-G791 VanDerWaalsContact C-N 3.27Å; S789-G791 PolarHBondContact O-N 3.15Å; S789-L792 WeakPolarHBondContact O-CB 3.49Å; S789-L792 WeakPolarHBondContact O-CG 3.42Å; S789-L792 PolarHBondContact O-N 2.79Å; S789-L792 VanDerWaalsContact O-N 3.11Å; S789-P816 WeakPolarHBondContact OG-CB 3.06Å; S789-P816 WeakPolarHBondContact OG-CG 3.38Å
790	Y	91.5	Very high	86.6	Confident	48 Å²	48	27.6 Å²	27.6	19%	0.188	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	42.5	179.5	-64.2	-87.3	0	0	0	114.2	R660 M662 P664 L689 E786 I787 L792	R660-Y790 WeakPolarHBondContact CA-O 3.39Å; R660-Y790 VanDerWaalsContact CG-O 3.31Å; R660-Y790 WeakPolarHBondContact CG-O 3.24Å; R660-Y790 PolarHBondContact N-O 3.09Å; M662-Y790 WeakPolarHBondContact O-CE1 3.3Å; P664-Y790 HydrophobicContact CG-CE2 3.99Å; L689-Y790 HydrophobicContact CB-CE1 4.15Å; L689-Y790 PolarHBondContact O-OH 2.87Å; E786-Y790 PolarHBondContact O-N 3.3Å; E786-Y790 VanDerWaalsContact O-N 3.08Å; I787-Y790 PolarHBondContact O-N 2.83Å; Y790-L792 PolarHBondContact O-N 2.95Å
791	G	87.9	Confident	85.3	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	16.5	176.3	0	0	0	0	0	115	N656 R660 E786 S789	N656-G791 PolarHBondContact ND2-O 3.13Å; R660-G791 PolarHBondContact NE-O 2.95Å; R660-G791 PolarHBondContact NH2-O 3.29Å; E786-G791 PolarHBondContact O-N 2.82Å; S789-G791 VanDerWaalsContact C-N 3.27Å; S789-G791 PolarHBondContact O-N 3.15Å
792	L	85.8	Confident	83.4	Confident	98 Å²	98	34.6 Å²	34.6	51%	0.513	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-57.1	151.5	168.2	-76.7	175.4	0	0	0	111.2	W785 S789 Y790 P794	W785-L792 HydrophobicContact CH2-CB 4.14Å; W785-L792 HydrophobicContact CZ3-CB 4.23Å; W785-L792 WeakPolarHBondContact CZ3-O 3.48Å; S789-L792 WeakPolarHBondContact O-CB 3.49Å; S789-L792 WeakPolarHBondContact O-CG 3.42Å; S789-L792 PolarHBondContact O-N 2.79Å; S789-L792 VanDerWaalsContact O-N 3.11Å; Y790-L792 PolarHBondContact O-N 2.95Å; L792-P794 WeakPolarHBondContact O-CD 3.3Å
793	Q	87.5	Confident	82.1	Confident	41 Å²	41	34.6 Å²	34.6	19%	0.192	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-71.2	128.4	177	-172.6	177.4	64.8	0	0	110.2	D746 Y795 Y796	D746-Q793 PolarHBondContact OD1-NE2 3.27Å; Q793-Y795 PolarHBondContact O-N 3.36Å; Q793-Y796 WeakPolarHBondContact O-CB 3.47Å; Q793-Y796 PolarHBondContact O-N 3.32Å
794	P	89.5	Confident	80.8	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	139.2	174.9	-22.2	32.3	0	0	0	111.7	R759 W760 V782 W785 E786 L792 Y796 L813	R759-P794 HydrophobicContact CB-CB 4.36Å; R759-P794 WeakPolarHBondContact CD-O 3.45Å; R759-P794 PolarHBondContact NH1-O 3.19Å; W760-P794 HydrophobicContact CH2-CG 4.07Å; W760-P794 HydrophobicContact CZ2-CG 3.62Å; V782-P794 HydrophobicContact CG1-CB 3.76Å; V782-P794 HydrophobicContact CG1-CG 3.4Å; W785-P794 HydrophobicContact CE3-CB 4.2Å; W785-P794 HydrophobicContact CE3-CG 4.09Å; W785-P794 VanDerWaalsContact CZ3-CA 3.48Å; W785-P794 HydrophobicContact CZ3-CB 4.15Å; W785-P794 HydrophobicContact CZ3-CG 4.11Å; E786-P794 HydrophobicContact CG-CG 3.95Å; L792-P794 WeakPolarHBondContact O-CD 3.3Å; P794-Y796 PolarHBondContact O-N 3.27Å; P794-L813 HydrophobicContact CB-CD1 4.05Å; P794-L813 HydrophobicContact CB-CD2 4.27Å
795	Y	82.7	Confident	78.9	Confident	10 Å²	10	38.8 Å²	38.8	4%	0.039	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	38.9	-175.1	-46.5	-85.4	0	0	0	111.9	R759 Q793 G797 M798 V803 Y806 V807 L813	R759-Y795 HydrophobicContact CB-CD2 4.21Å; R759-Y795 HydrophobicContact CG-CD2 4.41Å; R759-Y795 PolarHBondContact NH1-O 3.45Å; Q793-Y795 PolarHBondContact O-N 3.36Å; Y795-G797 PolarHBondContact O-N 2.96Å; Y795-M798 HydrophobicContact CD1-SD 4.25Å; Y795-M798 WeakPolarHBondContact O-CB 3.45Å; Y795-M798 PolarHBondContact O-N 3.32Å; Y795-V803 VanDerWaalsContact CB-CG2 3.49Å; Y795-V803 HydrophobicContact CD2-CG1 3.68Å; Y795-V803 HydrophobicContact CD2-CG2 3.96Å; Y795-V803 HydrophobicContact CE2-CG1 3.85Å; Y795-V803 HydrophobicContact CG-CG1 4.11Å; Y795-V803 HydrophobicContact CG-CG2 3.76Å; Y795-Y806 AromaticContact CD1-CD1 3.83Å; Y795-Y806 HydrophobicContact CD1-CD1 3.83Å; Y795-Y806 AromaticContact CD1-CE1 3.99Å; Y795-Y806 HydrophobicContact CD1-CE1 3.99Å; Y795-Y806 AromaticContact CE1-CD1 3.57Å; Y795-Y806 HydrophobicContact CE1-CD1 3.57Å; Y795-Y806 AromaticContact CE1-CE1 3.71Å; Y795-Y806 HydrophobicContact CE1-CE1 3.71Å; Y795-V807 HydrophobicContact CE1-CG2 4.45Å; Y795-L813 HydrophobicContact CD1-CD2 3.47Å; Y795-L813 VanDerWaalsContact CD1-CD2 3.47Å; Y795-L813 HydrophobicContact CD1-CG 4.1Å; Y795-L813 HydrophobicContact CD2-CD2 3.88Å; Y795-L813 HydrophobicContact CD2-CG 4.43Å; Y795-L813 HydrophobicContact CE1-CD2 3.57Å; Y795-L813 HydrophobicContact CE1-CG 3.63Å; Y795-L813 HydrophobicContact CE2-CD1 4.14Å; Y795-L813 HydrophobicContact CE2-CD2 3.97Å; Y795-L813 HydrophobicContact CE2-CG 4.01Å; Y795-L813 HydrophobicContact CG-CD2 3.63Å; Y795-L813 HydrophobicContact CG-CG 4.47Å
796	Y	67.6	Low	77.5	Confident	184 Å²	184	41.3 Å²	41.3	72%	0.722	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50	134.9	175.9	179.6	-97.9	0	0	0	110.8	Q793 P794 M798	Q793-Y796 WeakPolarHBondContact O-CB 3.47Å; Q793-Y796 PolarHBondContact O-N 3.32Å; P794-Y796 PolarHBondContact O-N 3.27Å; Y796-M798 VanDerWaalsContact C-N 3.34Å
797	G	60.7	Low	76.5	Confident	70 Å²	70	41.5 Å²	41.5	72%	0.722	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.9	-10.6	-174.8	0	0	0	0	0	115.3	Y795	Y795-G797 PolarHBondContact O-N 2.96Å
798	M	61.7	Low	75.4	Confident	58 Å²	58	44.2 Å²	44.2	29%	0.286	22%	0.216	S	C	.	.			trans	-100.8	144.4	173.4	-58.5	-177.2	-173.7	0	0	111.6	R759 Y795 Y796 E802 V803 Y806	R759-M798 PolarHBondContact NH1-O 3.35Å; R759-M798 PolarHBondContact NH2-O 3.48Å; Y795-M798 HydrophobicContact CD1-SD 4.25Å; Y795-M798 WeakPolarHBondContact O-CB 3.45Å; Y795-M798 PolarHBondContact O-N 3.32Å; Y796-M798 VanDerWaalsContact C-N 3.34Å; M798-E802 WeakPolarHBondContact CA-OE2 3.5Å; M798-E802 HydrophobicContact CB-CB 4.07Å; M798-V803 HydrophobicContact CB-CG2 3.91Å; M798-Y806 HydrophobicContact CE-CD2 3.84Å; M798-Y806 HydrophobicContact CE-CE2 3.75Å; M798-Y806 HydrophobicContact CE-CG 4.33Å; M798-Y806 HydrophobicContact SD-CD2 4.09Å; M798-Y806 HydrophobicContact SD-CG 4.08Å
