A0A5K4ERP3_SCHMA Loading...

Transducin-like enhancer protein 1

AlphaFold DB , UniProt , Accession A0A5K4ERP3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,214 aa.

						>A0A5K4ERP3_SCHMA|A0A5K4ERP3
MYPSRISSSSQSNQHTKFSVPEACDKIKDELLGLQTQYHSLKCEFEKAVQEKSELQRHYLLYYEITYGLNVEMHKQMEIAKRLNAILVQVIPFLSQEHQSQVAAAVDRAKQVTLSELSSIIGMDESKGPKFLNGSLGSTFDQMDFFKTMQQQQLLMNSGSGGLNSGFPHSLIPPSLGQLPSDNSVLPISGSRGGAQSTPSLTSLSGLNAPPCTGINSLSSGLPALNNNTANNLLLPPNPFLPQMTSSVTPPTTNTNPVGNPSISGVQSSLSGIPGPNNPAFFSGLAQSHPAVAAAMAAVAAAGFPSGNTNPTMNQLSSGLLNNNSHPYSQIPAHINNISTSFPPGTSNSLTGASLPSSISSNASLATSSYHGPSASGAHTPFSPTSTSLSNPNAPRPLMFPMDGVTGQPPFPPMISPAALSAIISDKNLDEKQRTAAAAAMAAAMAAAAAASQGGPPGAFGLPLNFGSNSLSGSSPMDAHNLMATMASFAAAQSAAAVGMNPDIHDGLNSSLPLSSGLFGGLNPDISGFGPNNLLPPSSSISSTFPNPGSVLPPSKSSTPVPSVNSCPSRQRANSRSPALLDVHSNAPPDEKRRKTERPTSGEKCNAVGNSSLEENGLVRVKSSNSSGRRTPSTKHNGNSNSSNGGPNSSVYKNHSTGNGLTLSHLDSNNQNHNTTMNNNAQRDHSLELDHKEFDENPPPLLSGGSGSGTPSCTTSPQNQQSHTTCSDPPPPPAPPLTGTFHNKQHTTTSNVKSSLSPVVAGTTNVLNSCRIGSISSLAGGELSVPSPLSSMGAGGGVNLPGVGAVSLSPPNLTSDALTPNSDGHSVSSTQQNPPSVPLSTTITTSSSSTMMFDTNFGSSGMGGISNISRPPYSFLRLDNQSPTPVPFTPDAFFGPGIPHQAKAIHCLDHGEVVCAVTINNATHQIYTGGKGTVKLWDLNSTTSNQSPNCSGSSSQSIITNKTCITSLECLQRDKYIRSIKLTQDGRTLVVGGESSILSIWDLGQASPHPKSELTFTAPACYALAVSPDSKLCFSCCSNGNIGVWDIHNRILVRQYQGHAEGASCVDIRPDGTRLWSGGLDKTVRCWDLREHCQISQVDLSAQIFSLGYCPTGDWLAVGLETDQVEVFGPGRPERYQLSLHESCVLSLKFAHSGLWFASTGKDHCLYAWRTPYGANLFQVKENSSVLSCDISLDDKLLVTGSGDRKATVYEIIY
					

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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	34.9	Very low	33.4	Very low	236 Å²	236	158.7 Å²	158.7	100%	1.163	87%	0.865	S	S	*	*				0	130	0	-73.4	172	166.7	0	0	108.3
2	Y	26.1	Very low	33.3	Very low	191 Å²	191	155.2 Å²	155.2	75%	0.749	86%	0.86	S	S	*	*			trans	-147.2	108.4	168.2	-96.4	-72.3	0	0	0	108.7	Q37	Y2-Q37 PolarHBondContact OH-NE2 2.97Å; Y2-Q37 PolarHBondContact OH-OE1 2.91Å
3	P	46.8	Very low	33.1	Very low	125 Å²	125	156.1 Å²	156.1	81%	0.812	86%	0.863	S	S	*	*			trans	-95	109.4	-177.9	33.4	-29.9	0	0	0	111.8
4	S	36.9	Very low	33.4	Very low	112 Å²	112	156.9 Å²	156.9	78%	0.783	86%	0.857	S	S	*	*			trans	-81.1	131.1	171.3	-40.1	0	0	0	0	111.3
5	R	34.1	Very low	33.7	Very low	252 Å²	252	159.1 Å²	159.1	95%	0.951	86%	0.858	S	S	*	*			trans	-171.8	157.1	140.9	-106.8	160.4	-156	-130.4	3.6	113.8
6	I	33.9	Very low	34.3	Very low	169 Å²	169	156.3 Å²	156.3	87%	0.867	85%	0.849	S	S	*	*			trans	-107	138.9	177.9	-61.1	160.1	0	0	0	108.3
7	S	31.5	Very low	34.9	Very low	121 Å²	121	157.9 Å²	157.9	85%	0.846	85%	0.846	S	S	*	*			trans	-154.3	156.6	148.9	60	0	0	0	0	110.2
8	S	31.1	Very low	35.9	Very low	118 Å²	118	159 Å²	159	83%	0.825	84%	0.842	S	S	*	*			trans	-109.9	148.8	-173.1	51.1	0	0	0	0	112.5
9	S	32.6	Very low	37.4	Very low	125 Å²	125	153.2 Å²	153.2	87%	0.874	82%	0.815	S	S	*	*			trans	-145.4	155.9	155.1	60.9	0	0	0	0	109.2
10	S	29.9	Very low	39.2	Very low	109 Å²	109	150.3 Å²	150.3	76%	0.762	80%	0.803	S	S	*	*			trans	-128.5	162.4	-171.9	57.8	0	0	0	0	111.6
11	Q	29.3	Very low	41.1	Very low	188 Å²	188	146.9 Å²	146.9	88%	0.879	79%	0.79	S	S	*	*			trans	67.7	112.3	176.3	-54.2	-175.1	-5.3	0	0	117.1
12	S	32.5	Very low	43.1	Very low	116 Å²	116	141.4 Å²	141.4	81%	0.811	76%	0.761	S	S	*	*				-162.1	157.2	102.7	46.6	0	0	0	0	110.8	Q14	S12-Q14 PolarHBondContact O-N 2.73Å
13	N	30.8	Very low	45.7	Very low	167 Å²	167	133.6 Å²	133.6	89%	0.893	74%	0.736	S	S	*	*			trans	-73.5	116	-176.6	-68.7	-37.9	0	0	0	111.4
14	Q	37.1	Very low	47.3	Very low	168 Å²	168	130.4 Å²	130.4	79%	0.785	72%	0.716	S	S	*	*			trans	-131.5	126	147.8	-70.1	-158.7	21.5	0	0	110.1	S12 T16	S12-Q14 PolarHBondContact O-N 2.73Å; Q14-T16 PolarHBondContact O-N 2.73Å
15	H	37.7	Very low	49.6	Very low	189 Å²	189	128.5 Å²	128.5	88%	0.875	70%	0.697	S	S	*	*			trans	-84.4	58.9	-175.1	-168.5	-60.9	0	0	0	110.3	K17	H15-K17 PolarHBondContact O-N 2.63Å
16	T	44.5	Very low	52.1	Low	115 Å²	115	123.2 Å²	123.2	71%	0.706	68%	0.681	S	S	*	*			trans	-62	118.8	176.4	43	0	0	0	0	109.4	Q14 F18	Q14-T16 PolarHBondContact O-N 2.73Å; T16-F18 PolarHBondContact O-N 2.72Å
17	K	43.7	Very low	54.7	Low	183 Å²	183	120.5 Å²	120.5	80%	0.796	67%	0.667	S	S	*	*			trans	-59	123	168.4	-79.6	-177.8	174.5	178.9	0	107	H15 S19	H15-K17 PolarHBondContact O-N 2.63Å; K17-S19 PolarHBondContact O-N 3.29Å
18	F	53.3	Low	57.4	Low	178 Å²	178	120.5 Å²	120.5	78%	0.781	65%	0.652	S	S	*	*			trans	-70.4	83.6	173.6	-163	-86.8	0	0	0	108.8	T16 V20 A23	T16-F18 PolarHBondContact O-N 2.72Å; F18-V20 PolarHBondContact O-N 3.29Å; F18-A23 HydrophobicContact CE1-CB 3.75Å; F18-A23 HydrophobicContact CZ-CB 3.9Å
19	S	64.7	Low	60.2	Low	48 Å²	48	120.2 Å²	120.2	34%	0.336	64%	0.641	S	S	.	*			trans	-72.4	110.8	-179.1	-162.5	0	0	0	0	108	K17 P21 E22 A23	K17-S19 PolarHBondContact O-N 3.29Å; S19-P21 VanDerWaalsContact C-CD 3.43Å; S19-E22 WeakPolarHBondContact CB-OE2 3.5Å; S19-E22 PolarHBondContact O-N 3.37Å; S19-A23 PolarHBondContact O-N 3.07Å
20	V	72.1	Confident	63	Low	95 Å²	95	120.8 Å²	120.8	58%	0.576	63%	0.63	S	S	*	*	H	α-helix	trans	-50.8	-39.4	178.1	179.7	0	0	0	0	112	F18 E22 A23 C24	F18-V20 PolarHBondContact O-N 3.29Å; V20-E22 PolarHBondContact O-N 3.39Å; V20-A23 PolarHBondContact O-N 3.15Å; V20-C24 WeakPolarHBondContact O-CB 3.24Å; V20-C24 PolarHBondContact O-N 3.13Å; V20-C24 PolarHBondContact O-SG 3.12Å
21	P	79.8	Confident	65.9	Low	79 Å²	79	120.9 Å²	120.9	51%	0.513	62%	0.621	S	S	.	*	H	α-helix	trans	-51	-51.2	168.4	-30.7	36.9	0	0	0	115.2	S19 A23 C24 D25	S19-P21 VanDerWaalsContact C-CD 3.43Å; P21-A23 VanDerWaalsContact C-N 3.28Å; P21-A23 PolarHBondContact O-N 3.07Å; P21-C24 CarbonylContact O-C 3.55Å; P21-C24 WeakPolarHBondContact O-CB 3.46Å; P21-C24 PolarHBondContact O-N 2.61Å; P21-C24 VanDerWaalsContact O-N 3.12Å; P21-D25 PolarHBondContact O-N 3.03Å
22	E	77.7	Confident	68.8	Low	122 Å²	122	116.8 Å²	116.8	57%	0.57	61%	0.605	S	S	*	*	H	α-helix	trans	-65.1	-31.9	-178.9	-65.7	178.5	119.5	0	0	112.5	S19 V20 K26	S19-E22 WeakPolarHBondContact CB-OE2 3.5Å; S19-E22 PolarHBondContact O-N 3.37Å; V20-E22 PolarHBondContact O-N 3.39Å; E22-K26 WeakPolarHBondContact O-CG 3.4Å; E22-K26 PolarHBondContact O-N 3.11Å; E22-K26 VanDerWaalsContact O-N 3.15Å
23	A	79.2	Confident	71.5	Confident	26 Å²	26	112.8 Å²	112.8	22%	0.215	58%	0.582	C	S	.	*	H	α-helix	trans	-70.1	-43.6	172.4	0	0	0	0	0	111.4	F18 S19 V20 P21 D25 I27	F18-A23 HydrophobicContact CE1-CB 3.75Å; F18-A23 HydrophobicContact CZ-CB 3.9Å; S19-A23 PolarHBondContact O-N 3.07Å; V20-A23 PolarHBondContact O-N 3.15Å; P21-A23 VanDerWaalsContact C-N 3.28Å; P21-A23 PolarHBondContact O-N 3.07Å; A23-D25 VanDerWaalsContact C-N 3.35Å; A23-D25 PolarHBondContact O-N 2.76Å; A23-I27 WeakPolarHBondContact O-CD1 3.41Å; A23-I27 VanDerWaalsContact O-CG1 3.26Å; A23-I27 WeakPolarHBondContact O-CG1 3.42Å; A23-I27 PolarHBondContact O-N 2.72Å
24	C	80.2	Confident	74.4	Confident	59 Å²	59	110.3 Å²	110.3	40%	0.399	57%	0.568	S	S	.	*	H	α-helix	trans	-63.3	-38.2	175.2	-71.7	0	0	0	0	112.7	V20 P21 I27 K28	V20-C24 WeakPolarHBondContact O-CB 3.24Å; V20-C24 PolarHBondContact O-N 3.13Å; V20-C24 PolarHBondContact O-SG 3.12Å; P21-C24 CarbonylContact O-C 3.55Å; P21-C24 WeakPolarHBondContact O-CB 3.46Å; P21-C24 PolarHBondContact O-N 2.61Å; P21-C24 VanDerWaalsContact O-N 3.12Å; C24-I27 PolarHBondContact O-N 2.78Å; C24-K28 WeakPolarHBondContact O-CG 3.39Å; C24-K28 PolarHBondContact O-N 3.21Å
25	D	85	Confident	76.8	Confident	72 Å²	72	108.2 Å²	108.2	39%	0.385	56%	0.558	S	S	.	*	H	α-helix	trans	-71.6	-40.8	179.8	-68	-30.4	0	0	0	111.5	P21 A23 I27 K28 D29	P21-D25 PolarHBondContact O-N 3.03Å; A23-D25 VanDerWaalsContact C-N 3.35Å; A23-D25 PolarHBondContact O-N 2.76Å; D25-I27 VanDerWaalsContact C-N 3.3Å; D25-I27 PolarHBondContact O-N 2.91Å; D25-K28 WeakPolarHBondContact O-CB 3.17Å; D25-K28 PolarHBondContact O-N 3.35Å; D25-K28 VanDerWaalsContact O-N 3.07Å; D25-K28 WeakPolarHBondContact OD1-CE 3.43Å; D25-K28 IonicContact OD1-NZ 2.92Å; D25-K28 PolarHBondContact OD1-NZ 2.86Å; D25-D29 PolarHBondContact O-N 2.93Å
26	K	87.7	Confident	79.4	Confident	141 Å²	141	103.7 Å²	103.7	61%	0.613	54%	0.544	S	S	*	.	H	α-helix	trans	-58.3	-40.3	169.3	-75.6	174.7	-179.9	176.2	0	112.9	E22 K28 D29 E30	E22-K26 WeakPolarHBondContact O-CG 3.4Å; E22-K26 PolarHBondContact O-N 3.11Å; E22-K26 VanDerWaalsContact O-N 3.15Å; K26-K28 VanDerWaalsContact C-N 3.31Å; K26-K28 PolarHBondContact O-N 2.85Å; K26-D29 PolarHBondContact O-N 3.36Å; K26-E30 WeakPolarHBondContact O-CB 3.37Å; K26-E30 WeakPolarHBondContact O-CG 3.38Å; K26-E30 PolarHBondContact O-N 2.93Å
27	I	89.2	Confident	81.5	Confident	111 Å²	111	103.5 Å²	103.5	57%	0.569	54%	0.535	S	S	*	.	H	α-helix	trans	-65.5	-33.9	176.2	-69.7	164.5	0	0	0	111.3	A23 C24 D25 L31	A23-I27 WeakPolarHBondContact O-CD1 3.41Å; A23-I27 VanDerWaalsContact O-CG1 3.26Å; A23-I27 WeakPolarHBondContact O-CG1 3.42Å; A23-I27 PolarHBondContact O-N 2.72Å; C24-I27 PolarHBondContact O-N 2.78Å; D25-I27 VanDerWaalsContact C-N 3.3Å; D25-I27 PolarHBondContact O-N 2.91Å; I27-L31 WeakPolarHBondContact O-CB 3.49Å; I27-L31 PolarHBondContact O-N 2.82Å
28	K	87.8	Confident	83.8	Confident	122 Å²	122	102.6 Å²	102.6	53%	0.53	53%	0.528	S	S	.	.	H	α-helix	trans	-66.4	-44.7	171.9	-66.3	166.9	-164	164.9	0	111.5	C24 D25 K26 L31 L32	C24-K28 WeakPolarHBondContact O-CG 3.39Å; C24-K28 PolarHBondContact O-N 3.21Å; D25-K28 WeakPolarHBondContact O-CB 3.17Å; D25-K28 PolarHBondContact O-N 3.35Å; D25-K28 VanDerWaalsContact O-N 3.07Å; D25-K28 WeakPolarHBondContact OD1-CE 3.43Å; D25-K28 IonicContact OD1-NZ 2.92Å; D25-K28 PolarHBondContact OD1-NZ 2.86Å; K26-K28 VanDerWaalsContact C-N 3.31Å; K26-K28 PolarHBondContact O-N 2.85Å; K28-L31 PolarHBondContact O-N 2.88Å; K28-L32 WeakPolarHBondContact O-CB 3.32Å; K28-L32 PolarHBondContact O-N 3.39Å
29	D	90	Very high	85.5	Confident	112 Å²	112	100 Å²	100	60%	0.599	52%	0.518	S	S	*	.	H	α-helix	trans	-65.2	-42.4	-179.8	-69.5	-21.3	0	0	0	111.5	D25 K26 L32 G33	D25-D29 PolarHBondContact O-N 2.93Å; K26-D29 PolarHBondContact O-N 3.36Å; D29-L32 PolarHBondContact O-N 3.08Å; D29-G33 PolarHBondContact O-N 3.28Å
30	E	90.6	Very high	86.7	Confident	136 Å²	136	101.1 Å²	101.1	64%	0.636	53%	0.526	S	S	*	.	H	α-helix	trans	-62.7	-43	172.9	-74.7	179.1	-170.4	0	0	111.9	K26 G33 L34	K26-E30 WeakPolarHBondContact O-CB 3.37Å; K26-E30 WeakPolarHBondContact O-CG 3.38Å; K26-E30 PolarHBondContact O-N 2.93Å; E30-G33 PolarHBondContact O-N 2.88Å; E30-L34 WeakPolarHBondContact O-CB 3.28Å; E30-L34 PolarHBondContact O-N 3.29Å
31	L	90.1	Very high	87.6	Confident	111 Å²	111	102 Å²	102	58%	0.581	53%	0.527	S	S	*	.	H	α-helix	trans	-63.6	-41.2	176.1	-177.9	65.7	0	0	0	112	I27 K28 L34 Q35	I27-L31 WeakPolarHBondContact O-CB 3.49Å; I27-L31 PolarHBondContact O-N 2.82Å; K28-L31 PolarHBondContact O-N 2.88Å; L31-L34 PolarHBondContact O-N 3.1Å; L31-Q35 WeakPolarHBondContact O-CB 3.42Å; L31-Q35 PolarHBondContact O-N 3.48Å
32	L	90.3	Very high	88.1	Confident	103 Å²	103	101.4 Å²	101.4	54%	0.539	52%	0.516	S	S	.	.	H	α-helix	trans	-68.4	-37.5	177.6	-166.8	70.9	0	0	0	111.4	K28 D29 Q35 T36	K28-L32 WeakPolarHBondContact O-CB 3.32Å; K28-L32 PolarHBondContact O-N 3.39Å; D29-L32 PolarHBondContact O-N 3.08Å; L32-Q35 PolarHBondContact O-N 3.31Å; L32-T36 WeakPolarHBondContact O-CB 3.13Å; L32-T36 PolarHBondContact O-N 3.05Å; L32-T36 PolarHBondContact O-OG1 3.18Å
33	G	91	Very high	88.6	Confident	32 Å²	32	98.6 Å²	98.6	33%	0.33	51%	0.509	S	S	.	.	H	α-helix	trans	-61.5	-48.2	170.6	0	0	0	0	0	112.3	D29 E30 Q35 T36 Q37	D29-G33 PolarHBondContact O-N 3.28Å; E30-G33 PolarHBondContact O-N 2.88Å; G33-Q35 PolarHBondContact O-N 3.29Å; G33-T36 WeakPolarHBondContact O-CB 3.23Å; G33-T36 PolarHBondContact O-N 3.31Å; G33-Q37 WeakPolarHBondContact O-CG 3.44Å; G33-Q37 PolarHBondContact O-N 3.11Å
34	L	90.6	Very high	89	Confident	114 Å²	114	103.3 Å²	103.3	60%	0.597	53%	0.526	S	S	*	.	H	α-helix	trans	-59.2	-44	174	-96.4	152.8	0	0	0	112.4	E30 L31 T36 Q37 Y38	E30-L34 WeakPolarHBondContact O-CB 3.28Å; E30-L34 PolarHBondContact O-N 3.29Å; L31-L34 PolarHBondContact O-N 3.1Å; L34-T36 VanDerWaalsContact C-N 3.31Å; L34-T36 PolarHBondContact O-N 2.84Å; L34-Q37 PolarHBondContact O-N 3.37Å; L34-Y38 WeakPolarHBondContact O-CB 3.32Å; L34-Y38 PolarHBondContact O-N 3.32Å
35	Q	87.8	Confident	89.4	Confident	125 Å²	125	107.1 Å²	107.1	58%	0.584	54%	0.537	S	S	*	.	H	α-helix	trans	-63.5	-37.6	177	-171.6	173.8	4.2	0	0	111.8	L31 L32 G33 H39	L31-Q35 WeakPolarHBondContact O-CB 3.42Å; L31-Q35 PolarHBondContact O-N 3.48Å; L32-Q35 PolarHBondContact O-N 3.31Å; G33-Q35 PolarHBondContact O-N 3.29Å; Q35-H39 PolarHBondContact O-N 2.78Å
36	T	91.1	Very high	89.5	Confident	93 Å²	93	105.7 Å²	105.7	57%	0.571	53%	0.528	S	S	*	.	H	α-helix	trans	-68	-44.1	175.3	-55.6	0	0	0	0	111.6	L32 G33 L34 H39 S40	L32-T36 WeakPolarHBondContact O-CB 3.13Å; L32-T36 PolarHBondContact O-N 3.05Å; L32-T36 PolarHBondContact O-OG1 3.18Å; G33-T36 WeakPolarHBondContact O-CB 3.23Å; G33-T36 PolarHBondContact O-N 3.31Å; L34-T36 VanDerWaalsContact C-N 3.31Å; L34-T36 PolarHBondContact O-N 2.84Å; T36-H39 PolarHBondContact O-N 3.28Å; T36-S40 PolarHBondContact O-N 2.53Å
37	Q	90.5	Very high	89.6	Confident	112 Å²	112	105 Å²	105	52%	0.523	53%	0.525	S	S	.	.	H	α-helix	trans	-63.4	-42.1	175.2	-71.2	-171.6	9.6	0	0	112.1	Y2 G33 L34 H39 S40 L41	Y2-Q37 PolarHBondContact OH-NE2 2.97Å; Y2-Q37 PolarHBondContact OH-OE1 2.91Å; G33-Q37 WeakPolarHBondContact O-CG 3.44Å; G33-Q37 PolarHBondContact O-N 3.11Å; L34-Q37 PolarHBondContact O-N 3.37Å; Q37-H39 VanDerWaalsContact C-N 3.33Å; Q37-H39 PolarHBondContact O-N 2.95Å; Q37-S40 PolarHBondContact O-N 2.94Å; Q37-L41 WeakPolarHBondContact O-CB 3.43Å; Q37-L41 PolarHBondContact O-N 2.82Å
38	Y	90.7	Very high	89.4	Confident	164 Å²	164	102.2 Å²	102.2	64%	0.643	52%	0.518	S	S	*	.	H	α-helix	trans	-59.3	-42.9	174.7	175.5	-97.9	0	0	0	111.9	L34 L41 K42	L34-Y38 WeakPolarHBondContact O-CB 3.32Å; L34-Y38 PolarHBondContact O-N 3.32Å; Y38-L41 PolarHBondContact O-N 2.86Å; Y38-K42 WeakPolarHBondContact O-CB 3.43Å; Y38-K42 PolarHBondContact O-N 2.84Å
39	H	90.4	Very high	89.3	Confident	124 Å²	124	100 Å²	100	57%	0.574	51%	0.514	S	S	*	.	H	α-helix	trans	-64.9	-43.9	176.6	-166.2	73.2	0	0	0	112	Q35 T36 Q37 L41 K42 C43	Q35-H39 PolarHBondContact O-N 2.78Å; T36-H39 PolarHBondContact O-N 3.28Å; Q37-H39 VanDerWaalsContact C-N 3.33Å; Q37-H39 PolarHBondContact O-N 2.95Å; H39-L41 PolarHBondContact O-N 3.15Å; H39-K42 PolarHBondContact O-N 2.9Å; H39-C43 PolarHBondContact O-N 2.97Å; H39-C43 VanDerWaalsContact O-N 3.08Å; H39-C43 PolarHBondContact O-SG 2.77Å; H39-C43 VanDerWaalsContact O-SG 3.39Å
40	S	89.9	Confident	89	Confident	71 Å²	71	100.1 Å²	100.1	50%	0.497	51%	0.512	S	S	.	.	H	α-helix	trans	-60.1	-46	175.8	-166.9	0	0	0	0	112.3	T36 Q37 K42 C43 E44	T36-S40 PolarHBondContact O-N 2.53Å; Q37-S40 PolarHBondContact O-N 2.94Å; S40-K42 VanDerWaalsContact C-N 3.32Å; S40-K42 PolarHBondContact O-N 3.46Å; S40-C43 PolarHBondContact O-N 3.2Å; S40-E44 PolarHBondContact O-N 3.46Å; S40-E44 VanDerWaalsContact O-N 3.07Å
41	L	90.6	Very high	88.8	Confident	113 Å²	113	98 Å²	98	59%	0.592	50%	0.502	S	S	*	.	H	α-helix	trans	-66.9	-33.6	179.4	-173.4	64.6	0	0	0	111.9	Q37 Y38 H39 E44 F45	Q37-L41 WeakPolarHBondContact O-CB 3.43Å; Q37-L41 PolarHBondContact O-N 2.82Å; Y38-L41 PolarHBondContact O-N 2.86Å; H39-L41 PolarHBondContact O-N 3.15Å; L41-E44 PolarHBondContact O-N 3.21Å; L41-F45 WeakPolarHBondContact O-CB 3.45Å; L41-F45 PolarHBondContact O-N 3.47Å
42	K	89.8	Confident	88.5	Confident	67 Å²	67	99 Å²	99	29%	0.291	50%	0.501	S	S	.	.	H	α-helix	trans	-62.4	-44.6	171.8	-178.9	177.2	172.8	177	0	111.5	Y38 H39 S40 F45 E46	Y38-K42 WeakPolarHBondContact O-CB 3.43Å; Y38-K42 PolarHBondContact O-N 2.84Å; H39-K42 PolarHBondContact O-N 2.9Å; S40-K42 VanDerWaalsContact C-N 3.32Å; S40-K42 PolarHBondContact O-N 3.46Å; K42-F45 PolarHBondContact O-N 3.48Å; K42-E46 WeakPolarHBondContact CE-OE1 3.19Å; K42-E46 IonicContact NZ-OE1 3.21Å; K42-E46 PolarHBondContact O-N 3.27Å
43	C	87.4	Confident	88.1	Confident	62 Å²	62	96 Å²	96	42%	0.419	49%	0.49	S	S	.	.	H	α-helix	trans	-64.3	-39	177.4	-66.7	0	0	0	0	112.6	H39 S40 E46 K47	H39-C43 PolarHBondContact O-N 2.97Å; H39-C43 VanDerWaalsContact O-N 3.08Å; H39-C43 PolarHBondContact O-SG 2.77Å; H39-C43 VanDerWaalsContact O-SG 3.39Å; S40-C43 PolarHBondContact O-N 3.2Å; C43-E46 PolarHBondContact O-N 2.67Å; C43-K47 WeakPolarHBondContact O-CB 3.44Å; C43-K47 PolarHBondContact O-N 2.86Å
44	E	88.4	Confident	87.6	Confident	125 Å²	125	99.2 Å²	99.2	58%	0.584	50%	0.496	S	S	*	.	H	α-helix	trans	-64.5	-39.5	173	-71.2	-170.9	157.1	0	0	112.2	S40 L41 K47 A48	S40-E44 PolarHBondContact O-N 3.46Å; S40-E44 VanDerWaalsContact O-N 3.07Å; L41-E44 PolarHBondContact O-N 3.21Å; E44-K47 PolarHBondContact O-N 3.13Å; E44-A48 WeakPolarHBondContact O-CB 3.48Å; E44-A48 PolarHBondContact O-N 3.21Å
45	F	88.2	Confident	87.3	Confident	139 Å²	139	99.4 Å²	99.4	61%	0.61	50%	0.497	S	S	*	.	H	α-helix	trans	-64.7	-45.2	175	-179.5	-94.4	0	0	0	112.4	L41 K42 K47 A48 V49	L41-F45 WeakPolarHBondContact O-CB 3.45Å; L41-F45 PolarHBondContact O-N 3.47Å; K42-F45 PolarHBondContact O-N 3.48Å; F45-K47 VanDerWaalsContact C-N 3.31Å; F45-K47 PolarHBondContact O-N 2.81Å; F45-A48 PolarHBondContact O-N 3.12Å; F45-V49 HydrophobicContact CD1-CG2 4.2Å; F45-V49 HydrophobicContact CE1-CG2 3.77Å; F45-V49 HydrophobicContact CZ-CG2 3.94Å; F45-V49 WeakPolarHBondContact O-CG2 3.11Å; F45-V49 PolarHBondContact O-N 3.48Å
46	E	87.5	Confident	87.1	Confident	43 Å²	43	98.7 Å²	98.7	20%	0.201	49%	0.493	C	S	.	.	H	α-helix	trans	-62.8	-38	176.8	-73.1	177.2	165.4	0	0	111.3	K42 C43 V49 Q50 M313 Q315	K42-E46 WeakPolarHBondContact CE-OE1 3.19Å; K42-E46 IonicContact NZ-OE1 3.21Å; K42-E46 PolarHBondContact O-N 3.27Å; C43-E46 PolarHBondContact O-N 2.67Å; E46-V49 PolarHBondContact O-N 3.02Å; E46-Q50 PolarHBondContact O-N 2.81Å; E46-M313 HydrophobicContact CB-CE 4.44Å; E46-Q315 PolarHBondContact OE1-NE2 2.82Å
47	K	90.3	Very high	86.7	Confident	126 Å²	126	101.7 Å²	101.7	55%	0.548	49%	0.494	S	S	.	.	H	α-helix	trans	-62.4	-44.7	171.3	-176.5	172.5	-178.4	-73.4	0	112.7	C43 E44 F45 V49 Q50 E51	C43-K47 WeakPolarHBondContact O-CB 3.44Å; C43-K47 PolarHBondContact O-N 2.86Å; E44-K47 PolarHBondContact O-N 3.13Å; F45-K47 VanDerWaalsContact C-N 3.31Å; F45-K47 PolarHBondContact O-N 2.81Å; K47-V49 VanDerWaalsContact C-N 3.32Å; K47-V49 PolarHBondContact O-N 2.87Å; K47-Q50 WeakPolarHBondContact O-CB 3.41Å; K47-Q50 PolarHBondContact O-N 3.36Å; K47-E51 IonicContact NZ-OE1 2.59Å; K47-E51 PolarHBondContact NZ-OE1 2.86Å; K47-E51 WeakPolarHBondContact O-CG 3.25Å; K47-E51 PolarHBondContact O-N 2.91Å
48	A	84.5	Confident	86.3	Confident	53 Å²	53	101.2 Å²	101.2	44%	0.438	49%	0.492	S	S	.	.	H	α-helix	trans	-65.8	-33	178	0	0	0	0	0	112.9	E44 F45 K52	E44-A48 WeakPolarHBondContact O-CB 3.48Å; E44-A48 PolarHBondContact O-N 3.21Å; F45-A48 PolarHBondContact O-N 3.12Å; A48-K52 WeakPolarHBondContact O-CB 3.23Å; A48-K52 PolarHBondContact O-N 2.64Å
49	V	85.9	Confident	86	Confident	74 Å²	74	100.6 Å²	100.6	45%	0.448	49%	0.489	S	S	.	.	H	α-helix	trans	-67.2	-41.1	171.8	171	0	0	0	0	111.1	F45 E46 K47 K52 S53	F45-V49 HydrophobicContact CD1-CG2 4.2Å; F45-V49 HydrophobicContact CE1-CG2 3.77Å; F45-V49 HydrophobicContact CZ-CG2 3.94Å; F45-V49 WeakPolarHBondContact O-CG2 3.11Å; F45-V49 PolarHBondContact O-N 3.48Å; E46-V49 PolarHBondContact O-N 3.02Å; K47-V49 VanDerWaalsContact C-N 3.32Å; K47-V49 PolarHBondContact O-N 2.87Å; V49-K52 PolarHBondContact O-N 2.88Å; V49-S53 PolarHBondContact O-N 3.15Å
50	Q	84.4	Confident	85.4	Confident	115 Å²	115	99.5 Å²	99.5	54%	0.537	49%	0.487	S	S	.	.	H	α-helix	trans	-60.2	-52.4	174.9	-163.9	74.5	10.2	0	0	111.1	E46 K47 K52 S53 E54	E46-Q50 PolarHBondContact O-N 2.81Å; K47-Q50 WeakPolarHBondContact O-CB 3.41Å; K47-Q50 PolarHBondContact O-N 3.36Å; Q50-K52 VanDerWaalsContact C-N 3.33Å; Q50-K52 PolarHBondContact O-N 2.86Å; Q50-S53 WeakPolarHBondContact O-CB 3.43Å; Q50-S53 PolarHBondContact O-N 3.47Å; Q50-S53 PolarHBondContact O-OG 2.83Å; Q50-E54 PolarHBondContact O-N 2.87Å
51	E	85.5	Confident	85	Confident	92 Å²	92	100.3 Å²	100.3	43%	0.43	49%	0.486	S	S	.	.	H	α-helix	trans	-59.2	-40.5	178.4	-73.1	173.2	-179.4	0	0	112.4	K47 S53 E54 L55	K47-E51 IonicContact NZ-OE1 2.59Å; K47-E51 PolarHBondContact NZ-OE1 2.86Å; K47-E51 WeakPolarHBondContact O-CG 3.25Å; K47-E51 PolarHBondContact O-N 2.91Å; E51-S53 PolarHBondContact O-N 2.89Å; E51-E54 PolarHBondContact O-N 2.83Å; E51-L55 WeakPolarHBondContact O-CB 3.38Å; E51-L55 PolarHBondContact O-N 3.01Å
52	K	84.5	Confident	84.6	Confident	131 Å²	131	98 Å²	98	57%	0.57	47%	0.469	S	S	*	.	H	α-helix	trans	-59.8	-45.1	172.7	-179.9	-171.8	171	-171.4	0	111.6	A48 V49 Q50 E54 L55 Q56	A48-K52 WeakPolarHBondContact O-CB 3.23Å; A48-K52 PolarHBondContact O-N 2.64Å; V49-K52 PolarHBondContact O-N 2.88Å; Q50-K52 VanDerWaalsContact C-N 3.33Å; Q50-K52 PolarHBondContact O-N 2.86Å; K52-E54 PolarHBondContact O-N 2.89Å; K52-L55 PolarHBondContact O-N 2.57Å; K52-Q56 WeakPolarHBondContact O-CG 3.46Å; K52-Q56 PolarHBondContact O-N 2.89Å
53	S	81.2	Confident	84.2	Confident	42 Å²	42	101.3 Å²	101.3	29%	0.294	48%	0.481	S	S	.	.	H	α-helix	trans	-63.8	-33	179.5	82.2	0	0	0	0	112.2	V49 Q50 E51 R57	V49-S53 PolarHBondContact O-N 3.15Å; Q50-S53 WeakPolarHBondContact O-CB 3.43Å; Q50-S53 PolarHBondContact O-N 3.47Å; Q50-S53 PolarHBondContact O-OG 2.83Å; E51-S53 PolarHBondContact O-N 2.89Å; S53-R57 PolarHBondContact O-N 2.8Å; S53-R57 VanDerWaalsContact O-N 3.09Å