799	A	67	Low	74.1	Confident	9 Å²	9	47.6 Å²	47.6	7%	0.074	24%	0.235	C	C	.	.			trans	-68.7	161.8	166.3	0	0	0	0	0	112.4	F292 E801 E802 V803	F292-A799 HydrophobicContact CD1-CB 3.36Å; F292-A799 HydrophobicContact CE1-CB 3.11Å; F292-A799 HydrophobicContact CG-CB 4.27Å; F292-A799 HydrophobicContact CZ-CB 3.83Å; A799-E801 VanDerWaalsContact C-N 3.28Å; A799-E801 PolarHBondContact O-N 3.34Å; A799-E802 HydrophobicContact CB-CB 4.24Å; A799-E802 HydrophobicContact CB-CG 3.97Å; A799-E802 WeakPolarHBondContact CB-OE2 3.43Å; A799-E802 PolarHBondContact N-OE2 2.89Å; A799-E802 WeakPolarHBondContact O-CB 3.31Å; A799-E802 PolarHBondContact O-N 2.99Å; A799-E802 VanDerWaalsContact O-N 3.15Å; A799-V803 WeakPolarHBondContact O-CG2 3.34Å; A799-V803 PolarHBondContact O-N 3.16Å
800	H	67.7	Low	73.3	Confident	21 Å²	21	49.3 Å²	49.3	10%	0.097	25%	0.254	C	S	.	.	H	α-helix	trans	-60.3	-39.8	176	-70.6	109.6	0	0	0	112.2	A745 Y748 I758 E802 V803 I804	A745-H800 PolarHBondContact O-CE1 3.27Å; A745-H800 PolarHBondContact O-NE2 2.79Å; Y748-H800 HydrophobicContact CD2-CB 3.83Å; Y748-H800 HydrophobicContact CG-CB 4.33Å; I758-H800 HydrophobicContact CG2-CB 4.29Å; H800-E802 VanDerWaalsContact C-N 3.33Å; H800-E802 PolarHBondContact O-N 3.48Å; H800-V803 PolarHBondContact O-N 3.06Å; H800-I804 WeakPolarHBondContact O-CG1 3.41Å; H800-I804 PolarHBondContact O-N 3.5Å
801	E	70.3	Confident	72.8	Confident	66 Å²	66	50.5 Å²	50.5	31%	0.308	26%	0.263	S	S	.	.	H	α-helix	trans	-63.7	-40.4	176.7	-62.4	81.3	176.2	0	0	111.2	Y748 A799 I804 Y805	Y748-E801 WeakPolarHBondContact CE2-OE1 3.4Å; A799-E801 VanDerWaalsContact C-N 3.28Å; A799-E801 PolarHBondContact O-N 3.34Å; E801-I804 WeakPolarHBondContact O-CB 3.29Å; E801-I804 PolarHBondContact O-N 3.49Å; E801-Y805 WeakPolarHBondContact O-CD2 3.25Å; E801-Y805 PolarHBondContact O-N 2.91Å
802	E	58.8	Low	72.9	Confident	82 Å²	82	52.3 Å²	52.3	38%	0.383	27%	0.273	S	S	.	.	H	α-helix	trans	-64.9	-41.5	175.2	-68.2	177.6	132.6	0	0	111.1	M798 A799 H800 I804 Y805 Y806	M798-E802 WeakPolarHBondContact CA-OE2 3.5Å; M798-E802 HydrophobicContact CB-CB 4.07Å; A799-E802 HydrophobicContact CB-CB 4.24Å; A799-E802 HydrophobicContact CB-CG 3.97Å; A799-E802 WeakPolarHBondContact CB-OE2 3.43Å; A799-E802 PolarHBondContact N-OE2 2.89Å; A799-E802 WeakPolarHBondContact O-CB 3.31Å; A799-E802 PolarHBondContact O-N 2.99Å; A799-E802 VanDerWaalsContact O-N 3.15Å; H800-E802 VanDerWaalsContact C-N 3.33Å; H800-E802 PolarHBondContact O-N 3.48Å; E802-I804 VanDerWaalsContact C-N 3.35Å; E802-I804 PolarHBondContact O-N 3.08Å; E802-Y805 PolarHBondContact O-N 3.15Å; E802-Y806 VanDerWaalsContact O-CB 3.24Å; E802-Y806 WeakPolarHBondContact O-CB 3.4Å; E802-Y806 PolarHBondContact O-N 3.29Å
803	V	70.6	Confident	73.1	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-61.7	-42.2	175.5	175	0	0	0	0	111.5	I758 R759 Y795 M798 A799 H800 Y805 Y806 V807	I758-V803 HydrophobicContact CG2-CB 4.25Å; I758-V803 HydrophobicContact CG2-CG1 4.09Å; R759-V803 HydrophobicContact CG-CG1 4.34Å; R759-V803 HydrophobicContact CG-CG2 4.33Å; Y795-V803 VanDerWaalsContact CB-CG2 3.49Å; Y795-V803 HydrophobicContact CD2-CG1 3.68Å; Y795-V803 HydrophobicContact CD2-CG2 3.96Å; Y795-V803 HydrophobicContact CE2-CG1 3.85Å; Y795-V803 HydrophobicContact CG-CG1 4.11Å; Y795-V803 HydrophobicContact CG-CG2 3.76Å; M798-V803 HydrophobicContact CB-CG2 3.91Å; A799-V803 WeakPolarHBondContact O-CG2 3.34Å; A799-V803 PolarHBondContact O-N 3.16Å; H800-V803 PolarHBondContact O-N 3.06Å; V803-Y805 VanDerWaalsContact C-N 3.29Å; V803-Y805 PolarHBondContact O-N 3.22Å; V803-Y806 PolarHBondContact O-N 2.98Å; V803-V807 HydrophobicContact CG1-CG2 4.18Å; V803-V807 WeakPolarHBondContact O-CB 3.36Å; V803-V807 WeakPolarHBondContact O-CG2 3.31Å; V803-V807 PolarHBondContact O-N 3.1Å
804	I	71.9	Confident	72.9	Confident	17 Å²	17	50 Å²	50	9%	0.087	27%	0.269	C	S	.	.	H	α-helix	trans	-54.4	-48.1	174.3	-71.3	168.1	0	0	0	110.1	L535 I758 I766 F767 H800 E801 E802 R808	L535-I804 HydrophobicContact CD1-CD1 4.02Å; I758-I804 HydrophobicContact CD1-CD1 3.8Å; I758-I804 HydrophobicContact CD1-CG1 3.86Å; I758-I804 HydrophobicContact CG1-CD1 4.27Å; I758-I804 HydrophobicContact CG1-CG1 4.41Å; I758-I804 HydrophobicContact CG2-CD1 4.33Å; I758-I804 HydrophobicContact CG2-CG1 3.7Å; I766-I804 HydrophobicContact CG2-CB 4.5Å; I766-I804 HydrophobicContact CG2-CG1 4.02Å; I766-I804 HydrophobicContact CG2-CG2 3.94Å; F767-I804 HydrophobicContact CE1-CG2 3.59Å; F767-I804 HydrophobicContact CZ-CG2 3.69Å; H800-I804 WeakPolarHBondContact O-CG1 3.41Å; H800-I804 PolarHBondContact O-N 3.5Å; E801-I804 WeakPolarHBondContact O-CB 3.29Å; E801-I804 PolarHBondContact O-N 3.49Å; E802-I804 VanDerWaalsContact C-N 3.35Å; E802-I804 PolarHBondContact O-N 3.08Å; I804-R808 VanDerWaalsContact O-CB 3.26Å; I804-R808 WeakPolarHBondContact O-CB 3.39Å; I804-R808 PolarHBondContact O-N 2.99Å
805	Y	59	Low	72.8	Confident	70 Å²	70	52.6 Å²	52.6	28%	0.275	29%	0.287	S	S	.	.	H	α-helix	trans	-71.3	-41.3	-179.9	-64.2	-56.3	0	0	0	113	L136 E801 E802 V803 V807 R808 D809	L136-Y805 HydrophobicContact CD1-CD2 4.19Å; L136-Y805 HydrophobicContact CD1-CE1 4.3Å; L136-Y805 HydrophobicContact CD1-CE2 3.86Å; L136-Y805 HydrophobicContact CD2-CD1 4.14Å; L136-Y805 HydrophobicContact CD2-CD2 3.76Å; L136-Y805 HydrophobicContact CD2-CE2 4.28Å; L136-Y805 HydrophobicContact CD2-CG 3.69Å; E801-Y805 WeakPolarHBondContact O-CD2 3.25Å; E801-Y805 PolarHBondContact O-N 2.91Å; E802-Y805 PolarHBondContact O-N 3.15Å; V803-Y805 VanDerWaalsContact C-N 3.29Å; V803-Y805 PolarHBondContact O-N 3.22Å; Y805-V807 PolarHBondContact O-N 3.43Å; Y805-R808 VanDerWaalsContact CD1-CZ 3.49Å; Y805-R808 WeakPolarHBondContact O-CB 3.19Å; Y805-R808 PolarHBondContact O-N 3.12Å; Y805-D809 WeakPolarHBondContact O-CB 3.18Å; Y805-D809 VanDerWaalsContact O-CG 3.25Å; Y805-D809 PolarHBondContact O-N 3.49Å