54	E	80.4	Confident	83.7	Confident	98 Å²	98	103 Å²	103	46%	0.458	48%	0.483	S	S	.	.	H	α-helix	trans	-74.2	-43.4	177.3	-166.6	173.9	157.5	0	0	112	Q50 E51 K52 Q56 R57 H58	Q50-E54 PolarHBondContact O-N 2.87Å; E51-E54 PolarHBondContact O-N 2.83Å; K52-E54 PolarHBondContact O-N 2.89Å; E54-Q56 VanDerWaalsContact C-N 3.31Å; E54-Q56 PolarHBondContact O-N 3.27Å; E54-R57 WeakPolarHBondContact O-CB 3.32Å; E54-R57 PolarHBondContact O-N 3.05Å; E54-R57 VanDerWaalsContact O-N 3.16Å; E54-H58 PolarHBondContact O-N 3.43Å; E54-H58 PolarHBondContact O-ND1 3.21Å; E54-H58 IonicContact OE1-CE1 2.65Å
55	L	84.1	Confident	83.2	Confident	119 Å²	119	101.3 Å²	101.3	62%	0.623	48%	0.477	S	S	*	.	H	α-helix	trans	-58.5	-40.1	170	-89.8	160.6	0	0	0	112.5	E51 K52 H58 Y59	E51-L55 WeakPolarHBondContact O-CB 3.38Å; E51-L55 PolarHBondContact O-N 3.01Å; K52-L55 PolarHBondContact O-N 2.57Å; L55-H58 PolarHBondContact O-N 2.95Å; L55-Y59 WeakPolarHBondContact O-CB 3.34Å; L55-Y59 PolarHBondContact O-N 2.86Å
56	Q	84.3	Confident	82.7	Confident	109 Å²	109	97.7 Å²	97.7	51%	0.509	47%	0.466	S	S	.	.	H	α-helix	trans	-65.2	-39.3	174.8	-72.3	-175.6	-90.1	0	0	112	K52 E54 Y59 L60	K52-Q56 WeakPolarHBondContact O-CG 3.46Å; K52-Q56 PolarHBondContact O-N 2.89Å; E54-Q56 VanDerWaalsContact C-N 3.31Å; E54-Q56 PolarHBondContact O-N 3.27Å; Q56-Y59 PolarHBondContact O-N 3.22Å; Q56-L60 VanDerWaalsContact O-CD1 3.23Å; Q56-L60 WeakPolarHBondContact O-CD1 3.28Å; Q56-L60 PolarHBondContact O-N 2.78Å
57	R	82.5	Confident	82.1	Confident	157 Å²	157	101.5 Å²	101.5	59%	0.592	48%	0.479	S	S	*	.	H	α-helix	trans	-64.7	-44.3	174.8	-170.3	-177.8	-63.5	97.2	3.3	112	S53 E54 Y59 L60 L61	S53-R57 PolarHBondContact O-N 2.8Å; S53-R57 VanDerWaalsContact O-N 3.09Å; E54-R57 WeakPolarHBondContact O-CB 3.32Å; E54-R57 PolarHBondContact O-N 3.05Å; E54-R57 VanDerWaalsContact O-N 3.16Å; R57-Y59 VanDerWaalsContact C-N 3.32Å; R57-Y59 PolarHBondContact O-N 2.93Å; R57-L60 PolarHBondContact O-N 3.3Å; R57-L61 WeakPolarHBondContact O-CB 3.28Å; R57-L61 PolarHBondContact O-N 3.35Å
58	H	82.9	Confident	81.4	Confident	101 Å²	101	97.4 Å²	97.4	47%	0.468	47%	0.473	S	S	.	.	H	α-helix	trans	-64.1	-35.4	174.7	-70.3	135.6	0	0	0	112.6	E54 L55 Y62	E54-H58 PolarHBondContact O-N 3.43Å; E54-H58 PolarHBondContact O-ND1 3.21Å; E54-H58 IonicContact OE1-CE1 2.65Å; L55-H58 PolarHBondContact O-N 2.95Å; H58-Y62 VanDerWaalsContact O-CB 3.31Å; H58-Y62 WeakPolarHBondContact O-CB 3.47Å; H58-Y62 PolarHBondContact O-N 2.77Å
59	Y	82.7	Confident	81	Confident	152 Å²	152	100.5 Å²	100.5	60%	0.596	48%	0.482	S	S	*	.	H	α-helix	trans	-66.4	-43.7	175.2	-177.2	-95.8	0	0	0	112.7	L55 Q56 R57 Y62 Y63	L55-Y59 WeakPolarHBondContact O-CB 3.34Å; L55-Y59 PolarHBondContact O-N 2.86Å; Q56-Y59 PolarHBondContact O-N 3.22Å; R57-Y59 VanDerWaalsContact C-N 3.32Å; R57-Y59 PolarHBondContact O-N 2.93Å; Y59-Y62 PolarHBondContact O-N 3.44Å; Y59-Y63 WeakPolarHBondContact O-CB 3.35Å; Y59-Y63 PolarHBondContact O-N 3.15Å
60	L	78.1	Confident	80.7	Confident	101 Å²	101	100.2 Å²	100.2	53%	0.529	48%	0.477	S	S	.	.	H	α-helix	trans	-62.2	-48	173.6	-91.8	85.1	0	0	0	111.3	Q56 R57 Y62 Y63 E64	Q56-L60 VanDerWaalsContact O-CD1 3.23Å; Q56-L60 WeakPolarHBondContact O-CD1 3.28Å; Q56-L60 PolarHBondContact O-N 2.78Å; R57-L60 PolarHBondContact O-N 3.3Å; L60-Y62 VanDerWaalsContact C-N 3.32Å; L60-Y62 PolarHBondContact O-N 2.81Å; L60-Y63 WeakPolarHBondContact O-CB 3.44Å; L60-Y63 PolarHBondContact O-N 3.28Å; L60-E64 WeakPolarHBondContact O-CG 3.46Å; L60-E64 PolarHBondContact O-N 2.82Å
61	L	81.9	Confident	80.4	Confident	88 Å²	88	98.1 Å²	98.1	46%	0.461	47%	0.472	S	S	.	.	H	α-helix	trans	-58.7	-42.8	178.6	-179	62.9	0	0	0	112.1	R57 E64 I65	R57-L61 WeakPolarHBondContact O-CB 3.28Å; R57-L61 PolarHBondContact O-N 3.35Å; L61-E64 PolarHBondContact O-N 3Å; L61-I65 HydrophobicContact CD1-CD1 3.9Å; L61-I65 HydrophobicContact CD1-CG1 4.32Å; L61-I65 HydrophobicContact CG-CD1 3.89Å; L61-I65 WeakPolarHBondContact O-CB 3.38Å; L61-I65 VanDerWaalsContact O-CG1 3.26Å; L61-I65 WeakPolarHBondContact O-CG1 3.36Å; L61-I65 PolarHBondContact O-N 3.27Å
62	Y	82.3	Confident	79.8	Confident	63 Å²	63	97.1 Å²	97.1	25%	0.247	47%	0.468	C	S	.	.	H	α-helix	trans	-62.6	-41.5	174.2	176.5	-102.2	0	0	0	112.2	H58 Y59 L60 T66 F146 Q153	H58-Y62 VanDerWaalsContact O-CB 3.31Å; H58-Y62 WeakPolarHBondContact O-CB 3.47Å; H58-Y62 PolarHBondContact O-N 2.77Å; Y59-Y62 PolarHBondContact O-N 3.44Å; L60-Y62 VanDerWaalsContact C-N 3.32Å; L60-Y62 PolarHBondContact O-N 2.81Å; Y62-T66 WeakPolarHBondContact O-CB 3.32Å; Y62-T66 PolarHBondContact O-N 2.97Å; Y62-T66 PolarHBondContact O-OG1 3.25Å; Y62-F146 HydrophobicContact CE2-CE2 4.42Å; Y62-Q153 PolarHBondContact OH-OE1 3.03Å
63	Y	80.4	Confident	79.5	Confident	137 Å²	137	96.2 Å²	96.2	54%	0.537	47%	0.467	S	S	.	.	H	α-helix	trans	-64.6	-45.4	177.5	-172.5	-91.5	0	0	0	111.8	Y59 L60 T66 Y67	Y59-Y63 WeakPolarHBondContact O-CB 3.35Å; Y59-Y63 PolarHBondContact O-N 3.15Å; L60-Y63 WeakPolarHBondContact O-CB 3.44Å; L60-Y63 PolarHBondContact O-N 3.28Å; Y63-T66 PolarHBondContact O-N 3.02Å; Y63-Y67 WeakPolarHBondContact O-CB 3.18Å; Y63-Y67 PolarHBondContact O-N 2.88Å
64	E	77.5	Confident	79.3	Confident	98 Å²	98	98.9 Å²	98.9	46%	0.458	48%	0.475	S	S	.	.	H	α-helix	trans	-62.7	-47.9	177.9	-72.3	175.9	167.4	0	0	111.9	L60 L61 Y67 G68	L60-E64 WeakPolarHBondContact O-CG 3.46Å; L60-E64 PolarHBondContact O-N 2.82Å; L61-E64 PolarHBondContact O-N 3Å; E64-Y67 PolarHBondContact O-N 3.34Å; E64-G68 PolarHBondContact O-N 2.79Å
65	I	78.9	Confident	79.4	Confident	90 Å²	90	99.3 Å²	99.3	46%	0.462	48%	0.475	S	S	.	.	H	α-helix	trans	-60.5	-48.3	176	-69.3	168.4	0	0	0	110.6	L61 Y67 G68 L69	L61-I65 HydrophobicContact CD1-CD1 3.9Å; L61-I65 HydrophobicContact CD1-CG1 4.32Å; L61-I65 HydrophobicContact CG-CD1 3.89Å; L61-I65 WeakPolarHBondContact O-CB 3.38Å; L61-I65 VanDerWaalsContact O-CG1 3.26Å; L61-I65 WeakPolarHBondContact O-CG1 3.36Å; L61-I65 PolarHBondContact O-N 3.27Å; I65-Y67 VanDerWaalsContact C-N 3.35Å; I65-Y67 PolarHBondContact O-N 2.73Å; I65-G68 PolarHBondContact O-N 3.39Å; I65-L69 HydrophobicContact CG2-CD1 3.83Å; I65-L69 HydrophobicContact CG2-CG 4.42Å; I65-L69 WeakPolarHBondContact O-CB 3.46Å; I65-L69 VanDerWaalsContact O-CG 3.29Å; I65-L69 WeakPolarHBondContact O-CG 3.48Å; I65-L69 PolarHBondContact O-N 2.94Å
66	T	77	Confident	79.1	Confident	62 Å²	62	97.3 Å²	97.3	38%	0.38	46%	0.463	S	S	.	.	H	α-helix	trans	-64.3	-39.9	-179	-57.3	0	0	0	0	111.7	Y62 Y63 N70	Y62-T66 WeakPolarHBondContact O-CB 3.32Å; Y62-T66 PolarHBondContact O-N 2.97Å; Y62-T66 PolarHBondContact O-OG1 3.25Å; Y63-T66 PolarHBondContact O-N 3.02Å; T66-N70 WeakPolarHBondContact O-CB 3.36Å; T66-N70 PolarHBondContact O-N 3.09Å
67	Y	74.2	Confident	78.8	Confident	123 Å²	123	96.2 Å²	96.2	48%	0.482	46%	0.458	S	S	.	.	H	α-helix	trans	-68.1	-45.3	177.6	-166.7	-91.4	0	0	0	111.7	Y63 E64 I65 N70 V71	Y63-Y67 WeakPolarHBondContact O-CB 3.18Å; Y63-Y67 PolarHBondContact O-N 2.88Å; E64-Y67 PolarHBondContact O-N 3.34Å; I65-Y67 VanDerWaalsContact C-N 3.35Å; I65-Y67 PolarHBondContact O-N 2.73Å; Y67-N70 PolarHBondContact O-N 3.37Å; Y67-V71 HydrophobicContact CD1-CG2 3.95Å; Y67-V71 HydrophobicContact CE1-CG2 3.67Å; Y67-V71 WeakPolarHBondContact O-CG2 3.41Å; Y67-V71 PolarHBondContact O-N 2.95Å
68	G	76.8	Confident	78.7	Confident	40 Å²	40	92.2 Å²	92.2	41%	0.412	45%	0.446	S	S	.	.	H	α-helix	trans	-59.7	-46.9	176.3	0	0	0	0	0	112.6	E64 I65 N70 V71 E72	E64-G68 PolarHBondContact O-N 2.79Å; I65-G68 PolarHBondContact O-N 3.39Å; G68-N70 PolarHBondContact O-N 2.85Å; G68-V71 PolarHBondContact O-N 2.85Å; G68-E72 PolarHBondContact O-N 2.72Å
69	L	76.5	Confident	78.7	Confident	118 Å²	118	91.2 Å²	91.2	62%	0.618	44%	0.443	S	S	*	.	H	α-helix	trans	-60.5	-41.8	174.7	-72.4	172.4	0	0	0	112.1	I65 E72 M73	I65-L69 HydrophobicContact CG2-CD1 3.83Å; I65-L69 HydrophobicContact CG2-CG 4.42Å; I65-L69 WeakPolarHBondContact O-CB 3.46Å; I65-L69 VanDerWaalsContact O-CG 3.29Å; I65-L69 WeakPolarHBondContact O-CG 3.48Å; I65-L69 PolarHBondContact O-N 2.94Å; L69-E72 PolarHBondContact O-N 3Å; L69-M73 VanDerWaalsContact O-CB 3.25Å; L69-M73 WeakPolarHBondContact O-CB 3.38Å; L69-M73 PolarHBondContact O-N 2.95Å
70	N	77.7	Confident	78.5	Confident	68 Å²	68	86.7 Å²	86.7	36%	0.364	44%	0.438	S	S	.	.	H	α-helix	trans	-68.2	-37.6	179	-174	64.3	0	0	0	112.7	T66 Y67 G68 M73 H74	T66-N70 WeakPolarHBondContact O-CB 3.36Å; T66-N70 PolarHBondContact O-N 3.09Å; Y67-N70 PolarHBondContact O-N 3.37Å; G68-N70 PolarHBondContact O-N 2.85Å; N70-M73 VanDerWaalsContact OD1-CE 3.24Å; N70-M73 WeakPolarHBondContact OD1-CE 3.4Å; N70-H74 PolarHBondContact O-N 2.86Å
71	V	78.6	Confident	78.8	Confident	71 Å²	71	87.3 Å²	87.3	43%	0.43	44%	0.436	S	S	.	.	H	α-helix	trans	-64.4	-46.6	173.8	169.7	0	0	0	0	110.9	Y67 G68 H74 K75	Y67-V71 HydrophobicContact CD1-CG2 3.95Å; Y67-V71 HydrophobicContact CE1-CG2 3.67Å; Y67-V71 WeakPolarHBondContact O-CG2 3.41Å; Y67-V71 PolarHBondContact O-N 2.95Å; G68-V71 PolarHBondContact O-N 2.85Å; V71-H74 PolarHBondContact O-N 3.01Å; V71-K75 PolarHBondContact O-N 3.18Å
72	E	73.5	Confident	79.1	Confident	72 Å²	72	88.5 Å²	88.5	34%	0.336	43%	0.434	S	S	.	.	H	α-helix	trans	-67.1	-39.8	178.9	-171.3	56.3	-147.4	0	0	111.7	G68 L69 H74 K75 Q76	G68-E72 PolarHBondContact O-N 2.72Å; L69-E72 PolarHBondContact O-N 3Å; E72-H74 PolarHBondContact O-N 2.79Å; E72-K75 WeakPolarHBondContact O-CB 3.33Å; E72-K75 PolarHBondContact O-N 2.91Å; E72-K75 VanDerWaalsContact O-N 3.15Å; E72-K75 IonicContact OE1-NZ 3.01Å; E72-K75 PolarHBondContact OE1-NZ 3.02Å; E72-K75 WeakPolarHBondContact OE2-CD 3.34Å; E72-K75 IonicContact OE2-NZ 2.67Å; E72-K75 PolarHBondContact OE2-NZ 2.81Å; E72-Q76 HydrophobicContact CG-CG 4.45Å; E72-Q76 WeakPolarHBondContact O-CG 3.35Å; E72-Q76 PolarHBondContact O-N 3.08Å; E72-Q76 PolarHBondContact OE1-NE2 2.86Å
73	M	77.8	Confident	79.2	Confident	111 Å²	111	90.2 Å²	90.2	55%	0.547	45%	0.447	S	S	.	.	H	α-helix	trans	-58.2	-44	172.8	-178.7	-176.6	66.1	0	0	112	L69 N70 Q76 M77	L69-M73 VanDerWaalsContact O-CB 3.25Å; L69-M73 WeakPolarHBondContact O-CB 3.38Å; L69-M73 PolarHBondContact O-N 2.95Å; N70-M73 VanDerWaalsContact OD1-CE 3.24Å; N70-M73 WeakPolarHBondContact OD1-CE 3.4Å; M73-Q76 PolarHBondContact O-N 3.03Å; M73-M77 WeakPolarHBondContact O-CB 3.48Å; M73-M77 PolarHBondContact O-N 3.03Å
74	H	76.5	Confident	79.3	Confident	99 Å²	99	86.8 Å²	86.8	46%	0.458	44%	0.438	S	S	.	.	H	α-helix	trans	-64.4	-39	174.6	-80.3	-5.5	0	0	0	112.6	N70 V71 E72 M77 E78	N70-H74 PolarHBondContact O-N 2.86Å; V71-H74 PolarHBondContact O-N 3.01Å; E72-H74 PolarHBondContact O-N 2.79Å; H74-M77 PolarHBondContact O-N 3.27Å; H74-E78 WeakPolarHBondContact O-CB 3.47Å; H74-E78 PolarHBondContact O-N 2.87Å
75	K	82.4	Confident	79.6	Confident	106 Å²	106	84.3 Å²	84.3	46%	0.461	43%	0.434	S	S	.	.	H	α-helix	trans	-62.4	-47.1	174.6	164.7	163.5	159.3	-87.2	0	111.9	V71 E72 E78 I79	V71-K75 PolarHBondContact O-N 3.18Å; E72-K75 WeakPolarHBondContact O-CB 3.33Å; E72-K75 PolarHBondContact O-N 2.91Å; E72-K75 VanDerWaalsContact O-N 3.15Å; E72-K75 IonicContact OE1-NZ 3.01Å; E72-K75 PolarHBondContact OE1-NZ 3.02Å; E72-K75 WeakPolarHBondContact OE2-CD 3.34Å; E72-K75 IonicContact OE2-NZ 2.67Å; E72-K75 PolarHBondContact OE2-NZ 2.81Å; K75-E78 PolarHBondContact O-N 2.71Å; K75-I79 HydrophobicContact CG-CD1 4.01Å; K75-I79 VanDerWaalsContact O-CG1 3.31Å; K75-I79 WeakPolarHBondContact O-CG1 3.34Å; K75-I79 PolarHBondContact O-N 2.95Å
76	Q	77.9	Confident	79.9	Confident	78 Å²	78	84.9 Å²	84.9	36%	0.364	44%	0.438	S	S	.	.	H	α-helix	trans	-66.3	-40.1	177	-64.5	-59.8	-19.8	0	0	112.4	E72 M73 E78 I79 A80	E72-Q76 HydrophobicContact CG-CG 4.45Å; E72-Q76 WeakPolarHBondContact O-CG 3.35Å; E72-Q76 PolarHBondContact O-N 3.08Å; E72-Q76 PolarHBondContact OE1-NE2 2.86Å; M73-Q76 PolarHBondContact O-N 3.03Å; Q76-E78 VanDerWaalsContact C-N 3.32Å; Q76-E78 PolarHBondContact O-N 2.75Å; Q76-I79 PolarHBondContact O-N 3.32Å; Q76-A80 WeakPolarHBondContact O-CB 3.36Å; Q76-A80 PolarHBondContact O-N 3.34Å
77	M	78.2	Confident	80.1	Confident	85 Å²	85	84 Å²	84	42%	0.419	43%	0.43	S	S	.	.	H	α-helix	trans	-59.7	-40.6	173.3	176.6	-179.5	50.9	0	0	112.2	M73 H74 A80 K81	M73-M77 WeakPolarHBondContact O-CB 3.48Å; M73-M77 PolarHBondContact O-N 3.03Å; H74-M77 PolarHBondContact O-N 3.27Å; M77-A80 PolarHBondContact O-N 2.56Å; M77-K81 HydrophobicContact CG-CD 4.34Å; M77-K81 VanDerWaalsContact O-CG 3.3Å; M77-K81 WeakPolarHBondContact O-CG 3.5Å; M77-K81 PolarHBondContact O-N 2.85Å
78	E	81.4	Confident	80.5	Confident	74 Å²	74	82.6 Å²	82.6	35%	0.346	43%	0.434	S	S	.	.	H	α-helix	trans	-71.4	-37.8	178.4	-179.2	60.8	-170.5	0	0	112.3	H74 K75 Q76 K81 R82	H74-E78 WeakPolarHBondContact O-CB 3.47Å; H74-E78 PolarHBondContact O-N 2.87Å; K75-E78 PolarHBondContact O-N 2.71Å; Q76-E78 VanDerWaalsContact C-N 3.32Å; Q76-E78 PolarHBondContact O-N 2.75Å; E78-K81 PolarHBondContact O-N 3.44Å; E78-R82 WeakPolarHBondContact O-CG 3.49Å; E78-R82 PolarHBondContact O-N 3.27Å; E78-R82 IonicContact OE1-CZ 3.84Å; E78-R82 IonicContact OE1-NE 2.7Å; E78-R82 PolarHBondContact OE1-NE 2.69Å; E78-R82 IonicContact OE1-NH2 2.65Å; E78-R82 PolarHBondContact OE1-NH2 3.02Å
79	I	82.6	Confident	80.9	Confident	79 Å²	79	87.3 Å²	87.3	41%	0.405	45%	0.446	S	S	.	.	H	α-helix	trans	-60	-48.5	171	-68.7	163.6	0	0	0	110	K75 Q76 K81 R82 L83	K75-I79 HydrophobicContact CG-CD1 4.01Å; K75-I79 VanDerWaalsContact O-CG1 3.31Å; K75-I79 WeakPolarHBondContact O-CG1 3.34Å; K75-I79 PolarHBondContact O-N 2.95Å; Q76-I79 PolarHBondContact O-N 3.32Å; I79-K81 PolarHBondContact O-N 2.94Å; I79-R82 PolarHBondContact O-N 2.79Å; I79-L83 WeakPolarHBondContact O-CB 3.48Å; I79-L83 PolarHBondContact O-N 3.47Å
80	A	78	Confident	81.1	Confident	57 Å²	57	85 Å²	85	47%	0.471	44%	0.436	S	S	.	.	H	α-helix	trans	-60.3	-42	178.3	0	0	0	0	0	112.6	Q76 M77 L83 N84	Q76-A80 WeakPolarHBondContact O-CB 3.36Å; Q76-A80 PolarHBondContact O-N 3.34Å; M77-A80 PolarHBondContact O-N 2.56Å; A80-L83 PolarHBondContact O-N 2.92Å; A80-N84 VanDerWaalsContact O-CB 3.29Å; A80-N84 WeakPolarHBondContact O-CB 3.47Å; A80-N84 PolarHBondContact O-N 2.8Å
81	K	84.9	Confident	81.3	Confident	114 Å²	114	83.7 Å²	83.7	50%	0.496	43%	0.429	S	S	.	.	H	α-helix	trans	-59	-46.8	174	-76.8	169.5	-177.1	172.5	0	112.1	M77 E78 I79 A85	M77-K81 HydrophobicContact CG-CD 4.34Å; M77-K81 VanDerWaalsContact O-CG 3.3Å; M77-K81 WeakPolarHBondContact O-CG 3.5Å; M77-K81 PolarHBondContact O-N 2.85Å; E78-K81 PolarHBondContact O-N 3.44Å; I79-K81 PolarHBondContact O-N 2.94Å; K81-A85 WeakPolarHBondContact O-CB 3.41Å; K81-A85 PolarHBondContact O-N 2.98Å
82	R	88.2	Confident	81.4	Confident	113 Å²	113	84.4 Å²	84.4	43%	0.426	44%	0.435	S	S	.	.	H	α-helix	trans	-67	-42.4	179.5	-69.9	175.3	-171.6	-152.4	0.9	112.1	E78 I79 A85 I86	E78-R82 WeakPolarHBondContact O-CG 3.49Å; E78-R82 PolarHBondContact O-N 3.27Å; E78-R82 IonicContact OE1-CZ 3.84Å; E78-R82 IonicContact OE1-NE 2.7Å; E78-R82 PolarHBondContact OE1-NE 2.69Å; E78-R82 IonicContact OE1-NH2 2.65Å; E78-R82 PolarHBondContact OE1-NH2 3.02Å; I79-R82 PolarHBondContact O-N 2.79Å; R82-A85 PolarHBondContact O-N 2.88Å; R82-I86 WeakPolarHBondContact O-CG1 3.16Å; R82-I86 PolarHBondContact O-N 3.15Å
83	L	83.9	Confident	81.8	Confident	99 Å²	99	89.6 Å²	89.6	52%	0.518	46%	0.457	S	S	.	.	H	α-helix	trans	-64.2	-42.5	178.4	-157.2	161.1	0	0	0	110.5	I79 A80 I86 L87	I79-L83 WeakPolarHBondContact O-CB 3.48Å; I79-L83 PolarHBondContact O-N 3.47Å; A80-L83 PolarHBondContact O-N 2.92Å; L83-I86 PolarHBondContact O-N 2.87Å; L83-L87 HydrophobicContact CD2-CD1 3.48Å; L83-L87 VanDerWaalsContact CD2-CD1 3.48Å; L83-L87 HydrophobicContact CD2-CG 4.07Å; L83-L87 WeakPolarHBondContact O-CB 3.3Å; L83-L87 WeakPolarHBondContact O-CG 3.48Å; L83-L87 PolarHBondContact O-N 3.22Å
84	N	83.3	Confident	81.9	Confident	65 Å²	65	87.2 Å²	87.2	35%	0.348	45%	0.446	S	S	.	.	H	α-helix	trans	-63.1	-40.1	172	-174.1	76	0	0	0	112.6	A80 L87 V88	A80-N84 VanDerWaalsContact O-CB 3.29Å; A80-N84 WeakPolarHBondContact O-CB 3.47Å; A80-N84 PolarHBondContact O-N 2.8Å; N84-L87 PolarHBondContact O-N 3.5Å; N84-V88 WeakPolarHBondContact O-CG2 3.49Å; N84-V88 PolarHBondContact O-N 2.97Å
85	A	83.9	Confident	82.1	Confident	46 Å²	46	85.5 Å²	85.5	38%	0.38	45%	0.445	S	S	.	.	H	α-helix	trans	-65.2	-38.3	175.7	0	0	0	0	0	113	K81 R82 Q89	K81-A85 WeakPolarHBondContact O-CB 3.41Å; K81-A85 PolarHBondContact O-N 2.98Å; R82-A85 PolarHBondContact O-N 2.88Å; A85-Q89 WeakPolarHBondContact O-CG 3.32Å; A85-Q89 PolarHBondContact O-N 2.84Å
86	I	85.2	Confident	81.9	Confident	103 Å²	103	88.5 Å²	88.5	53%	0.528	46%	0.461	S	S	.	.	H	α-helix	trans	-66	-45	173.5	-68.3	163.4	0	0	0	110.3	R82 L83 V88 Q89 V90	R82-I86 WeakPolarHBondContact O-CG1 3.16Å; R82-I86 PolarHBondContact O-N 3.15Å; L83-I86 PolarHBondContact O-N 2.87Å; I86-V88 VanDerWaalsContact C-N 3.34Å; I86-V88 PolarHBondContact O-N 2.92Å; I86-Q89 PolarHBondContact O-N 3.48Å; I86-V90 HydrophobicContact CG2-CG2 4.11Å; I86-V90 WeakPolarHBondContact O-CG2 3.44Å; I86-V90 PolarHBondContact O-N 2.91Å
87	L	80.5	Confident	81.9	Confident	42 Å²	42	92.2 Å²	92.2	22%	0.22	48%	0.478	C	S	.	.	H	α-helix	trans	-58	-44.4	176.6	-76.7	164.2	0	0	0	112.1	L83 N84 Q89 V90 I91 V102 V106	L83-L87 HydrophobicContact CD2-CD1 3.48Å; L83-L87 VanDerWaalsContact CD2-CD1 3.48Å; L83-L87 HydrophobicContact CD2-CG 4.07Å; L83-L87 WeakPolarHBondContact O-CB 3.3Å; L83-L87 WeakPolarHBondContact O-CG 3.48Å; L83-L87 PolarHBondContact O-N 3.22Å; N84-L87 PolarHBondContact O-N 3.5Å; L87-Q89 PolarHBondContact O-N 3.22Å; L87-V90 PolarHBondContact O-N 3.22Å; L87-V90 VanDerWaalsContact O-N 3.13Å; L87-I91 HydrophobicContact CB-CD1 4.44Å; L87-I91 WeakPolarHBondContact O-CB 3.47Å; L87-I91 WeakPolarHBondContact O-CD1 3.5Å; L87-I91 WeakPolarHBondContact O-CG1 3.38Å; L87-I91 PolarHBondContact O-N 2.97Å; L87-V102 HydrophobicContact CD2-CG1 4.06Å; L87-V106 HydrophobicContact CD1-CG2 3.65Å
88	V	83.2	Confident	82	Confident	95 Å²	95	92.5 Å²	92.5	58%	0.576	48%	0.478	S	S	*	.	H	α-helix	trans	-59.8	-32.7	175.5	169.1	0	0	0	0	112.3	N84 I86 P92	N84-V88 WeakPolarHBondContact O-CG2 3.49Å; N84-V88 PolarHBondContact O-N 2.97Å; I86-V88 VanDerWaalsContact C-N 3.34Å; I86-V88 PolarHBondContact O-N 2.92Å; V88-P92 VanDerWaalsContact O-CD 3.28Å; V88-P92 WeakPolarHBondContact O-CD 3.37Å
89	Q	83.8	Confident	82.1	Confident	139 Å²	139	91.7 Å²	91.7	65%	0.65	48%	0.475	S	S	*	.	H	α-helix	trans	-78.8	-32.2	174.6	-67.4	178.1	26.4	0	0	113.3	A85 I86 L87 F93	A85-Q89 WeakPolarHBondContact O-CG 3.32Å; A85-Q89 PolarHBondContact O-N 2.84Å; I86-Q89 PolarHBondContact O-N 3.48Å; L87-Q89 PolarHBondContact O-N 3.22Å; Q89-F93 VanDerWaalsContact O-CD2 3.25Å; Q89-F93 WeakPolarHBondContact O-CD2 3.48Å; Q89-F93 VanDerWaalsContact O-CE2 3.23Å; Q89-F93 WeakPolarHBondContact O-CE2 3.26Å
90	V	81.5	Confident	82	Confident	69 Å²	69	92 Å²	92	42%	0.418	48%	0.483	S	S	.	.	H	α-helix	trans	-84.4	-35.4	-176.3	172.6	0	0	0	0	112.8	I86 L87 F93	I86-V90 HydrophobicContact CG2-CG2 4.11Å; I86-V90 WeakPolarHBondContact O-CG2 3.44Å; I86-V90 PolarHBondContact O-N 2.91Å; L87-V90 PolarHBondContact O-N 3.22Å; L87-V90 VanDerWaalsContact O-N 3.13Å; V90-F93 PolarHBondContact O-N 2.96Å
91	I	81.7	Confident	82.2	Confident	40 Å²	40	95.7 Å²	95.7	21%	0.205	49%	0.491	C	S	.	.	G	3₁₀ helix	trans	-49.8	-47.5	-178.5	-77.1	163.4	0	0	0	112.7	L87 F93 L94 Q99 V102	L87-I91 HydrophobicContact CB-CD1 4.44Å; L87-I91 WeakPolarHBondContact O-CB 3.47Å; L87-I91 WeakPolarHBondContact O-CD1 3.5Å; L87-I91 WeakPolarHBondContact O-CG1 3.38Å; L87-I91 PolarHBondContact O-N 2.97Å; I91-F93 PolarHBondContact O-N 2.86Å; I91-L94 PolarHBondContact O-N 2.88Å; I91-Q99 HydrophobicContact CG2-CB 4.29Å; I91-Q99 HydrophobicContact CG2-CG 4.07Å; I91-Q99 VanDerWaalsContact O-CG 3.27Å; I91-Q99 WeakPolarHBondContact O-CG 3.27Å; I91-Q99 PolarHBondContact O-NE2 2.86Å; I91-Q99 VanDerWaalsContact O-NE2 3.1Å; I91-V102 HydrophobicContact CD1-CG1 4.16Å; I91-V102 HydrophobicContact CG1-CG1 4.02Å
92	P	81.2	Confident	81.9	Confident	86 Å²	86	92.3 Å²	92.3	56%	0.558	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-56.2	-20.2	177.9	-28.5	36.6	0	0	0	116.2	V88	V88-P92 VanDerWaalsContact O-CD 3.28Å; V88-P92 WeakPolarHBondContact O-CD 3.37Å
93	F	80.7	Confident	81.5	Confident	182 Å²	182	88.8 Å²	88.8	80%	0.798	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-94.6	-5.6	179.4	-59.2	-77.7	0	0	0	113.9	Q89 V90 I91	Q89-F93 VanDerWaalsContact O-CD2 3.25Å; Q89-F93 WeakPolarHBondContact O-CD2 3.48Å; Q89-F93 VanDerWaalsContact O-CE2 3.23Å; Q89-F93 WeakPolarHBondContact O-CE2 3.26Å; V90-F93 PolarHBondContact O-N 2.96Å; I91-F93 PolarHBondContact O-N 2.86Å
94	L	80.6	Confident	81.4	Confident	60 Å²	60	87 Å²	87	31%	0.314	48%	0.475	S	S	.	.	S	Bend	trans	-84	158.2	175.1	-63.5	175.8	0	0	0	111.7	I91 H98 Q99 V102	I91-L94 PolarHBondContact O-N 2.88Å; L94-H98 HydrophobicContact CB-CB 4.22Å; L94-Q99 HydrophobicContact CB-CG 3.94Å; L94-Q99 PolarHBondContact O-NE2 2.62Å; L94-V102 HydrophobicContact CD1-CG2 3.97Å
95	S	82	Confident	81.1	Confident	64 Å²	64	86.8 Å²	86.8	45%	0.448	48%	0.482	S	S	.	.			trans	-62.8	149.2	169.2	55.5	0	0	0	0	111.1	E97 H98 Q99	S95-E97 PolarHBondContact O-N 2.84Å; S95-E97 VanDerWaalsContact O-N 3.09Å; S95-H98 PolarHBondContact O-N 2.76Å; S95-H98 PolarHBondContact OG-ND1 3.49Å; S95-H98 VanDerWaalsContact OG-ND1 3.11Å; S95-Q99 WeakPolarHBondContact O-CG 3.4Å; S95-Q99 PolarHBondContact O-N 3.36Å
96	Q	77.9	Confident	80.9	Confident	168 Å²	168	86 Å²	86	79%	0.785	47%	0.472	S	S	*	.	H	α-helix	trans	-57.6	-30.9	-171.1	-161.7	175.7	21.2	0	0	114	S100	Q96-S100 PolarHBondContact O-N 2.84Å