806	Y	66.7	Low	72.9	Confident	74 Å²	74	52.7 Å²	52.7	29%	0.29	29%	0.288	S	S	.	.	H	α-helix	trans	-58	-48.1	178.9	-169.8	-96	0	0	0	111	Y795 M798 E802 V803 D809 N811 I812	Y795-Y806 AromaticContact CD1-CD1 3.83Å; Y795-Y806 HydrophobicContact CD1-CD1 3.83Å; Y795-Y806 AromaticContact CD1-CE1 3.99Å; Y795-Y806 HydrophobicContact CD1-CE1 3.99Å; Y795-Y806 AromaticContact CE1-CD1 3.57Å; Y795-Y806 HydrophobicContact CE1-CD1 3.57Å; Y795-Y806 AromaticContact CE1-CE1 3.71Å; Y795-Y806 HydrophobicContact CE1-CE1 3.71Å; M798-Y806 HydrophobicContact CE-CD2 3.84Å; M798-Y806 HydrophobicContact CE-CE2 3.75Å; M798-Y806 HydrophobicContact CE-CG 4.33Å; M798-Y806 HydrophobicContact SD-CD2 4.09Å; M798-Y806 HydrophobicContact SD-CG 4.08Å; E802-Y806 VanDerWaalsContact O-CB 3.24Å; E802-Y806 WeakPolarHBondContact O-CB 3.4Å; E802-Y806 PolarHBondContact O-N 3.29Å; V803-Y806 PolarHBondContact O-N 2.98Å; Y806-D809 PolarHBondContact O-N 3.31Å; Y806-N811 HydrophobicContact CD1-CB 3.61Å; Y806-N811 HydrophobicContact CD2-CB 3.86Å; Y806-N811 HydrophobicContact CE1-CB 3.34Å; Y806-N811 HydrophobicContact CE2-CB 3.6Å; Y806-N811 HydrophobicContact CG-CB 3.86Å; Y806-N811 WeakPolarHBondContact O-CB 3.41Å; Y806-N811 PolarHBondContact O-N 3.15Å; Y806-N811 VanDerWaalsContact O-N 3.09Å; Y806-N811 PolarHBondContact O-ND2 2.78Å; Y806-I812 WeakPolarHBondContact CE1-O 3.06Å; Y806-I812 PolarHBondContact OH-O 2.87Å; Y806-I812 VanDerWaalsContact OH-O 3.12Å
807	V	76.3	Confident	73.5	Confident	6 Å²	6	51.8 Å²	51.8	4%	0.036	29%	0.291	C	S	.	.	H	α-helix	trans	-68.4	-41	176.1	172.8	0	0	0	0	111.8	P763 W778 Y795 V803 Y805 D809 G810	P763-V807 HydrophobicContact CB-CG1 4.39Å; W778-V807 HydrophobicContact CH2-CG1 3.79Å; W778-V807 HydrophobicContact CZ2-CG1 3.5Å; W778-V807 HydrophobicContact CZ2-CG2 4.33Å; Y795-V807 HydrophobicContact CE1-CG2 4.45Å; V803-V807 HydrophobicContact CG1-CG2 4.18Å; V803-V807 WeakPolarHBondContact O-CB 3.36Å; V803-V807 WeakPolarHBondContact O-CG2 3.31Å; V803-V807 PolarHBondContact O-N 3.1Å; Y805-V807 PolarHBondContact O-N 3.43Å; V807-D809 PolarHBondContact O-N 3.19Å; V807-G810 PolarHBondContact O-N 2.68Å; V807-G810 VanDerWaalsContact O-N 3.08Å
808	R	73.5	Confident	74.3	Confident	56 Å²	56	56.1 Å²	56.1	21%	0.211	30%	0.297	C	S	.	.	H	α-helix	trans	-56.8	-39.7	177.6	-168	-173.5	68.1	-167.5	-11.9	112.6	F767 I804 Y805 G810	F767-R808 HydrophobicContact CE1-CB 4.44Å; F767-R808 HydrophobicContact CE1-CG 4.27Å; F767-R808 HydrophobicContact CE2-CB 3.73Å; F767-R808 HydrophobicContact CE2-CG 3.76Å; F767-R808 HydrophobicContact CZ-CB 3.49Å; F767-R808 VanDerWaalsContact CZ-CB 3.49Å; F767-R808 HydrophobicContact CZ-CG 3.65Å; I804-R808 VanDerWaalsContact O-CB 3.26Å; I804-R808 WeakPolarHBondContact O-CB 3.39Å; I804-R808 PolarHBondContact O-N 2.99Å; Y805-R808 VanDerWaalsContact CD1-CZ 3.49Å; Y805-R808 WeakPolarHBondContact O-CB 3.19Å; Y805-R808 PolarHBondContact O-N 3.12Å; R808-G810 PolarHBondContact O-N 3.29Å
809	D	67.2	Low	75.5	Confident	77 Å²	77	53.9 Å²	53.9	41%	0.412	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	2.3	-174.5	-63	-10.8	0	0	0	111.5	Y805 Y806 V807	Y805-D809 WeakPolarHBondContact O-CB 3.18Å; Y805-D809 VanDerWaalsContact O-CG 3.25Å; Y805-D809 PolarHBondContact O-N 3.49Å; Y806-D809 PolarHBondContact O-N 3.31Å; V807-D809 PolarHBondContact O-N 3.19Å
810	G	75.1	Confident	76.5	Confident	48 Å²	48	55.3 Å²	55.3	50%	0.495	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	9	173	0	0	0	0	0	113.9	V807 R808	V807-G810 PolarHBondContact O-N 2.68Å; V807-G810 VanDerWaalsContact O-N 3.08Å; R808-G810 PolarHBondContact O-N 3.29Å
811	N	81	Confident	77.4	Confident	73 Å²	73	59.2 Å²	59.2	39%	0.39	32%	0.321	S	S	.	.			trans	-79.6	151.1	174.8	-50.6	-62.3	0	0	0	110.2	Y806	Y806-N811 HydrophobicContact CD1-CB 3.61Å; Y806-N811 HydrophobicContact CD2-CB 3.86Å; Y806-N811 HydrophobicContact CE1-CB 3.34Å; Y806-N811 HydrophobicContact CE2-CB 3.6Å; Y806-N811 HydrophobicContact CG-CB 3.86Å; Y806-N811 WeakPolarHBondContact O-CB 3.41Å; Y806-N811 PolarHBondContact O-N 3.15Å; Y806-N811 VanDerWaalsContact O-N 3.09Å; Y806-N811 PolarHBondContact O-ND2 2.78Å
812	I	90.4	Very high	78.3	Confident	38 Å²	38	61.5 Å²	61.5	20%	0.195	33%	0.331	C	S	.	.			trans	-132.9	168.2	-176.2	55.8	169.1	0	0	0	110	Y806 R828 W831	Y806-I812 WeakPolarHBondContact CE1-O 3.06Å; Y806-I812 PolarHBondContact OH-O 2.87Å; Y806-I812 VanDerWaalsContact OH-O 3.12Å; I812-R828 HydrophobicContact CD1-CB 4.49Å; I812-R828 HydrophobicContact CD1-CG 3.74Å; I812-W831 HydrophobicContact CB-CD2 4.46Å; I812-W831 HydrophobicContact CB-CE3 3.82Å; I812-W831 HydrophobicContact CB-CZ3 4.38Å; I812-W831 HydrophobicContact CD1-CE3 4.02Å; I812-W831 HydrophobicContact CG1-CE3 4.45Å; I812-W831 HydrophobicContact CG2-CB 3.78Å; I812-W831 HydrophobicContact CG2-CD2 4.45Å; I812-W831 HydrophobicContact CG2-CE3 4.17Å; I812-W831 HydrophobicContact CG2-CG 4.35Å
813	L	89	Confident	80	Confident	7 Å²	7	57.6 Å²	57.6	4%	0.037	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-61.2	143.8	175.7	-68.6	161	0	0	0	111.1	V782 W785 P794 Y795 Y824 W831	V782-L813 HydrophobicContact CG1-CD1 4.31Å; V782-L813 HydrophobicContact CG2-CD1 4.47Å; W785-L813 HydrophobicContact CB-CD1 4.12Å; W785-L813 HydrophobicContact CD2-CD1 3.91Å; W785-L813 HydrophobicContact CD2-CD2 4.47Å; W785-L813 HydrophobicContact CE3-CD1 4.38Å; W785-L813 HydrophobicContact CG-CB 4.26Å; W785-L813 HydrophobicContact CG-CD1 3.75Å; W785-L813 HydrophobicContact CG-CG 4.5Å; W785-L813 HydrophobicContact CZ2-CD2 4.34Å; P794-L813 HydrophobicContact CB-CD1 4.05Å; P794-L813 HydrophobicContact CB-CD2 4.27Å; Y795-L813 HydrophobicContact CD1-CD2 3.47Å; Y795-L813 VanDerWaalsContact CD1-CD2 3.47Å; Y795-L813 HydrophobicContact CD1-CG 4.1Å; Y795-L813 HydrophobicContact CD2-CD2 3.88Å; Y795-L813 HydrophobicContact CD2-CG 4.43Å; Y795-L813 HydrophobicContact CE1-CD2 3.57Å; Y795-L813 HydrophobicContact CE1-CG 3.63Å; Y795-L813 HydrophobicContact CE2-CD1 4.14Å; Y795-L813 HydrophobicContact CE2-CD2 3.97Å; Y795-L813 HydrophobicContact CE2-CG 4.01Å; Y795-L813 HydrophobicContact CG-CD2 3.63Å; Y795-L813 HydrophobicContact CG-CG 4.47Å; L813-Y824 PolarHBondContact O-OH 2.91Å; L813-W831 HydrophobicContact CB-CH2 3.74Å; L813-W831 HydrophobicContact CB-CZ2 4.39Å; L813-W831 HydrophobicContact CB-CZ3 4.09Å; L813-W831 HydrophobicContact CD1-CH2 3.96Å; L813-W831 HydrophobicContact CD1-CZ2 3.8Å; L813-W831 HydrophobicContact CG-CH2 4.37Å