97	E	78	Confident	80.7	Confident	157 Å²	157	84.8 Å²	84.8	73%	0.734	47%	0.467	S	S	*	.	H	α-helix	trans	-68.1	-49.7	173.2	-174.5	170.8	-160.9	0	0	111.9	S95 Q99 S100 Q101	S95-E97 PolarHBondContact O-N 2.84Å; S95-E97 VanDerWaalsContact O-N 3.09Å; E97-Q99 VanDerWaalsContact C-N 3.32Å; E97-Q99 PolarHBondContact O-N 3.3Å; E97-S100 PolarHBondContact O-N 2.92Å; E97-Q101 PolarHBondContact O-N 3.43Å; E97-Q101 VanDerWaalsContact O-N 3.14Å
98	H	80.5	Confident	80.7	Confident	91 Å²	91	91.5 Å²	91.5	42%	0.421	49%	0.489	S	S	.	.	H	α-helix	trans	-65.4	-32.7	175.9	-65.8	162.3	0	0	0	112.5	L94 S95 S100 Q101 V102	L94-H98 HydrophobicContact CB-CB 4.22Å; S95-H98 PolarHBondContact O-N 2.76Å; S95-H98 PolarHBondContact OG-ND1 3.49Å; S95-H98 VanDerWaalsContact OG-ND1 3.11Å; H98-S100 PolarHBondContact O-N 2.91Å; H98-Q101 PolarHBondContact O-N 3.29Å; H98-V102 WeakPolarHBondContact O-CB 3.3Å; H98-V102 VanDerWaalsContact O-CG2 3.31Å; H98-V102 WeakPolarHBondContact O-CG2 3.29Å; H98-V102 PolarHBondContact O-N 2.94Å
99	Q	82.1	Confident	80.2	Confident	57 Å²	57	89.8 Å²	89.8	27%	0.266	49%	0.485	S	S	.	.	H	α-helix	trans	-56.8	-49	174.1	-72.4	-177.8	-4.3	0	0	111.6	I91 L94 S95 E97 A103	I91-Q99 HydrophobicContact CG2-CB 4.29Å; I91-Q99 HydrophobicContact CG2-CG 4.07Å; I91-Q99 VanDerWaalsContact O-CG 3.27Å; I91-Q99 WeakPolarHBondContact O-CG 3.27Å; I91-Q99 PolarHBondContact O-NE2 2.86Å; I91-Q99 VanDerWaalsContact O-NE2 3.1Å; L94-Q99 HydrophobicContact CB-CG 3.94Å; L94-Q99 PolarHBondContact O-NE2 2.62Å; S95-Q99 WeakPolarHBondContact O-CG 3.4Å; S95-Q99 PolarHBondContact O-N 3.36Å; E97-Q99 VanDerWaalsContact C-N 3.32Å; E97-Q99 PolarHBondContact O-N 3.3Å; Q99-A103 WeakPolarHBondContact O-CB 3.33Å; Q99-A103 PolarHBondContact O-N 2.95Å
100	S	81.4	Confident	79.7	Confident	84 Å²	84	85.6 Å²	85.6	59%	0.587	47%	0.465	S	S	*	.	H	α-helix	trans	-64	-43.9	178.1	-175.8	0	0	0	0	111.7	Q96 E97 H98 A103 A104	Q96-S100 PolarHBondContact O-N 2.84Å; E97-S100 PolarHBondContact O-N 2.92Å; H98-S100 PolarHBondContact O-N 2.91Å; S100-A103 PolarHBondContact O-N 3.14Å; S100-A104 WeakPolarHBondContact O-CB 3.46Å; S100-A104 PolarHBondContact O-N 3.25Å
101	Q	82.2	Confident	79.5	Confident	135 Å²	135	89 Å²	89	63%	0.631	48%	0.476	S	S	*	.	H	α-helix	trans	-66.5	-39.9	-178.4	-160.6	174.1	44.2	0	0	112.7	E97 H98 A105	E97-Q101 PolarHBondContact O-N 3.43Å; E97-Q101 VanDerWaalsContact O-N 3.14Å; H98-Q101 PolarHBondContact O-N 3.29Å; Q101-A105 WeakPolarHBondContact O-CB 3.47Å; Q101-A105 PolarHBondContact O-N 3.45Å; Q101-A105 VanDerWaalsContact O-N 3.08Å
102	V	78.7	Confident	79	Confident	43 Å²	43	88.4 Å²	88.4	26%	0.261	47%	0.474	S	S	.	.	H	α-helix	trans	-68.6	-44.1	174.9	170.7	0	0	0	0	111.1	L87 I91 L94 H98 A104 A105 V106	L87-V102 HydrophobicContact CD2-CG1 4.06Å; I91-V102 HydrophobicContact CD1-CG1 4.16Å; I91-V102 HydrophobicContact CG1-CG1 4.02Å; L94-V102 HydrophobicContact CD1-CG2 3.97Å; H98-V102 WeakPolarHBondContact O-CB 3.3Å; H98-V102 VanDerWaalsContact O-CG2 3.31Å; H98-V102 WeakPolarHBondContact O-CG2 3.29Å; H98-V102 PolarHBondContact O-N 2.94Å; V102-A104 PolarHBondContact O-N 3.17Å; V102-A105 PolarHBondContact O-N 3.42Å; V102-V106 HydrophobicContact CG1-CG2 4.31Å; V102-V106 WeakPolarHBondContact O-CB 3.42Å; V102-V106 VanDerWaalsContact O-CG2 3.25Å; V102-V106 WeakPolarHBondContact O-CG2 3.4Å; V102-V106 PolarHBondContact O-N 2.8Å
103	A	79	Confident	78.7	Confident	40 Å²	40	87.4 Å²	87.4	33%	0.331	47%	0.466	S	S	.	.	H	α-helix	trans	-58.9	-46.5	176.6	0	0	0	0	0	111.9	Q99 S100 A105 V106 D107	Q99-A103 WeakPolarHBondContact O-CB 3.33Å; Q99-A103 PolarHBondContact O-N 2.95Å; S100-A103 PolarHBondContact O-N 3.14Å; A103-A105 PolarHBondContact O-N 2.94Å; A103-V106 PolarHBondContact O-N 2.85Å; A103-D107 PolarHBondContact O-N 2.83Å
104	A	81.8	Confident	77.7	Confident	62 Å²	62	84.9 Å²	84.9	51%	0.512	46%	0.461	S	S	.	.	H	α-helix	trans	-62.9	-37.9	176.9	0	0	0	0	0	113.1	S100 V102 R108	S100-A104 WeakPolarHBondContact O-CB 3.46Å; S100-A104 PolarHBondContact O-N 3.25Å; V102-A104 PolarHBondContact O-N 3.17Å; A104-R108 VanDerWaalsContact O-CB 3.31Å; A104-R108 WeakPolarHBondContact O-CB 3.49Å; A104-R108 PolarHBondContact O-N 3.3Å
105	A	78	Confident	77.3	Confident	60 Å²	60	86.5 Å²	86.5	50%	0.496	48%	0.477	S	S	.	.	H	α-helix	trans	-66.3	-40.3	174.8	0	0	0	0	0	112.2	Q101 V102 A103 R108 A109	Q101-A105 WeakPolarHBondContact O-CB 3.47Å; Q101-A105 PolarHBondContact O-N 3.45Å; Q101-A105 VanDerWaalsContact O-N 3.08Å; V102-A105 PolarHBondContact O-N 3.42Å; A103-A105 PolarHBondContact O-N 2.94Å; A105-R108 PolarHBondContact O-N 2.8Å; A105-A109 PolarHBondContact O-N 2.79Å
106	V	78.9	Confident	76.7	Confident	29 Å²	29	87 Å²	87	18%	0.176	47%	0.472	C	S	.	.	H	α-helix	trans	-66.7	-42.7	178	168.9	0	0	0	0	111.6	L87 V102 A103 A109 K110	L87-V106 HydrophobicContact CD1-CG2 3.65Å; V102-V106 HydrophobicContact CG1-CG2 4.31Å; V102-V106 WeakPolarHBondContact O-CB 3.42Å; V102-V106 VanDerWaalsContact O-CG2 3.25Å; V102-V106 WeakPolarHBondContact O-CG2 3.4Å; V102-V106 PolarHBondContact O-N 2.8Å; A103-V106 PolarHBondContact O-N 2.85Å; V106-A109 PolarHBondContact O-N 2.91Å; V106-K110 WeakPolarHBondContact O-CG 3.5Å; V106-K110 PolarHBondContact O-N 2.93Å
107	D	80.3	Confident	75.9	Confident	78 Å²	78	79.3 Å²	79.3	42%	0.417	44%	0.436	S	S	.	.	H	α-helix	trans	-73.1	-29.7	177.3	-73	-23.7	0	0	0	112.7	A103 K110 Q111	A103-D107 PolarHBondContact O-N 2.83Å; D107-K110 WeakPolarHBondContact O-CB 3.11Å; D107-K110 PolarHBondContact O-N 3.04Å; D107-K110 WeakPolarHBondContact OD1-CE 3.48Å; D107-K110 IonicContact OD1-NZ 3.62Å; D107-K110 PolarHBondContact OD1-NZ 2.77Å; D107-Q111 WeakPolarHBondContact O-CG 3.36Å
108	R	81.4	Confident	75.1	Confident	182 Å²	182	75.1 Å²	75.1	69%	0.687	43%	0.425	S	S	*	.	H	α-helix	trans	-64	-42.6	169.5	-170.5	178.9	-170.6	167.2	4.4	112.2	A104 A105 K110 Q111 V112	A104-R108 VanDerWaalsContact O-CB 3.31Å; A104-R108 WeakPolarHBondContact O-CB 3.49Å; A104-R108 PolarHBondContact O-N 3.3Å; A105-R108 PolarHBondContact O-N 2.8Å; R108-K110 PolarHBondContact O-N 2.85Å; R108-Q111 PolarHBondContact O-N 2.95Å; R108-V112 PolarHBondContact O-N 3.46Å
109	A	72.1	Confident	74.4	Confident	59 Å²	59	73.9 Å²	73.9	49%	0.488	43%	0.426	S	S	.	.	H	α-helix	trans	-61.7	-24.3	178	0	0	0	0	0	113.3	A105 V106 Q111	A105-A109 PolarHBondContact O-N 2.79Å; V106-A109 PolarHBondContact O-N 2.91Å; A109-Q111 VanDerWaalsContact C-N 3.33Å
110	K	74.1	Confident	73.4	Confident	51 Å²	51	75 Å²	75	22%	0.222	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-11.5	174.7	-63.9	170	-165.7	165.2	0	114.2	V106 D107 R108 A496 A497 V498	V106-K110 WeakPolarHBondContact O-CG 3.5Å; V106-K110 PolarHBondContact O-N 2.93Å; D107-K110 WeakPolarHBondContact O-CB 3.11Å; D107-K110 PolarHBondContact O-N 3.04Å; D107-K110 WeakPolarHBondContact OD1-CE 3.48Å; D107-K110 IonicContact OD1-NZ 3.62Å; D107-K110 PolarHBondContact OD1-NZ 2.77Å; R108-K110 PolarHBondContact O-N 2.85Å; K110-A496 CarbonylContact O-C 3.59Å; K110-A497 PolarHBondContact O-N 2.9Å; K110-A497 VanDerWaalsContact O-N 3.09Å; K110-V498 HydrophobicContact CB-CB 3.88Å; K110-V498 HydrophobicContact CD-CB 3.93Å; K110-V498 HydrophobicContact CD-CG1 4.17Å; K110-V498 HydrophobicContact CG-CB 3.77Å; K110-V498 HydrophobicContact CG-CG2 4.23Å; K110-V498 PolarHBondContact O-N 3.3Å
111	Q	77.7	Confident	72.5	Confident	141 Å²	141	73 Å²	73	66%	0.659	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.1	1.7	-165.8	-69	-176.1	14.5	0	0	115.2	D107 R108 A109	D107-Q111 WeakPolarHBondContact O-CG 3.36Å; R108-Q111 PolarHBondContact O-N 2.95Å; A109-Q111 VanDerWaalsContact C-N 3.33Å
112	V	71.5	Confident	70.8	Confident	27 Å²	27	68.7 Å²	68.7	16%	0.164	41%	0.407	C	S	.	.			trans	-57.6	152.7	175.5	171	0	0	0	0	110.8	R108 E116 L117 A495 A496	R108-V112 PolarHBondContact O-N 3.46Å; V112-E116 WeakPolarHBondContact CA-OE2 3.44Å; V112-E116 HydrophobicContact CG1-CB 3.76Å; V112-L117 HydrophobicContact CG1-CD1 4.1Å; V112-A495 CarbonylContact C-O 3.53Å; V112-A495 HydrophobicContact CB-CB 3.58Å; V112-A495 WeakPolarHBondContact CB-O 3.29Å; V112-A495 HydrophobicContact CG1-CB 3.87Å; V112-A495 WeakPolarHBondContact CG1-O 3.26Å; V112-A495 HydrophobicContact CG2-CB 4.01Å; V112-A496 VanDerWaalsContact O-CA 3.24Å; V112-A496 WeakPolarHBondContact O-CA 3.39Å; V112-A496 VanDerWaalsContact O-CB 3.31Å; V112-A496 WeakPolarHBondContact O-CB 3.29Å
113	T	73.8	Confident	69.3	Low	65 Å²	65	73.2 Å²	73.2	40%	0.399	43%	0.427	S	S	.	.			trans	-114.7	158.9	-167.3	61.8	0	0	0	0	113.2	S115 E116 L117	T113-S115 PolarHBondContact O-N 2.86Å; T113-S115 VanDerWaalsContact O-N 3.07Å; T113-E116 WeakPolarHBondContact CB-OE2 3.45Å; T113-E116 PolarHBondContact N-OE2 2.77Å; T113-E116 PolarHBondContact O-N 3.41Å; T113-E116 PolarHBondContact OG1-N 3.09Å; T113-E116 PolarHBondContact OG1-OE2 2.94Å; T113-L117 PolarHBondContact O-N 3.46Å
114	L	60.7	Low	67.6	Low	130 Å²	130	76.2 Å²	76.2	68%	0.681	44%	0.438	S	S	*	.	H	α-helix	trans	-54.2	-26.6	174.1	-105	164.9	0	0	0	113.7	L117 S118	L114-L117 HydrophobicContact CD2-CD2 4Å; L114-L117 HydrophobicContact CG-CD2 4.45Å; L114-L117 VanDerWaalsContact O-CB 3.3Å; L114-L117 WeakPolarHBondContact O-CB 3.22Å; L114-S118 PolarHBondContact O-N 3.11Å; L114-S118 PolarHBondContact O-OG 3.37Å
115	S	70.9	Confident	65.7	Low	94 Å²	94	81.1 Å²	81.1	66%	0.657	45%	0.45	S	S	*	.	H	α-helix	trans	-76.5	-40.2	175.4	-58	0	0	0	0	113	T113 S118 S119	T113-S115 PolarHBondContact O-N 2.86Å; T113-S115 VanDerWaalsContact O-N 3.07Å; S115-S118 PolarHBondContact O-N 3.01Å; S115-S119 PolarHBondContact O-N 2.83Å; S115-S119 VanDerWaalsContact O-N 3.11Å
116	E	70.1	Confident	63.8	Low	73 Å²	73	82.9 Å²	82.9	34%	0.341	46%	0.459	S	S	.	.	H	α-helix	trans	-68.9	-39.5	173.7	-71.9	162.7	118.2	0	0	111.1	V112 T113 S118 S119 I120	V112-E116 WeakPolarHBondContact CA-OE2 3.44Å; V112-E116 HydrophobicContact CG1-CB 3.76Å; T113-E116 WeakPolarHBondContact CB-OE2 3.45Å; T113-E116 PolarHBondContact N-OE2 2.77Å; T113-E116 PolarHBondContact O-N 3.41Å; T113-E116 PolarHBondContact OG1-N 3.09Å; T113-E116 PolarHBondContact OG1-OE2 2.94Å; E116-S118 VanDerWaalsContact C-N 3.26Å; E116-S118 PolarHBondContact O-N 2.66Å; E116-S119 PolarHBondContact O-N 2.85Å; E116-S119 VanDerWaalsContact O-N 3.11Å; E116-S119 PolarHBondContact O-OG 3.13Å; E116-I120 WeakPolarHBondContact O-CG1 3.15Å; E116-I120 PolarHBondContact O-N 2.87Å
117	L	61.1	Low	61.5	Low	7 Å²	7	90.5 Å²	90.5	4%	0.037	49%	0.489	C	S	.	.	H	α-helix	trans	-46.2	-51.5	166	-112.6	63.2	0	0	0	112.1	V112 T113 L114 S119 I121 Q493	V112-L117 HydrophobicContact CG1-CD1 4.1Å; T113-L117 PolarHBondContact O-N 3.46Å; L114-L117 HydrophobicContact CD2-CD2 4Å; L114-L117 HydrophobicContact CG-CD2 4.45Å; L114-L117 VanDerWaalsContact O-CB 3.3Å; L114-L117 WeakPolarHBondContact O-CB 3.22Å; L117-S119 VanDerWaalsContact C-N 3.32Å; L117-S119 PolarHBondContact O-N 3.48Å; L117-I121 WeakPolarHBondContact O-CB 3.34Å; L117-I121 WeakPolarHBondContact O-CG1 3.14Å; L117-I121 PolarHBondContact O-N 2.95Å; L117-I121 VanDerWaalsContact O-N 3.16Å; L117-Q493 HydrophobicContact CD2-CB 3.94Å; L117-Q493 HydrophobicContact CD2-CG 3.9Å; L117-Q493 HydrophobicContact CG-CB 4.13Å; L117-Q493 HydrophobicContact CG-CG 3.94Å
118	S	60.6	Low	59.1	Low	70 Å²	70	89.2 Å²	89.2	49%	0.49	49%	0.494	S	S	.	.	H	α-helix	trans	-69.5	-27.9	-177.3	-57.8	0	0	0	0	112.6	L114 S115 E116 G122	L114-S118 PolarHBondContact O-N 3.11Å; L114-S118 PolarHBondContact O-OG 3.37Å; S115-S118 PolarHBondContact O-N 3.01Å; E116-S118 VanDerWaalsContact C-N 3.26Å; E116-S118 PolarHBondContact O-N 2.66Å; S118-G122 PolarHBondContact O-N 2.84Å; S118-G122 VanDerWaalsContact O-N 3.17Å
119	S	65.4	Low	56.8	Low	65 Å²	65	85.7 Å²	85.7	46%	0.455	50%	0.495	S	S	.	.	H	α-helix	trans	-79.5	-38.7	176.8	72.9	0	0	0	0	112.8	S115 E116 L117 I121 G122 M123	S115-S119 PolarHBondContact O-N 2.83Å; S115-S119 VanDerWaalsContact O-N 3.11Å; E116-S119 PolarHBondContact O-N 2.85Å; E116-S119 VanDerWaalsContact O-N 3.11Å; E116-S119 PolarHBondContact O-OG 3.13Å; L117-S119 VanDerWaalsContact C-N 3.32Å; L117-S119 PolarHBondContact O-N 3.48Å; S119-I121 VanDerWaalsContact C-N 3.29Å; S119-I121 PolarHBondContact O-N 3.46Å; S119-G122 PolarHBondContact O-N 3.28Å; S119-G122 VanDerWaalsContact O-N 3.16Å; S119-M123 WeakPolarHBondContact O-CG 3.32Å; S119-M123 PolarHBondContact O-N 2.96Å; S119-M123 VanDerWaalsContact O-N 3.14Å
120	I	62.1	Low	54.7	Low	79 Å²	79	92.7 Å²	92.7	41%	0.405	52%	0.515	S	S	.	.	H	α-helix	trans	-60.4	-44.5	173.5	-59.8	159.7	0	0	0	109.6	E116 G122 M123 A492	E116-I120 WeakPolarHBondContact O-CG1 3.15Å; E116-I120 PolarHBondContact O-N 2.87Å; I120-G122 VanDerWaalsContact C-N 3.33Å; I120-G122 PolarHBondContact O-N 2.92Å; I120-M123 PolarHBondContact O-N 3.08Å; I120-M123 VanDerWaalsContact O-N 3.14Å; I120-A492 HydrophobicContact CB-CB 4.32Å; I120-A492 HydrophobicContact CG2-CB 3.61Å
121	I	61.7	Low	52.6	Low	43 Å²	43	100 Å²	100	22%	0.221	55%	0.547	C	S	.	.	H	α-helix	trans	-54.8	-43.9	172.9	-83.3	179.9	0	0	0	112.6	L117 S119 M123 F489 Q493	L117-I121 WeakPolarHBondContact O-CB 3.34Å; L117-I121 WeakPolarHBondContact O-CG1 3.14Å; L117-I121 PolarHBondContact O-N 2.95Å; L117-I121 VanDerWaalsContact O-N 3.16Å; S119-I121 VanDerWaalsContact C-N 3.29Å; S119-I121 PolarHBondContact O-N 3.46Å; I121-M123 VanDerWaalsContact C-N 3.33Å; I121-M123 PolarHBondContact O-N 3.29Å; I121-F489 HydrophobicContact CB-CE1 4.12Å; I121-F489 HydrophobicContact CB-CE2 4.38Å; I121-F489 HydrophobicContact CB-CZ 3.78Å; I121-F489 HydrophobicContact CD1-CD1 4.36Å; I121-F489 HydrophobicContact CD1-CE1 4Å; I121-F489 HydrophobicContact CG1-CD1 4.11Å; I121-F489 HydrophobicContact CG1-CE1 3.63Å; I121-F489 HydrophobicContact CG1-CE2 4.17Å; I121-F489 HydrophobicContact CG1-CZ 3.69Å; I121-F489 HydrophobicContact CG2-CE1 3.83Å; I121-F489 HydrophobicContact CG2-CZ 3.6Å; I121-F489 WeakPolarHBondContact O-CZ 3.39Å; I121-Q493 HydrophobicContact CD1-CG 4.02Å
122	G	47.6	Very low	50.3	Low	44 Å²	44	101.2 Å²	101.2	45%	0.454	56%	0.557	S	S	.	*	H	α-helix	trans	-74.8	-13.1	178.6	0	0	0	0	0	115.4	S118 S119 I120	S118-G122 PolarHBondContact O-N 2.84Å; S118-G122 VanDerWaalsContact O-N 3.17Å; S119-G122 PolarHBondContact O-N 3.28Å; S119-G122 VanDerWaalsContact O-N 3.16Å; I120-G122 VanDerWaalsContact C-N 3.33Å; I120-G122 PolarHBondContact O-N 2.92Å
123	M	47.2	Very low	48.1	Very low	139 Å²	139	108.3 Å²	108.3	69%	0.685	59%	0.594	S	S	*	*	H	α-helix	trans	-83.9	-29.5	-178.4	-75.1	-176.6	75.6	0	0	113.5	S119 I120 I121 S126	S119-M123 WeakPolarHBondContact O-CG 3.32Å; S119-M123 PolarHBondContact O-N 2.96Å; S119-M123 VanDerWaalsContact O-N 3.14Å; I120-M123 PolarHBondContact O-N 3.08Å; I120-M123 VanDerWaalsContact O-N 3.14Å; I121-M123 VanDerWaalsContact C-N 3.33Å; I121-M123 PolarHBondContact O-N 3.29Å; M123-S126 WeakPolarHBondContact O-CB 3.33Å; M123-S126 PolarHBondContact O-N 3.16Å; M123-S126 PolarHBondContact O-OG 3.4Å
124	D	43.3	Very low	45.9	Very low	102 Å²	102	108.6 Å²	108.6	55%	0.545	61%	0.61	S	S	.	*	H	α-helix	trans	-76.2	-21.2	-176.7	-112.4	-14.1	0	0	0	113.8	S126 K127 F489	D124-S126 PolarHBondContact O-N 2.89Å; D124-K127 PolarHBondContact O-N 3.19Å; D124-F489 HydrophobicContact CB-CE2 4.28Å
125	E	40.5	Very low	44.2	Very low	165 Å²	165	108.5 Å²	108.5	77%	0.771	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-57.4	-19.3	171.1	-73.4	-157.8	105.3	0	0	113	K127	E125-K127 PolarHBondContact O-N 2.84Å
126	S	38.8	Very low	42.3	Very low	97 Å²	97	111.7 Å²	111.7	68%	0.678	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-69.9	-7.9	179.1	69	0	0	0	0	115	M123 D124	M123-S126 WeakPolarHBondContact O-CB 3.33Å; M123-S126 PolarHBondContact O-N 3.16Å; M123-S126 PolarHBondContact O-OG 3.4Å; D124-S126 PolarHBondContact O-N 2.89Å
127	K	30.6	Very low	40.2	Very low	189 Å²	189	110.9 Å²	110.9	82%	0.822	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-133	29.4	-175.4	-70.5	-175.2	-179.5	172.1	0	115.8	D124 E125	D124-K127 PolarHBondContact O-N 3.19Å; E125-K127 PolarHBondContact O-N 2.84Å
128	G	30.1	Very low	38.7	Very low	51 Å²	51	116.1 Å²	116.1	53%	0.526	68%	0.677	S	S	.	*	S	Bend	trans	-139.4	133.7	170.5	0	0	0	0	0	113	K130	G128-K130 PolarHBondContact O-N 2.9Å
129	P	33.1	Very low	37.2	Very low	109 Å²	109	118.1 Å²	118.1	71%	0.708	69%	0.687	S	S	*	*			trans	-83.1	105.2	-174.3	31.6	-34	0	0	0	113.7	F131	P129-F131 VanDerWaalsContact O-CD2 3.25Å; P129-F131 WeakPolarHBondContact O-CD2 3.43Å; P129-F131 PolarHBondContact O-N 3Å
130	K	27.9	Very low	35.6	Very low	205 Å²	205	123.2 Å²	123.2	89%	0.891	70%	0.701	S	S	*	*			trans	40.7	71.5	141.5	-59.4	-178.3	178.4	179.8	0	117.5	G128	G128-K130 PolarHBondContact O-N 2.9Å
131	F	29	Very low	34.5	Very low	204 Å²	204	125.2 Å²	125.2	90%	0.895	71%	0.712	S	S	*	*			trans	-116.5	37.2	168.4	-87.5	-75.5	0	0	0	114.4	P129	P129-F131 VanDerWaalsContact O-CD2 3.25Å; P129-F131 WeakPolarHBondContact O-CD2 3.43Å; P129-F131 PolarHBondContact O-N 3Å
132	L	29.4	Very low	33.4	Very low	168 Å²	168	130.4 Å²	130.4	88%	0.88	74%	0.736	S	S	*	*			trans	-128.6	77.9	166.1	-84.9	173.9	0	0	0	110.9
133	N	26.8	Very low	32.8	Very low	176 Å²	176	135 Å²	135	94%	0.941	75%	0.748	S	S	*	*			trans	-158.1	70.5	160.4	-135.3	-3.4	0	0	0	110.8
134	G	26.6	Very low	32.3	Very low	70 Å²	70	132.1 Å²	132.1	72%	0.722	74%	0.735	S	S	*	*			trans	-142.1	113.7	178.3	0	0	0	0	0	109.4	L136	G134-L136 PolarHBondContact O-N 3Å
135	S	26.4	Very low	32.2	Very low	128 Å²	128	133.7 Å²	133.7	90%	0.895	74%	0.737	S	S	*	*			trans	-67.5	114.1	-164	-170.7	0	0	0	0	113.7
136	L	30.1	Very low	32.2	Very low	161 Å²	161	131.1 Å²	131.1	84%	0.843	72%	0.723	S	S	*	*			trans	-132.7	142	151.9	-89.8	169.4	0	0	0	108.1	G134	G134-L136 PolarHBondContact O-N 3Å
137	G	26.9	Very low	32.4	Very low	57 Å²	57	132.3 Å²	132.3	59%	0.588	72%	0.716	S	S	*	*			trans	-82	159.1	-175.1	0	0	0	0	0	113.8
138	S	27.7	Very low	33.1	Very low	116 Å²	116	127.2 Å²	127.2	81%	0.811	70%	0.701	S	S	*	*			trans	50.5	64.5	164.7	56.3	0	0	0	0	116.4
139	T	29.8	Very low	33.5	Very low	112 Å²	112	128.1 Å²	128.1	69%	0.687	69%	0.693	S	S	*	*			trans	-116.9	74.6	163.5	58	0	0	0	0	110.7
140	F	32.6	Very low	34	Very low	173 Å²	173	128 Å²	128	76%	0.759	68%	0.682	S	S	*	*	S	Bend	trans	-140.6	-38.1	168.6	-149.5	-98.1	0	0	0	112.7	Q142 M143	F140-Q142 PolarHBondContact O-N 2.87Å; F140-Q142 VanDerWaalsContact O-N 3.1Å; F140-M143 PolarHBondContact O-N 2.95Å
141	D	38	Very low	34.7	Very low	120 Å²	120	123.4 Å²	123.4	64%	0.642	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	-19.7	-178.4	-51.4	-80.2	0	0	0	114.5	M143 D144 F145	D141-M143 VanDerWaalsContact C-N 3.25Å; D141-M143 PolarHBondContact O-N 3.06Å; D141-D144 PolarHBondContact O-N 3.37Å; D141-F145 PolarHBondContact O-N 2.88Å; D141-F145 VanDerWaalsContact O-N 3.14Å
142	Q	38.4	Very low	35.2	Very low	152 Å²	152	119.7 Å²	119.7	71%	0.71	65%	0.649	S	S	*	*	H	α-helix	trans	-65.6	-26.1	-176.2	-155.1	169.7	18.4	0	0	113.1	F140 F146	F140-Q142 PolarHBondContact O-N 2.87Å; F140-Q142 VanDerWaalsContact O-N 3.1Å; Q142-F146 PolarHBondContact O-N 2.85Å; Q142-F146 VanDerWaalsContact O-N 3.17Å
143	M	35.1	Very low	35.6	Very low	142 Å²	142	116.6 Å²	116.6	70%	0.7	63%	0.631	S	S	*	*	H	α-helix	trans	-71.2	-37.5	174.4	-82.4	-83	-86.3	0	0	112.9	F140 D141 F146 K147	F140-M143 PolarHBondContact O-N 2.95Å; D141-M143 VanDerWaalsContact C-N 3.25Å; D141-M143 PolarHBondContact O-N 3.06Å; M143-F146 WeakPolarHBondContact O-CB 3.22Å; M143-F146 PolarHBondContact O-N 2.89Å; M143-K147 PolarHBondContact O-N 3.43Å
144	D	38.1	Very low	36.1	Very low	77 Å²	77	113.8 Å²	113.8	41%	0.412	62%	0.615	S	S	.	*	H	α-helix	trans	-80	-25.6	178.2	-73.9	-40	0	0	0	112.3	D141 K147 T148	D141-D144 PolarHBondContact O-N 3.37Å; D144-K147 WeakPolarHBondContact OD1-CD 3.34Å; D144-K147 IonicContact OD1-NZ 2.73Å; D144-K147 PolarHBondContact OD1-NZ 2.98Å; D144-T148 WeakPolarHBondContact O-CB 3.44Å; D144-T148 PolarHBondContact O-N 2.91Å; D144-T148 PolarHBondContact O-OG1 2.89Å
145	F	40.1	Very low	36.4	Very low	135 Å²	135	114.9 Å²	114.9	59%	0.592	60%	0.604	S	S	*	*	H	α-helix	trans	-62.9	-41.5	163.8	-166.3	-107.7	0	0	0	111.8	D141 T148 M149	D141-F145 PolarHBondContact O-N 2.88Å; D141-F145 VanDerWaalsContact O-N 3.14Å; F145-T148 PolarHBondContact O-N 2.92Å; F145-M149 HydrophobicContact CD1-CE 4.14Å; F145-M149 HydrophobicContact CE1-CE 3.41Å; F145-M149 VanDerWaalsContact CE1-CE 3.41Å; F145-M149 HydrophobicContact CZ-CE 3.94Å; F145-M149 PolarHBondContact O-N 3Å
146	F	41.5	Very low	36.8	Very low	112 Å²	112	116.2 Å²	116.2	49%	0.491	60%	0.598	S	S	.	*	H	α-helix	trans	-62	-45.6	175.5	-169.7	-92	0	0	0	112.1	Y62 Q142 M143 T148 M149 Q150	Y62-F146 HydrophobicContact CE2-CE2 4.42Å; Q142-F146 PolarHBondContact O-N 2.85Å; Q142-F146 VanDerWaalsContact O-N 3.17Å; M143-F146 WeakPolarHBondContact O-CB 3.22Å; M143-F146 PolarHBondContact O-N 2.89Å; F146-T148 PolarHBondContact O-N 2.75Å; F146-M149 PolarHBondContact O-N 3.48Å; F146-Q150 WeakPolarHBondContact O-CB 3.4Å; F146-Q150 PolarHBondContact O-N 2.94Å
147	K	42.9	Very low	36.9	Very low	122 Å²	122	116 Å²	116	53%	0.53	60%	0.597	S	S	.	*	H	α-helix	trans	-57	-47.2	171.3	-76.2	-176	-165.2	145.1	0	112.2	M143 D144 M149 Q150 Q151	M143-K147 PolarHBondContact O-N 3.43Å; D144-K147 WeakPolarHBondContact OD1-CD 3.34Å; D144-K147 IonicContact OD1-NZ 2.73Å; D144-K147 PolarHBondContact OD1-NZ 2.98Å; K147-M149 PolarHBondContact O-N 2.93Å; K147-Q150 PolarHBondContact O-N 2.67Å; K147-Q151 VanDerWaalsContact O-CB 3.28Å; K147-Q151 WeakPolarHBondContact O-CB 3.32Å; K147-Q151 PolarHBondContact O-N 3.15Å
148	T	44.1	Very low	36.9	Very low	82 Å²	82	116.5 Å²	116.5	50%	0.503	59%	0.592	S	S	.	*	H	α-helix	trans	-62.6	-43.4	-175.2	-57.6	0	0	0	0	110.9	D144 F145 F146 Q152	D144-T148 WeakPolarHBondContact O-CB 3.44Å; D144-T148 PolarHBondContact O-N 2.91Å; D144-T148 PolarHBondContact O-OG1 2.89Å; F145-T148 PolarHBondContact O-N 2.92Å; F146-T148 PolarHBondContact O-N 2.75Å; T148-Q152 WeakPolarHBondContact O-CB 3.41Å; T148-Q152 PolarHBondContact O-N 2.82Å