814	S	84.2	Confident	81.2	Confident	84 Å²	84	59.4 Å²	59.4	59%	0.587	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-67	157.4	171.2	53	0	0	0	0	111.2	W785 P816	W785-S814 PolarHBondContact NE1-O 3.13Å; S814-P816 WeakPolarHBondContact O-CD 3.3Å
815	C	87.9	Confident	82.1	Confident	55 Å²	55	62.1 Å²	62.1	37%	0.372	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-61.5	128.3	173	-173	0	0	0	0	110.1	Y824	C815-Y824 VanDerWaalsContact CA-CE2 3.43Å; C815-Y824 HydrophobicContact CB-CD1 3.81Å; C815-Y824 HydrophobicContact CB-CD2 3.78Å; C815-Y824 HydrophobicContact CB-CE1 3.91Å; C815-Y824 HydrophobicContact CB-CE2 3.89Å; C815-Y824 HydrophobicContact CB-CG 3.73Å
816	P	85.3	Confident	83.8	Confident	12 Å²	12	59 Å²	59	8%	0.078	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-60.6	153.4	170.9	-21	32	0	0	0	111.9	W785 F788 S789 S814 C819	W785-P816 HydrophobicContact CG-CG 4.08Å; F788-P816 HydrophobicContact CB-CB 4.11Å; F788-P816 HydrophobicContact CB-CG 4.07Å; F788-P816 WeakPolarHBondContact O-CB 3.38Å; S789-P816 WeakPolarHBondContact OG-CB 3.06Å; S789-P816 WeakPolarHBondContact OG-CG 3.38Å; S814-P816 WeakPolarHBondContact O-CD 3.3Å; P816-C819 HydrophobicContact CB-CB 4.02Å; P816-C819 HydrophobicContact CG-CB 4.27Å; P816-C819 VanDerWaalsContact O-CB 3.27Å; P816-C819 WeakPolarHBondContact O-CB 3.43Å; P816-C819 PolarHBondContact O-N 2.85Å
817	E	78.3	Confident	85.3	Confident	165 Å²	165	55.5 Å²	55.5	77%	0.771	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	138.9	173.3	-64.3	-172.2	177.2	0	0	110.4	C819	E817-C819 PolarHBondContact O-N 3.4Å; E817-C819 VanDerWaalsContact O-N 3.1Å
818	N	77.7	Confident	86.2	Confident	160 Å²	160	61.7 Å²	61.7	86%	0.856	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	11.8	-177.5	-51.1	-51.1	0	0	0	115.8
819	C	88	Confident	87.2	Confident	12 Å²	12	63.2 Å²	63.2	8%	0.081	34%	0.344	C	S	.	.			trans	-74.9	131	173.2	179.6	0	0	0	0	111.4	F788 P816 E817 V821	F788-C819 HydrophobicContact CB-CB 4.37Å; F788-C819 HydrophobicContact CD1-CB 4.21Å; P816-C819 HydrophobicContact CB-CB 4.02Å; P816-C819 HydrophobicContact CG-CB 4.27Å; P816-C819 VanDerWaalsContact O-CB 3.27Å; P816-C819 WeakPolarHBondContact O-CB 3.43Å; P816-C819 PolarHBondContact O-N 2.85Å; E817-C819 PolarHBondContact O-N 3.4Å; E817-C819 VanDerWaalsContact O-N 3.1Å; C819-V821 PolarHBondContact O-N 3.48Å
820	P	87.7	Confident	88.6	Confident	38 Å²	38	59.5 Å²	59.5	25%	0.247	32%	0.324	C	S	.	.			trans	-58.9	133.6	174.1	-23.6	33.4	0	0	0	111.9	F788 E822 L823 Y824	F788-P820 HydrophobicContact CE1-CG 4.5Å; P820-E822 PolarHBondContact O-N 2.85Å; P820-L823 HydrophobicContact CB-CB 4.19Å; P820-L823 WeakPolarHBondContact O-CA 3.29Å; P820-L823 WeakPolarHBondContact O-CB 3.37Å; P820-L823 PolarHBondContact O-N 2.76Å; P820-Y824 PolarHBondContact O-N 3.28Å
821	V	86.2	Confident	89.7	Confident	104 Å²	104	57.8 Å²	57.8	63%	0.63	30%	0.303	S	S	*	.	H	α-helix	trans	-57.1	-38.2	-179.9	177	0	0	0	0	111.9	C819 L823 Y824 N825	C819-V821 PolarHBondContact O-N 3.48Å; V821-L823 VanDerWaalsContact C-N 3.27Å; V821-L823 PolarHBondContact O-N 2.96Å; V821-Y824 PolarHBondContact O-N 3.07Å; V821-N825 PolarHBondContact O-N 3.47Å; V821-N825 PolarHBondContact O-ND2 2.84Å
822	E	90.3	Very high	90.2	Very high	113 Å²	113	55.4 Å²	55.4	53%	0.528	29%	0.292	S	S	.	.	H	α-helix	trans	-58.4	-40	175	-64.2	-175	177.5	0	0	111.8	P820 L826 M851 R854	P820-E822 PolarHBondContact O-N 2.85Å; E822-L826 PolarHBondContact O-N 2.94Å; E822-L826 VanDerWaalsContact O-N 3.16Å; E822-M851 HydrophobicContact CB-CE 3.88Å; E822-R854 IonicContact OE2-NH1 3.7Å
823	L	93.8	Very high	89.9	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-72.5	-41.6	178.2	-169.9	69.8	0	0	0	111.6	L695 L784 F788 P820 V821 N825 L826 M827 L848 M851	L695-L823 HydrophobicContact CD2-CD1 4.16Å; L695-L823 HydrophobicContact CD2-CD2 4.27Å; L784-L823 HydrophobicContact CD1-CD1 4.33Å; L784-L823 HydrophobicContact CD2-CD1 4.45Å; F788-L823 HydrophobicContact CD1-CD2 4.06Å; F788-L823 HydrophobicContact CD2-CD2 3.44Å; F788-L823 VanDerWaalsContact CD2-CD2 3.44Å; F788-L823 HydrophobicContact CE1-CD2 3.71Å; F788-L823 HydrophobicContact CE2-CD2 3.06Å; F788-L823 HydrophobicContact CG-CD2 3.94Å; F788-L823 HydrophobicContact CZ-CD2 3.2Å; P820-L823 HydrophobicContact CB-CB 4.19Å; P820-L823 WeakPolarHBondContact O-CA 3.29Å; P820-L823 WeakPolarHBondContact O-CB 3.37Å; P820-L823 PolarHBondContact O-N 2.76Å; V821-L823 VanDerWaalsContact C-N 3.27Å; V821-L823 PolarHBondContact O-N 2.96Å; L823-N825 VanDerWaalsContact C-N 3.27Å; L823-N825 PolarHBondContact O-N 2.97Å; L823-L826 HydrophobicContact CD1-CD2 4.21Å; L823-L826 WeakPolarHBondContact O-CA 3.45Å; L823-L826 VanDerWaalsContact O-CB 3.28Å; L823-L826 WeakPolarHBondContact O-CB 3.04Å; L823-L826 PolarHBondContact O-N 3.33Å; L823-M827 HydrophobicContact CD2-CE 3.99Å; L823-M827 HydrophobicContact CG-CE 4.03Å; L823-M827 WeakPolarHBondContact O-CG 3.35Å; L823-M827 PolarHBondContact O-N 3Å; L823-L848 HydrophobicContact CD1-CD2 3.61Å; L823-M851 HydrophobicContact CB-CE 3.94Å; L823-M851 HydrophobicContact CD1-CE 4.39Å; L823-M851 HydrophobicContact CD1-SD 4.37Å
824	Y	94.9	Very high	89.6	Confident	39 Å²	39	65.9 Å²	65.9	15%	0.153	34%	0.34	C	S	.	.	H	α-helix	trans	-63.8	-35.7	175.9	-175.3	-115.9	0	0	0	111.8	L813 C815 P820 V821 L826 M827 R828 W831	L813-Y824 PolarHBondContact O-OH 2.91Å; C815-Y824 VanDerWaalsContact CA-CE2 3.43Å; C815-Y824 HydrophobicContact CB-CD1 3.81Å; C815-Y824 HydrophobicContact CB-CD2 3.78Å; C815-Y824 HydrophobicContact CB-CE1 3.91Å; C815-Y824 HydrophobicContact CB-CE2 3.89Å; C815-Y824 HydrophobicContact CB-CG 3.73Å; P820-Y824 PolarHBondContact O-N 3.28Å; V821-Y824 PolarHBondContact O-N 3.07Å; Y824-L826 VanDerWaalsContact C-N 3.31Å; Y824-L826 PolarHBondContact O-N 3.06Å; Y824-M827 HydrophobicContact CD2-CB 4.41Å; Y824-M827 HydrophobicContact CD2-SD 4.02Å; Y824-M827 WeakPolarHBondContact O-CB 3.28Å; Y824-M827 PolarHBondContact O-N 3.35Å; Y824-M827 VanDerWaalsContact O-N 3.15Å; Y824-R828 HydrophobicContact CD1-CG 4.35Å; Y824-R828 HydrophobicContact CE1-CG 4.04Å; Y824-R828 WeakPolarHBondContact O-CG 3.32Å; Y824-R828 PolarHBondContact O-N 2.78Å; Y824-W831 HydrophobicContact CE2-CZ3 4.08Å
825	N	90.6	Very high	89.9	Confident	73 Å²	73	63.3 Å²	63.3	39%	0.39	32%	0.322	S	S	.	.	H	α-helix	trans	-61.9	-38.5	171.4	-73.4	-30.4	0	0	0	112	V821 L823 R828 L829	V821-N825 PolarHBondContact O-N 3.47Å; V821-N825 PolarHBondContact O-ND2 2.84Å; L823-N825 VanDerWaalsContact C-N 3.27Å; L823-N825 PolarHBondContact O-N 2.97Å; N825-R828 PolarHBondContact O-N 2.8Å; N825-L829 WeakPolarHBondContact O-CG 3.22Å; N825-L829 PolarHBondContact O-N 2.86Å
826	L	95.7	Very high	90	Very high	5 Å²	5	65 Å²	65	3%	0.026	34%	0.34	C	S	.	.	H	α-helix	trans	-61.1	-43.9	171.3	-177.4	63.2	0	0	0	111.6	L784 E822 L823 Y824 R828 L829 C830 P839 I844 I847 L848	L784-L826 HydrophobicContact CD1-CD2 4.2Å; L784-L826 HydrophobicContact CD1-CG 4.39Å; E822-L826 PolarHBondContact O-N 2.94Å; E822-L826 VanDerWaalsContact O-N 3.16Å; L823-L826 HydrophobicContact CD1-CD2 4.21Å; L823-L826 WeakPolarHBondContact O-CA 3.45Å; L823-L826 VanDerWaalsContact O-CB 3.28Å; L823-L826 WeakPolarHBondContact O-CB 3.04Å; L823-L826 PolarHBondContact O-N 3.33Å; Y824-L826 VanDerWaalsContact C-N 3.31Å; Y824-L826 PolarHBondContact O-N 3.06Å; L826-R828 VanDerWaalsContact C-N 3.32Å; L826-R828 PolarHBondContact O-N 3.01Å; L826-L829 WeakPolarHBondContact O-CB 3.32Å; L826-L829 PolarHBondContact O-N 2.79Å; L826-C830 PolarHBondContact O-N 3.13Å; L826-C830 PolarHBondContact O-SG 2.89Å; L826-C830 VanDerWaalsContact O-SG 3.35Å; L826-P839 HydrophobicContact CD1-CG 4.35Å; L826-I844 HydrophobicContact CD1-CG1 4.35Å; L826-I844 HydrophobicContact CD2-CG2 4.35Å; L826-I847 HydrophobicContact CD1-CD1 3.85Å; L826-I847 HydrophobicContact CD2-CG2 4.05Å; L826-L848 HydrophobicContact CD2-CD2 4.21Å; L826-L848 HydrophobicContact CD2-CG 4.22Å
827	M	97.9	Very high	90.4	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-58.2	-43.8	174.5	-58.9	-177.8	-162.4	0	0	111.6	L784 W785 F788 L823 Y824 L829 C830 W831	L784-M827 HydrophobicContact CB-CE 3.7Å; L784-M827 HydrophobicContact CB-CG 3.87Å; L784-M827 HydrophobicContact CB-SD 4.17Å; L784-M827 HydrophobicContact CD1-CG 3.96Å; W785-M827 HydrophobicContact CB-SD 4.05Å; F788-M827 HydrophobicContact CD2-CE 4.49Å; L823-M827 HydrophobicContact CD2-CE 3.99Å; L823-M827 HydrophobicContact CG-CE 4.03Å; L823-M827 WeakPolarHBondContact O-CG 3.35Å; L823-M827 PolarHBondContact O-N 3Å; Y824-M827 HydrophobicContact CD2-CB 4.41Å; Y824-M827 HydrophobicContact CD2-SD 4.02Å; Y824-M827 WeakPolarHBondContact O-CB 3.28Å; Y824-M827 PolarHBondContact O-N 3.35Å; Y824-M827 VanDerWaalsContact O-N 3.15Å; M827-L829 VanDerWaalsContact C-N 3.32Å; M827-L829 PolarHBondContact O-N 2.93Å; M827-C830 WeakPolarHBondContact O-CB 3.41Å; M827-C830 PolarHBondContact O-N 2.84Å; M827-C830 VanDerWaalsContact O-N 3.15Å; M827-W831 HydrophobicContact CB-CE3 4.16Å; M827-W831 HydrophobicContact CB-CH2 3.74Å; M827-W831 HydrophobicContact CB-CZ2 4.21Å; M827-W831 HydrophobicContact CB-CZ3 3.72Å; M827-W831 HydrophobicContact CG-CH2 4.4Å; M827-W831 VanDerWaalsContact O-CD2 3.3Å; M827-W831 PolarHBondContact O-N 3.05Å; M827-W831 HydrophobicContact SD-CH2 4.06Å
828	R	94.6	Very high	91.3	Very high	136 Å²	136	62 Å²	62	51%	0.513	33%	0.327	S	S	.	.	H	α-helix	trans	-61.4	-38.2	176.9	-68.1	-177.5	68.4	-158.7	0.7	112.7	I812 Y824 N825 L826 W831 S832	I812-R828 HydrophobicContact CD1-CB 4.49Å; I812-R828 HydrophobicContact CD1-CG 3.74Å; Y824-R828 HydrophobicContact CD1-CG 4.35Å; Y824-R828 HydrophobicContact CE1-CG 4.04Å; Y824-R828 WeakPolarHBondContact O-CG 3.32Å; Y824-R828 PolarHBondContact O-N 2.78Å; N825-R828 PolarHBondContact O-N 2.8Å; L826-R828 VanDerWaalsContact C-N 3.32Å; L826-R828 PolarHBondContact O-N 3.01Å; R828-W831 CarbonylContact O-C 3.58Å; R828-W831 PolarHBondContact O-N 2.9Å; R828-S832 PolarHBondContact O-N 2.04Å
829	L	94.8	Very high	92.3	Very high	88 Å²	88	55.5 Å²	55.5	46%	0.461	29%	0.294	S	S	.	.	H	α-helix	trans	-65.1	-41.5	174.1	-68.7	173.2	0	0	0	111.3	N825 L826 M827 W831 S832 P839	N825-L829 WeakPolarHBondContact O-CG 3.22Å; N825-L829 PolarHBondContact O-N 2.86Å; L826-L829 WeakPolarHBondContact O-CB 3.32Å; L826-L829 PolarHBondContact O-N 2.79Å; M827-L829 VanDerWaalsContact C-N 3.32Å; M827-L829 PolarHBondContact O-N 2.93Å; L829-W831 PolarHBondContact O-N 2.93Å; L829-S832 WeakPolarHBondContact O-CB 3.03Å; L829-S832 PolarHBondContact O-N 3.23Å; L829-S832 PolarHBondContact O-OG 3.22Å; L829-P839 HydrophobicContact CB-CG 4.26Å
830	C	97.5	Very high	92.7	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60.5	-33.7	173.4	-65.6	0	0	0	0	112.4	V777 L826 M827 S832 R838	V777-C830 HydrophobicContact CG1-CB 4.03Å; V777-C830 WeakPolarHBondContact O-CB 3.48Å; L826-C830 PolarHBondContact O-N 3.13Å; L826-C830 PolarHBondContact O-SG 2.89Å; L826-C830 VanDerWaalsContact O-SG 3.35Å; M827-C830 WeakPolarHBondContact O-CB 3.41Å; M827-C830 PolarHBondContact O-N 2.84Å; M827-C830 VanDerWaalsContact O-N 3.15Å; C830-S832 VanDerWaalsContact C-N 3.28Å; C830-S832 PolarHBondContact O-N 2.92Å; C830-R838 VanDerWaalsContact O-CD 3.23Å; C830-R838 WeakPolarHBondContact O-CD 3.33Å; C830-R838 WeakPolarHBondContact O-CG 3.41Å