149	M	39.6	Very low	37	Very low	70 Å²	70	114.8 Å²	114.8	35%	0.345	59%	0.592	S	S	.	*	H	α-helix	trans	-68.9	-42.7	177	-164	-175.2	-58	0	0	112.1	F145 F146 K147 Q151 Q152 Q153	F145-M149 HydrophobicContact CD1-CE 4.14Å; F145-M149 HydrophobicContact CE1-CE 3.41Å; F145-M149 VanDerWaalsContact CE1-CE 3.41Å; F145-M149 HydrophobicContact CZ-CE 3.94Å; F145-M149 PolarHBondContact O-N 3Å; F146-M149 PolarHBondContact O-N 3.48Å; K147-M149 PolarHBondContact O-N 2.93Å; M149-Q151 VanDerWaalsContact C-N 3.33Å; M149-Q151 PolarHBondContact O-N 3.26Å; M149-Q152 PolarHBondContact O-N 2.79Å; M149-Q153 PolarHBondContact O-N 3.17Å
150	Q	43.9	Very low	36.9	Very low	105 Å²	105	115.3 Å²	115.3	49%	0.491	60%	0.601	S	S	.	*	H	α-helix	trans	-61.8	-40.6	176.3	-172.2	178	53.1	0	0	111.8	F146 K147 Q153 L154	F146-Q150 WeakPolarHBondContact O-CB 3.4Å; F146-Q150 PolarHBondContact O-N 2.94Å; K147-Q150 PolarHBondContact O-N 2.67Å; Q150-Q153 PolarHBondContact O-N 3.46Å; Q150-L154 PolarHBondContact O-N 2.86Å; Q150-L154 VanDerWaalsContact O-N 3.11Å
151	Q	40.7	Very low	36.8	Very low	109 Å²	109	110.5 Å²	110.5	51%	0.509	60%	0.6	S	S	.	*	H	α-helix	trans	-65.1	-41.8	174.9	-170.8	171.2	11.1	0	0	111.6	K147 M149 Q153 L154 L155	K147-Q151 VanDerWaalsContact O-CB 3.28Å; K147-Q151 WeakPolarHBondContact O-CB 3.32Å; K147-Q151 PolarHBondContact O-N 3.15Å; M149-Q151 VanDerWaalsContact C-N 3.33Å; M149-Q151 PolarHBondContact O-N 3.26Å; Q151-Q153 VanDerWaalsContact C-N 3.35Å; Q151-Q153 PolarHBondContact O-N 2.84Å; Q151-L154 PolarHBondContact O-N 2.76Å; Q151-L155 HydrophobicContact CG-CD1 4.37Å; Q151-L155 VanDerWaalsContact O-CD1 3.32Å; Q151-L155 WeakPolarHBondContact O-CD1 3.32Å; Q151-L155 PolarHBondContact O-N 2.83Å; Q151-L155 VanDerWaalsContact O-N 3.12Å
152	Q	40.1	Very low	36.3	Very low	126 Å²	126	108.2 Å²	108.2	59%	0.589	61%	0.605	S	S	*	*	H	α-helix	trans	-66.5	-34.7	177.7	-164.8	168.6	52.9	0	0	112.6	T148 M149 L155 M156	T148-Q152 WeakPolarHBondContact O-CB 3.41Å; T148-Q152 PolarHBondContact O-N 2.82Å; M149-Q152 PolarHBondContact O-N 2.79Å; Q152-L155 PolarHBondContact O-N 3.25Å; Q152-M156 PolarHBondContact O-N 3.29Å
153	Q	38.3	Very low	35.9	Very low	103 Å²	103	108.5 Å²	108.5	48%	0.481	61%	0.611	S	S	.	*	H	α-helix	trans	-76.7	-26.9	177.6	-163.6	148.8	24.9	0	0	113.4	Y62 M149 Q150 Q151	Y62-Q153 PolarHBondContact OH-OE1 3.03Å; M149-Q153 PolarHBondContact O-N 3.17Å; Q150-Q153 PolarHBondContact O-N 3.46Å; Q151-Q153 VanDerWaalsContact C-N 3.35Å; Q151-Q153 PolarHBondContact O-N 2.84Å
154	L	36.1	Very low	35.5	Very low	118 Å²	118	109 Å²	109	62%	0.618	62%	0.616	S	S	*	*	H	α-helix	trans	-68.7	-39.6	167.7	-82.7	162.2	0	0	0	112.3	Q150 Q151 M156 N157 S158	Q150-L154 PolarHBondContact O-N 2.86Å; Q150-L154 VanDerWaalsContact O-N 3.11Å; Q151-L154 PolarHBondContact O-N 2.76Å; L154-M156 PolarHBondContact O-N 2.96Å; L154-N157 PolarHBondContact O-N 2.92Å; L154-S158 PolarHBondContact O-OG 2.78Å
155	L	34.2	Very low	35.1	Very low	93 Å²	93	111 Å²	111	49%	0.487	64%	0.636	S	S	.	*	H	α-helix	trans	-64.3	-36.8	176.1	-97.1	73.4	0	0	0	112.9	Q151 Q152 N157 S158	Q151-L155 HydrophobicContact CG-CD1 4.37Å; Q151-L155 VanDerWaalsContact O-CD1 3.32Å; Q151-L155 WeakPolarHBondContact O-CD1 3.32Å; Q151-L155 PolarHBondContact O-N 2.83Å; Q151-L155 VanDerWaalsContact O-N 3.12Å; Q152-L155 PolarHBondContact O-N 3.25Å; L155-N157 VanDerWaalsContact C-N 3.25Å; L155-N157 PolarHBondContact O-N 3.1Å; L155-S158 PolarHBondContact O-N 2.93Å
156	M	33.9	Very low	34.6	Very low	156 Å²	156	108.3 Å²	108.3	77%	0.768	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-6.4	179.8	-69.3	-154.1	-69.9	0	0	115	Q152 L154	Q152-M156 PolarHBondContact O-N 3.29Å; L154-M156 PolarHBondContact O-N 2.96Å
157	N	33.4	Very low	33.7	Very low	155 Å²	155	112.9 Å²	112.9	83%	0.829	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	10.1	172.9	-105.6	2.7	0	0	0	113.4	L154 L155	L154-N157 PolarHBondContact O-N 2.92Å; L155-N157 VanDerWaalsContact C-N 3.25Å; L155-N157 PolarHBondContact O-N 3.1Å
158	S	26.4	Very low	33.3	Very low	69 Å²	69	111.5 Å²	111.5	48%	0.483	67%	0.67	S	S	.	*	S	Bend	trans	-144.4	91.1	-177.5	50.7	0	0	0	0	114	L154 L155	L154-S158 PolarHBondContact O-OG 2.78Å; L155-S158 PolarHBondContact O-N 2.93Å
159	G	29.1	Very low	32.7	Very low	79 Å²	79	115.5 Å²	115.5	81%	0.814	68%	0.682	S	S	*	*			trans	159.7	104.9	166.5	0	0	0	0	0	116.1
160	S	27.8	Very low	32.2	Very low	123 Å²	123	116.7 Å²	116.7	86%	0.86	70%	0.697	S	S	*	*			trans	-145	115.3	167.5	62.4	0	0	0	0	111.3
161	G	30.5	Very low	31.5	Very low	73 Å²	73	119.9 Å²	119.9	75%	0.753	72%	0.717	S	S	*	*			trans	90.9	141	-166	0	0	0	0	0	111.2
162	G	28.9	Very low	31	Very low	72 Å²	72	122.2 Å²	122.2	74%	0.742	73%	0.731	S	S	*	*			cis	135	133.3	10.9	0	0	0	0	0	107.3
163	L	29.5	Very low	30.9	Very low	158 Å²	158	121.5 Å²	121.5	83%	0.827	74%	0.737	S	S	*	*			cis	-163.6	162.9	42	-70.9	161.4	0	0	0	110.7
164	N	27.6	Very low	30.7	Very low	152 Å²	152	122.6 Å²	122.6	81%	0.813	75%	0.754	S	S	*	*			trans	59.4	150.3	147.5	-70.4	-19.9	0	0	0	120
165	S	28.3	Very low	30.3	Very low	120 Å²	120	122.6 Å²	122.6	84%	0.839	76%	0.763	S	S	*	*			cis	-153.2	162.6	4.4	46.4	0	0	0	0	111.4
166	G	29.3	Very low	30.1	Very low	77 Å²	77	127 Å²	127	79%	0.794	79%	0.787	S	S	*	*			trans	150.3	92.4	167.6	0	0	0	0	0	116.5
167	F	23.7	Very low	29.8	Very low	209 Å²	209	123 Å²	123	92%	0.917	79%	0.785	S	S	*	*			trans	-96.1	171.1	165.3	-88.9	-69	0	0	0	109.6
168	P	33.9	Very low	29.5	Very low	93 Å²	93	124.7 Å²	124.7	60%	0.604	79%	0.788	S	S	*	*			cis	-144.5	-171.2	27.3	39.6	-17	0	0	0	118.3
169	H	31.9	Very low	29.5	Very low	166 Å²	166	129.6 Å²	129.6	77%	0.769	81%	0.808	S	S	*	*			trans	86.5	135.5	166	-57	-47.1	0	0	0	118.3
170	S	29	Very low	29.9	Very low	94 Å²	94	130.9 Å²	130.9	66%	0.657	80%	0.802	S	S	*	*			cis	-166.8	160.1	-13	-104.1	0	0	0	0	111.9
171	L	28.5	Very low	29.9	Very low	173 Å²	173	130.8 Å²	130.8	91%	0.906	80%	0.801	S	S	*	*			trans	79.4	128.2	167.6	-59.5	175.1	0	0	0	119.6
172	I	30.1	Very low	29.7	Very low	157 Å²	157	134.1 Å²	134.1	81%	0.805	80%	0.802	S	S	*	*			trans	-128.7	143.8	171.5	-69.9	173.9	0	0	0	106.5
173	P	38.3	Very low	29.8	Very low	111 Å²	111	138.5 Å²	138.5	72%	0.721	81%	0.808	S	S	*	*			trans	-86.7	161.6	-178.6	35.4	-37.1	0	0	0	113.8
174	P	33.9	Very low	29.7	Very low	127 Å²	127	136 Å²	136	83%	0.825	80%	0.804	S	S	*	*			trans	-101.4	143.8	168.1	36.4	-29.7	0	0	0	113
175	S	29.5	Very low	29.9	Very low	117 Å²	117	134.8 Å²	134.8	82%	0.818	80%	0.802	S	S	*	*			trans	-112.2	136.4	169.3	-59.9	0	0	0	0	110.3
176	L	29.1	Very low	30	Very low	187 Å²	187	135.4 Å²	135.4	98%	0.979	80%	0.795	S	S	*	*			trans	-169.1	150.9	166.5	-116.8	167.9	0	0	0	111.8
177	G	27.9	Very low	30.3	Very low	71 Å²	71	138.2 Å²	138.2	73%	0.732	80%	0.799	S	S	*	*			trans	120.8	105.8	161.3	0	0	0	0	0	116.1
178	Q	27.3	Very low	30.7	Very low	191 Å²	191	135.1 Å²	135.1	89%	0.893	79%	0.791	S	S	*	*			trans	-81.6	152.1	152	-65.3	171.1	-31	0	0	109.2
179	L	26.5	Very low	30.4	Very low	171 Å²	171	136.5 Å²	136.5	90%	0.895	80%	0.802	S	S	*	*			trans	175.6	153.9	132	-93.4	163.9	0	0	0	110.1
180	P	36.3	Very low	30.3	Very low	107 Å²	107	132.2 Å²	132.2	70%	0.695	80%	0.804	S	S	*	*			trans	-97.9	162.4	-179.7	38.4	-33.5	0	0	0	113
181	S	29.2	Very low	30.3	Very low	121 Å²	121	133.5 Å²	133.5	85%	0.846	81%	0.812	S	S	*	*			trans	-158.9	151.9	159.7	-70.7	0	0	0	0	111.1
182	D	25.4	Very low	30.4	Very low	143 Å²	143	137.3 Å²	137.3	77%	0.765	82%	0.815	S	S	*	*			trans	-71.1	155.6	-170.3	-52.8	-92.1	0	0	0	115.6
183	N	31.5	Very low	30.4	Very low	163 Å²	163	133.5 Å²	133.5	87%	0.872	82%	0.815	S	S	*	*				-155.2	124.1	124.8	-112	-53.3	0	0	0	110.9
184	S	26.3	Very low	29.9	Very low	105 Å²	105	132 Å²	132	73%	0.734	82%	0.819	S	S	*	*			trans	-142.3	113.8	176	58.7	0	0	0	0	111
185	V	32.2	Very low	29.8	Very low	128 Å²	128	130.2 Å²	130.2	78%	0.776	82%	0.815	S	S	*	*			trans	-139.6	97.6	172.9	-174.7	0	0	0	0	110.5
186	L	30.8	Very low	29.9	Very low	133 Å²	133	134 Å²	134	70%	0.696	82%	0.82	S	S	*	*			trans	20.9	124.3	141.3	-51.7	175.5	0	0	0	119.8	I188	L186-I188 HydrophobicContact CB-CG1 4.15Å; L186-I188 HydrophobicContact CD1-CD1 4.14Å; L186-I188 HydrophobicContact CD1-CG1 4.4Å
187	P	34.8	Very low	30.1	Very low	136 Å²	136	130.5 Å²	130.5	88%	0.883	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-83.4	119.9	143.2	32.6	-27.4	0	0	0	110.1
188	I	32.1	Very low	30.2	Very low	144 Å²	144	133 Å²	133	74%	0.738	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-101.9	139.7	174	-68.5	178.7	0	0	0	110	L186	L186-I188 HydrophobicContact CB-CG1 4.15Å; L186-I188 HydrophobicContact CD1-CD1 4.14Å; L186-I188 HydrophobicContact CD1-CG1 4.4Å
189	S	27.8	Very low	30.9	Very low	121 Å²	121	129.5 Å²	129.5	85%	0.846	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-85.2	140.5	174.6	50	0	0	0	0	112.4
190	G	29.1	Very low	31	Very low	77 Å²	77	126.2 Å²	126.2	79%	0.794	80%	0.797	S	S	*	*			trans	-154.1	144.4	178.6	0	0	0	0	0	110.9
191	S	29.9	Very low	30.8	Very low	120 Å²	120	128.1 Å²	128.1	84%	0.839	80%	0.801	S	S	*	*			trans	-120.3	167.3	-165.1	-66.8	0	0	0	0	114.3
192	R	31.2	Very low	30.8	Very low	253 Å²	253	128.3 Å²	128.3	96%	0.955	80%	0.797	S	S	*	*			trans	83.8	144.9	176.3	-53.7	172.9	167.7	-167.2	-4.5	115.3
193	G	28.7	Very low	31.2	Very low	78 Å²	78	125.8 Å²	125.8	80%	0.804	79%	0.791	S	S	*	*			cis	154.3	126.7	-12.6	0	0	0	0	0	115.2
194	G	28.2	Very low	31.2	Very low	79 Å²	79	125.7 Å²	125.7	81%	0.814	79%	0.789	S	S	*	*			trans	93	156.9	171.6	0	0	0	0	0	115.6
195	A	32.1	Very low	31.3	Very low	90 Å²	90	125.9 Å²	125.9	74%	0.744	79%	0.791	S	S	*	*			cis	-164.4	156.8	-10.5	0	0	0	0	0	112.3
196	Q	31.1	Very low	31.2	Very low	196 Å²	196	123.3 Å²	123.3	92%	0.916	79%	0.79	S	S	*	*			trans	68.7	151.1	167.1	-49.8	-179	21.3	0	0	115.8
197	S	33	Very low	31.3	Very low	114 Å²	114	124.7 Å²	124.7	80%	0.797	80%	0.797	S	S	*	*			cis	-143.7	171.3	9.8	54	0	0	0	0	112.7
198	T	31.4	Very low	31.2	Very low	124 Å²	124	125.5 Å²	125.5	76%	0.761	79%	0.794	S	S	*	*			trans	-123.5	164.9	174.9	54.3	0	0	0	0	111.4
199	P	40.6	Very low	31	Very low	116 Å²	116	122.9 Å²	122.9	75%	0.753	79%	0.794	S	S	*	*				-126.6	149.1	105.7	1.9	20.4	0	0	0	112.4
200	S	29.9	Very low	31.4	Very low	102 Å²	102	122.9 Å²	122.9	71%	0.713	79%	0.791	S	S	*	*				67	129.6	72.6	-44.2	0	0	0	0	112.3
201	L	31.8	Very low	31.8	Very low	148 Å²	148	124.9 Å²	124.9	78%	0.775	79%	0.79	S	S	*	*			cis	-149.6	142.4	39.2	-76.6	166.4	0	0	0	110.8
202	T	29.9	Very low	31.6	Very low	124 Å²	124	124.6 Å²	124.6	76%	0.761	79%	0.787	S	S	*	*				46.2	143.6	97.7	80	0	0	0	0	115.9
203	S	32.6	Very low	31.7	Very low	91 Å²	91	119.7 Å²	119.7	64%	0.636	79%	0.785	S	S	*	*			cis	-168.6	155.2	30.2	60.1	0	0	0	0	114.9
204	L	31.6	Very low	31.7	Very low	161 Å²	161	119.1 Å²	119.1	84%	0.843	78%	0.779	S	S	*	*			trans	55	141.7	147.7	-57.9	160	0	0	0	120.6
205	S	28.1	Very low	31.9	Very low	109 Å²	109	123 Å²	123	76%	0.762	78%	0.779	S	S	*	*			cis	132	126.5	-18.7	70.3	0	0	0	0	113.9
206	G	31.4	Very low	31.8	Very low	73 Å²	73	126.3 Å²	126.3	75%	0.753	79%	0.785	S	S	*	*			trans	140.7	149.9	161.7	0	0	0	0	0	114
207	L	31.8	Very low	31.9	Very low	163 Å²	163	121.7 Å²	121.7	85%	0.853	77%	0.774	S	S	*	*			cis	-161.5	172.5	-11.1	-121.4	174.7	0	0	0	109.7
208	N	32.1	Very low	31.9	Very low	152 Å²	152	124 Å²	124	81%	0.813	78%	0.777	S	S	*	*			trans	71.4	143.7	-178.6	-56.7	-18.2	0	0	0	116.6
209	A	29.1	Very low	32	Very low	89 Å²	89	123.6 Å²	123.6	74%	0.736	78%	0.779	S	S	*	*			cis	-158.5	150.1	-22.6	0	0	0	0	0	111.2
210	P	36.3	Very low	31.5	Very low	121 Å²	121	124 Å²	124	79%	0.786	79%	0.785	S	S	*	*			trans	-95.8	-164.6	175.3	43.5	-38.6	0	0	0	111
211	P	37.6	Very low	31.5	Very low	120 Å²	120	122.7 Å²	122.7	78%	0.779	79%	0.787	S	S	*	*			cis	-142.7	-167.4	9.9	45.3	-24.6	0	0	0	117.4
212	C	25.8	Very low	31.4	Very low	114 Å²	114	124.1 Å²	124.1	77%	0.77	80%	0.795	S	S	*	*			trans	-98.6	-177.3	175.1	-57.3	0	0	0	0	113.4
213	T	32.5	Very low	31.9	Very low	149 Å²	149	123.9 Å²	123.9	91%	0.914	80%	0.795	S	S	*	*			trans	85.9	134.4	173.4	73.5	0	0	0	0	116.4
214	G	29.1	Very low	31.8	Very low	66 Å²	66	123.9 Å²	123.9	68%	0.68	80%	0.8	S	S	*	*			cis	179	-159.6	-4.6	0	0	0	0	0	115.5
215	I	31.2	Very low	31.6	Very low	160 Å²	160	124.4 Å²	124.4	82%	0.821	80%	0.803	S	S	*	*			trans	53.5	100.7	165.8	47.2	173.9	0	0	0	120.4
216	N	31.6	Very low	31.7	Very low	160 Å²	160	126.8 Å²	126.8	86%	0.856	81%	0.807	S	S	*	*				-162.2	152.8	93.3	-96.3	-29.6	0	0	0	113.5
217	S	32.4	Very low	31.6	Very low	99 Å²	99	129.4 Å²	129.4	69%	0.692	80%	0.804	S	S	*	*			trans	-82.8	157.3	-176.4	49.5	0	0	0	0	113.2
218	L	32.3	Very low	31.5	Very low	164 Å²	164	127.3 Å²	127.3	86%	0.859	79%	0.794	S	S	*	*				-163.9	162.6	62.9	-76	161.5	0	0	0	109
219	S	33.9	Very low	31.3	Very low	114 Å²	114	126.1 Å²	126.1	80%	0.797	79%	0.792	S	S	*	*			cis	-158.6	155.8	-4.1	43.5	0	0	0	0	110.4
220	S	29.6	Very low	31.3	Very low	126 Å²	126	125.4 Å²	125.4	88%	0.881	79%	0.786	S	S	*	*			trans	-90.6	156.4	-175.8	51.9	0	0	0	0	115.4
221	G	30.1	Very low	31	Very low	74 Å²	74	126.8 Å²	126.8	76%	0.763	79%	0.787	S	S	*	*			trans	-149.2	-24.9	-175.2	0	0	0	0	0	122.1
222	L	31.4	Very low	30.6	Very low	178 Å²	178	127.4 Å²	127.4	93%	0.932	78%	0.784	S	S	*	*			trans	60.1	165	174.9	-71.2	173.8	0	0	0	119.7
223	P	39.7	Very low	30.9	Very low	118 Å²	118	129.2 Å²	129.2	77%	0.766	79%	0.785	S	S	*	*			trans	-124.8	172.6	-168.8	43.4	-30.5	0	0	0	116.7
224	A	30.9	Very low	30.8	Very low	91 Å²	91	128.9 Å²	128.9	75%	0.752	78%	0.777	S	S	*	*			trans	-142.1	139.8	156.7	0	0	0	0	0	108.9
225	L	27.8	Very low	30.7	Very low	172 Å²	172	133.3 Å²	133.3	90%	0.901	78%	0.784	S	S	*	*				62.2	108.7	58.9	-98.1	169.5	0	0	0	114.4
226	N	28.4	Very low	31.3	Very low	159 Å²	159	131.4 Å²	131.4	85%	0.85	78%	0.782	S	S	*	*			trans	-149.5	135.1	157.1	-169.5	7	0	0	0	109.5
227	N	29.9	Very low	31.4	Very low	128 Å²	128	129.4 Å²	129.4	68%	0.684	78%	0.778	S	S	*	*			trans	-162.8	155	175.2	-161.2	14.7	0	0	0	109.2
228	N	29.2	Very low	31.3	Very low	120 Å²	120	131.9 Å²	131.9	64%	0.642	78%	0.784	S	S	*	*			trans	66.6	112.5	174.1	-66.7	-9.2	0	0	0	116
229	T	29.3	Very low	31.7	Very low	126 Å²	126	128.8 Å²	128.8	77%	0.773	77%	0.773	S	S	*	*				69.9	144.1	69.3	66.5	0	0	0	0	114.9
230	A	28.8	Very low	31.5	Very low	74 Å²	74	133 Å²	133	61%	0.612	78%	0.778	S	S	*	*			cis	-177.2	-175.5	-15.4	0	0	0	0	0	108.8
231	N	29.7	Very low	31.4	Very low	150 Å²	150	134.1 Å²	134.1	80%	0.802	77%	0.773	S	S	*	*			trans	75.8	154.8	157.1	-58.1	-22.4	0	0	0	116.7
232	N	28.5	Very low	31.8	Very low	133 Å²	133	135.8 Å²	135.8	71%	0.711	77%	0.77	S	S	*	*			cis	-151.5	-177.5	15	-143.4	-14.2	0	0	0	114.6
233	L	31.9	Very low	31.7	Very low	152 Å²	152	135.4 Å²	135.4	80%	0.796	76%	0.763	S	S	*	*			trans	89.1	142.4	175.1	-52.4	176.1	0	0	0	115.4
234	L	31.2	Very low	31	Very low	142 Å²	142	137.6 Å²	137.6	74%	0.743	77%	0.766	S	S	*	*			cis	-178.6	160	-33.8	-133.7	83.5	0	0	0	104.6
235	L	27	Very low	30.9	Very low	160 Å²	160	140.4 Å²	140.4	84%	0.838	77%	0.773	S	S	*	*			trans	-84.1	164	179.3	-57.7	86.6	0	0	0	111.3
236	P	44	Very low	30.9	Very low	119 Å²	119	137 Å²	137	77%	0.773	76%	0.764	S	S	*	*			cis	-120.4	-137	8.2	34.6	-10.4	0	0	0	109.9
237	P	34.1	Very low	31	Very low	119 Å²	119	134.5 Å²	134.5	77%	0.773	76%	0.759	S	S	*	*			cis	-138.1	-162.6	-4.1	45.3	-24.6	0	0	0	116.6
238	N	29.3	Very low	31.2	Very low	151 Å²	151	135.4 Å²	135.4	81%	0.807	77%	0.769	S	S	*	*			trans	-102.2	171.9	167.4	-116.1	-18.3	0	0	0	109.7
239	P	41.3	Very low	31.3	Very low	99 Å²	99	135.5 Å²	135.5	64%	0.643	77%	0.774	S	S	*	*			cis	-139	-168.5	3.2	27.6	-1	0	0	0	116.1
240	F	29	Very low	31.8	Very low	202 Å²	202	134.9 Å²	134.9	89%	0.886	77%	0.772	S	S	*	*			trans	105.2	133.4	157	-85.5	-78.9	0	0	0	121.9
241	L	29	Very low	32.6	Very low	150 Å²	150	137 Å²	137	79%	0.785	78%	0.78	S	S	*	*			trans	-87.7	166.8	-179.4	-115.5	80.4	0	0	0	111.6
242	P	37	Very low	33	Very low	108 Å²	108	135.7 Å²	135.7	70%	0.701	78%	0.777	S	S	*	*				-137.9	-166.4	54.1	43.8	-24.9	0	0	0	113.1
243	Q	29.9	Very low	33.4	Very low	170 Å²	170	134.8 Å²	134.8	79%	0.794	78%	0.777	S	S	*	*			cis	-145	-121.9	9.7	-159.9	147.7	-90.3	0	0	113.3
244	M	25.1	Very low	33.4	Very low	165 Å²	165	133.9 Å²	133.9	81%	0.813	77%	0.773	S	S	*	*			trans	-153.8	155.2	-172.5	-65.8	-165.4	-179.5	0	0	111.6
245	T	28.8	Very low	33.7	Very low	149 Å²	149	132 Å²	132	91%	0.914	77%	0.767	S	S	*	*				178.7	158.7	109.6	27.8	0	0	0	0	112.1
246	S	27.9	Very low	34	Very low	100 Å²	100	131.6 Å²	131.6	70%	0.699	77%	0.766	S	S	*	*			trans	-112.7	160.2	177.1	56.7	0	0	0	0	111.5
247	S	30.3	Very low	34.1	Very low	107 Å²	107	130.7 Å²	130.7	75%	0.748	76%	0.76	S	S	*	*	S	Bend	trans	60.1	136.3	158.2	51.4	0	0	0	0	119.1
248	V	33.4	Very low	34.2	Very low	148 Å²	148	131.8 Å²	131.8	90%	0.897	76%	0.764	S	S	*	*			trans	-69.1	143.2	-177.7	178.2	0	0	0	0	112.4
249	T	31.4	Very low	34.4	Very low	121 Å²	121	128 Å²	128	74%	0.742	76%	0.76	S	S	*	*			trans	-126.3	-173.3	174.7	55.9	0	0	0	0	107.8
250	P	40.9	Very low	33.9	Very low	113 Å²	113	130.7 Å²	130.7	73%	0.734	77%	0.769	S	S	*	*			cis	-121.8	-170.4	-1.2	41.2	-23.5	0	0	0	112.1
251	P	45.6	Very low	34.7	Very low	119 Å²	119	126.4 Å²	126.4	77%	0.773	76%	0.762	S	S	*	*			cis	-115.7	-147.8	7.2	23.2	4.2	0	0	0	112
252	T	37.7	Very low	34.9	Very low	123 Å²	123	124.5 Å²	124.5	76%	0.755	76%	0.761	S	S	*	*			cis	-149.7	166.9	21.5	55	0	0	0	0	115.5
253	T	36.7	Very low	34.7	Very low	114 Å²	114	127 Å²	127	70%	0.699	77%	0.767	S	S	*	*			trans	-56.6	154.5	160.2	50.8	0	0	0	0	112.9
254	N	31.4	Very low	34.8	Very low	133 Å²	133	123.8 Å²	123.8	71%	0.711	76%	0.764	S	S	*	*			cis	-172.8	165.4	1.8	-107.7	17	0	0	0	108.3
255	T	38.5	Very low	35.1	Very low	101 Å²	101	119.5 Å²	119.5	62%	0.62	76%	0.761	S	S	*	*			cis	-172.3	132.7	-20.2	23.2	0	0	0	0	110.6
256	N	32.4	Very low	35.3	Very low	153 Å²	153	117.9 Å²	117.9	82%	0.818	75%	0.751	S	S	*	*				48.9	166.7	127.3	-91.7	-3.8	0	0	0	123.9
257	P	47.3	Very low	35.3	Very low	99 Å²	99	121.8 Å²	121.8	64%	0.643	76%	0.758	S	S	*	*			cis	-143.6	-175.9	-11.3	31.2	-6.9	0	0	0	118
258	V	35.1	Very low	35.3	Very low	143 Å²	143	121.8 Å²	121.8	87%	0.867	76%	0.758	S	S	*	*			trans	74.3	132.9	160.3	-161.5	0	0	0	0	117.5
259	G	33.6	Very low	35.1	Very low	70 Å²	70	119.6 Å²	119.6	72%	0.722	75%	0.749	S	S	*	*			cis	172.1	-172.6	1.7	0	0	0	0	0	109.2
260	N	30.9	Very low	34.8	Very low	156 Å²	156	121.6 Å²	121.6	83%	0.834	76%	0.755	S	S	*	*			cis	-161.6	152.8	-8.4	-177.5	78.2	0	0	0	109.2
261	P	45.8	Very low	34.1	Very low	112 Å²	112	122.1 Å²	122.1	73%	0.727	76%	0.761	S	S	*	*			trans	-127.8	-177.2	-156.9	45	-33.3	0	0	0	119
262	S	33.3	Very low	33.2	Very low	111 Å²	111	120.1 Å²	120.1	78%	0.776	76%	0.762	S	S	*	*			trans	-161.2	175.6	157.3	72.7	0	0	0	0	108.4
263	I	32.8	Very low	32.6	Very low	159 Å²	159	122.2 Å²	122.2	82%	0.815	77%	0.767	S	S	*	*			cis	-153.9	-178	-0.5	-154.9	162	0	0	0	110.4
264	S	32.5	Very low	32.4	Very low	104 Å²	104	123 Å²	123	73%	0.727	77%	0.774	S	S	*	*			trans	-91.1	164.3	178.3	52.3	0	0	0	0	114.7
265	G	31.8	Very low	32	Very low	74 Å²	74	119.9 Å²	119.9	76%	0.763	77%	0.773	S	S	*	*			cis	159.9	-158.3	6.6	0	0	0	0	0	109.4
266	V	32.4	Very low	31.9	Very low	115 Å²	115	121 Å²	121	70%	0.697	78%	0.782	S	S	*	*			cis	-162.6	140.7	-6.1	-163.9	0	0	0	0	109.6
267	Q	28.4	Very low	31.6	Very low	182 Å²	182	121.1 Å²	121.1	85%	0.85	78%	0.783	S	S	*	*			trans	64.4	163.7	154.6	-85.5	163.1	8	0	0	121.1
268	S	29.6	Very low	30.7	Very low	108 Å²	108	124 Å²	124	76%	0.755	79%	0.793	S	S	*	*			cis	-159.3	-161.4	-5.4	47.7	0	0	0	0	111.2
269	S	28.3	Very low	30.5	Very low	101 Å²	101	122 Å²	122	71%	0.706	78%	0.782	S	S	*	*				-161.2	144.1	-102.7	55.9	0	0	0	0	116.9
270	L	26	Very low	30.1	Very low	163 Å²	163	122.8 Å²	122.8	85%	0.853	78%	0.783	S	S	*	*			trans	71.9	132.3	157.8	-92.7	82	0	0	0	124.1
271	S	26	Very low	29.7	Very low	125 Å²	125	124.2 Å²	124.2	87%	0.874	78%	0.782	S	S	*	*				122.8	134.7	127.2	72.4	0	0	0	0	119
272	G	26	Very low	28.6	Very low	77 Å²	77	128.1 Å²	128.1	79%	0.794	79%	0.787	S	S	*	*			trans	148.6	106.4	173	0	0	0	0	0	115.9
273	I	26.9	Very low	28.2	Very low	167 Å²	167	129.2 Å²	129.2	86%	0.856	80%	0.795	S	S	*	*			trans	-146.4	139.2	175.7	-69.6	179.8	0	0	0	104.8
274	P	31.4	Very low	27.7	Very low	130 Å²	130	125.4 Å²	125.4	84%	0.844	80%	0.795	S	S	*	*			cis	-141.5	-176.6	42.8	41.9	-23.2	0	0	0	117
275	G	23.4	Very low	27.3	Very low	67 Å²	67	128.8 Å²	128.8	69%	0.691	80%	0.804	S	S	*	*			trans	145.1	123.4	156.4	0	0	0	0	0	114.5
276	P	35.6	Very low	26.9	Very low	125 Å²	125	129.3 Å²	129.3	81%	0.812	80%	0.801	S	S	*	*			trans	-87.5	133.8	178.6	33.6	-32.4	0	0	0	112.3
277	N	26.6	Very low	26.7	Very low	156 Å²	156	132.7 Å²	132.7	83%	0.834	81%	0.81	S	S	*	*			trans	-165.3	114	151.7	-106.5	-35.5	0	0	0	110.9
278	N	28.6	Very low	26.6	Very low	160 Å²	160	128.5 Å²	128.5	86%	0.856	80%	0.8	S	S	*	*			trans	-150.5	86.4	160.5	-172.1	11.4	0	0	0	111.5
279	P	30.1	Very low	26.6	Very low	99 Å²	99	126.5 Å²	126.5	64%	0.643	78%	0.779	S	S	*	*			trans	-138.4	103.9	164.6	35	-15.4	0	0	0	114
280	A	25.2	Very low	26.9	Very low	88 Å²	88	125 Å²	125	73%	0.727	77%	0.766	S	S	*	*			trans	-159.9	112.8	146.8	0	0	0	0	0	108.1
281	F	22.5	Very low	27.1	Very low	185 Å²	185	120 Å²	120	81%	0.811	75%	0.749	S	S	*	*				80.1	144.9	64.6	-90.2	-104.1	0	0	0	115.5
282	F	22.8	Very low	27.4	Very low	194 Å²	194	115.1 Å²	115.1	85%	0.851	71%	0.714	S	S	*	*			trans	71.1	74.2	178	-65.2	-78.3	0	0	0	118.9
283	S	25.2	Very low	27.7	Very low	134 Å²	134	113 Å²	113	94%	0.937	69%	0.689	S	S	*	*			trans	-166	91.3	134.9	-84.2	0	0	0	0	109.9
284	G	23	Very low	27.9	Very low	79 Å²	79	108 Å²	108	81%	0.814	67%	0.673	S	S	*	*			trans	-168.4	41.3	-169.9	0	0	0	0	0	115.4
285	L	23.4	Very low	27.9	Very low	175 Å²	175	104 Å²	104	92%	0.916	65%	0.65	S	S	*	*	S	Bend	trans	-144	31.8	-176	-127	171	0	0	0	114.1
286	A	24.8	Very low	28.2	Very low	85 Å²	85	106 Å²	106	70%	0.702	64%	0.643	S	S	*	*			trans	-159.1	99.9	171.5	0	0	0	0	0	112.6
287	Q	26.9	Very low	28	Very low	187 Å²	187	102.4 Å²	102.4	87%	0.874	62%	0.624	S	S	*	*			trans	175.3	66.2	151.8	-99.8	159.5	79.4	0	0	112.2
288	S	26	Very low	28.2	Very low	93 Å²	93	97.5 Å²	97.5	65%	0.65	61%	0.605	S	S	*	*			trans	-78.9	131.5	158.6	48.1	0	0	0	0	109.6
289	H	30.6	Very low	28.4	Very low	66 Å²	66	90.9 Å²	90.9	31%	0.306	57%	0.57	S	S	.	*			trans	-69.7	140.8	-177.7	-141.8	-103.1	0	0	0	110.9	A291 V292 A293	H289-A291 PolarHBondContact O-N 3Å; H289-V292 PolarHBondContact O-N 2.91Å; H289-A293 PolarHBondContact O-N 3.09Å
290	P	34.1	Very low	28.4	Very low	69 Å²	69	89.4 Å²	89.4	45%	0.448	57%	0.566	S	S	.	*	H	α-helix	trans	-62.7	-16.7	-172.2	21.8	-34	0	0	0	115.2	A294 T435	P290-A294 WeakPolarHBondContact O-CB 3.44Å; P290-A294 PolarHBondContact O-N 2.92Å; P290-T435 HydrophobicContact CG-CG2 3.76Å
291	A	30	Very low	28.6	Very low	60 Å²	60	89.6 Å²	89.6	50%	0.496	57%	0.568	S	S	.	*	H	α-helix	trans	-69.5	-39	171.9	0	0	0	0	0	112.7	H289 A294 A295	H289-A291 PolarHBondContact O-N 3Å; A291-A294 PolarHBondContact O-N 2.94Å; A291-A295 PolarHBondContact O-N 3Å
292	V	32.5	Very low	28.7	Very low	21 Å²	21	83.2 Å²	83.2	13%	0.127	55%	0.549	C	S	.	.	H	α-helix	trans	-69.9	-40.3	175.1	-174.6	0	0	0	0	109.7	H289 A295 M296 Y976	H289-V292 PolarHBondContact O-N 2.91Å; V292-A295 PolarHBondContact O-N 3.2Å; V292-M296 PolarHBondContact O-N 2.79Å; V292-Y976 HydrophobicContact CG1-CE2 4.43Å; V292-Y976 HydrophobicContact CG2-CD2 3.65Å; V292-Y976 HydrophobicContact CG2-CE2 3.81Å
293	A	32.5	Very low	28.8	Very low	33 Å²	33	76.5 Å²	76.5	27%	0.273	54%	0.535	S	S	.	.	H	α-helix	trans	-61.1	-43.2	171.9	0	0	0	0	0	111.7	H289 M296 A297	H289-A293 PolarHBondContact O-N 3.09Å; A293-M296 PolarHBondContact O-N 3.46Å; A293-A297 WeakPolarHBondContact O-CA 3.38Å; A293-A297 WeakPolarHBondContact O-CB 3.5Å; A293-A297 PolarHBondContact O-N 2.91Å
294	A	30.6	Very low	28.9	Very low	62 Å²	62	78.5 Å²	78.5	51%	0.512	53%	0.527	S	S	.	.	H	α-helix	trans	-62.8	-45.2	177.5	0	0	0	0	0	112.5	P290 A291 A297 A298	P290-A294 WeakPolarHBondContact O-CB 3.44Å; P290-A294 PolarHBondContact O-N 2.92Å; A291-A294 PolarHBondContact O-N 2.94Å; A294-A297 PolarHBondContact O-N 3.16Å; A294-A298 PolarHBondContact O-N 2.81Å; A294-A298 VanDerWaalsContact O-N 3.07Å
295	A	30.7	Very low	29.1	Very low	45 Å²	45	80.5 Å²	80.5	37%	0.372	53%	0.526	S	S	.	.	H	α-helix	trans	-64.9	-39.3	177.6	0	0	0	0	0	112.7	A291 V292 V299	A291-A295 PolarHBondContact O-N 3Å; V292-A295 PolarHBondContact O-N 3.2Å; A295-V299 WeakPolarHBondContact O-CG2 3.4Å
296	M	31.4	Very low	29.1	Very low	111 Å²	111	78 Å²	78	55%	0.547	52%	0.523	S	S	.	.	H	α-helix	trans	-82.2	-24	176.8	-71.6	-166	171.8	0	0	114.1	V292 A293 V299 A300	V292-M296 PolarHBondContact O-N 2.79Å; A293-M296 PolarHBondContact O-N 3.46Å; M296-V299 CarbonylContact O-C 3.59Å; M296-V299 VanDerWaalsContact O-C 3.23Å; M296-V299 PolarHBondContact O-N 2.88Å; M296-A300 PolarHBondContact O-N 2.9Å
297	A	31.3	Very low	29.3	Very low	48 Å²	48	77.7 Å²	77.7	40%	0.397	53%	0.528	S	S	.	.	H	α-helix	trans	-79.9	-31.2	178.3	0	0	0	0	0	112.6	A293 A294 V299 A300 A301	A293-A297 WeakPolarHBondContact O-CA 3.38Å; A293-A297 WeakPolarHBondContact O-CB 3.5Å; A293-A297 PolarHBondContact O-N 2.91Å; A294-A297 PolarHBondContact O-N 3.16Å; A297-V299 PolarHBondContact O-N 2.83Å; A297-A300 CarbonylContact O-C 3.21Å; A297-A300 PolarHBondContact O-N 3.43Å; A297-A301 WeakPolarHBondContact O-CB 3.4Å; A297-A301 PolarHBondContact O-N 2.82Å
298	A	30.5	Very low	29.2	Very low	53 Å²	53	75.8 Å²	75.8	44%	0.438	52%	0.524	S	S	.	.	H	α-helix	trans	-54	-47.6	163.4	0	0	0	0	0	110	A294 A300 A301 A302	A294-A298 PolarHBondContact O-N 2.81Å; A294-A298 VanDerWaalsContact O-N 3.07Å; A298-A300 PolarHBondContact O-N 2.93Å; A298-A300 VanDerWaalsContact O-N 3.15Å; A298-A301 PolarHBondContact O-N 2.69Å; A298-A302 PolarHBondContact O-N 2.83Å
299	V	32.9	Very low	29.3	Very low	21 Å²	21	77.8 Å²	77.8	13%	0.127	53%	0.532	C	S	.	.	H	α-helix	trans	-77.5	10	177	-170.7	0	0	0	0	113.2	A295 M296 A297 F1105 C1144 K1162	A295-V299 WeakPolarHBondContact O-CG2 3.4Å; M296-V299 CarbonylContact O-C 3.59Å; M296-V299 VanDerWaalsContact O-C 3.23Å; M296-V299 PolarHBondContact O-N 2.88Å; A297-V299 PolarHBondContact O-N 2.83Å; V299-F1105 HydrophobicContact CG1-CE2 4Å; V299-F1105 HydrophobicContact CG1-CZ 4.36Å; V299-F1105 HydrophobicContact CG2-CE1 4.46Å; V299-F1105 HydrophobicContact CG2-CE2 3.96Å; V299-F1105 HydrophobicContact CG2-CZ 3.54Å; V299-C1144 HydrophobicContact CG1-CB 4.34Å; V299-C1144 WeakPolarHBondContact CG1-SG 3.41Å; V299-K1162 HydrophobicContact CG1-CD 4.31Å; V299-K1162 PolarHBondContact O-NZ 2.93Å
300	A	29.7	Very low	29.1	Very low	68 Å²	68	81.6 Å²	81.6	56%	0.562	56%	0.555	S	S	*	*	H	α-helix	trans	-117.3	-24.6	168.7	0	0	0	0	0	112.2	M296 A297 A298	M296-A300 PolarHBondContact O-N 2.9Å; A297-A300 CarbonylContact O-C 3.21Å; A297-A300 PolarHBondContact O-N 3.43Å; A298-A300 PolarHBondContact O-N 2.93Å; A298-A300 VanDerWaalsContact O-N 3.15Å
301	A	28.9	Very low	28.9	Very low	92 Å²	92	83.3 Å²	83.3	76%	0.76	57%	0.566	S	S	*	*	H	α-helix	trans	-80.5	-21.8	174.8	0	0	0	0	0	113.3	A297 A298	A297-A301 WeakPolarHBondContact O-CB 3.4Å; A297-A301 PolarHBondContact O-N 2.82Å; A298-A301 PolarHBondContact O-N 2.69Å
302	A	24.5	Very low	28.8	Very low	51 Å²	51	86.8 Å²	86.8	42%	0.421	58%	0.581	S	S	.	*	S	Bend	trans	-115.4	79.6	-178.8	0	0	0	0	0	111.6	A298	A298-A302 PolarHBondContact O-N 2.83Å
303	G	25.7	Very low	28.4	Very low	54 Å²	54	91.4 Å²	91.4	56%	0.557	60%	0.603	S	S	*	*			trans	179.6	40.8	-176	0	0	0	0	0	120.3
304	F	27.4	Very low	28.2	Very low	175 Å²	175	96 Å²	96	77%	0.768	62%	0.622	S	S	*	*			trans	-145	115.7	165.8	-80.2	-63.4	0	0	0	114.2
305	P	25.8	Very low	28	Very low	122 Å²	122	98 Å²	98	79%	0.792	62%	0.621	S	S	*	*			trans	-113.4	119.7	142.6	33.3	-23.9	0	0	0	109.9	G307	P305-G307 PolarHBondContact O-N 2.81Å
306	S	25	Very low	27.9	Very low	123 Å²	123	103 Å²	103	86%	0.86	64%	0.641	S	S	*	*			trans	-72.7	87.9	-173.8	-55	0	0	0	0	113.5
307	G	28	Very low	27.8	Very low	77 Å²	77	102.4 Å²	102.4	79%	0.794	65%	0.648	S	S	*	*			trans	-80.4	118.6	170.9	0	0	0	0	0	112.3	P305	P305-G307 PolarHBondContact O-N 2.81Å
308	N	24.4	Very low	27.6	Very low	148 Å²	148	105.8 Å²	105.8	79%	0.791	67%	0.669	S	S	*	*			trans	-112	105	-170.4	178.4	21.4	0	0	0	113.1
309	T	29	Very low	27.4	Very low	135 Å²	135	106.8 Å²	106.8	83%	0.828	68%	0.684	S	S	*	*			trans	-145.9	120.4	165.5	49.5	0	0	0	0	112.8
310	N	25.8	Very low	27.1	Very low	146 Å²	146	113.9 Å²	113.9	78%	0.781	72%	0.72	S	S	*	*			trans	-64.2	155.7	163.4	-90.6	-49.3	0	0	0	111.4
311	P	31	Very low	27	Very low	105 Å²	105	118 Å²	118	68%	0.682	73%	0.732	S	S	*	*				-144.3	127.7	100.2	33.9	-17	0	0	0	116.7
312	T	27	Very low	26.9	Very low	132 Å²	132	120.1 Å²	120.1	81%	0.81	73%	0.73	S	S	*	*			trans	29.7	129.1	139	53.9	0	0	0	0	122.6
313	M	25.2	Very low	27	Very low	119 Å²	119	123 Å²	123	59%	0.586	74%	0.739	S	S	*	*			trans	-60.4	150.3	169.6	-57.6	-171	-71.9	0	0	115.5	E46	E46-M313 HydrophobicContact CB-CE 4.44Å
314	N	27.7	Very low	26.9	Very low	128 Å²	128	127.4 Å²	127.4	68%	0.684	75%	0.749	S	S	*	*				159.9	149.7	114.9	-85.6	-28.8	0	0	0	110.6
315	Q	26.6	Very low	26.9	Very low	105 Å²	105	124.8 Å²	124.8	49%	0.491	75%	0.753	S	S	.	*			cis	-168	-179.6	-17.5	-112.6	-89.6	10.3	0	0	106	E46	E46-Q315 PolarHBondContact OE1-NE2 2.82Å
316	L	28.1	Very low	27	Very low	151 Å²	151	127.9 Å²	127.9	79%	0.791	76%	0.756	S	S	*	*			trans	73.3	132.4	178.6	-49.8	175.7	0	0	0	114.8
317	S	28.5	Very low	27.6	Very low	98 Å²	98	127.2 Å²	127.2	69%	0.685	75%	0.749	S	S	*	*			cis	-150.7	151.9	-1.8	-95.9	0	0	0	0	112.7
318	S	27.8	Very low	27.5	Very low	119 Å²	119	134 Å²	134	83%	0.832	75%	0.752	S	S	*	*			trans	15.1	139.9	155.4	59.3	0	0	0	0	121.3
319	G	27.5	Very low	27.6	Very low	73 Å²	73	130.9 Å²	130.9	75%	0.753	74%	0.742	S	S	*	*			cis	-158.8	157.8	27.2	0	0	0	0	0	117.3
320	L	24.7	Very low	27.5	Very low	170 Å²	170	132.1 Å²	132.1	89%	0.89	74%	0.739	S	S	*	*			trans	-132.2	178.6	166.6	-84.2	171.3	0	0	0	107.9
321	L	28.9	Very low	27.6	Very low	154 Å²	154	131.3 Å²	131.3	81%	0.806	73%	0.733	S	S	*	*			trans	88.8	138.2	-168.4	-54	163.1	0	0	0	112.2
322	N	27.2	Very low	27.9	Very low	137 Å²	137	131.8 Å²	131.8	73%	0.733	74%	0.736	S	S	*	*			cis	-136.7	123.5	8.5	-151.5	37.5	0	0	0	108.4
323	N	25.7	Very low	28	Very low	113 Å²	113	129.5 Å²	129.5	60%	0.604	73%	0.73	S	S	*	*				69.5	106.7	63.2	-133.5	17.6	0	0	0	115.1
324	N	23.7	Very low	28.2	Very low	145 Å²	145	131.6 Å²	131.6	78%	0.775	74%	0.738	S	S	*	*			trans	40.5	125.6	148.1	-57	-23	0	0	0	123
325	S	27.6	Very low	28.4	Very low	120 Å²	120	131.6 Å²	131.6	84%	0.839	74%	0.737	S	S	*	*				-171.9	118.1	115.8	60.4	0	0	0	0	115.1
326	H	28.4	Very low	28.6	Very low	188 Å²	188	132.5 Å²	132.5	87%	0.87	75%	0.745	S	S	*	*			trans	-76	168.6	145.4	-90.1	-47	0	0	0	109
327	P	36.3	Very low	28.6	Very low	109 Å²	109	131.7 Å²	131.7	71%	0.708	74%	0.742	S	S	*	*			cis	-151.6	-179.2	38.5	41.2	-18.2	0	0	0	119.2
328	Y	27.2	Very low	28.7	Very low	218 Å²	218	133.7 Å²	133.7	86%	0.855	74%	0.743	S	S	*	*			trans	26.5	143.8	144.1	-76.8	-110.1	0	0	0	121.4
329	S	25.9	Very low	28.6	Very low	83 Å²	83	132.8 Å²	132.8	58%	0.58	74%	0.737	S	S	*	*			cis	-148.5	-154.1	25	51.4	0	0	0	0	110.6
330	Q	26.6	Very low	28.7	Very low	162 Å²	162	135.2 Å²	135.2	76%	0.757	74%	0.737	S	S	*	*			cis	-158.2	155.7	10.2	-133.3	162.9	110.6	0	0	107.2
331	I	27.2	Very low	28.7	Very low	129 Å²	129	131.2 Å²	131.2	66%	0.662	72%	0.723	S	S	*	*			cis	83.7	128.4	23.2	-65.8	168.7	0	0	0	113.6
332	P	38.6	Very low	28.7	Very low	115 Å²	115	132.1 Å²	132.1	75%	0.747	72%	0.721	S	S	*	*			cis	-148	-142.3	-20.1	43.4	-21	0	0	0	114.1
333	A	28.7	Very low	29	Very low	83 Å²	83	131.1 Å²	131.1	69%	0.686	72%	0.722	S	S	*	*			trans	92.3	138.1	152.8	0	0	0	0	0	118.4
334	H	30.3	Very low	29.7	Very low	163 Å²	163	132 Å²	132	76%	0.755	73%	0.734	S	S	*	*			cis	-166	164.8	-5.3	-135.1	-55.5	0	0	0	112.8
335	I	31.2	Very low	29.9	Very low	129 Å²	129	128.5 Å²	128.5	66%	0.662	73%	0.732	S	S	*	*			trans	72.1	135.3	147.8	-85.8	149.2	0	0	0	116.4
336	N	30.8	Very low	29.9	Very low	123 Å²	123	129.4 Å²	129.4	66%	0.658	73%	0.733	S	S	*	*			cis	-157.2	144.6	-4.4	-109.9	-4.1	0	0	0	110
337	N	29.1	Very low	29.9	Very low	135 Å²	135	125.6 Å²	125.6	72%	0.722	73%	0.728	S	S	*	*				74.8	141.8	88.3	-143	10.2	0	0	0	112.6
338	I	30.2	Very low	29.5	Very low	140 Å²	140	127.4 Å²	127.4	72%	0.718	73%	0.731	S	S	*	*			cis	-148.4	175	27.7	-62.5	160.7	0	0	0	110.3
339	S	26	Very low	29.5	Very low	100 Å²	100	122 Å²	122	70%	0.699	73%	0.725	S	S	*	*			trans	-141.6	-163.2	174.8	-64.9	0	0	0	0	111.6
340	T	28.8	Very low	29.7	Very low	124 Å²	124	125.4 Å²	125.4	76%	0.761	74%	0.736	S	S	*	*			cis	-171.2	151.9	24.3	-24.3	0	0	0	0	113.1
341	S	25.4	Very low	29.9	Very low	85 Å²	85	124.2 Å²	124.2	59%	0.594	74%	0.74	S	S	*	*			trans	68.6	150	140.6	64.1	0	0	0	0	125.5
342	F	27.2	Very low	29.9	Very low	173 Å²	173	122.2 Å²	122.2	76%	0.759	75%	0.751	S	S	*	*			trans	84.4	160	159.6	-59.6	-62.8	0	0	0	118.8
343	P	34.4	Very low	29.3	Very low	117 Å²	117	121 Å²	121	76%	0.76	75%	0.751	S	S	*	*				-131.4	-140.6	-89.7	41.6	-18	0	0	0	113.6
344	P	39.5	Very low	29.1	Very low	131 Å²	131	122.3 Å²	122.3	85%	0.851	76%	0.755	S	S	*	*			trans	-118	161.3	-130.3	29.6	-6.3	0	0	0	117.7
345	G	29	Very low	28.8	Very low	71 Å²	71	122.4 Å²	122.4	73%	0.732	76%	0.76	S	S	*	*			trans	-172.5	99.2	172.1	0	0	0	0	0	116.4
346	T	27.7	Very low	29.2	Very low	140 Å²	140	121.8 Å²	121.8	86%	0.859	77%	0.765	S	S	*	*			trans	23.6	113.9	155.7	55.9	0	0	0	0	121.3
347	S	27.9	Very low	28.9	Very low	108 Å²	108	121 Å²	121	76%	0.755	77%	0.769	S	S	*	*				155.4	149.8	101.1	59.5	0	0	0	0	116.1
348	N	28.9	Very low	28.7	Very low	147 Å²	147	119.6 Å²	119.6	79%	0.786	77%	0.77	S	S	*	*			trans	60.8	104.4	156.2	-63.4	-8.2	0	0	0	122.8
349	S	27.1	Very low	28.6	Very low	104 Å²	104	120.4 Å²	120.4	73%	0.727	77%	0.774	S	S	*	*			trans	58.9	127.9	132	70.9	0	0	0	0	119.8
350	L	29.9	Very low	28.5	Very low	154 Å²	154	120 Å²	120	81%	0.806	77%	0.771	S	S	*	*				-161	161.4	62.3	-92	161.3	0	0	0	113.3
351	T	30.4	Very low	28.4	Very low	137 Å²	137	118.4 Å²	118.4	84%	0.84	77%	0.765	S	S	*	*			trans	51.8	91.2	162	53	0	0	0	0	118.7
352	G	27.4	Very low	28.5	Very low	87 Å²	87	121.6 Å²	121.6	90%	0.897	78%	0.775	S	S	*	*			trans	-99.1	178	158.7	0	0	0	0	0	112.9
353	A	26.2	Very low	28.4	Very low	91 Å²	91	117.3 Å²	117.3	75%	0.752	77%	0.772	S	S	*	*			trans	-108.5	167.9	-172.6	0	0	0	0	0	114.4
354	S	24.3	Very low	27.9	Very low	110 Å²	110	116.6 Å²	116.6	77%	0.769	77%	0.77	S	S	*	*			trans	57.2	134.5	153.2	54.1	0	0	0	0	121.9
355	L	24.4	Very low	27.2	Very low	164 Å²	164	118.5 Å²	118.5	86%	0.859	77%	0.772	S	S	*	*			trans	6.8	156.7	140.1	-62.4	165.7	0	0	0	120.2
356	P	39.2	Very low	27.1	Very low	116 Å²	116	119.1 Å²	119.1	75%	0.753	77%	0.77	S	S	*	*			cis	-139.7	169.9	-40.4	39.9	-24.1	0	0	0	112.8
357	S	23.4	Very low	26.9	Very low	106 Å²	106	119.5 Å²	119.5	74%	0.741	77%	0.772	S	S	*	*			trans	-163.4	131.8	170.2	58.9	0	0	0	0	117.7
358	S	24.8	Very low	27.1	Very low	107 Å²	107	119.5 Å²	119.5	75%	0.748	77%	0.773	S	S	*	*			trans	66.4	171.8	149.9	82.8	0	0	0	0	117.1
359	I	29.3	Very low	27.3	Very low	157 Å²	157	116 Å²	116	81%	0.805	76%	0.759	S	S	*	*			cis	-140.6	172.6	17.6	-126.8	149.8	0	0	0	110.7
360	S	24	Very low	27.7	Very low	90 Å²	90	120.2 Å²	120.2	63%	0.629	76%	0.761	S	S	*	*			trans	-93	174.7	-176.2	59.6	0	0	0	0	115.8
361	S	25.6	Very low	27.9	Very low	91 Å²	91	120.3 Å²	120.3	64%	0.636	76%	0.757	S	S	*	*			trans	72.7	142.8	141	54.1	0	0	0	0	121.9
362	N	27.4	Very low	27.8	Very low	153 Å²	153	117.1 Å²	117.1	82%	0.818	75%	0.751	S	S	*	*			trans	62.8	129.9	157.4	-59.3	-11.8	0	0	0	117.7
363	A	24.8	Very low	28.7	Very low	82 Å²	82	118.7 Å²	118.7	68%	0.678	75%	0.745	S	S	*	*			cis	105.2	134.6	29.1	0	0	0	0	0	113.6
364	S	24.6	Very low	29.1	Very low	103 Å²	103	120 Å²	120	72%	0.72	75%	0.749	S	S	*	*			trans	64.2	121.6	159.8	60.2	0	0	0	0	121.4
365	L	25.5	Very low	29.6	Very low	170 Å²	170	119.1 Å²	119.1	89%	0.89	75%	0.748	S	S	*	*			trans	66.4	153	135.2	-58.5	169.3	0	0	0	118.8
366	A	26.2	Very low	30	Very low	85 Å²	85	117.2 Å²	117.2	70%	0.702	75%	0.749	S	S	*	*			cis	-163.8	158.8	-24.9	0	0	0	0	0	108.9
367	T	24.4	Very low	29.6	Very low	147 Å²	147	115.6 Å²	115.6	90%	0.902	75%	0.753	S	S	*	*			trans	-104	141.2	166.6	45.8	0	0	0	0	111.6
368	S	31	Very low	30.1	Very low	109 Å²	109	115.1 Å²	115.1	76%	0.762	76%	0.755	S	S	*	*			trans	-151.7	164.7	174.3	71.7	0	0	0	0	106.6
369	S	32.7	Very low	30.5	Very low	72 Å²	72	117.9 Å²	117.9	50%	0.503	76%	0.756	S	S	.	*			cis	-161.5	-177	23.4	-73	0	0	0	0	111.8
370	Y	35.7	Very low	30.7	Very low	194 Å²	194	116.1 Å²	116.1	76%	0.761	75%	0.753	S	S	*	*			trans	91.5	150.5	136.4	-65.7	-32.9	0	0	0	120.7
371	H	35.5	Very low	31.3	Very low	156 Å²	156	117.5 Å²	117.5	72%	0.722	76%	0.76	S	S	*	*			cis	-156.2	166.3	-6.9	-123.6	-40.7	0	0	0	112
372	G	28.3	Very low	31.4	Very low	69 Å²	69	123.2 Å²	123.2	71%	0.711	77%	0.773	S	S	*	*			trans	172.8	111.7	166.8	0	0	0	0	0	112.6
373	P	45.6	Very low	31.5	Very low	120 Å²	120	121 Å²	121	78%	0.779	77%	0.77	S	S	*	*			trans	-122.6	157	-164.2	40.8	-31.2	0	0	0	117.1
374	S	34	Very low	32	Very low	119 Å²	119	122.6 Å²	122.6	83%	0.832	77%	0.773	S	S	*	*			trans	-163.7	143.3	150.5	45.6	0	0	0	0	114.9
375	A	34.6	Very low	32.2	Very low	91 Å²	91	124.3 Å²	124.3	75%	0.752	78%	0.779	S	S	*	*			trans	49.5	109.6	152.6	0	0	0	0	0	123.5
376	S	33	Very low	32.5	Very low	125 Å²	125	120.9 Å²	120.9	87%	0.874	77%	0.77	S	S	*	*			trans	48.3	114.5	133.6	61.5	0	0	0	0	122.3
377	G	32.2	Very low	32.7	Very low	81 Å²	81	124 Å²	124	84%	0.835	78%	0.78	S	S	*	*			trans	-167.5	138.9	162.1	0	0	0	0	0	111.3
378	A	33	Very low	33	Very low	96 Å²	96	121.4 Å²	121.4	79%	0.793	77%	0.768	S	S	*	*			trans	-83	136.8	-160.1	0	0	0	0	0	117
379	H	33.5	Very low	33	Very low	166 Å²	166	124 Å²	124	77%	0.769	77%	0.772	S	S	*	*			trans	49.9	107.6	136.5	-74.1	-84.4	0	0	0	122.9
380	T	34.1	Very low	33.1	Very low	120 Å²	120	125.2 Å²	125.2	74%	0.736	78%	0.781	S	S	*	*				48.1	119.6	126.8	57.2	0	0	0	0	121.7
381	P	35.3	Very low	32.8	Very low	119 Å²	119	123.5 Å²	123.5	77%	0.773	79%	0.785	S	S	*	*			trans	-94.5	139	162.2	35.8	-30.3	0	0	0	113
382	F	29.2	Very low	33.3	Very low	211 Å²	211	120.5 Å²	120.5	93%	0.925	78%	0.78	S	S	*	*			trans	-173.4	168.9	151.6	-111.7	-71	0	0	0	111.1
383	S	29.6	Very low	33.7	Very low	106 Å²	106	125.3 Å²	125.3	74%	0.741	79%	0.789	S	S	*	*			trans	77.3	112.8	164.7	-53.2	0	0	0	0	120
384	P	33.2	Very low	33	Very low	116 Å²	116	124 Å²	124	75%	0.753	79%	0.788	S	S	*	*			trans	-92.9	172.2	147.3	36.8	-30.8	0	0	0	111.7
385	T	30.8	Very low	33.5	Very low	138 Å²	138	124.4 Å²	124.4	85%	0.847	79%	0.788	S	S	*	*			trans	78.6	145.5	-171.8	73.2	0	0	0	0	115.2
386	S	30.1	Very low	33.1	Very low	99 Å²	99	131 Å²	131	69%	0.692	79%	0.793	S	S	*	*			cis	-168.4	147.5	-21.2	49.4	0	0	0	0	109.6
387	T	31.1	Very low	33.4	Very low	150 Å²	150	130.9 Å²	130.9	92%	0.92	79%	0.79	S	S	*	*			trans	-98.6	144.1	164.7	40.8	0	0	0	0	111.4
388	S	30.1	Very low	33.3	Very low	93 Å²	93	134.1 Å²	134.1	65%	0.65	79%	0.787	S	S	*	*			trans	-157.1	179.1	-173	60.1	0	0	0	0	111
389	L	31.8	Very low	33	Very low	162 Å²	162	137.4 Å²	137.4	85%	0.848	79%	0.788	S	S	*	*			trans	76.1	143.7	172.9	-57	166	0	0	0	115.7
390	S	35.3	Very low	32.6	Very low	99 Å²	99	138.3 Å²	138.3	69%	0.692	79%	0.79	S	S	*	*			cis	-171.2	136.3	-7.2	46.6	0	0	0	0	114.2
391	N	27.9	Very low	32.7	Very low	158 Å²	158	137.5 Å²	137.5	85%	0.845	79%	0.787	S	S	*	*			trans	46.1	177.9	136.1	-105.3	-3.2	0	0	0	122.5
392	P	47.8	Very low	32.5	Very low	93 Å²	93	139.4 Å²	139.4	60%	0.604	79%	0.788	S	S	*	*			cis	-133.9	161.4	-34.8	35.8	-20.3	0	0	0	114.8
393	N	35	Very low	32.5	Very low	170 Å²	170	135.5 Å²	135.5	91%	0.909	78%	0.776	S	S	*	*				176.7	165.7	129.7	-101.2	-34.3	0	0	0	114.1
394	A	32.5	Very low	32.5	Very low	92 Å²	92	133.6 Å²	133.6	76%	0.76	77%	0.773	S	S	*	*			trans	-118.1	176.7	-178.5	0	0	0	0	0	111.2
395	P	42.8	Very low	32.3	Very low	127 Å²	127	134.2 Å²	134.2	83%	0.825	77%	0.774	S	S	*	*				-137.4	179.2	52.2	38.3	-18.6	0	0	0	117
396	R	27.9	Very low	32	Very low	229 Å²	229	134 Å²	134	86%	0.864	77%	0.774	S	S	*	*			trans	-63.5	152.9	173.8	-70.3	174.9	175.2	-112.7	1.1	111.7
397	P	38.5	Very low	31.9	Very low	124 Å²	124	133.1 Å²	133.1	81%	0.805	78%	0.78	S	S	*	*				-115.1	-167.7	55.6	43.9	-38.6	0	0	0	113.4
398	L	29.9	Very low	31.7	Very low	149 Å²	149	134.3 Å²	134.3	78%	0.78	78%	0.775	S	S	*	*			cis	-136.2	-96.2	0.2	-149.4	-157.5	0	0	0	113.4
399	M	26.8	Very low	31.6	Very low	165 Å²	165	135.4 Å²	135.4	81%	0.813	78%	0.78	S	S	*	*			trans	-121.1	124.8	-167	-99.9	171.2	75.7	0	0	114
400	F	24.5	Very low	31.5	Very low	184 Å²	184	132.9 Å²	132.9	81%	0.807	77%	0.773	S	S	*	*			trans	-88.7	-179.3	139.9	-84.2	-93.8	0	0	0	108.1
401	P	36.7	Very low	31.2	Very low	104 Å²	104	138.2 Å²	138.2	68%	0.675	78%	0.784	S	S	*	*			cis	-125	-159.5	-0.6	47.3	-32.6	0	0	0	111.1
402	M	32	Very low	31.4	Very low	159 Å²	159	135.9 Å²	135.9	78%	0.783	78%	0.778	S	S	*	*			cis	-133	147.4	-2.8	-102	-159.7	161.3	0	0	106.9
403	D	27.6	Very low	30.6	Very low	129 Å²	129	137.2 Å²	137.2	69%	0.69	79%	0.786	S	S	*	*				58.7	127.4	71.8	-53.8	-58.4	0	0	0	114.3
404	G	29.5	Very low	30.4	Very low	65 Å²	65	137.8 Å²	137.8	67%	0.67	79%	0.786	S	S	*	*			cis	169.2	-178.1	-7.6	0	0	0	0	0	114.3
405	V	29.3	Very low	30.5	Very low	129 Å²	129	140.3 Å²	140.3	78%	0.782	79%	0.785	S	S	*	*			trans	58.3	91.8	151.5	-176.1	0	0	0	0	116.6
406	T	25.1	Very low	29.7	Very low	135 Å²	135	137.7 Å²	137.7	83%	0.828	77%	0.77	S	S	*	*				49.8	109	81.1	72.6	0	0	0	0	115.7
407	G	28	Very low	30	Very low	80 Å²	80	132.1 Å²	132.1	83%	0.825	76%	0.763	S	S	*	*			trans	-157.7	108.2	179	0	0	0	0	0	114.8
408	Q	26.4	Very low	29.6	Very low	175 Å²	175	129.2 Å²	129.2	82%	0.818	75%	0.75	S	S	*	*			trans	-40.7	147.4	168	-76.1	-88.5	-41.1	0	0	116.1	P410	Q408-P410 WeakPolarHBondContact O-CD 3.38Å
409	P	27.5	Very low	30	Very low	115 Å²	115	124 Å²	124	75%	0.747	73%	0.727	S	S	*	*			trans	-90.2	125.2	166.7	34.1	-29.8	0	0	0	112.5
410	P	31.6	Very low	30.5	Very low	110 Å²	110	119.4 Å²	119.4	71%	0.714	71%	0.706	S	S	*	*			trans	-123.3	90.7	171.4	35.4	-18.6	0	0	0	112	Q408	Q408-P410 WeakPolarHBondContact O-CD 3.38Å
411	F	28.5	Very low	31.1	Very low	210 Å²	210	114 Å²	114	92%	0.921	69%	0.692	S	S	*	*			trans	-116.3	110.1	157.3	-86	-71.5	0	0	0	109
412	P	31.5	Very low	31.2	Very low	110 Å²	110	112 Å²	112	71%	0.714	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-70.6	158.7	172.1	31	-34	0	0	0	110.6
413	P	31.7	Very low	32.1	Very low	120 Å²	120	107 Å²	107	78%	0.779	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-66.1	149	-174.9	27.2	-35.5	0	0	0	112.9	I415	P413-I415 PolarHBondContact O-N 2.8Å
414	M	30.4	Very low	33	Very low	182 Å²	182	105.7 Å²	105.7	90%	0.897	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-49.3	133.1	172	-76.4	-79	-81	0	0	111.6	S416	M414-S416 PolarHBondContact O-N 3.12Å
415	I	33.7	Very low	33.7	Very low	146 Å²	146	106.5 Å²	106.5	75%	0.749	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-62.8	128.8	-178.8	-66.9	173.9	0	0	0	110	P413 A419	P413-I415 PolarHBondContact O-N 2.8Å; I415-A419 HydrophobicContact CG2-CB 3.41Å; I415-A419 VanDerWaalsContact CG2-CB 3.41Å