831	W	97.9	Very high	93.2	Very high	11 Å²	11	55.9 Å²	55.9	4%	0.042	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	22.8	177	-56.2	-38.8	0	0	0	114.4	W778 G781 V782 W785 I812 L813 Y824 M827 R828 L829 K833	W778-W831 AromaticContact CD2-CD1 3.66Å; W778-W831 HydrophobicContact CD2-CG 4.45Å; W778-W831 AromaticContact CE2-CD1 3.71Å; W778-W831 HydrophobicContact CE3-CB 4.16Å; W778-W831 AromaticContact CG-CD1 3.91Å; W778-W831 HydrophobicContact CH2-CB 4.08Å; W778-W831 HydrophobicContact CZ2-CB 4.47Å; W778-W831 HydrophobicContact CZ2-CG 4.49Å; W778-W831 HydrophobicContact CZ3-CB 3.93Å; W778-W831 VanDerWaalsContact CZ3-O 3.25Å; W778-W831 WeakPolarHBondContact CZ3-O 3.43Å; W778-W831 AromaticContact NE1-CD1 4Å; W778-W831 PolarHBondContact O-NE1 2.81Å; G781-W831 VanDerWaalsContact C-CZ2 3.44Å; G781-W831 WeakPolarHBondContact O-CZ2 3.43Å; V782-W831 HydrophobicContact CG2-CZ2 4.27Å; W785-W831 HydrophobicContact CB-CH2 4.19Å; W785-W831 HydrophobicContact CB-CZ2 4.26Å; I812-W831 HydrophobicContact CB-CD2 4.46Å; I812-W831 HydrophobicContact CB-CE3 3.82Å; I812-W831 HydrophobicContact CB-CZ3 4.38Å; I812-W831 HydrophobicContact CD1-CE3 4.02Å; I812-W831 HydrophobicContact CG1-CE3 4.45Å; I812-W831 HydrophobicContact CG2-CB 3.78Å; I812-W831 HydrophobicContact CG2-CD2 4.45Å; I812-W831 HydrophobicContact CG2-CE3 4.17Å; I812-W831 HydrophobicContact CG2-CG 4.35Å; L813-W831 HydrophobicContact CB-CH2 3.74Å; L813-W831 HydrophobicContact CB-CZ2 4.39Å; L813-W831 HydrophobicContact CB-CZ3 4.09Å; L813-W831 HydrophobicContact CD1-CH2 3.96Å; L813-W831 HydrophobicContact CD1-CZ2 3.8Å; L813-W831 HydrophobicContact CG-CH2 4.37Å; Y824-W831 HydrophobicContact CE2-CZ3 4.08Å; M827-W831 HydrophobicContact CB-CE3 4.16Å; M827-W831 HydrophobicContact CB-CH2 3.74Å; M827-W831 HydrophobicContact CB-CZ2 4.21Å; M827-W831 HydrophobicContact CB-CZ3 3.72Å; M827-W831 HydrophobicContact CG-CH2 4.4Å; M827-W831 VanDerWaalsContact O-CD2 3.3Å; M827-W831 PolarHBondContact O-N 3.05Å; M827-W831 HydrophobicContact SD-CH2 4.06Å; R828-W831 CarbonylContact O-C 3.58Å; R828-W831 PolarHBondContact O-N 2.9Å; L829-W831 PolarHBondContact O-N 2.93Å; W831-K833 PolarHBondContact O-N 3.13Å
832	S	91.9	Very high	93.7	Very high	24 Å²	24	53.4 Å²	53.4	17%	0.168	28%	0.283	C	S	.	.			trans	-60.8	134.7	172.4	-62.1	0	0	0	0	110.7	R828 L829 C830 L834 R838	R828-S832 PolarHBondContact O-N 2.04Å; L829-S832 WeakPolarHBondContact O-CB 3.03Å; L829-S832 PolarHBondContact O-N 3.23Å; L829-S832 PolarHBondContact O-OG 3.22Å; C830-S832 VanDerWaalsContact C-N 3.28Å; C830-S832 PolarHBondContact O-N 2.92Å; S832-L834 VanDerWaalsContact C-N 3.33Å; S832-L834 PolarHBondContact O-N 3.49Å; S832-R838 PolarHBondContact O-NE 3.04Å; S832-R838 PolarHBondContact O-NH2 2.88Å; S832-R838 VanDerWaalsContact O-NH2 3.16Å
833	K	83.2	Confident	94	Very high	156 Å²	156	50.3 Å²	50.3	68%	0.678	27%	0.274	S	S	*	.	S	Bend	trans	-62.9	-38.9	-176.5	-177	175.3	-179.4	174.2	0	112.4	W831	W831-K833 PolarHBondContact O-N 3.13Å
834	L	83.6	Confident	94.2	Very high	108 Å²	108	50.3 Å²	50.3	57%	0.565	27%	0.274	S	S	*	.	S	Bend	trans	-85.6	124.8	172.7	-66.4	174	0	0	0	108.7	S832 A836 D837	S832-L834 VanDerWaalsContact C-N 3.33Å; S832-L834 PolarHBondContact O-N 3.49Å; L834-A836 PolarHBondContact O-N 3.27Å; L834-D837 HydrophobicContact CB-CB 4.46Å; L834-D837 WeakPolarHBondContact CB-OD2 3.42Å; L834-D837 PolarHBondContact O-N 3.11Å; L834-D837 VanDerWaalsContact O-N 3.12Å
835	P	89.9	Confident	94.3	Very high	31 Å²	31	50.4 Å²	50.4	20%	0.201	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-57.1	-35.3	-179.8	-27.9	35.6	0	0	0	113.8	E764 E774 D837 R838	E764-P835 HydrophobicContact CG-CG 4.05Å; E774-P835 HydrophobicContact CB-CB 3.75Å; E774-P835 HydrophobicContact CG-CB 4.28Å; E774-P835 WeakPolarHBondContact CG-O 3.02Å; P835-D837 PolarHBondContact O-N 2.79Å; P835-R838 WeakPolarHBondContact O-CB 3.34Å; P835-R838 WeakPolarHBondContact O-CG 3.27Å; P835-R838 PolarHBondContact O-N 3.35Å
836	A	89.9	Confident	94.5	Very high	90 Å²	90	54 Å²	54	74%	0.744	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-67.7	-19.8	-179.2	0	0	0	0	0	114.3	L834 R838	L834-A836 PolarHBondContact O-N 3.27Å; A836-R838 VanDerWaalsContact C-N 3.3Å
837	D	94.2	Very high	94.4	Very high	101 Å²	101	56.8 Å²	56.8	54%	0.54	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-84.5	-9.5	178.4	-63.8	-16.2	0	0	0	112	L834 P835	L834-D837 HydrophobicContact CB-CB 4.46Å; L834-D837 WeakPolarHBondContact CB-OD2 3.42Å; L834-D837 PolarHBondContact O-N 3.11Å; L834-D837 VanDerWaalsContact O-N 3.12Å; P835-D837 PolarHBondContact O-N 2.79Å
838	R	97.8	Very high	94.3	Very high	13 Å²	13	56.8 Å²	56.8	5%	0.049	30%	0.298	C	S	.	.	S	Bend	trans	-76.7	142.3	179.7	-57.9	175.9	-169.1	152.5	8.5	109.8	E764 E774 V777 C830 S832 P835 A836	E764-R838 IonicContact OE1-CZ 3.27Å; E764-R838 IonicContact OE1-NH1 2.64Å; E764-R838 PolarHBondContact OE1-NH1 3.49Å; E764-R838 IonicContact OE1-NH2 3.6Å; E764-R838 IonicContact OE2-CZ 2.76Å; E764-R838 IonicContact OE2-NH1 2.79Å; E764-R838 IonicContact OE2-NH2 2.76Å; E764-R838 PolarHBondContact OE2-NH2 3.38Å; E774-R838 VanDerWaalsContact O-CD 3.28Å; E774-R838 WeakPolarHBondContact O-CD 3.28Å; E774-R838 PolarHBondContact O-NH1 3.32Å; V777-R838 HydrophobicContact CB-CB 4.46Å; V777-R838 HydrophobicContact CG1-CB 3.86Å; C830-R838 VanDerWaalsContact O-CD 3.23Å; C830-R838 WeakPolarHBondContact O-CD 3.33Å; C830-R838 WeakPolarHBondContact O-CG 3.41Å; S832-R838 PolarHBondContact O-NE 3.04Å; S832-R838 PolarHBondContact O-NH2 2.88Å; S832-R838 VanDerWaalsContact O-NH2 3.16Å; P835-R838 WeakPolarHBondContact O-CB 3.34Å; P835-R838 WeakPolarHBondContact O-CG 3.27Å; P835-R838 PolarHBondContact O-N 3.35Å; A836-R838 VanDerWaalsContact C-N 3.3Å
839	P	97.1	Very high	94.1	Very high	24 Å²	24	54.1 Å²	54.1	16%	0.156	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-68.1	147.9	179.4	27.6	-32.8	0	0	0	111	V777 L826 L829 I844	V777-P839 HydrophobicContact CG1-CG 4.48Å; V777-P839 WeakPolarHBondContact CG1-O 3.44Å; V777-P839 WeakPolarHBondContact CG2-O 3.3Å; L826-P839 HydrophobicContact CD1-CG 4.35Å; L829-P839 HydrophobicContact CB-CG 4.26Å; P839-I844 HydrophobicContact CB-CG1 3.95Å; P839-I844 HydrophobicContact CG-CD1 4Å; P839-I844 HydrophobicContact CG-CG1 3.74Å
840	S	97.8	Very high	93.9	Very high	58 Å²	58	57.5 Å²	57.5	41%	0.406	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-69.8	152.8	171.5	65.8	0	0	0	0	111.2	T842 S843 I844	S840-T842 PolarHBondContact O-N 2.98Å; S840-S843 WeakPolarHBondContact O-CA 3.47Å; S840-S843 WeakPolarHBondContact O-CB 3.22Å; S840-S843 PolarHBondContact O-N 3.3Å; S840-S843 PolarHBondContact OG-N 2.04Å; S840-S843 PolarHBondContact OG-OG 3.21Å; S840-I844 WeakPolarHBondContact O-CG1 3.43Å; S840-I844 PolarHBondContact O-N 2.9Å