416	S	27.3	Very low	34.5	Very low	72 Å²	72	103.4 Å²	103.4	50%	0.503	63%	0.626	S	S	.	*	P	Polyproline II helix	trans	-70.8	157.6	-178.1	74.2	0	0	0	0	113.1	M414 A418 A419	M414-S416 PolarHBondContact O-N 3.12Å; S416-A418 PolarHBondContact O-N 3.21Å; S416-A419 PolarHBondContact O-N 3.03Å; S416-A419 VanDerWaalsContact O-N 3.11Å
417	P	33.5	Very low	35.7	Very low	112 Å²	112	106.3 Å²	106.3	73%	0.727	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-15.3	177.2	-28.2	36.3	0	0	0	115.8	A419 L420 S421	P417-A419 PolarHBondContact O-N 3.32Å; P417-L420 PolarHBondContact O-N 2.91Å; P417-S421 PolarHBondContact O-N 3.19Å; P417-S421 VanDerWaalsContact O-N 3.17Å
418	A	31.2	Very low	36.8	Very low	63 Å²	63	109.3 Å²	109.3	52%	0.521	62%	0.624	S	S	.	*	H	α-helix	trans	-59.2	-31.6	174.2	0	0	0	0	0	113.2	S416 S421 A422	S416-A418 PolarHBondContact O-N 3.21Å; A418-S421 PolarHBondContact O-N 2.92Å; A418-A422 WeakPolarHBondContact O-CB 3.37Å; A418-A422 PolarHBondContact O-N 2.88Å
419	A	37.4	Very low	38.2	Very low	38 Å²	38	103.5 Å²	103.5	31%	0.314	60%	0.599	S	S	.	*	H	α-helix	trans	-67.9	-38.4	177.5	0	0	0	0	0	112.4	I415 S416 P417 A422 I423	I415-A419 HydrophobicContact CG2-CB 3.41Å; I415-A419 VanDerWaalsContact CG2-CB 3.41Å; S416-A419 PolarHBondContact O-N 3.03Å; S416-A419 VanDerWaalsContact O-N 3.11Å; P417-A419 PolarHBondContact O-N 3.32Å; A419-A422 PolarHBondContact O-N 2.83Å; A419-I423 WeakPolarHBondContact O-CG1 3.43Å; A419-I423 PolarHBondContact O-N 3.27Å; A419-I423 VanDerWaalsContact O-N 3.12Å
420	L	38.1	Very low	39.9	Very low	69 Å²	69	101.7 Å²	101.7	36%	0.361	58%	0.582	S	S	.	*	H	α-helix	trans	-64.6	-43.9	174.1	-174.5	66.2	0	0	0	110.5	P417 A422 I423 I424	P417-L420 PolarHBondContact O-N 2.91Å; L420-A422 VanDerWaalsContact C-N 3.3Å; L420-A422 PolarHBondContact O-N 2.97Å; L420-I423 PolarHBondContact O-N 3.36Å; L420-I424 HydrophobicContact CD1-CD1 4.09Å; L420-I424 HydrophobicContact CG-CD1 3.89Å; L420-I424 WeakPolarHBondContact O-CB 3.19Å; L420-I424 VanDerWaalsContact O-CG1 3.32Å; L420-I424 WeakPolarHBondContact O-CG1 3.04Å; L420-I424 PolarHBondContact O-N 2.96Å
421	S	35.7	Very low	40.8	Very low	72 Å²	72	101.3 Å²	101.3	50%	0.503	57%	0.571	S	S	.	*	H	α-helix	trans	-60.9	-36.6	174.7	-168.2	0	0	0	0	112.8	P417 A418 S425	P417-S421 PolarHBondContact O-N 3.19Å; P417-S421 VanDerWaalsContact O-N 3.17Å; A418-S421 PolarHBondContact O-N 2.92Å; S421-S425 VanDerWaalsContact O-CB 3.27Å; S421-S425 WeakPolarHBondContact O-CB 3.41Å; S421-S425 PolarHBondContact O-N 2.96Å; S421-S425 VanDerWaalsContact O-N 3.13Å; S421-S425 PolarHBondContact O-OG 2.95Å
422	A	39.9	Very low	41.9	Very low	62 Å²	62	99.6 Å²	99.6	51%	0.512	56%	0.563	S	S	.	*	H	α-helix	trans	-67.6	-46.7	178.2	0	0	0	0	0	112	A418 A419 L420 S425 D426	A418-A422 WeakPolarHBondContact O-CB 3.37Å; A418-A422 PolarHBondContact O-N 2.88Å; A419-A422 PolarHBondContact O-N 2.83Å; L420-A422 VanDerWaalsContact C-N 3.3Å; L420-A422 PolarHBondContact O-N 2.97Å; A422-S425 PolarHBondContact O-N 3.15Å; A422-D426 PolarHBondContact O-N 2.96Å; A422-D426 VanDerWaalsContact O-N 3.15Å
423	I	49.3	Very low	43	Very low	52 Å²	52	98.6 Å²	98.6	27%	0.267	55%	0.549	S	S	.	.	H	α-helix	trans	-67.3	-37.8	-179.5	-65.7	167	0	0	0	111.6	A419 L420 S425 D426 L429 A437 M441	A419-I423 WeakPolarHBondContact O-CG1 3.43Å; A419-I423 PolarHBondContact O-N 3.27Å; A419-I423 VanDerWaalsContact O-N 3.12Å; L420-I423 PolarHBondContact O-N 3.36Å; I423-S425 VanDerWaalsContact C-N 3.28Å; I423-S425 PolarHBondContact O-N 3.01Å; I423-D426 PolarHBondContact O-N 3.47Å; I423-L429 HydrophobicContact CG2-CD1 4.09Å; I423-A437 HydrophobicContact CG2-CB 4.28Å; I423-M441 HydrophobicContact CD1-CE 3.64Å
424	I	47.4	Very low	43.8	Very low	102 Å²	102	95.8 Å²	95.8	52%	0.523	52%	0.523	S	S	.	.	H	α-helix	trans	-68	-29.8	175.1	-67.8	171.3	0	0	0	111.4	L420	L420-I424 HydrophobicContact CD1-CD1 4.09Å; L420-I424 HydrophobicContact CG-CD1 3.89Å; L420-I424 WeakPolarHBondContact O-CB 3.19Å; L420-I424 VanDerWaalsContact O-CG1 3.32Å; L420-I424 WeakPolarHBondContact O-CG1 3.04Å; L420-I424 PolarHBondContact O-N 2.96Å
425	S	43.3	Very low	44.8	Very low	83 Å²	83	88.5 Å²	88.5	58%	0.58	49%	0.489	S	S	*	.	H	α-helix	trans	-86.3	-7.8	180	-56.2	0	0	0	0	114.5	S421 A422 I423 K427	S421-S425 VanDerWaalsContact O-CB 3.27Å; S421-S425 WeakPolarHBondContact O-CB 3.41Å; S421-S425 PolarHBondContact O-N 2.96Å; S421-S425 VanDerWaalsContact O-N 3.13Å; S421-S425 PolarHBondContact O-OG 2.95Å; A422-S425 PolarHBondContact O-N 3.15Å; I423-S425 VanDerWaalsContact C-N 3.28Å; I423-S425 PolarHBondContact O-N 3.01Å; S425-K427 PolarHBondContact O-N 2.58Å
426	D	46.4	Very low	45.5	Very low	64 Å²	64	84.2 Å²	84.2	34%	0.342	48%	0.475	S	S	.	.			trans	-74.3	122.9	-177.9	-159.6	-28.2	0	0	0	111.2	A422 I423 N428 L429 R434	A422-D426 PolarHBondContact O-N 2.96Å; A422-D426 VanDerWaalsContact O-N 3.15Å; I423-D426 PolarHBondContact O-N 3.47Å; D426-N428 VanDerWaalsContact C-N 3.33Å; D426-N428 WeakPolarHBondContact OD1-CB 3.49Å; D426-N428 PolarHBondContact OD1-N 3.38Å; D426-N428 PolarHBondContact OD1-ND2 3.48Å; D426-L429 HydrophobicContact CB-CD1 4.37Å; D426-L429 HydrophobicContact CB-CG 4.47Å; D426-R434 PolarHBondContact O-NH1 2.94Å
427	K	51.5	Low	46.3	Very low	195 Å²	195	82.1 Å²	82.1	85%	0.848	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-10.9	179.9	-64.7	-172.2	177.8	-175.7	0	113.4	S425	S425-K427 PolarHBondContact O-N 2.58Å
428	N	49.9	Very low	46.8	Very low	143 Å²	143	79 Å²	79	77%	0.765	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-11.2	-179.6	-55.6	-73.5	0	0	0	112.9	D426	D426-N428 VanDerWaalsContact C-N 3.33Å; D426-N428 WeakPolarHBondContact OD1-CB 3.49Å; D426-N428 PolarHBondContact OD1-N 3.38Å; D426-N428 PolarHBondContact OD1-ND2 3.48Å
429	L	56.7	Low	47.4	Very low	54 Å²	54	78.5 Å²	78.5	28%	0.283	44%	0.442	S	S	.	.	S	Bend	trans	-95.9	137.7	175.8	-61.4	176.5	0	0	0	110.9	I423 D426 Q433 R434	I423-L429 HydrophobicContact CG2-CD1 4.09Å; D426-L429 HydrophobicContact CB-CD1 4.37Å; D426-L429 HydrophobicContact CB-CG 4.47Å; L429-Q433 HydrophobicContact CB-CB 4.31Å; L429-Q433 HydrophobicContact CD2-CB 4.39Å; L429-Q433 VanDerWaalsContact CD2-OE1 3.26Å; L429-R434 HydrophobicContact CB-CG 3.96Å; L429-R434 HydrophobicContact CD1-CG 4.41Å; L429-R434 PolarHBondContact O-NH1 2.85Å
430	D	63.1	Low	47.8	Very low	76 Å²	76	77.9 Å²	77.9	41%	0.406	44%	0.436	S	S	.	.			trans	-76.2	166.3	170	77.7	50.4	0	0	0	111.8	K432 Q433 R434	D430-K432 VanDerWaalsContact C-N 3.26Å; D430-K432 PolarHBondContact O-N 3.17Å; D430-K432 VanDerWaalsContact OD1-CA 3.29Å; D430-K432 WeakPolarHBondContact OD1-CA 3.44Å; D430-K432 WeakPolarHBondContact OD1-CB 3.43Å; D430-K432 PolarHBondContact OD1-N 3.29Å; D430-Q433 WeakPolarHBondContact O-CB 3.12Å; D430-Q433 PolarHBondContact O-N 3.44Å; D430-Q433 WeakPolarHBondContact OD1-CG 3.32Å; D430-Q433 PolarHBondContact OD1-N 3.38Å; D430-Q433 VanDerWaalsContact OD2-CD 3.24Å; D430-Q433 WeakPolarHBondContact OD2-CG 3.37Å; D430-Q433 PolarHBondContact OD2-NE2 3.36Å; D430-R434 PolarHBondContact O-N 2.84Å
431	E	51.1	Low	48.1	Very low	102 Å²	102	78.3 Å²	78.3	48%	0.477	44%	0.438	S	S	.	.	H	α-helix	trans	-65.7	-28.8	-175.3	-165.4	58.9	-157.5	0	0	113.2	R434 T435	E431-R434 IonicContact OE2-CZ 3.54Å; E431-R434 IonicContact OE2-NE 3.82Å; E431-R434 PolarHBondContact OE2-NE 2.81Å; E431-R434 VanDerWaalsContact OE2-NE 3.15Å; E431-R434 IonicContact OE2-NH2 3.93Å; E431-R434 PolarHBondContact OE2-NH2 3.3Å; E431-T435 VanDerWaalsContact O-CB 3.25Å; E431-T435 WeakPolarHBondContact O-CB 3.48Å; E431-T435 PolarHBondContact O-N 3.47Å; E431-T435 PolarHBondContact O-OG1 3.43Å
432	K	50.8	Low	48.4	Very low	174 Å²	174	77.8 Å²	77.8	76%	0.757	44%	0.437	S	S	*	.	H	α-helix	trans	-74.1	-37.3	176.2	-168.3	179.8	-179.2	-179.3	0	110.4	D430 A436	D430-K432 VanDerWaalsContact C-N 3.26Å; D430-K432 PolarHBondContact O-N 3.17Å; D430-K432 VanDerWaalsContact OD1-CA 3.29Å; D430-K432 WeakPolarHBondContact OD1-CA 3.44Å; D430-K432 WeakPolarHBondContact OD1-CB 3.43Å; D430-K432 PolarHBondContact OD1-N 3.29Å; K432-A436 VanDerWaalsContact O-CB 3.24Å; K432-A436 WeakPolarHBondContact O-CB 3.45Å; K432-A436 PolarHBondContact O-N 3.47Å
433	Q	54.2	Low	48.4	Very low	89 Å²	89	77.6 Å²	77.6	42%	0.416	44%	0.436	S	S	.	.	H	α-helix	trans	-66.8	-46.7	172.9	-66.3	170.3	18.1	0	0	111.8	L429 D430 T435 A436 A437	L429-Q433 HydrophobicContact CB-CB 4.31Å; L429-Q433 HydrophobicContact CD2-CB 4.39Å; L429-Q433 VanDerWaalsContact CD2-OE1 3.26Å; D430-Q433 WeakPolarHBondContact O-CB 3.12Å; D430-Q433 PolarHBondContact O-N 3.44Å; D430-Q433 WeakPolarHBondContact OD1-CG 3.32Å; D430-Q433 PolarHBondContact OD1-N 3.38Å; D430-Q433 VanDerWaalsContact OD2-CD 3.24Å; D430-Q433 WeakPolarHBondContact OD2-CG 3.37Å; D430-Q433 PolarHBondContact OD2-NE2 3.36Å; Q433-T435 VanDerWaalsContact C-N 3.35Å; Q433-T435 PolarHBondContact O-N 2.85Å; Q433-A436 PolarHBondContact O-N 3.4Å; Q433-A437 WeakPolarHBondContact O-CB 3.32Å; Q433-A437 PolarHBondContact O-N 3.23Å
434	R	48	Very low	48	Very low	61 Å²	61	78 Å²	78	23%	0.23	45%	0.447	C	S	.	.	H	α-helix	trans	-58.7	-45.4	173.3	-75.8	-165.7	-72	-92.3	-7.6	111.5	D426 L429 D430 E431 A437 A438	D426-R434 PolarHBondContact O-NH1 2.94Å; L429-R434 HydrophobicContact CB-CG 3.96Å; L429-R434 HydrophobicContact CD1-CG 4.41Å; L429-R434 PolarHBondContact O-NH1 2.85Å; D430-R434 PolarHBondContact O-N 2.84Å; E431-R434 IonicContact OE2-CZ 3.54Å; E431-R434 IonicContact OE2-NE 3.82Å; E431-R434 PolarHBondContact OE2-NE 2.81Å; E431-R434 VanDerWaalsContact OE2-NE 3.15Å; E431-R434 IonicContact OE2-NH2 3.93Å; E431-R434 PolarHBondContact OE2-NH2 3.3Å; R434-A437 PolarHBondContact O-N 3.17Å; R434-A438 WeakPolarHBondContact O-CB 3.26Å; R434-A438 PolarHBondContact O-N 3.3Å
435	T	52.1	Low	47.8	Very low	30 Å²	30	79.4 Å²	79.4	18%	0.184	45%	0.453	C	S	.	.	H	α-helix	trans	-62.5	-43.4	176.6	-61.6	0	0	0	0	112.1	P290 E431 Q433 A438 A439	P290-T435 HydrophobicContact CG-CG2 3.76Å; E431-T435 VanDerWaalsContact O-CB 3.25Å; E431-T435 WeakPolarHBondContact O-CB 3.48Å; E431-T435 PolarHBondContact O-N 3.47Å; E431-T435 PolarHBondContact O-OG1 3.43Å; Q433-T435 VanDerWaalsContact C-N 3.35Å; Q433-T435 PolarHBondContact O-N 2.85Å; T435-A438 PolarHBondContact O-N 3.11Å; T435-A439 WeakPolarHBondContact O-CB 3.09Å; T435-A439 PolarHBondContact O-N 2.65Å
436	A	47.9	Very low	47.6	Very low	56 Å²	56	78.4 Å²	78.4	46%	0.463	45%	0.449	S	S	.	.	H	α-helix	trans	-67.2	-38.3	178.2	0	0	0	0	0	112.7	K432 Q433 A440	K432-A436 VanDerWaalsContact O-CB 3.24Å; K432-A436 WeakPolarHBondContact O-CB 3.45Å; K432-A436 PolarHBondContact O-N 3.47Å; Q433-A436 PolarHBondContact O-N 3.4Å; A436-A440 VanDerWaalsContact O-CB 3.26Å; A436-A440 WeakPolarHBondContact O-CB 3.37Å; A436-A440 PolarHBondContact O-N 3.47Å
437	A	44.8	Very low	47.2	Very low	27 Å²	27	78.2 Å²	78.2	22%	0.223	46%	0.457	C	S	.	.	H	α-helix	trans	-63	-46.8	174.1	0	0	0	0	0	111.4	I423 Q433 R434 A440 M441	I423-A437 HydrophobicContact CG2-CB 4.28Å; Q433-A437 WeakPolarHBondContact O-CB 3.32Å; Q433-A437 PolarHBondContact O-N 3.23Å; R434-A437 PolarHBondContact O-N 3.17Å; A437-A440 PolarHBondContact O-N 2.86Å; A437-M441 WeakPolarHBondContact O-CG 3.3Å; A437-M441 PolarHBondContact O-N 3.01Å
438	A	44.1	Very low	46.5	Very low	47 Å²	47	72 Å²	72	39%	0.388	44%	0.442	S	S	.	.	H	α-helix	trans	-62.1	-45.9	176.6	0	0	0	0	0	112.3	R434 T435 A440 M441 A442	R434-A438 WeakPolarHBondContact O-CB 3.26Å; R434-A438 PolarHBondContact O-N 3.3Å; T435-A438 PolarHBondContact O-N 3.11Å; A438-A440 PolarHBondContact O-N 2.98Å; A438-M441 PolarHBondContact O-N 3.39Å; A438-A442 WeakPolarHBondContact O-CB 3.22Å; A438-A442 PolarHBondContact O-N 2.92Å
439	A	44.6	Very low	45.8	Very low	52 Å²	52	66.8 Å²	66.8	43%	0.43	42%	0.419	S	S	.	.	H	α-helix	trans	-62.7	-41.8	177.3	0	0	0	0	0	112.4	T435 M441 A442 A443	T435-A439 WeakPolarHBondContact O-CB 3.09Å; T435-A439 PolarHBondContact O-N 2.65Å; A439-M441 PolarHBondContact O-N 3.13Å; A439-A442 PolarHBondContact O-N 3.36Å; A439-A443 WeakPolarHBondContact O-CB 3.35Å; A439-A443 PolarHBondContact O-N 3.31Å
440	A	45.6	Very low	44.9	Very low	25 Å²	25	67.9 Å²	67.9	21%	0.207	44%	0.436	C	S	.	.	H	α-helix	trans	-67.2	-34.2	177	0	0	0	0	0	112.8	A436 A437 A438 A444	A436-A440 VanDerWaalsContact O-CB 3.26Å; A436-A440 WeakPolarHBondContact O-CB 3.37Å; A436-A440 PolarHBondContact O-N 3.47Å; A437-A440 PolarHBondContact O-N 2.86Å; A438-A440 PolarHBondContact O-N 2.98Å; A440-A444 WeakPolarHBondContact O-CB 3.18Å; A440-A444 PolarHBondContact O-N 2.93Å
441	M	44.7	Very low	43.6	Very low	79 Å²	79	68 Å²	68	39%	0.389	45%	0.447	S	S	.	.	H	α-helix	trans	-72	-39.4	173.6	-71.7	-174.8	-179.5	0	0	112.2	I423 A437 A438 A439 A444 M445	I423-M441 HydrophobicContact CD1-CE 3.64Å; A437-M441 WeakPolarHBondContact O-CG 3.3Å; A437-M441 PolarHBondContact O-N 3.01Å; A438-M441 PolarHBondContact O-N 3.39Å; A439-M441 PolarHBondContact O-N 3.13Å; M441-A444 PolarHBondContact O-N 2.77Å; M441-M445 WeakPolarHBondContact O-CG 3.49Å; M441-M445 PolarHBondContact O-N 2.95Å
442	A	40.8	Very low	42.8	Very low	60 Å²	60	67.6 Å²	67.6	50%	0.496	46%	0.456	S	S	.	.	H	α-helix	trans	-61.7	-44.3	173.4	0	0	0	0	0	111.7	A438 A439 A444 M445 A446	A438-A442 WeakPolarHBondContact O-CB 3.22Å; A438-A442 PolarHBondContact O-N 2.92Å; A439-A442 PolarHBondContact O-N 3.36Å; A442-A444 VanDerWaalsContact C-N 3.35Å; A442-A444 PolarHBondContact O-N 2.84Å; A442-M445 PolarHBondContact O-N 3.39Å; A442-A446 PolarHBondContact O-N 3.4Å
443	A	40.1	Very low	42	Very low	58 Å²	58	67.7 Å²	67.7	48%	0.479	46%	0.459	S	S	.	.	H	α-helix	trans	-62.9	-38.2	174.5	0	0	0	0	0	112.6	A439 A446 A447	A439-A443 WeakPolarHBondContact O-CB 3.35Å; A439-A443 PolarHBondContact O-N 3.31Å; A443-A446 PolarHBondContact O-N 3.05Å; A443-A447 WeakPolarHBondContact O-CB 3.49Å; A443-A447 PolarHBondContact O-N 3.16Å
444	A	41	Very low	40.8	Very low	60 Å²	60	66.6 Å²	66.6	50%	0.496	47%	0.471	S	S	.	.	H	α-helix	trans	-67.2	-37	174.8	0	0	0	0	0	112.7	A440 M441 A442 A448	A440-A444 WeakPolarHBondContact O-CB 3.18Å; A440-A444 PolarHBondContact O-N 2.93Å; M441-A444 PolarHBondContact O-N 2.77Å; A442-A444 VanDerWaalsContact C-N 3.35Å; A442-A444 PolarHBondContact O-N 2.84Å; A444-A448 WeakPolarHBondContact O-CB 3.21Å; A444-A448 PolarHBondContact O-N 2.86Å
445	M	42.8	Very low	39.9	Very low	133 Å²	133	66.7 Å²	66.7	66%	0.655	49%	0.491	S	S	*	.	H	α-helix	trans	-67.9	-42.3	174.4	-71.4	176.3	-178	0	0	111.8	M441 A442 A448 A449	M441-M445 WeakPolarHBondContact O-CG 3.49Å; M441-M445 PolarHBondContact O-N 2.95Å; A442-M445 PolarHBondContact O-N 3.39Å; M445-A448 PolarHBondContact O-N 3.37Å; M445-A449 PolarHBondContact O-N 3.19Å
446	A	39.5	Very low	39	Very low	61 Å²	61	71.1 Å²	71.1	50%	0.504	52%	0.52	S	S	.	.	H	α-helix	trans	-62.7	-41.1	174	0	0	0	0	0	112.2	A442 A443 A448 A449 A450	A442-A446 PolarHBondContact O-N 3.4Å; A443-A446 PolarHBondContact O-N 3.05Å; A446-A448 PolarHBondContact O-N 3.12Å; A446-A449 PolarHBondContact O-N 3.11Å; A446-A450 PolarHBondContact O-N 3.21Å
447	A	37.6	Very low	38.2	Very low	61 Å²	61	74.6 Å²	74.6	50%	0.504	54%	0.538	S	S	.	.	H	α-helix	trans	-64.1	-38	174.2	0	0	0	0	0	112.6	A443 A450 A451	A443-A447 WeakPolarHBondContact O-CB 3.49Å; A443-A447 PolarHBondContact O-N 3.16Å; A447-A450 PolarHBondContact O-N 2.95Å; A447-A451 WeakPolarHBondContact O-CB 3.44Å; A447-A451 PolarHBondContact O-N 3.35Å
448	A	36.9	Very low	37.5	Very low	64 Å²	64	77.1 Å²	77.1	53%	0.529	57%	0.567	S	S	.	*	H	α-helix	trans	-68	-36.9	174.6	0	0	0	0	0	112.6	A444 M445 A446 A451 S452	A444-A448 WeakPolarHBondContact O-CB 3.21Å; A444-A448 PolarHBondContact O-N 2.86Å; M445-A448 PolarHBondContact O-N 3.37Å; A446-A448 PolarHBondContact O-N 3.12Å; A448-A451 PolarHBondContact O-N 3.48Å; A448-S452 PolarHBondContact O-N 2.95Å
449	A	36.3	Very low	36.6	Very low	34 Å²	34	79.1 Å²	79.1	28%	0.281	58%	0.583	S	S	.	*	H	α-helix	trans	-63.7	-47.6	173.2	0	0	0	0	0	111.3	M445 A446 A451 S452	M445-A449 PolarHBondContact O-N 3.19Å; A446-A449 PolarHBondContact O-N 3.11Å; A449-A451 VanDerWaalsContact C-N 3.33Å; A449-A451 PolarHBondContact O-N 2.87Å; A449-S452 WeakPolarHBondContact O-CB 3.44Å; A449-S452 PolarHBondContact O-N 3.37Å; A449-S452 VanDerWaalsContact O-N 3.08Å; A449-S452 PolarHBondContact O-OG 2.97Å
450	A	36.1	Very low	35.8	Very low	77 Å²	77	86.9 Å²	86.9	64%	0.636	61%	0.608	S	S	*	*	H	α-helix	trans	-59.9	-39.7	175.8	0	0	0	0	0	112.8	A446 A447 S452	A446-A450 PolarHBondContact O-N 3.21Å; A447-A450 PolarHBondContact O-N 2.95Å; A450-S452 PolarHBondContact O-N 3.19Å
451	A	36.2	Very low	34.9	Very low	78 Å²	78	89.1 Å²	89.1	65%	0.645	63%	0.634	S	S	*	*	H	α-helix	trans	-66	-20.4	176.7	0	0	0	0	0	113.9	A447 A448 A449 Q453	A447-A451 WeakPolarHBondContact O-CB 3.44Å; A447-A451 PolarHBondContact O-N 3.35Å; A448-A451 PolarHBondContact O-N 3.48Å; A449-A451 VanDerWaalsContact C-N 3.33Å; A449-A451 PolarHBondContact O-N 2.87Å; A451-Q453 PolarHBondContact O-N 3.49Å
452	S	34.9	Very low	34	Very low	94 Å²	94	93.1 Å²	93.1	66%	0.657	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-10.6	-175.1	74.5	0	0	0	0	115.3	A448 A449 A450	A448-S452 PolarHBondContact O-N 2.95Å; A449-S452 WeakPolarHBondContact O-CB 3.44Å; A449-S452 PolarHBondContact O-N 3.37Å; A449-S452 VanDerWaalsContact O-N 3.08Å; A449-S452 PolarHBondContact O-OG 2.97Å; A450-S452 PolarHBondContact O-N 3.19Å
453	Q	33.4	Very low	33.4	Very low	176 Å²	176	96 Å²	96	82%	0.822	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	5.1	177	-58.7	-157.2	28.2	0	0	114	A451 G455	A451-Q453 PolarHBondContact O-N 3.49Å; Q453-G455 PolarHBondContact O-N 2.68Å; Q453-G455 VanDerWaalsContact O-N 3.14Å
454	G	30.1	Very low	32.7	Very low	65 Å²	65	100.5 Å²	100.5	67%	0.67	69%	0.685	S	S	*	*			trans	-78.5	87	175.3	0	0	0	0	0	113.5
455	G	28.7	Very low	32	Very low	63 Å²	63	105.1 Å²	105.1	65%	0.649	70%	0.701	S	S	*	*			trans	-62.8	140.5	165.7	0	0	0	0	0	111.6	Q453	Q453-G455 PolarHBondContact O-N 2.68Å; Q453-G455 VanDerWaalsContact O-N 3.14Å
456	P	32.8	Very low	31.1	Very low	123 Å²	123	108 Å²	108	80%	0.799	71%	0.71	S	S	*	*			trans	-73.7	135.8	-171	28.6	-35	0	0	0	112.7	G458	P456-G458 PolarHBondContact O-N 3.18Å
457	P	31.4	Very low	30.5	Very low	129 Å²	129	108.9 Å²	108.9	84%	0.838	73%	0.725	S	S	*	*			trans	-74.7	97.3	176.6	29.9	-33.9	0	0	0	111.2	A459	P457-A459 PolarHBondContact O-N 3.13Å
458	G	30.7	Very low	30	Very low	80 Å²	80	110.8 Å²	110.8	83%	0.825	73%	0.734	S	S	*	*			trans	-73.1	105.7	172.1	0	0	0	0	0	111.7	P456	P456-G458 PolarHBondContact O-N 3.18Å
459	A	25.1	Very low	29.4	Very low	89 Å²	89	115.1 Å²	115.1	74%	0.736	75%	0.749	S	S	*	*			trans	-80.5	126.7	178.7	0	0	0	0	0	112.4	P457	P457-A459 PolarHBondContact O-N 3.13Å
460	F	26.6	Very low	29.1	Very low	215 Å²	215	118.6 Å²	118.6	94%	0.943	77%	0.771	S	S	*	*			trans	-161.3	124	151.5	-104.9	-66.7	0	0	0	113
461	G	27.1	Very low	28.7	Very low	73 Å²	73	122.6 Å²	122.6	75%	0.753	78%	0.781	S	S	*	*			trans	60.3	100.8	146.7	0	0	0	0	0	121
462	L	26	Very low	28.4	Very low	163 Å²	163	124.3 Å²	124.3	85%	0.853	79%	0.788	S	S	*	*			trans	-91.8	158.6	142.1	-70.3	176.1	0	0	0	109.4
463	P	29.3	Very low	28	Very low	121 Å²	121	123.6 Å²	123.6	79%	0.786	80%	0.796	S	S	*	*				-141	133.6	99.6	36.2	-22.9	0	0	0	116
464	L	24.4	Very low	27.6	Very low	152 Å²	152	121 Å²	121	80%	0.796	80%	0.797	S	S	*	*			trans	13.5	126.6	139	-54	170.6	0	0	0	119.4
465	N	26.3	Very low	27.2	Very low	156 Å²	156	123.2 Å²	123.2	83%	0.834	80%	0.802	S	S	*	*				-159	166.6	112	-136.8	0.2	0	0	0	114.5
466	F	24.6	Very low	27.8	Very low	195 Å²	195	125.6 Å²	125.6	86%	0.855	81%	0.806	S	S	*	*			trans	-76.6	156.1	-164	-76.2	-117	0	0	0	117.4
467	G	26.9	Very low	27.5	Very low	79 Å²	79	127.7 Å²	127.7	81%	0.814	81%	0.807	S	S	*	*			trans	-175.4	127.8	157.7	0	0	0	0	0	110.8
468	S	25.6	Very low	27.3	Very low	100 Å²	100	126.6 Å²	126.6	70%	0.699	79%	0.794	S	S	*	*			trans	-134.3	157.9	-162.8	54.5	0	0	0	0	116.1
469	N	26.1	Very low	27.2	Very low	155 Å²	155	127 Å²	127	83%	0.829	79%	0.791	S	S	*	*			trans	70.6	128.1	172.7	-51	-23.6	0	0	0	114.6
470	S	29.7	Very low	27.4	Very low	107 Å²	107	130.8 Å²	130.8	75%	0.748	79%	0.793	S	S	*	*			cis	-164.4	162.2	33.2	46.2	0	0	0	0	113.5
471	L	28	Very low	27.7	Very low	162 Å²	162	125.4 Å²	125.4	85%	0.848	77%	0.774	S	S	*	*			trans	20.6	140.2	146.1	-56.5	164.1	0	0	0	119.8
472	S	28.8	Very low	27.9	Very low	113 Å²	113	127.3 Å²	127.3	79%	0.79	77%	0.766	S	S	*	*			cis	179.4	143.8	-10.6	48.4	0	0	0	0	107.3
473	G	25.9	Very low	28.2	Very low	80 Å²	80	126.5 Å²	126.5	83%	0.825	76%	0.759	S	S	*	*			cis	-157.2	165.7	-5.2	0	0	0	0	0	109.7
474	S	24.7	Very low	28.2	Very low	122 Å²	122	123.4 Å²	123.4	85%	0.853	74%	0.744	S	S	*	*			trans	-127.3	171.9	-162.7	57.6	0	0	0	0	114.5
475	S	22.9	Very low	28.6	Very low	110 Å²	110	120.3 Å²	120.3	77%	0.769	73%	0.732	S	S	*	*			trans	-83.2	-161.8	-179.4	58	0	0	0	0	113
476	P	40.7	Very low	28.7	Very low	114 Å²	114	118.8 Å²	118.8	74%	0.74	72%	0.721	S	S	*	*				-107.7	-175.1	-116.8	39	-22	0	0	0	113.7
477	M	26	Very low	29	Very low	166 Å²	166	112.6 Å²	112.6	82%	0.818	71%	0.706	S	S	*	*			trans	162.8	-178.3	144.5	-88.9	-69.3	-80.1	0	0	111.6
478	D	27	Very low	29.1	Very low	106 Å²	106	112.1 Å²	112.1	57%	0.567	69%	0.69	S	S	*	*			trans	75.9	34.9	160.3	-65.7	-4	0	0	0	121	H480	D478-H480 VanDerWaalsContact C-N 3.27Å
479	A	28.7	Very low	29.3	Very low	90 Å²	90	111.1 Å²	111.1	74%	0.744	67%	0.673	S	S	*	*	H	α-helix	trans	-69	-24	157.3	0	0	0	0	0	113.4
480	H	31.1	Very low	29.4	Very low	168 Å²	168	106.8 Å²	106.8	78%	0.778	66%	0.659	S	S	*	*	H	α-helix	trans	-81.7	-24.7	-166.3	-150.2	-49.5	0	0	0	114.5	D478	D478-H480 VanDerWaalsContact C-N 3.27Å
481	N	31.7	Very low	29.4	Very low	102 Å²	102	105 Å²	105	55%	0.545	65%	0.651	S	S	.	*	H	α-helix	trans	-76.6	-39.4	177.3	-87.4	-40	0	0	0	112.2	M483 A484 T485	N481-M483 VanDerWaalsContact C-N 3.32Å; N481-M483 PolarHBondContact O-N 3.46Å; N481-A484 WeakPolarHBondContact O-CB 3.42Å; N481-A484 PolarHBondContact O-N 3.15Å; N481-A484 VanDerWaalsContact O-N 3.11Å; N481-T485 PolarHBondContact O-N 3.48Å; N481-T485 PolarHBondContact O-OG1 2.9Å
482	L	32.3	Very low	29.4	Very low	112 Å²	112	98.3 Å²	98.3	59%	0.586	62%	0.619	S	S	*	*	H	α-helix	trans	-60.3	-41.7	-176.5	-170.1	69.5	0	0	0	112.1	T485 M486	L482-T485 PolarHBondContact O-N 2.82Å; L482-M486 HydrophobicContact CD1-CE 4.33Å; L482-M486 HydrophobicContact CG-CE 4.28Å; L482-M486 WeakPolarHBondContact O-CG 3.38Å; L482-M486 PolarHBondContact O-N 2.8Å
483	M	30.8	Very low	29.4	Very low	146 Å²	146	97.5 Å²	97.5	72%	0.719	60%	0.603	S	S	*	*	H	α-helix	trans	-67.6	-35.5	177.2	-168.9	176.6	-72.7	0	0	112.4	N481 A487	N481-M483 VanDerWaalsContact C-N 3.32Å; N481-M483 PolarHBondContact O-N 3.46Å; M483-A487 WeakPolarHBondContact O-CB 3.49Å; M483-A487 PolarHBondContact O-N 3.09Å
484	A	31.1	Very low	29.4	Very low	57 Å²	57	97.9 Å²	97.9	47%	0.471	59%	0.593	S	S	.	*	H	α-helix	trans	-65.7	-45	174.1	0	0	0	0	0	111.6	N481 A487 S488	N481-A484 WeakPolarHBondContact O-CB 3.42Å; N481-A484 PolarHBondContact O-N 3.15Å; N481-A484 VanDerWaalsContact O-N 3.11Å; A484-A487 PolarHBondContact O-N 3.47Å; A484-S488 PolarHBondContact O-N 3.4Å; A484-S488 VanDerWaalsContact O-N 3.15Å; A484-S488 PolarHBondContact O-OG 2.84Å
485	T	31.2	Very low	29.4	Very low	87 Å²	87	93.1 Å²	93.1	53%	0.534	56%	0.561	S	S	.	*	H	α-helix	trans	-64.1	-40.7	177.4	-54.9	0	0	0	0	112.3	N481 L482 S488 F489	N481-T485 PolarHBondContact O-N 3.48Å; N481-T485 PolarHBondContact O-OG1 2.9Å; L482-T485 PolarHBondContact O-N 2.82Å; T485-S488 WeakPolarHBondContact CA-OG 3.47Å; T485-S488 PolarHBondContact O-N 2.7Å; T485-S488 PolarHBondContact O-OG 3.01Å; T485-F489 PolarHBondContact O-N 2.92Å; T485-F489 VanDerWaalsContact O-N 3.13Å
486	M	29.4	Very low	29.5	Very low	123 Å²	123	90.7 Å²	90.7	61%	0.606	55%	0.548	S	S	*	.	H	α-helix	trans	-66.3	-35	175.1	-73.4	-177.7	171.8	0	0	112.7	L482 F489 A490	L482-M486 HydrophobicContact CD1-CE 4.33Å; L482-M486 HydrophobicContact CG-CE 4.28Å; L482-M486 WeakPolarHBondContact O-CG 3.38Å; L482-M486 PolarHBondContact O-N 2.8Å; M486-F489 WeakPolarHBondContact O-CB 2.95Å; M486-F489 PolarHBondContact O-N 3.24Å; M486-A490 PolarHBondContact O-N 2.92Å
487	A	30.5	Very low	28.8	Very low	65 Å²	65	89.5 Å²	89.5	54%	0.537	55%	0.547	S	S	.	.	H	α-helix	trans	-64.3	-39.9	174.4	0	0	0	0	0	112.5	M483 A484 F489 A491	M483-A487 WeakPolarHBondContact O-CB 3.49Å; M483-A487 PolarHBondContact O-N 3.09Å; A484-A487 PolarHBondContact O-N 3.47Å; A487-F489 VanDerWaalsContact C-N 3.3Å; A487-F489 PolarHBondContact O-N 3.14Å; A487-A491 PolarHBondContact O-N 3.16Å
488	S	28.1	Very low	28.8	Very low	69 Å²	69	86.4 Å²	86.4	48%	0.483	54%	0.537	S	S	.	.	H	α-helix	trans	-65.4	-30.7	171.7	36.9	0	0	0	0	113.3	A484 T485 A491	A484-S488 PolarHBondContact O-N 3.4Å; A484-S488 VanDerWaalsContact O-N 3.15Å; A484-S488 PolarHBondContact O-OG 2.84Å; T485-S488 WeakPolarHBondContact CA-OG 3.47Å; T485-S488 PolarHBondContact O-N 2.7Å; T485-S488 PolarHBondContact O-OG 3.01Å; S488-A491 PolarHBondContact O-N 3.09Å
489	F	29.8	Very low	28.7	Very low	79 Å²	79	84.6 Å²	84.6	35%	0.346	54%	0.544	S	S	.	.	H	α-helix	trans	-74.1	-37.4	179.5	-143.9	-122.8	0	0	0	112.5	I121 D124 T485 M486 A487 A491 A492	I121-F489 HydrophobicContact CB-CE1 4.12Å; I121-F489 HydrophobicContact CB-CE2 4.38Å; I121-F489 HydrophobicContact CB-CZ 3.78Å; I121-F489 HydrophobicContact CD1-CD1 4.36Å; I121-F489 HydrophobicContact CD1-CE1 4Å; I121-F489 HydrophobicContact CG1-CD1 4.11Å; I121-F489 HydrophobicContact CG1-CE1 3.63Å; I121-F489 HydrophobicContact CG1-CE2 4.17Å; I121-F489 HydrophobicContact CG1-CZ 3.69Å; I121-F489 HydrophobicContact CG2-CE1 3.83Å; I121-F489 HydrophobicContact CG2-CZ 3.6Å; I121-F489 WeakPolarHBondContact O-CZ 3.39Å; D124-F489 HydrophobicContact CB-CE2 4.28Å; T485-F489 PolarHBondContact O-N 2.92Å; T485-F489 VanDerWaalsContact O-N 3.13Å; M486-F489 WeakPolarHBondContact O-CB 2.95Å; M486-F489 PolarHBondContact O-N 3.24Å; A487-F489 VanDerWaalsContact C-N 3.3Å; A487-F489 PolarHBondContact O-N 3.14Å; F489-A491 VanDerWaalsContact C-N 3.27Å; F489-A491 PolarHBondContact O-N 2.74Å; F489-A492 WeakPolarHBondContact O-CB 3.42Å; F489-A492 PolarHBondContact O-N 3.02Å; F489-A492 VanDerWaalsContact O-N 3.15Å
490	A	30	Very low	28.7	Very low	64 Å²	64	89.2 Å²	89.2	53%	0.529	55%	0.552	S	S	.	*	H	α-helix	trans	-64.2	-32.1	174	0	0	0	0	0	112.6	M486 A492 Q493	M486-A490 PolarHBondContact O-N 2.92Å; A490-A492 PolarHBondContact O-N 3.36Å; A490-Q493 PolarHBondContact O-N 2.82Å
491	A	28.8	Very low	28.4	Very low	70 Å²	70	87.3 Å²	87.3	58%	0.579	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-19	175.1	0	0	0	0	0	113.6	A487 S488 F489 Q493	A487-A491 PolarHBondContact O-N 3.16Å; S488-A491 PolarHBondContact O-N 3.09Å; F489-A491 VanDerWaalsContact C-N 3.27Å; F489-A491 PolarHBondContact O-N 2.74Å; A491-Q493 VanDerWaalsContact C-N 3.3Å
492	A	28.3	Very low	28.5	Very low	22 Å²	22	87.7 Å²	87.7	18%	0.182	56%	0.556	C	S	.	*	T	Hydrogen-bonded Turn	trans	-79	-9.6	171.5	0	0	0	0	0	113.7	I120 F489 A490	I120-A492 HydrophobicContact CB-CB 4.32Å; I120-A492 HydrophobicContact CG2-CB 3.61Å; F489-A492 WeakPolarHBondContact O-CB 3.42Å; F489-A492 PolarHBondContact O-N 3.02Å; F489-A492 VanDerWaalsContact O-N 3.15Å; A490-A492 PolarHBondContact O-N 3.36Å
493	Q	28.2	Very low	28	Very low	95 Å²	95	89 Å²	89	44%	0.444	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100	-12.9	-178	-71.3	-129.8	-19.3	0	0	115.8	L117 I121 A490 A491 A495	L117-Q493 HydrophobicContact CD2-CB 3.94Å; L117-Q493 HydrophobicContact CD2-CG 3.9Å; L117-Q493 HydrophobicContact CG-CB 4.13Å; L117-Q493 HydrophobicContact CG-CG 3.94Å; I121-Q493 HydrophobicContact CD1-CG 4.02Å; A490-Q493 PolarHBondContact O-N 2.82Å; A491-Q493 VanDerWaalsContact C-N 3.3Å; Q493-A495 PolarHBondContact O-N 2.98Å
494	S	27.3	Very low	28.1	Very low	88 Å²	88	89.7 Å²	89.7	62%	0.615	57%	0.568	S	S	*	*			trans	-87.1	47.3	-175	65.2	0	0	0	0	113.7
495	A	24.4	Very low	27.8	Very low	23 Å²	23	95.5 Å²	95.5	19%	0.19	59%	0.586	C	S	.	*			trans	-139.8	89.3	176.3	0	0	0	0	0	109.2	V112 Q493	V112-A495 CarbonylContact C-O 3.53Å; V112-A495 HydrophobicContact CB-CB 3.58Å; V112-A495 WeakPolarHBondContact CB-O 3.29Å; V112-A495 HydrophobicContact CG1-CB 3.87Å; V112-A495 WeakPolarHBondContact CG1-O 3.26Å; V112-A495 HydrophobicContact CG2-CB 4.01Å; Q493-A495 PolarHBondContact O-N 2.98Å
496	A	24.5	Very low	27.8	Very low	59 Å²	59	99.7 Å²	99.7	49%	0.488	60%	0.604	S	S	.	*			trans	-170.8	148.5	169.4	0	0	0	0	0	108.2	K110 V112	K110-A496 CarbonylContact O-C 3.59Å; V112-A496 VanDerWaalsContact O-CA 3.24Å; V112-A496 WeakPolarHBondContact O-CA 3.39Å; V112-A496 VanDerWaalsContact O-CB 3.31Å; V112-A496 WeakPolarHBondContact O-CB 3.29Å
497	A	25.7	Very low	27.7	Very low	89 Å²	89	96.7 Å²	96.7	74%	0.736	61%	0.605	S	S	*	*			trans	56.5	80.4	171.8	0	0	0	0	0	117.6	K110	K110-A497 PolarHBondContact O-N 2.9Å; K110-A497 VanDerWaalsContact O-N 3.09Å
498	V	25.8	Very low	27.5	Very low	100 Å²	100	100.3 Å²	100.3	61%	0.606	62%	0.615	S	S	*	*			trans	-126	114.4	137.7	-178.3	0	0	0	0	110.3	K110	K110-V498 HydrophobicContact CB-CB 3.88Å; K110-V498 HydrophobicContact CD-CB 3.93Å; K110-V498 HydrophobicContact CD-CG1 4.17Å; K110-V498 HydrophobicContact CG-CB 3.77Å; K110-V498 HydrophobicContact CG-CG2 4.23Å; K110-V498 PolarHBondContact O-N 3.3Å
499	G	25.6	Very low	27.4	Very low	68 Å²	68	103.8 Å²	103.8	70%	0.701	63%	0.628	S	S	*	*			trans	143.6	121.9	-176.7	0	0	0	0	0	108.9
500	M	27.6	Very low	27.5	Very low	187 Å²	187	105 Å²	105	92%	0.921	65%	0.647	S	S	*	*			cis	-132.6	165.4	9.2	-62.7	-179.2	174	0	0	111.7
501	N	26.4	Very low	27.3	Very low	128 Å²	128	107 Å²	107	68%	0.684	66%	0.656	S	S	*	*			trans	-69.4	147	159.6	-166.7	28.5	0	0	0	109.2	D503	N501-D503 PolarHBondContact ND2-OD2 3.47Å; N501-D503 PolarHBondContact OD1-N 3.28Å
502	P	33.4	Very low	27.4	Very low	110 Å²	110	110.8 Å²	110.8	71%	0.714	67%	0.666	S	S	*	*				-143.1	126.7	118.1	34.1	-19.3	0	0	0	114.5
503	D	22.3	Very low	27.5	Very low	139 Å²	139	114.5 Å²	114.5	74%	0.743	69%	0.688	S	S	*	*			trans	-72.4	119.2	142.5	-68.6	-78	0	0	0	108.3	N501	N501-D503 PolarHBondContact ND2-OD2 3.47Å; N501-D503 PolarHBondContact OD1-N 3.28Å
504	I	32	Very low	27.4	Very low	161 Å²	161	117.1 Å²	117.1	83%	0.826	71%	0.705	S	S	*	*			trans	-166.9	145.1	152.3	-104.8	152.7	0	0	0	108.8
505	H	24.9	Very low	27.4	Very low	180 Å²	180	117.8 Å²	117.8	83%	0.833	71%	0.709	S	S	*	*			trans	-64.7	136.6	171.8	-77.7	-123.5	0	0	0	110.9
506	D	30.2	Very low	27.6	Very low	174 Å²	174	121.4 Å²	121.4	93%	0.93	73%	0.733	S	S	*	*				-159.2	169	127.8	-116.5	-35.4	0	0	0	112.1
507	G	27.2	Very low	27.7	Very low	60 Å²	60	121.9 Å²	121.9	62%	0.619	74%	0.743	S	S	*	*			trans	-118.8	156.8	-167.2	0	0	0	0	0	116.9
508	L	26.4	Very low	27.8	Very low	142 Å²	142	125.1 Å²	125.1	74%	0.743	75%	0.748	S	S	*	*			trans	81.5	129.9	157.6	-57.8	175.3	0	0	0	120.4
509	N	27.5	Very low	27.9	Very low	142 Å²	142	129.5 Å²	129.5	76%	0.759	76%	0.759	S	S	*	*			trans	94.7	129.5	142.5	-66.9	-10.9	0	0	0	122.7
510	S	30.2	Very low	28	Very low	105 Å²	105	130.4 Å²	130.4	73%	0.734	77%	0.768	S	S	*	*			trans	59.2	85.6	147.2	53.6	0	0	0	0	119.4
511	S	27.3	Very low	28.1	Very low	104 Å²	104	124.9 Å²	124.9	73%	0.727	76%	0.759	S	S	*	*			trans	-8.4	126	131.1	53.5	0	0	0	0	118.2
512	L	29.3	Very low	28.3	Very low	151 Å²	151	127.3 Å²	127.3	79%	0.791	77%	0.771	S	S	*	*			trans	-70.7	169.6	142.4	-59.9	167.2	0	0	0	109.3
513	P	31.3	Very low	28.2	Very low	100 Å²	100	129.5 Å²	129.5	65%	0.649	78%	0.777	S	S	*	*				-143.1	173.6	88.5	35.8	-19	0	0	0	115
514	L	26.3	Very low	29.1	Very low	150 Å²	150	127.6 Å²	127.6	79%	0.785	77%	0.772	S	S	*	*			trans	-92.1	159.5	177.3	-47.1	101.1	0	0	0	112.2
515	S	27.1	Very low	28.9	Very low	102 Å²	102	126.5 Å²	126.5	71%	0.713	77%	0.768	S	S	*	*			trans	-160.7	147	134.4	58.5	0	0	0	0	113.7
516	S	28	Very low	29.3	Very low	99 Å²	99	124.6 Å²	124.6	69%	0.692	76%	0.762	S	S	*	*			trans	-52.8	159.6	158.6	38.8	0	0	0	0	112.6
517	G	26.2	Very low	29.5	Very low	68 Å²	68	121.6 Å²	121.6	70%	0.701	76%	0.755	S	S	*	*			cis	108.3	114.2	2.8	0	0	0	0	0	113.2
518	L	28.1	Very low	29.7	Very low	158 Å²	158	121.9 Å²	121.9	83%	0.827	76%	0.758	S	S	*	*			trans	-169	154.9	168.2	-108.4	169.2	0	0	0	112.9
519	F	28.9	Very low	30	Very low	192 Å²	192	124.8 Å²	124.8	84%	0.842	77%	0.765	S	S	*	*			trans	57.9	105.6	166.5	-79.7	-69.9	0	0	0	122.4
520	G	28	Very low	30	Very low	86 Å²	86	121.1 Å²	121.1	89%	0.887	76%	0.761	S	S	*	*			trans	75.2	134.7	142.4	0	0	0	0	0	118.3
521	G	28.2	Very low	30.6	Very low	71 Å²	71	121.5 Å²	121.5	73%	0.732	76%	0.76	S	S	*	*			cis	169.9	166.5	-4.2	0	0	0	0	0	111.1
522	L	32	Very low	30.7	Very low	180 Å²	180	123.4 Å²	123.4	94%	0.942	76%	0.763	S	S	*	*			trans	73.1	111.8	177	-53.8	177.5	0	0	0	118.1
523	N	29.7	Very low	30.9	Very low	156 Å²	156	123.2 Å²	123.2	83%	0.834	76%	0.762	S	S	*	*			trans	-53.5	170.4	152.5	-91.3	-9.5	0	0	0	113.6
524	P	41.9	Very low	30.9	Very low	99 Å²	99	126.1 Å²	126.1	64%	0.643	77%	0.772	S	S	*	*			cis	-140.7	-151.2	-32.6	38.5	-17.7	0	0	0	111.8
525	D	29.1	Very low	31.1	Very low	138 Å²	138	126.7 Å²	126.7	74%	0.738	78%	0.775	S	S	*	*			trans	113.5	137.1	140.3	-89.4	-22.7	0	0	0	123.3
526	I	33	Very low	32.1	Very low	140 Å²	140	127 Å²	127	72%	0.718	77%	0.774	S	S	*	*			trans	79.6	99.6	150.6	-66.3	160.9	0	0	0	121.3
527	S	32.7	Very low	32.4	Very low	111 Å²	111	128 Å²	128	78%	0.776	78%	0.778	S	S	*	*			trans	72.3	145.3	141.8	74.7	0	0	0	0	121.5
528	G	32	Very low	32.5	Very low	66 Å²	66	129.9 Å²	129.9	68%	0.68	78%	0.78	S	S	*	*			cis	172.3	172.6	-9	0	0	0	0	0	116.4
529	F	32.6	Very low	32.5	Very low	203 Å²	203	127.2 Å²	127.2	89%	0.89	78%	0.775	S	S	*	*			trans	62.5	104.5	162	-59.6	-77.3	0	0	0	121.1
530	G	28.2	Very low	32.4	Very low	65 Å²	65	122.7 Å²	122.7	67%	0.67	77%	0.768	S	S	*	*				-91.1	175.4	130	0	0	0	0	0	110.3
531	P	43.3	Very low	32.4	Very low	112 Å²	112	126.1 Å²	126.1	73%	0.727	76%	0.764	S	S	*	*				-153.6	139.6	119.2	35.4	-16.9	0	0	0	118.1
532	N	29.9	Very low	32.2	Very low	145 Å²	145	127 Å²	127	78%	0.775	76%	0.759	S	S	*	*			trans	65.1	163	133	-58.7	-12	0	0	0	123.3
533	N	32.3	Very low	31.9	Very low	147 Å²	147	123 Å²	123	79%	0.786	75%	0.746	S	S	*	*			trans	77.7	132.1	166.7	-62.7	-15.4	0	0	0	116.3
534	L	31.7	Very low	31.9	Very low	161 Å²	161	121.5 Å²	121.5	84%	0.843	74%	0.743	S	S	*	*			cis	-148.6	173.1	7.1	-111.9	156.7	0	0	0	112.3
535	L	30.6	Very low	31.2	Very low	162 Å²	162	125.3 Å²	125.3	85%	0.848	75%	0.749	S	S	*	*			trans	-90.1	164.1	-173.9	-82.8	154	0	0	0	114.2
536	P	47.2	Very low	31.5	Very low	109 Å²	109	124 Å²	124	71%	0.708	75%	0.748	S	S	*	*			trans	-97.6	179.1	-174.8	40.3	-37.8	0	0	0	114.2
537	P	35.9	Very low	31.2	Very low	119 Å²	119	124.5 Å²	124.5	77%	0.773	75%	0.752	S	S	*	*			trans	-132.3	119	154.7	35.7	-20.8	0	0	0	115.5
538	S	28.3	Very low	31.3	Very low	107 Å²	107	125 Å²	125	75%	0.748	75%	0.753	S	S	*	*				24.5	106.9	125.2	-47.6	0	0	0	0	121.7
539	S	27.6	Very low	30.9	Very low	102 Å²	102	124.8 Å²	124.8	71%	0.713	75%	0.751	S	S	*	*				56.1	138	117.7	71.3	0	0	0	0	124.4
540	S	26.8	Very low	30.6	Very low	98 Å²	98	120.8 Å²	120.8	69%	0.685	75%	0.748	S	S	*	*				110.5	154.4	126.6	79.5	0	0	0	0	120.8
541	I	28	Very low	30.7	Very low	157 Å²	157	124.2 Å²	124.2	81%	0.805	76%	0.756	S	S	*	*			trans	72.6	149.8	167.4	-53.2	171.5	0	0	0	115.9
542	S	24.4	Very low	29.8	Very low	91 Å²	91	125.8 Å²	125.8	64%	0.636	76%	0.757	S	S	*	*				-171.4	166.7	-71.3	61.3	0	0	0	0	109.6
543	S	24.5	Very low	30	Very low	96 Å²	96	124.6 Å²	124.6	67%	0.671	76%	0.758	S	S	*	*			trans	60.2	128.3	156.2	62.8	0	0	0	0	120.9
544	T	30	Very low	30.2	Very low	124 Å²	124	122.8 Å²	122.8	76%	0.761	75%	0.754	S	S	*	*			trans	178.5	92.3	136.4	-77.2	0	0	0	0	107.5
545	F	26.7	Very low	30	Very low	179 Å²	179	120.1 Å²	120.1	79%	0.785	75%	0.749	S	S	*	*				82.1	165.2	102	-73.5	-62.9	0	0	0	113.1
546	P	36.8	Very low	30	Very low	110 Å²	110	121.1 Å²	121.1	71%	0.714	75%	0.746	S	S	*	*				-135	-159.9	-83.6	37.8	-16.2	0	0	0	114.9
547	N	26.9	Very low	29.2	Very low	150 Å²	150	120.8 Å²	120.8	80%	0.802	75%	0.747	S	S	*	*			trans	-31.2	160.5	161.9	-74.5	-19.8	0	0	0	116.2
548	P	34	Very low	29	Very low	123 Å²	123	119.7 Å²	119.7	80%	0.799	74%	0.742	S	S	*	*			cis	-127.5	-165.9	21.1	39.1	-19.5	0	0	0	112.2
549	G	24	Very low	29	Very low	61 Å²	61	120.5 Å²	120.5	63%	0.629	74%	0.742	S	S	*	*			cis	104.4	122.6	9.4	0	0	0	0	0	113.3
550	S	25.8	Very low	29.4	Very low	118 Å²	118	120.9 Å²	120.9	83%	0.825	74%	0.742	S	S	*	*			trans	55.3	95	163.3	60	0	0	0	0	121.4
551	V	29.4	Very low	29.4	Very low	138 Å²	138	122.6 Å²	122.6	84%	0.836	75%	0.748	S	S	*	*			trans	-142.6	128.4	132.2	-136	0	0	0	0	104.5
552	L	25.5	Very low	29.9	Very low	144 Å²	144	120.4 Å²	120.4	75%	0.754	74%	0.744	S	S	*	*				56.1	145.3	52.7	-70.5	171.2	0	0	0	113.4
553	P	34.2	Very low	30	Very low	121 Å²	121	121.3 Å²	121.3	79%	0.786	75%	0.75	S	S	*	*			cis	-112.9	175.8	5.3	40.9	-30.1	0	0	0	114.7
554	P	36.4	Very low	30.2	Very low	108 Å²	108	122.5 Å²	122.5	70%	0.701	75%	0.754	S	S	*	*			trans	-105	-150.5	-176.5	42.6	-36.7	0	0	0	113.2
555	S	26.5	Very low	30.2	Very low	106 Å²	106	123.4 Å²	123.4	74%	0.741	75%	0.754	S	S	*	*			trans	104.6	140.5	-177.3	79.4	0	0	0	0	113.1
556	K	31.7	Very low	30.4	Very low	182 Å²	182	119.9 Å²	119.9	79%	0.791	75%	0.751	S	S	*	*			cis	-150	145.5	14.8	-134.1	150.5	-173.5	174.8	0	111.8
557	S	30.4	Very low	30.1	Very low	103 Å²	103	120.2 Å²	120.2	72%	0.72	76%	0.755	S	S	*	*			trans	35.8	142	144.8	55.3	0	0	0	0	121.2
558	S	31.4	Very low	30.7	Very low	96 Å²	96	118.3 Å²	118.3	67%	0.671	75%	0.751	S	S	*	*			cis	-169.8	147.4	4.1	41.2	0	0	0	0	106.7
559	T	27.6	Very low	30.7	Very low	124 Å²	124	117.5 Å²	117.5	76%	0.761	75%	0.748	S	S	*	*				51.2	146.9	64.1	67.3	0	0	0	0	115
560	P	37.3	Very low	31.1	Very low	109 Å²	109	124.4 Å²	124.4	71%	0.708	76%	0.755	S	S	*	*				-136.4	-152.2	-59.6	38.7	-20.8	0	0	0	112.5
561	V	25.6	Very low	31.3	Very low	135 Å²	135	126 Å²	126	82%	0.818	75%	0.75	S	S	*	*			trans	74.1	154.7	162.6	-70.4	0	0	0	0	121.1
562	P	39	Very low	31.3	Very low	111 Å²	111	131 Å²	131	72%	0.721	75%	0.753	S	S	*	*			trans	-124.8	-168	-158.4	44.8	-30.3	0	0	0	115.5
563	S	25.9	Very low	31.6	Very low	109 Å²	109	127.9 Å²	127.9	76%	0.762	75%	0.749	S	S	*	*			trans	87.5	154.9	178.1	-35.4	0	0	0	0	114
564	V	30.2	Very low	31.4	Very low	122 Å²	122	129.5 Å²	129.5	74%	0.739	75%	0.751	S	S	*	*			cis	-148.2	159.6	11.9	-133.6	0	0	0	0	111.4
565	N	28.7	Very low	31.1	Very low	142 Å²	142	128.6 Å²	128.6	76%	0.759	75%	0.747	S	S	*	*			trans	32.5	135.7	149.1	-57	-14.4	0	0	0	120.9
566	S	31.4	Very low	31.3	Very low	105 Å²	105	134.6 Å²	134.6	73%	0.734	75%	0.753	S	S	*	*				-171.1	128.6	65	-61.7	0	0	0	0	115.8
567	C	30.7	Very low	31.1	Very low	118 Å²	118	131.5 Å²	131.5	80%	0.797	75%	0.754	S	S	*	*				54.1	163.3	127.4	-58.5	0	0	0	0	123.5
568	P	40	Very low	31.6	Very low	109 Å²	109	132.6 Å²	132.6	71%	0.708	76%	0.759	S	S	*	*				-145.6	-177.6	-56.8	42.1	-24.8	0	0	0	115.9
569	S	32.9	Very low	31.5	Very low	106 Å²	106	132.4 Å²	132.4	74%	0.741	76%	0.763	S	S	*	*			trans	83.9	151.9	156.4	-50.2	0	0	0	0	118.9
570	R	32.4	Very low	31.7	Very low	206 Å²	206	133.4 Å²	133.4	78%	0.777	76%	0.763	S	S	*	*			cis	-160	142.1	-2.6	-131.5	-175.3	-169.7	-146.2	14.6	111.9
571	Q	30.7	Very low	31.3	Very low	153 Å²	153	134.8 Å²	134.8	72%	0.715	76%	0.764	S	S	*	*			trans	50.2	149.9	144.4	-72.5	168.9	-26.7	0	0	120.7
572	R	28.7	Very low	31.4	Very low	241 Å²	241	134.5 Å²	134.5	91%	0.909	76%	0.758	S	S	*	*			cis	-154.2	157.1	11.7	-154	-179.8	179.2	163.7	-1.6	110.9
573	A	31.4	Very low	31.1	Very low	80 Å²	80	134 Å²	134	66%	0.661	75%	0.752	S	S	*	*			trans	-106.3	-172.5	169.1	0	0	0	0	0	110.4
574	N	31.1	Very low	31.4	Very low	155 Å²	155	137 Å²	137	83%	0.829	75%	0.754	S	S	*	*			cis	-154.1	-147.1	9.5	-152.9	-13.1	0	0	0	111.5
575	S	30.4	Very low	31.5	Very low	89 Å²	89	135.2 Å²	135.2	62%	0.622	75%	0.747	S	S	*	*			trans	-121.5	160.7	-153.9	51.5	0	0	0	0	118
576	R	30	Very low	31.6	Very low	232 Å²	232	135.9 Å²	135.9	88%	0.875	75%	0.751	S	S	*	*			trans	63.5	118.7	146.5	-77.6	177.7	177.9	-173.9	-0.4	123.4
577	S	28.5	Very low	31.9	Very low	116 Å²	116	135.5 Å²	135.5	81%	0.811	75%	0.754	S	S	*	*			trans	80.1	150.3	130.8	-56.1	0	0	0	0	121.7
578	P	40.6	Very low	32.6	Very low	127 Å²	127	135.6 Å²	135.6	83%	0.825	75%	0.753	S	S	*	*			trans	-124.7	162	-168.5	42.5	-29	0	0	0	116.7
579	A	29.5	Very low	33	Very low	91 Å²	91	135.4 Å²	135.4	75%	0.752	75%	0.751	S	S	*	*			trans	179.5	139.1	136.2	0	0	0	0	0	114.4
580	L	30.3	Very low	33	Very low	146 Å²	146	137.1 Å²	137.1	76%	0.764	75%	0.752	S	S	*	*			trans	57.1	121.4	147.4	-66.6	167.6	0	0	0	123.1
581	L	29.4	Very low	33.1	Very low	138 Å²	138	133.6 Å²	133.6	72%	0.723	75%	0.745	S	S	*	*			trans	62.7	146.7	140	-51.6	175.7	0	0	0	118.9
582	D	28.1	Very low	33.2	Very low	128 Å²	128	133.8 Å²	133.8	68%	0.684	74%	0.743	S	S	*	*			cis	-159.5	148.3	-4.8	-121.3	-13.6	0	0	0	113.5
583	V	32.4	Very low	33.3	Very low	100 Å²	100	132 Å²	132	61%	0.606	74%	0.737	S	S	*	*			trans	72.2	142.2	136.9	166.4	0	0	0	0	124.2
584	H	31.3	Very low	33.4	Very low	173 Å²	173	137.1 Å²	137.1	80%	0.801	74%	0.739	S	S	*	*			trans	71.3	143.9	165.6	-68	-29.4	0	0	0	120.2
585	S	33	Very low	33.4	Very low	84 Å²	84	136.5 Å²	136.5	59%	0.587	73%	0.729	S	S	*	*			cis	-171.6	144.6	-18.5	-101.2	0	0	0	0	111.5
586	N	31.6	Very low	33.5	Very low	157 Å²	157	138.5 Å²	138.5	84%	0.84	74%	0.737	S	S	*	*				157.7	106.2	128	-82.2	-20.4	0	0	0	116.3
587	A	37.4	Very low	33.6	Very low	97 Å²	97	134 Å²	134	80%	0.802	73%	0.726	S	S	*	*				61.6	153	129.9	0	0	0	0	0	124.1
588	P	44.9	Very low	33.6	Very low	119 Å²	119	138.6 Å²	138.6	77%	0.773	73%	0.726	S	S	*	*			trans	-120.7	-163.6	-163.6	40.5	-21	0	0	0	113.7
589	P	47.7	Very low	33.5	Very low	105 Å²	105	138.1 Å²	138.1	68%	0.682	72%	0.723	S	S	*	*				-153.3	173.3	89	43.1	-25.1	0	0	0	117.8
590	D	33.9	Very low	33.6	Very low	142 Å²	142	137.7 Å²	137.7	76%	0.759	71%	0.711	S	S	*	*			trans	63.6	152.6	142.5	-70.7	-19.1	0	0	0	123.7
591	E	33.3	Very low	33.6	Very low	132 Å²	132	136.4 Å²	136.4	62%	0.617	71%	0.714	S	S	*	*			cis	-165.8	147.6	-17.1	175.4	175.2	-125.2	0	0	114.3
592	K	33.7	Very low	33.5	Very low	158 Å²	158	132.9 Å²	132.9	69%	0.687	71%	0.711	S	S	*	*			trans	65.6	147	154.4	-82.9	164.6	-163.2	143.6	0	125
593	R	30.2	Very low	33.5	Very low	204 Å²	204	134.5 Å²	134.5	77%	0.77	72%	0.715	S	S	*	*			trans	79	143.4	147.7	-88.5	-172.1	175.1	-168	2.7	117.8
594	R	33.7	Very low	33.3	Very low	187 Å²	187	137.8 Å²	137.8	71%	0.706	72%	0.72	S	S	*	*			cis	-153.5	149.4	0.8	-155.3	178.2	-171.7	-176.2	0.9	111.4
595	K	32.3	Very low	33.3	Very low	141 Å²	141	134.5 Å²	134.5	61%	0.613	72%	0.716	S	S	*	*			trans	38	147.4	153.8	-87.5	-162.6	157.3	-136.2	0	121.3	E597	K595-E597 WeakPolarHBondContact CD-OE1 3.23Å; K595-E597 WeakPolarHBondContact CE-OE1 3.39Å; K595-E597 WeakPolarHBondContact CE-OE2 3.5Å; K595-E597 IonicContact NZ-OE1 2.92Å; K595-E597 PolarHBondContact NZ-OE1 3.08Å; K595-E597 IonicContact NZ-OE2 3.1Å; K595-E597 PolarHBondContact NZ-OE2 3.3Å
596	T	32.5	Very low	33.3	Very low	131 Å²	131	137.9 Å²	137.9	80%	0.804	73%	0.728	S	S	*	*				-151.5	-105.1	-82.1	25.9	0	0	0	0	107.4
597	E	31.1	Very low	33.4	Very low	139 Å²	139	134.7 Å²	134.7	65%	0.65	72%	0.723	S	S	*	*			cis	-128.6	-136.1	-11.4	-80.5	-179.7	-107.2	0	0	108.4	K595	K595-E597 WeakPolarHBondContact CD-OE1 3.23Å; K595-E597 WeakPolarHBondContact CE-OE1 3.39Å; K595-E597 WeakPolarHBondContact CE-OE2 3.5Å; K595-E597 IonicContact NZ-OE1 2.92Å; K595-E597 PolarHBondContact NZ-OE1 3.08Å; K595-E597 IonicContact NZ-OE2 3.1Å; K595-E597 PolarHBondContact NZ-OE2 3.3Å