841	F	97.9	Very high	93.6	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-57	-35.2	176.1	-80.4	-66	0	0	0	113.4	M705 A706 T773 D776 V777 Y780 S843 I844 H845	M705-F841 HydrophobicContact CB-CB 4.49Å; M705-F841 HydrophobicContact CB-CD1 3.4Å; M705-F841 VanDerWaalsContact CB-CD1 3.4Å; M705-F841 HydrophobicContact CB-CD2 3.89Å; M705-F841 HydrophobicContact CB-CE1 3.35Å; M705-F841 HydrophobicContact CB-CE2 3.84Å; M705-F841 HydrophobicContact CB-CG 3.68Å; M705-F841 HydrophobicContact CB-CZ 3.58Å; M705-F841 HydrophobicContact CE-CE2 3.68Å; M705-F841 HydrophobicContact CE-CZ 3.73Å; M705-F841 HydrophobicContact CG-CD1 4.3Å; M705-F841 HydrophobicContact CG-CE1 3.76Å; M705-F841 HydrophobicContact CG-CE2 4.41Å; M705-F841 HydrophobicContact CG-CZ 3.82Å; A706-F841 HydrophobicContact CB-CB 3.92Å; T773-F841 HydrophobicContact CG2-CD2 3.79Å; T773-F841 HydrophobicContact CG2-CE2 3.99Å; D776-F841 HydrophobicContact CB-CE2 3.9Å; D776-F841 HydrophobicContact CB-CZ 3.98Å; V777-F841 HydrophobicContact CB-CZ 4.42Å; V777-F841 HydrophobicContact CG2-CD2 3.86Å; V777-F841 HydrophobicContact CG2-CE1 4.3Å; V777-F841 HydrophobicContact CG2-CE2 3.59Å; V777-F841 HydrophobicContact CG2-CG 4.32Å; V777-F841 HydrophobicContact CG2-CZ 3.84Å; Y780-F841 HydrophobicContact CD1-CE1 4.25Å; Y780-F841 AromaticContact CD2-CE1 3.94Å; Y780-F841 HydrophobicContact CD2-CE1 3.94Å; Y780-F841 AromaticContact CG-CE1 3.65Å; Y780-F841 HydrophobicContact CG-CE1 3.65Å; Y780-F841 HydrophobicContact CG-CZ 4.49Å; F841-S843 VanDerWaalsContact C-N 3.28Å; F841-S843 PolarHBondContact O-N 3.32Å; F841-I844 HydrophobicContact CD1-CD1 4.09Å; F841-I844 HydrophobicContact CE1-CD1 4.42Å; F841-I844 PolarHBondContact O-N 3Å; F841-H845 VanDerWaalsContact O-CB 3.31Å; F841-H845 WeakPolarHBondContact O-CB 3.17Å; F841-H845 PolarHBondContact O-N 2.82Å
842	T	96.3	Very high	93	Very high	51 Å²	51	58.1 Å²	58.1	31%	0.313	30%	0.302	S	S	.	.	H	α-helix	trans	-60.1	-38.5	172.3	-44.4	0	0	0	0	112	S840 R846	S840-T842 PolarHBondContact O-N 2.98Å; T842-R846 WeakPolarHBondContact O-CG 3.29Å; T842-R846 PolarHBondContact O-N 2.86Å
843	S	96.9	Very high	92.6	Very high	49 Å²	49	62.7 Å²	62.7	34%	0.343	32%	0.321	S	S	.	.	H	α-helix	trans	-72.2	-44.5	177.6	-54.6	0	0	0	0	111.3	S840 F841 H845 R846 I847	S840-S843 WeakPolarHBondContact O-CA 3.47Å; S840-S843 WeakPolarHBondContact O-CB 3.22Å; S840-S843 PolarHBondContact O-N 3.3Å; S840-S843 PolarHBondContact OG-N 2.04Å; S840-S843 PolarHBondContact OG-OG 3.21Å; F841-S843 VanDerWaalsContact C-N 3.28Å; F841-S843 PolarHBondContact O-N 3.32Å; S843-H845 PolarHBondContact O-N 3.07Å; S843-R846 PolarHBondContact O-N 3.09Å; S843-I847 VanDerWaalsContact O-CG1 3.3Å; S843-I847 WeakPolarHBondContact O-CG1 3.48Å; S843-I847 PolarHBondContact O-N 3.33Å
844	I	97.9	Very high	92.5	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-56.8	-49.1	175.4	-66.1	171.8	0	0	0	110.5	A702 V777 Y780 L826 P839 S840 F841 R846 I847 L848	A702-I844 HydrophobicContact CB-CG2 4.02Å; V777-I844 HydrophobicContact CG1-CD1 3.85Å; V777-I844 HydrophobicContact CG2-CD1 4.34Å; Y780-I844 HydrophobicContact CD1-CD1 4.12Å; Y780-I844 HydrophobicContact CD1-CG2 3.97Å; Y780-I844 HydrophobicContact CE1-CG2 3.32Å; L826-I844 HydrophobicContact CD1-CG1 4.35Å; L826-I844 HydrophobicContact CD2-CG2 4.35Å; P839-I844 HydrophobicContact CB-CG1 3.95Å; P839-I844 HydrophobicContact CG-CD1 4Å; P839-I844 HydrophobicContact CG-CG1 3.74Å; S840-I844 WeakPolarHBondContact O-CG1 3.43Å; S840-I844 PolarHBondContact O-N 2.9Å; F841-I844 HydrophobicContact CD1-CD1 4.09Å; F841-I844 HydrophobicContact CE1-CD1 4.42Å; F841-I844 PolarHBondContact O-N 3Å; I844-R846 PolarHBondContact O-N 2.87Å; I844-I847 PolarHBondContact O-N 2.67Å; I844-I847 VanDerWaalsContact O-N 3.16Å; I844-L848 HydrophobicContact CG2-CD1 3.86Å; I844-L848 WeakPolarHBondContact O-CG 3.36Å; I844-L848 PolarHBondContact O-N 3.49Å
845	H	96.7	Very high	92.1	Very high	40 Å²	40	58.9 Å²	58.9	19%	0.185	30%	0.3	C	S	.	.	H	α-helix	trans	-58.5	-45.5	179.8	-178.1	64.2	0	0	0	111.8	R699 A702 F841 S843 I847 L848 E849	R699-H845 PolarHBondContact O-ND1 2.87Å; A702-H845 HydrophobicContact CB-CB 4.08Å; F841-H845 VanDerWaalsContact O-CB 3.31Å; F841-H845 WeakPolarHBondContact O-CB 3.17Å; F841-H845 PolarHBondContact O-N 2.82Å; S843-H845 PolarHBondContact O-N 3.07Å; H845-I847 PolarHBondContact O-N 3.13Å; H845-L848 PolarHBondContact O-N 2.99Å; H845-E849 WeakPolarHBondContact O-CB 3.33Å; H845-E849 PolarHBondContact O-N 2.98Å
846	R	94.8	Very high	91.1	Very high	148 Å²	148	63.4 Å²	63.4	56%	0.558	32%	0.318	S	S	*	.	H	α-helix	trans	-64.1	-36	175.6	-74.1	176.2	179.6	168.6	1.3	113.6	T842 S843 I844 R850	T842-R846 WeakPolarHBondContact O-CG 3.29Å; T842-R846 PolarHBondContact O-N 2.86Å; S843-R846 PolarHBondContact O-N 3.09Å; I844-R846 PolarHBondContact O-N 2.87Å; R846-R850 WeakPolarHBondContact O-CG 3.36Å; R846-R850 PolarHBondContact O-N 3.37Å
847	I	94.6	Very high	89.4	Confident	64 Å²	64	61.1 Å²	61.1	33%	0.328	30%	0.304	S	S	.	.	H	α-helix	trans	-64.3	-48.4	175.7	-70.1	165.2	0	0	0	109.3	L826 S843 I844 H845 R850 M851	L826-I847 HydrophobicContact CD1-CD1 3.85Å; L826-I847 HydrophobicContact CD2-CG2 4.05Å; S843-I847 VanDerWaalsContact O-CG1 3.3Å; S843-I847 WeakPolarHBondContact O-CG1 3.48Å; S843-I847 PolarHBondContact O-N 3.33Å; I844-I847 PolarHBondContact O-N 2.67Å; I844-I847 VanDerWaalsContact O-N 3.16Å; H845-I847 PolarHBondContact O-N 3.13Å; I847-R850 PolarHBondContact O-N 3.21Å; I847-M851 HydrophobicContact CG2-SD 4.05Å; I847-M851 WeakPolarHBondContact O-CG 3.43Å; I847-M851 PolarHBondContact O-N 3.12Å; I847-M851 VanDerWaalsContact O-N 3.08Å
848	L	94.7	Very high	87.3	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-66.6	-38.2	-179.7	-69.6	166.7	0	0	0	112.7	L695 A698 R699 A702 Y780 L823 L826 I844 H845 R850 M851 C852	L695-L848 HydrophobicContact CD2-CD2 4.1Å; A698-L848 HydrophobicContact CB-CD1 4.18Å; A698-L848 HydrophobicContact CB-CD2 4.2Å; R699-L848 HydrophobicContact CB-CB 4.13Å; R699-L848 HydrophobicContact CG-CB 4.44Å; A702-L848 HydrophobicContact CB-CD1 3.97Å; Y780-L848 HydrophobicContact CE1-CD1 4.37Å; Y780-L848 WeakPolarHBondContact OH-CD1 3.49Å; L823-L848 HydrophobicContact CD1-CD2 3.61Å; L826-L848 HydrophobicContact CD2-CD2 4.21Å; L826-L848 HydrophobicContact CD2-CG 4.22Å; I844-L848 HydrophobicContact CG2-CD1 3.86Å; I844-L848 WeakPolarHBondContact O-CG 3.36Å; I844-L848 PolarHBondContact O-N 3.49Å; H845-L848 PolarHBondContact O-N 2.99Å; L848-R850 PolarHBondContact O-N 3.38Å; L848-M851 PolarHBondContact O-N 2.8Å; L848-M851 VanDerWaalsContact O-N 3.15Å; L848-C852 PolarHBondContact O-N 3.03Å; L848-C852 PolarHBondContact O-SG 3.03Å; L848-C852 VanDerWaalsContact O-SG 3.34Å
849	E	91.4	Very high	84.8	Confident	80 Å²	80	67.4 Å²	67.4	37%	0.374	35%	0.347	S	S	.	.	H	α-helix	trans	-55.5	-49.6	173.4	-176.4	173.8	-121.4	0	0	111.2	H845 M851 C852 E853	H845-E849 WeakPolarHBondContact O-CB 3.33Å; H845-E849 PolarHBondContact O-N 2.98Å; E849-M851 VanDerWaalsContact C-N 3.3Å; E849-M851 PolarHBondContact O-N 2.75Å; E849-C852 WeakPolarHBondContact O-CB 3.3Å; E849-C852 PolarHBondContact O-N 2.98Å; E849-E853 WeakPolarHBondContact O-CG 3.09Å; E849-E853 PolarHBondContact O-N 2.95Å
850	R	91.1	Very high	81.9	Confident	160 Å²	160	70.7 Å²	70.7	60%	0.604	37%	0.37	S	S	*	.	H	α-helix	trans	-63.1	-34.1	175.8	-68.9	174.1	-177.7	-178.8	0	113.4	R846 I847 L848 R854	R846-R850 WeakPolarHBondContact O-CG 3.36Å; R846-R850 PolarHBondContact O-N 3.37Å; I847-R850 PolarHBondContact O-N 3.21Å; L848-R850 PolarHBondContact O-N 3.38Å; R850-R854 WeakPolarHBondContact O-CG 3Å; R850-R854 PolarHBondContact O-N 3.01Å
851	M	90.4	Very high	78.8	Confident	17 Å²	17	78 Å²	78	8%	0.084	41%	0.412	C	S	.	.	H	α-helix	trans	-71	-39.5	176.6	-67.9	179.1	75.9	0	0	111.5	L695 E822 L823 I847 L848 E849 R854 A855	L695-M851 HydrophobicContact CD1-CB 4.26Å; L695-M851 HydrophobicContact CD2-CB 4.31Å; L695-M851 HydrophobicContact CD2-CE 4.22Å; E822-M851 HydrophobicContact CB-CE 3.88Å; L823-M851 HydrophobicContact CB-CE 3.94Å; L823-M851 HydrophobicContact CD1-CE 4.39Å; L823-M851 HydrophobicContact CD1-SD 4.37Å; I847-M851 HydrophobicContact CG2-SD 4.05Å; I847-M851 WeakPolarHBondContact O-CG 3.43Å; I847-M851 PolarHBondContact O-N 3.12Å; I847-M851 VanDerWaalsContact O-N 3.08Å; L848-M851 PolarHBondContact O-N 2.8Å; L848-M851 VanDerWaalsContact O-N 3.15Å; E849-M851 VanDerWaalsContact C-N 3.3Å; E849-M851 PolarHBondContact O-N 2.75Å; M851-R854 PolarHBondContact O-N 2.86Å; M851-A855 WeakPolarHBondContact O-CB 3.23Å; M851-A855 PolarHBondContact O-N 3.38Å
852	C	85.9	Confident	77.8	Confident	7 Å²	7	82 Å²	82	5%	0.047	43%	0.433	C	S	.	.	H	α-helix	trans	-60.7	-49.4	173.4	-72.6	0	0	0	0	111.3	L848 E849 R854 A855 E856	L848-C852 PolarHBondContact O-N 3.03Å; L848-C852 PolarHBondContact O-SG 3.03Å; L848-C852 VanDerWaalsContact O-SG 3.34Å; E849-C852 WeakPolarHBondContact O-CB 3.3Å; E849-C852 PolarHBondContact O-N 2.98Å; C852-R854 VanDerWaalsContact C-N 3.26Å; C852-R854 PolarHBondContact O-N 3.23Å; C852-A855 PolarHBondContact O-N 2.93Å; C852-A855 VanDerWaalsContact O-N 3.1Å; C852-E856 WeakPolarHBondContact O-CG 3.37Å; C852-E856 PolarHBondContact O-N 2.81Å
853	E	83.4	Confident	76.8	Confident	119 Å²	119	83.6 Å²	83.6	56%	0.556	44%	0.439	S	S	*	.	H	α-helix	trans	-56.2	-40.2	179.2	-72	172	172.6	0	0	112.3	E849 G857	E849-E853 WeakPolarHBondContact O-CG 3.09Å; E849-E853 PolarHBondContact O-N 2.95Å; E853-G857 PolarHBondContact O-N 2.88Å; E853-G857 VanDerWaalsContact O-N 3.1Å
854	R	81.2	Confident	75.7	Confident	160 Å²	160	85.5 Å²	85.5	60%	0.604	45%	0.445	S	S	*	.	H	α-helix	trans	-69.7	-41.7	176.8	-71.3	175.1	-174.2	179.5	-0.2	112.7	E822 R850 M851 C852 E856 G857 T858	E822-R854 IonicContact OE2-NH1 3.7Å; R850-R854 WeakPolarHBondContact O-CG 3Å; R850-R854 PolarHBondContact O-N 3.01Å; M851-R854 PolarHBondContact O-N 2.86Å; C852-R854 VanDerWaalsContact C-N 3.26Å; C852-R854 PolarHBondContact O-N 3.23Å; R854-E856 VanDerWaalsContact C-N 3.31Å; R854-G857 PolarHBondContact O-N 3.32Å; R854-T858 PolarHBondContact O-N 3Å; R854-T858 PolarHBondContact O-OG1 3.17Å; R854-T858 VanDerWaalsContact O-OG1 3.11Å
855	A	74.6	Confident	74.4	Confident	24 Å²	24	90.5 Å²	90.5	20%	0.198	47%	0.471	C	S	.	.	H	α-helix	trans	-65.6	-36.2	-179.8	0	0	0	0	0	111.7	A692 L695 M851 C852 T858	A692-A855 HydrophobicContact CB-CB 4.24Å; L695-A855 HydrophobicContact CD1-CB 4.16Å; M851-A855 WeakPolarHBondContact O-CB 3.23Å; M851-A855 PolarHBondContact O-N 3.38Å; C852-A855 PolarHBondContact O-N 2.93Å; C852-A855 VanDerWaalsContact O-N 3.1Å; A855-T858 PolarHBondContact O-OG1 2.92Å
856	E	69.4	Low	73	Confident	126 Å²	126	93.7 Å²	93.7	59%	0.589	49%	0.489	S	S	*	.	H	α-helix	trans	-71.6	-35.9	174.9	-69.8	173.9	-171	0	0	112.1	C852 R854 T858	C852-E856 WeakPolarHBondContact O-CG 3.37Å; C852-E856 PolarHBondContact O-N 2.81Å; R854-E856 VanDerWaalsContact C-N 3.31Å; E856-T858 VanDerWaalsContact C-N 3.33Å; E856-T858 PolarHBondContact O-N 3.09Å
857	G	54.2	Low	71.6	Confident	43 Å²	43	90.1 Å²	90.1	44%	0.443	48%	0.484	S	S	.	.	H	α-helix	trans	-68.8	-21	178.7	0	0	0	0	0	115.8	E853 R854 V859 S860	E853-G857 PolarHBondContact O-N 2.88Å; E853-G857 VanDerWaalsContact O-N 3.1Å; R854-G857 PolarHBondContact O-N 3.32Å; G857-V859 VanDerWaalsContact C-N 3.27Å; G857-V859 PolarHBondContact O-N 2.88Å; G857-S860 PolarHBondContact O-OG 3.25Å
858	T	49.8	Very low	69.9	Low	117 Å²	117	91.9 Å²	91.9	72%	0.718	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-2	178.4	19.7	0	0	0	0	115.4	R854 A855 E856	R854-T858 PolarHBondContact O-N 3Å; R854-T858 PolarHBondContact O-OG1 3.17Å; R854-T858 VanDerWaalsContact O-OG1 3.11Å; A855-T858 PolarHBondContact O-OG1 2.92Å; E856-T858 VanDerWaalsContact C-N 3.33Å; E856-T858 PolarHBondContact O-N 3.09Å
859	V	45	Very low	68	Low	129 Å²	129	99 Å²	99	78%	0.782	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	0.5	179.7	-174.1	0	0	0	0	112.6	G857	G857-V859 VanDerWaalsContact C-N 3.27Å; G857-V859 PolarHBondContact O-N 2.88Å
860	S	35.8	Very low	66.1	Low	92 Å²	92	100.6 Å²	100.6	64%	0.643	55%	0.547	S	S	*	.			trans	-129	71.7	-179.3	45.2	0	0	0	0	112.3	G857	G857-S860 PolarHBondContact O-OG 3.25Å
861	V	32.1	Very low	63.8	Low	213 Å²	213	95.2 Å²	95.2	100%	1.291	54%	0.541	S	S	*	.			trans	-142.6	0	152.4	-178.1	0	0	0	0	109

Retrieved 861 of 861 residues in 339.6 ms (Link to these results)

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