598	R	28.3	Very low	33.2	Very low	212 Å²	212	137.1 Å²	137.1	80%	0.8	73%	0.727	S	S	*	*			trans	-163.1	154.3	-171.8	-147.2	-179.8	-178.9	-161.1	6.1	109.6	T600	R598-T600 HydrophobicContact CG-CG2 3.99Å
599	P	38.2	Very low	32.6	Very low	117 Å²	117	134.4 Å²	134.4	76%	0.76	72%	0.721	S	S	*	*				-142.8	133.9	98.2	19.4	3	0	0	0	113.6
600	T	31.6	Very low	31.8	Very low	82 Å²	82	137 Å²	137	50%	0.503	73%	0.729	S	S	.	*				65.7	109.1	71.7	66.7	0	0	0	0	114.3	R598	R598-T600 HydrophobicContact CG-CG2 3.99Å
601	S	30.5	Very low	31.8	Very low	118 Å²	118	135.5 Å²	135.5	83%	0.825	73%	0.73	S	S	*	*				92.9	151.9	92.5	67.4	0	0	0	0	113.7
602	G	28.4	Very low	31.7	Very low	64 Å²	64	134.2 Å²	134.2	66%	0.66	74%	0.735	S	S	*	*			cis	139.5	161.9	-0.1	0	0	0	0	0	112.5
603	E	28.4	Very low	31.7	Very low	163 Å²	163	133.5 Å²	133.5	76%	0.762	74%	0.738	S	S	*	*			trans	66.4	167.7	170.4	-51.6	-152.3	128.4	0	0	115.9
604	K	27.5	Very low	31.7	Very low	168 Å²	168	131.8 Å²	131.8	73%	0.73	74%	0.739	S	S	*	*			cis	-164.9	-177.6	-12.6	-117.4	165.3	-168.3	152.6	0	107.3
605	C	31	Very low	31.6	Very low	105 Å²	105	130.5 Å²	130.5	71%	0.709	74%	0.741	S	S	*	*				-162.2	-175.8	-69.3	-161.9	0	0	0	0	108.6
606	N	32.8	Very low	31.5	Very low	155 Å²	155	130.6 Å²	130.6	83%	0.829	75%	0.749	S	S	*	*			trans	73.2	146.1	170	-61.8	-6.8	0	0	0	117
607	A	34.7	Very low	31.5	Very low	90 Å²	90	128 Å²	128	74%	0.744	75%	0.748	S	S	*	*			cis	-147	-165	-9	0	0	0	0	0	108
608	V	32.6	Very low	31.4	Very low	147 Å²	147	129.3 Å²	129.3	89%	0.891	76%	0.758	S	S	*	*			cis	-151	152.1	15.1	180	0	0	0	0	106.9
609	G	31.6	Very low	31.5	Very low	63 Å²	63	125 Å²	125	65%	0.649	76%	0.755	S	S	*	*			cis	174	166.9	-7	0	0	0	0	0	112.8
610	N	32	Very low	31.1	Very low	159 Å²	159	130.7 Å²	130.7	85%	0.85	76%	0.762	S	S	*	*			trans	52.2	119.5	166.7	-71.1	7.7	0	0	0	123.2
611	S	33.3	Very low	31.1	Very low	110 Å²	110	133.4 Å²	133.4	77%	0.769	78%	0.778	S	S	*	*				108.3	106.8	127	65.6	0	0	0	0	122
612	S	31.3	Very low	31	Very low	105 Å²	105	137.2 Å²	137.2	73%	0.734	78%	0.78	S	S	*	*			trans	73	121.5	138.3	60.6	0	0	0	0	123.4
613	L	33.3	Very low	31	Very low	143 Å²	143	139 Å²	139	75%	0.749	78%	0.782	S	S	*	*			trans	81.5	105.7	138.2	-68.1	165	0	0	0	121.2
614	E	30.7	Very low	31.2	Very low	169 Å²	169	137.1 Å²	137.1	79%	0.79	79%	0.787	S	S	*	*				71.2	102.7	126.6	-74.3	172.2	-179.9	0	0	122.6
615	E	30.7	Very low	31.3	Very low	159 Å²	159	136.3 Å²	136.3	74%	0.743	79%	0.791	S	S	*	*				100.2	116.2	115.6	-150.1	-175.2	159.8	0	0	121.5
616	N	31.9	Very low	31.3	Very low	144 Å²	144	136.8 Å²	136.8	77%	0.77	80%	0.795	S	S	*	*			trans	36.1	134.5	148.4	-57.2	-34.2	0	0	0	123
617	G	31.7	Very low	31.2	Very low	77 Å²	77	135.1 Å²	135.1	79%	0.794	80%	0.796	S	S	*	*			trans	-179	102.4	157.2	0	0	0	0	0	113.6
618	L	29	Very low	31.1	Very low	165 Å²	165	134.3 Å²	134.3	86%	0.864	80%	0.796	S	S	*	*			trans	-140.5	135.9	-177	-151.6	84	0	0	0	113
619	V	30.5	Very low	31	Very low	121 Å²	121	137.6 Å²	137.6	73%	0.733	79%	0.793	S	S	*	*			trans	67	140.9	165.2	-147.6	0	0	0	0	119.6
620	R	28.8	Very low	31	Very low	237 Å²	237	145.2 Å²	145.2	89%	0.894	80%	0.802	S	S	*	*			trans	79.3	131.1	149.6	-113.4	175.4	-169.7	169.9	4.8	119
621	V	32.7	Very low	31	Very low	140 Å²	140	144.1 Å²	144.1	85%	0.848	80%	0.801	S	S	*	*			trans	-128.1	127.8	169.4	177	0	0	0	0	109.9
622	K	27.3	Very low	31.4	Very low	197 Å²	197	144.6 Å²	144.6	86%	0.857	80%	0.802	S	S	*	*			trans	-151.9	115.3	152.4	-110.1	-169.4	178.3	-173.3	0	109.6
623	S	29.2	Very low	31.5	Very low	103 Å²	103	144.3 Å²	144.3	72%	0.72	80%	0.8	S	S	*	*			trans	40.9	116.6	151.4	58.5	0	0	0	0	120.8
624	S	33.2	Very low	31.6	Very low	123 Å²	123	143.6 Å²	143.6	86%	0.86	80%	0.801	S	S	*	*				-175.7	170.6	116.2	40.7	0	0	0	0	113
625	N	29.5	Very low	31.7	Very low	150 Å²	150	144.1 Å²	144.1	80%	0.802	80%	0.801	S	S	*	*			trans	-92.5	160.1	-154.7	-56.8	-26.2	0	0	0	116.3
626	S	30.6	Very low	31.9	Very low	116 Å²	116	143.7 Å²	143.7	81%	0.811	80%	0.799	S	S	*	*			trans	73.1	156.9	142.1	83.1	0	0	0	0	118.1
627	S	29.9	Very low	32	Very low	119 Å²	119	144.6 Å²	144.6	83%	0.832	80%	0.804	S	S	*	*			cis	-164	165.1	-9.3	41.5	0	0	0	0	111.6
628	G	32.6	Very low	32.1	Very low	74 Å²	74	144.7 Å²	144.7	76%	0.763	80%	0.804	S	S	*	*			trans	166.6	158.6	162.1	0	0	0	0	0	115.7
629	R	31.2	Very low	32.3	Very low	215 Å²	215	144.2 Å²	144.2	81%	0.811	80%	0.802	S	S	*	*			cis	-166.2	111.3	-15.2	-169.8	179.7	-166.3	-113.7	10.6	113.8
630	R	31.5	Very low	32.8	Very low	224 Å²	224	142.5 Å²	142.5	85%	0.845	80%	0.796	S	S	*	*			trans	62.3	162	151.5	-62.1	-176.3	179.5	-165	-1.2	120.6
631	T	33.2	Very low	33	Very low	136 Å²	136	138.6 Å²	138.6	83%	0.834	79%	0.793	S	S	*	*			trans	-114.7	158.8	-168.4	47	0	0	0	0	114.8
632	P	41.4	Very low	33.3	Very low	120 Å²	120	137 Å²	137	78%	0.779	79%	0.788	S	S	*	*			trans	-142.4	173.4	134.4	38.5	-24.5	0	0	0	113.1
633	S	33.2	Very low	33.9	Very low	99 Å²	99	132.3 Å²	132.3	69%	0.692	78%	0.78	S	S	*	*			cis	-170.8	128.5	-33	55.6	0	0	0	0	112.6
634	T	35.4	Very low	34.2	Very low	128 Å²	128	134.9 Å²	134.9	79%	0.785	79%	0.785	S	S	*	*			trans	55	126.4	153.4	51.3	0	0	0	0	123.9
635	K	32.5	Very low	34.3	Very low	179 Å²	179	132.9 Å²	132.9	78%	0.778	79%	0.785	S	S	*	*			trans	98.5	130.5	130.8	-86.9	-177.7	170.1	-165.3	0	124.1
636	H	35.3	Very low	34.4	Very low	151 Å²	151	129.5 Å²	129.5	70%	0.699	79%	0.785	S	S	*	*			trans	85.2	112.4	148.4	-70.7	-58.9	0	0	0	124.4
637	N	33.3	Very low	34.9	Very low	163 Å²	163	129.3 Å²	129.3	87%	0.872	78%	0.781	S	S	*	*			trans	-0.5	146	150	-61.3	5.2	0	0	0	122.1
638	G	34.5	Very low	35.1	Very low	78 Å²	78	131.1 Å²	131.1	80%	0.804	78%	0.781	S	S	*	*			trans	-174	29.5	170.6	0	0	0	0	0	121.1
639	N	33.2	Very low	35.2	Very low	155 Å²	155	132.8 Å²	132.8	83%	0.829	78%	0.782	S	S	*	*			trans	46.4	124.1	160.2	-111.7	41.8	0	0	0	124.3
640	S	40	Very low	35.1	Very low	85 Å²	85	128 Å²	128	59%	0.594	78%	0.781	S	S	*	*			trans	75.1	123.8	132.1	61.9	0	0	0	0	124.6
641	N	34.2	Very low	35.2	Very low	156 Å²	156	124.1 Å²	124.1	83%	0.834	78%	0.782	S	S	*	*			trans	70.8	144.4	143.4	-60	0.8	0	0	0	119
642	S	39	Very low	34.9	Very low	107 Å²	107	128.1 Å²	128.1	75%	0.748	78%	0.783	S	S	*	*			cis	-177.2	152.5	-8.8	44.7	0	0	0	0	108.6
643	S	38.5	Very low	34.3	Very low	97 Å²	97	131.4 Å²	131.4	68%	0.678	79%	0.785	S	S	*	*			cis	-167.5	-165	-9.2	56.4	0	0	0	0	109.2
644	N	37.1	Very low	34.2	Very low	157 Å²	157	134.6 Å²	134.6	84%	0.84	79%	0.794	S	S	*	*			trans	77.3	131.9	171.6	-48.9	-5.6	0	0	0	115.9
645	G	33.8	Very low	34	Very low	82 Å²	82	136.8 Å²	136.8	85%	0.845	80%	0.796	S	S	*	*			cis	172.3	141.5	-11.6	0	0	0	0	0	114
646	G	31.1	Very low	34	Very low	79 Å²	79	133 Å²	133	81%	0.814	79%	0.792	S	S	*	*			trans	99.8	105.4	163.1	0	0	0	0	0	118.1
647	P	42.3	Very low	34	Very low	111 Å²	111	132.8 Å²	132.8	72%	0.721	80%	0.801	S	S	*	*			trans	-123.9	-175.8	151.9	39.6	-29	0	0	0	112.3
648	N	33.2	Very low	33.9	Very low	157 Å²	157	128.6 Å²	128.6	84%	0.84	80%	0.796	S	S	*	*			trans	82.1	138.8	-179.1	-53.1	-22.2	0	0	0	115
649	S	35.3	Very low	33.9	Very low	110 Å²	110	133.2 Å²	133.2	77%	0.769	80%	0.803	S	S	*	*			cis	-161.9	151.3	-11.8	50	0	0	0	0	110.7
650	S	28.9	Very low	33.8	Very low	115 Å²	115	129.4 Å²	129.4	80%	0.804	80%	0.8	S	S	*	*			trans	-86.2	117.2	172.9	55.1	0	0	0	0	113
651	V	33.2	Very low	33.4	Very low	142 Å²	142	133.9 Å²	133.9	86%	0.861	82%	0.816	S	S	*	*			trans	-149.4	146.3	149.9	170.4	0	0	0	0	108.8
652	Y	26.8	Very low	33.5	Very low	220 Å²	220	133.2 Å²	133.2	86%	0.863	82%	0.818	S	S	*	*			trans	-62	140.8	-179.7	-76.1	-106.4	0	0	0	114.9
653	K	30.1	Very low	33	Very low	189 Å²	189	136.2 Å²	136.2	82%	0.822	83%	0.825	S	S	*	*			trans	-170	118.7	136	-108.5	167.6	-176.3	179.2	0	110.7
654	N	30.7	Very low	32.9	Very low	165 Å²	165	137.6 Å²	137.6	88%	0.882	83%	0.834	S	S	*	*			trans	-119.6	137.1	166	-96.2	0.4	0	0	0	108.9
655	H	31.1	Very low	32.6	Very low	175 Å²	175	137.8 Å²	137.8	81%	0.81	83%	0.83	S	S	*	*			trans	-146.1	165.3	174.4	-97.2	-74.9	0	0	0	110.2
656	S	33.4	Very low	32.5	Very low	99 Å²	99	141.3 Å²	141.3	69%	0.692	83%	0.828	S	S	*	*			trans	74.6	104.9	164.4	80.3	0	0	0	0	120.4
657	T	33.8	Very low	32.6	Very low	146 Å²	146	143.2 Å²	143.2	90%	0.896	82%	0.82	S	S	*	*				63.7	131.5	121.7	60.3	0	0	0	0	122.2
658	G	31.8	Very low	32.3	Very low	75 Å²	75	142.4 Å²	142.4	77%	0.773	82%	0.817	S	S	*	*			trans	163.8	101.7	156.7	0	0	0	0	0	113.4
659	N	33.5	Very low	32.3	Very low	176 Å²	176	142 Å²	142	94%	0.941	82%	0.815	S	S	*	*			trans	-89.6	158.7	-179	-76	-20.4	0	0	0	113.2
660	G	32	Very low	32.1	Very low	75 Å²	75	143.1 Å²	143.1	77%	0.773	81%	0.812	S	S	*	*			trans	-179.5	59.7	175.4	0	0	0	0	0	116.8
661	L	32.5	Very low	32.3	Very low	178 Å²	178	145.7 Å²	145.7	93%	0.932	81%	0.811	S	S	*	*			trans	-136.1	145.6	166.2	-77	176.5	0	0	0	110.6
662	T	34.6	Very low	32.2	Very low	142 Å²	142	145.6 Å²	145.6	87%	0.871	81%	0.806	S	S	*	*			trans	-136.2	151.2	177.9	49.7	0	0	0	0	111.1
663	L	29.5	Very low	32.6	Very low	171 Å²	171	144 Å²	144	90%	0.895	81%	0.806	S	S	*	*			trans	-92.8	156.3	-169.3	-55.8	85.8	0	0	0	113.7
664	S	36.3	Very low	32.7	Very low	125 Å²	125	141.3 Å²	141.3	87%	0.874	80%	0.801	S	S	*	*			trans	-154.7	145.8	135	57.8	0	0	0	0	111.7
665	H	29.9	Very low	32.9	Very low	162 Å²	162	139 Å²	139	75%	0.75	79%	0.793	S	S	*	*			trans	-95.5	157.8	-175.6	-135	-102.6	0	0	0	111.4
666	L	33.3	Very low	33	Very low	155 Å²	155	136.1 Å²	136.1	81%	0.812	79%	0.788	S	S	*	*				158.5	118.6	129.8	-84.5	161.4	0	0	0	115.3
667	D	32	Very low	33.1	Very low	119 Å²	119	138.8 Å²	138.8	64%	0.636	79%	0.791	S	S	*	*			trans	27.9	121.1	137.6	-75.4	-81.8	0	0	0	126.3
668	S	35.8	Very low	33.1	Very low	94 Å²	94	137.6 Å²	137.6	66%	0.657	78%	0.779	S	S	*	*				71.4	120.6	114.1	-59.2	0	0	0	0	124
669	N	33.1	Very low	33.2	Very low	150 Å²	150	140 Å²	140	80%	0.802	78%	0.775	S	S	*	*			trans	80.7	102	136.7	-79	-28.9	0	0	0	124.5
670	N	32.4	Very low	33.1	Very low	133 Å²	133	138.9 Å²	138.9	71%	0.711	77%	0.768	S	S	*	*				95.8	146.8	104.6	-152.5	12.1	0	0	0	122.5
671	Q	32.3	Very low	33.2	Very low	168 Å²	168	139.4 Å²	139.4	79%	0.785	77%	0.766	S	S	*	*			trans	94.7	140.2	158.5	-54.1	-151.5	5.7	0	0	123
672	N	30.5	Very low	33.2	Very low	141 Å²	141	138.4 Å²	138.4	75%	0.754	76%	0.756	S	S	*	*			trans	-106.9	167.9	-168.9	-55.3	-47.2	0	0	0	113
673	H	36.4	Very low	32.9	Very low	186 Å²	186	140.7 Å²	140.7	86%	0.861	75%	0.749	S	S	*	*			trans	-138.2	134.6	137	-87.7	-90.7	0	0	0	108.2
674	N	32.9	Very low	32.8	Very low	133 Å²	133	138.7 Å²	138.7	71%	0.711	74%	0.739	S	S	*	*			cis	74.2	143.9	43.1	-80.5	-14.9	0	0	0	115.2
675	T	34.4	Very low	32.5	Very low	117 Å²	117	141 Å²	141	72%	0.718	74%	0.736	S	S	*	*			cis	-96.1	-156	-5.8	51.5	0	0	0	0	110.7
676	T	32.1	Very low	32.4	Very low	113 Å²	113	138.2 Å²	138.2	69%	0.693	74%	0.735	S	S	*	*			cis	-158.4	174.6	10.1	-11.2	0	0	0	0	105.7
677	M	36.7	Very low	32.4	Very low	155 Å²	155	137.9 Å²	137.9	76%	0.764	73%	0.733	S	S	*	*			cis	-153.2	-170.8	20.6	-131.6	-45	173.4	0	0	112
678	N	33.8	Very low	32	Very low	122 Å²	122	139.3 Å²	139.3	65%	0.652	74%	0.736	S	S	*	*			trans	-60.1	165.2	178.2	-78.7	-23.9	0	0	0	117.4
679	N	33.9	Very low	31.8	Very low	126 Å²	126	141.5 Å²	141.5	67%	0.674	74%	0.739	S	S	*	*			cis	-179.7	158.5	-35.7	-121.3	-40	0	0	0	110.1
680	N	31.1	Very low	31.5	Very low	151 Å²	151	139.8 Å²	139.8	81%	0.807	73%	0.73	S	S	*	*			trans	64.8	156.7	163.4	-60.3	-16.4	0	0	0	119.2
681	A	34.2	Very low	31.6	Very low	87 Å²	87	142.3 Å²	142.3	72%	0.719	74%	0.737	S	S	*	*			cis	-168.4	140	-30.4	0	0	0	0	0	112.3
682	Q	31.3	Very low	31.4	Very low	157 Å²	157	142.6 Å²	142.6	73%	0.734	74%	0.736	S	S	*	*			trans	56	132.4	146	-102.7	-172.2	-38.2	0	0	124.8
683	R	29.3	Very low	31.2	Very low	189 Å²	189	142.9 Å²	142.9	71%	0.713	73%	0.733	S	S	*	*			trans	85.9	116.3	147.7	-63.8	-174.8	-137.5	157	10.1	122.5
684	D	27.1	Very low	31.1	Very low	130 Å²	130	142.2 Å²	142.2	70%	0.695	73%	0.727	S	S	*	*				61.4	149	121.6	-47.9	-40.1	0	0	0	124.4
685	H	31	Very low	31	Very low	173 Å²	173	142.1 Å²	142.1	80%	0.801	73%	0.727	S	S	*	*			trans	79.6	95.7	164.3	-63.9	-68.4	0	0	0	121.6
686	S	25.9	Very low	30.8	Very low	104 Å²	104	144.9 Å²	144.9	73%	0.727	73%	0.732	S	S	*	*				35.4	128.5	112.4	-57.4	0	0	0	0	123.4
687	L	33.7	Very low	30.7	Very low	148 Å²	148	146.8 Å²	146.8	78%	0.775	74%	0.738	S	S	*	*			trans	80	107.1	141.7	-63.3	172.2	0	0	0	122
688	E	24.9	Very low	31	Very low	149 Å²	149	144.6 Å²	144.6	70%	0.696	74%	0.735	S	S	*	*				86.4	125	108.2	-163.6	168.8	174.8	0	0	122.5
689	L	30.5	Very low	31.7	Very low	139 Å²	139	144.2 Å²	144.2	73%	0.728	74%	0.739	S	S	*	*			trans	63.4	156.2	160.9	-73.3	169.8	0	0	0	118.1
690	D	26.6	Very low	32.2	Very low	114 Å²	114	143.6 Å²	143.6	61%	0.61	74%	0.742	S	S	*	*			cis	-149	171.6	-5.8	-154.7	-27.8	0	0	0	108.6
691	H	34.9	Very low	32.4	Very low	186 Å²	186	143.9 Å²	143.9	86%	0.861	74%	0.743	S	S	*	*			trans	178.7	134.2	141.6	-90.2	-36.3	0	0	0	113.8
692	K	27.8	Very low	32.5	Very low	175 Å²	175	147.6 Å²	147.6	76%	0.761	75%	0.75	S	S	*	*			trans	-95.4	-174.6	163.6	-61.4	177.2	-178.8	172.8	0	109.2
693	E	27.4	Very low	32.7	Very low	147 Å²	147	146.2 Å²	146.2	69%	0.687	76%	0.757	S	S	*	*			cis	-171.2	-178.5	30.8	-166	159.5	-139.4	0	0	111.1
694	F	33.2	Very low	32.9	Very low	171 Å²	171	141.1 Å²	141.1	75%	0.75	76%	0.764	S	S	*	*			trans	73.9	142.2	171.9	-64.2	-86.3	0	0	0	118.3
695	D	30.4	Very low	33.3	Very low	131 Å²	131	138.4 Å²	138.4	70%	0.701	77%	0.766	S	S	*	*			cis	-166.4	-178.1	-21	-150.5	-16.5	0	0	0	112.1
696	E	31.1	Very low	33.6	Very low	176 Å²	176	136.7 Å²	136.7	82%	0.822	77%	0.774	S	S	*	*			trans	82.7	165.1	162	-61	-144.8	105.7	0	0	121.8
697	N	30.1	Very low	34	Very low	152 Å²	152	134.8 Å²	134.8	81%	0.813	77%	0.771	S	S	*	*			trans	-137.8	158.6	-152.2	-90.6	-80.3	0	0	0	116.7
698	P	43.9	Very low	34.1	Very low	109 Å²	109	134.3 Å²	134.3	71%	0.708	78%	0.78	S	S	*	*			trans	-104.9	-161.8	168.8	44.1	-36.9	0	0	0	111.9
699	P	47.3	Very low	34.5	Very low	115 Å²	115	130.6 Å²	130.6	75%	0.747	78%	0.781	S	S	*	*			cis	-129.2	-164.8	-13	44	-28	0	0	0	113.5
700	P	45.3	Very low	34.9	Very low	112 Å²	112	130.7 Å²	130.7	73%	0.727	79%	0.788	S	S	*	*			trans	-142.2	129.8	148.7	37.6	-21.8	0	0	0	119.4
701	L	35.2	Very low	35.7	Very low	158 Å²	158	130.5 Å²	130.5	83%	0.827	79%	0.793	S	S	*	*				59.9	156.2	126.1	-55.2	177.7	0	0	0	121.3
702	L	35.3	Very low	35.5	Very low	164 Å²	164	127.2 Å²	127.2	86%	0.859	79%	0.791	S	S	*	*			cis	-129.8	-173.1	17.9	-72.8	161.8	0	0	0	112.8
703	S	36.1	Very low	35.4	Very low	128 Å²	128	124.4 Å²	124.4	90%	0.895	79%	0.792	S	S	*	*			trans	-156.4	160.4	-178.7	62.1	0	0	0	0	115.9
704	G	33.7	Very low	35.6	Very low	83 Å²	83	123.6 Å²	123.6	86%	0.856	80%	0.797	S	S	*	*			trans	155.1	146.6	168.1	0	0	0	0	0	114.2
705	G	34.7	Very low	35.5	Very low	72 Å²	72	122 Å²	122	74%	0.742	80%	0.802	S	S	*	*			cis	170.4	155	-10.2	0	0	0	0	0	114.6
706	S	37.2	Very low	35.7	Very low	138 Å²	138	121.3 Å²	121.3	97%	0.965	81%	0.807	S	S	*	*			trans	64.5	149	161.2	-56.2	0	0	0	0	120.5
707	G	34.9	Very low	36.3	Very low	64 Å²	64	118.1 Å²	118.1	66%	0.66	80%	0.802	S	S	*	*			cis	167.2	156.7	-9.7	0	0	0	0	0	114.4
708	S	36.2	Very low	36.5	Very low	137 Å²	137	119.4 Å²	119.4	96%	0.958	80%	0.803	S	S	*	*			trans	61.2	156.7	172.6	74.2	0	0	0	0	118.9
709	G	33.1	Very low	35.9	Very low	71 Å²	71	120.2 Å²	120.2	73%	0.732	80%	0.801	S	S	*	*			cis	-155	-175.1	3.4	0	0	0	0	0	114.6
710	T	37.8	Very low	35.2	Very low	141 Å²	141	122 Å²	122	87%	0.865	80%	0.8	S	S	*	*			trans	-130.6	-161.8	-165.1	50.5	0	0	0	0	112
711	P	43.5	Very low	34.6	Very low	111 Å²	111	124.6 Å²	124.6	72%	0.721	80%	0.802	S	S	*	*				-125.5	-169.9	-72.3	38.8	-23.1	0	0	0	112.2
712	S	31.3	Very low	34.5	Very low	116 Å²	116	122 Å²	122	81%	0.811	80%	0.797	S	S	*	*				165.3	166.4	128.8	-74.9	0	0	0	0	113.4
713	C	26.8	Very low	34.4	Very low	117 Å²	117	122 Å²	122	79%	0.791	79%	0.792	S	S	*	*			trans	-132.7	174.6	-171.7	-61.6	0	0	0	0	112.9
714	T	29.9	Very low	34.2	Very low	129 Å²	129	121.4 Å²	121.4	79%	0.791	78%	0.783	S	S	*	*			trans	113.6	133.4	147.5	67.4	0	0	0	0	121.5
715	T	32.6	Very low	34.1	Very low	138 Å²	138	124.2 Å²	124.2	85%	0.847	78%	0.784	S	S	*	*			trans	76.1	137.9	147.3	40.5	0	0	0	0	124
716	S	33.3	Very low	33.8	Very low	116 Å²	116	126.3 Å²	126.3	81%	0.811	79%	0.786	S	S	*	*			trans	-89.5	-164.1	175.5	-27.7	0	0	0	0	110.9
717	P	43.8	Very low	33.4	Very low	109 Å²	109	124.4 Å²	124.4	71%	0.708	77%	0.773	S	S	*	*			cis	-146.3	-178	13.7	42.3	-20.2	0	0	0	119.4
718	Q	34.5	Very low	33	Very low	179 Å²	179	128.4 Å²	128.4	84%	0.836	78%	0.779	S	S	*	*			trans	77.6	119.3	138.4	-95.9	-178.7	0.4	0	0	125.2
719	N	30.4	Very low	33.6	Very low	126 Å²	126	127.6 Å²	127.6	67%	0.674	77%	0.77	S	S	*	*				100.7	106.8	117.1	-163.1	22.9	0	0	0	121.2
720	Q	34.4	Very low	34.2	Very low	154 Å²	154	130 Å²	130	72%	0.72	77%	0.774	S	S	*	*				174.6	129.6	109.5	-92	-178	71.2	0	0	114.6
721	Q	32.5	Very low	34.8	Very low	165 Å²	165	129 Å²	129	77%	0.771	77%	0.769	S	S	*	*			trans	38.6	129.6	143.8	-49.6	180	10.6	0	0	120
722	S	32.2	Very low	35.2	Very low	103 Å²	103	128.8 Å²	128.8	72%	0.72	77%	0.768	S	S	*	*				-179.1	158.4	57.8	45.3	0	0	0	0	115.7
723	H	33.9	Very low	36.3	Very low	166 Å²	166	129.3 Å²	129.3	77%	0.769	77%	0.768	S	S	*	*			trans	51.2	98.5	151.2	-66.7	-59.8	0	0	0	125.7
724	T	31.3	Very low	37.2	Very low	115 Å²	115	127.6 Å²	127.6	71%	0.706	76%	0.763	S	S	*	*				63.7	148.6	120.5	58.2	0	0	0	0	125.3
725	T	30.8	Very low	38	Very low	141 Å²	141	126.2 Å²	126.2	87%	0.865	76%	0.756	S	S	*	*			trans	100.1	170.4	159.7	72.5	0	0	0	0	118
726	C	28.8	Very low	38.9	Very low	116 Å²	116	125.5 Å²	125.5	78%	0.784	75%	0.754	S	S	*	*			trans	-119.9	162.1	-145.4	-55.1	0	0	0	0	114.6
727	S	28.4	Very low	38.9	Very low	99 Å²	99	127.1 Å²	127.1	69%	0.692	75%	0.753	S	S	*	*			trans	64.4	129.5	146.2	-67.7	0	0	0	0	121.6
728	D	28.6	Very low	38.6	Very low	147 Å²	147	128.4 Å²	128.4	79%	0.786	76%	0.759	S	S	*	*			trans	68.4	145.2	147.2	-57	-42.3	0	0	0	121.1
729	P	47.8	Very low	38.6	Very low	120 Å²	120	121.9 Å²	121.9	78%	0.779	74%	0.739	S	S	*	*			trans	-93.7	147.7	-178.4	36.2	-34.8	0	0	0	114
730	P	46.6	Very low	39	Very low	123 Å²	123	122.1 Å²	122.1	80%	0.799	75%	0.745	S	S	*	*			trans	-99.7	167.1	174.5	-0.3	21.7	0	0	0	115.9
731	P	48.8	Very low	38.8	Very low	119 Å²	119	122 Å²	122	77%	0.773	74%	0.742	S	S	*	*			trans	-117.9	-144.3	-172.5	42.9	-25.1	0	0	0	110.2
732	P	53.1	Low	39	Very low	106 Å²	106	121.3 Å²	121.3	69%	0.688	74%	0.739	S	S	*	*			cis	-130	-177.6	-14.6	44.8	-27.9	0	0	0	113.9
733	P	53.9	Low	38.9	Very low	127 Å²	127	123 Å²	123	83%	0.825	74%	0.74	S	S	*	*				-141	165.5	82.9	36.6	-20.6	0	0	0	114.4
734	A	44.7	Very low	38.8	Very low	82 Å²	82	122.8 Å²	122.8	68%	0.678	74%	0.737	S	S	*	*			cis	-163.7	151.7	-24.9	0	0	0	0	0	110.6
735	P	47.6	Very low	38.9	Very low	100 Å²	100	123.6 Å²	123.6	65%	0.649	73%	0.733	S	S	*	*			trans	-75.5	173.3	165.2	33.4	-34.9	0	0	0	111.7	L737	P735-L737 HydrophobicContact CB-CD1 3.73Å; P735-L737 HydrophobicContact CB-CG 3.99Å
736	P	50.8	Low	39	Very low	122 Å²	122	124.2 Å²	124.2	79%	0.792	73%	0.725	S	S	*	*			cis	-108.6	168.5	19.2	43.5	-37.4	0	0	0	114.8
737	L	33.6	Very low	39.1	Very low	151 Å²	151	124.4 Å²	124.4	79%	0.791	72%	0.723	S	S	*	*			cis	89.3	139.6	11.1	-53.6	-179.8	0	0	0	119	P735	P735-L737 HydrophobicContact CB-CD1 3.73Å; P735-L737 HydrophobicContact CB-CG 3.99Å
738	T	38.4	Very low	39.3	Very low	136 Å²	136	125 Å²	125	83%	0.834	72%	0.723	S	S	*	*			trans	-145.1	179.7	172.4	67.3	0	0	0	0	108
739	G	34.8	Very low	39.4	Very low	41 Å²	41	124.6 Å²	124.6	42%	0.423	73%	0.726	S	S	.	*			cis	94.4	116.9	11.3	0	0	0	0	0	112.1
740	T	38.1	Very low	38.7	Very low	132 Å²	132	124.3 Å²	124.3	81%	0.81	73%	0.726	S	S	*	*			cis	-118.2	157.1	-3.2	58.7	0	0	0	0	110.3
741	F	30.8	Very low	37.8	Very low	150 Å²	150	125.5 Å²	125.5	66%	0.658	73%	0.726	S	S	*	*			cis	75.3	140.4	31.5	-54.5	-43	0	0	0	113.9
742	H	35.3	Very low	37	Very low	151 Å²	151	125.8 Å²	125.8	70%	0.699	73%	0.726	S	S	*	*			cis	-156.7	171.2	-1.3	-123.9	135.1	0	0	0	113.2
743	N	30.4	Very low	35.7	Very low	138 Å²	138	130 Å²	130	74%	0.738	73%	0.733	S	S	*	*			trans	102.2	136.8	170.3	-65.1	-73	0	0	0	116.5
744	K	32.2	Very low	34.4	Very low	162 Å²	162	128.6 Å²	128.6	70%	0.704	73%	0.727	S	S	*	*			cis	-148.8	-109.9	-20.3	-154.1	174.7	-171.7	-71.7	0	113.9
745	Q	32.6	Very low	33.5	Very low	132 Å²	132	129.3 Å²	129.3	62%	0.617	73%	0.727	S	S	*	*			trans	-155.7	157.6	-157.4	-78.6	171.1	-48.6	0	0	111.9
746	H	33.5	Very low	32.5	Very low	154 Å²	154	132.8 Å²	132.8	71%	0.713	74%	0.739	S	S	*	*			cis	-125.7	-102.4	3.5	-138.5	-46.5	0	0	0	115.3
747	T	31	Very low	31.4	Very low	121 Å²	121	132.1 Å²	132.1	74%	0.742	74%	0.737	S	S	*	*			cis	-151.9	-151.5	-1.6	-37.3	0	0	0	0	109.7
748	T	32.4	Very low	31.6	Very low	111 Å²	111	130 Å²	130	68%	0.681	73%	0.732	S	S	*	*			trans	-124.8	134.8	-150.3	48.7	0	0	0	0	117.9
749	T	31.4	Very low	31.1	Very low	139 Å²	139	130.7 Å²	130.7	85%	0.853	74%	0.736	S	S	*	*			trans	65.2	145.1	144.7	54.3	0	0	0	0	119.8
750	S	33.6	Very low	30.7	Very low	113 Å²	113	135 Å²	135	79%	0.79	75%	0.754	S	S	*	*			cis	-147.6	175.3	8.1	59.5	0	0	0	0	114.2
751	N	27.6	Very low	30.2	Very low	148 Å²	148	132.7 Å²	132.7	79%	0.791	75%	0.748	S	S	*	*			trans	-58.3	170.7	168.1	-58.4	-61.9	0	0	0	112.4
752	V	31.4	Very low	30.1	Very low	126 Å²	126	129.2 Å²	129.2	76%	0.764	75%	0.754	S	S	*	*			cis	-153.8	164.3	42.5	176.3	0	0	0	0	112.5
753	K	25.3	Very low	29.7	Very low	193 Å²	193	128.1 Å²	128.1	84%	0.839	76%	0.759	S	S	*	*			trans	-25.3	154.9	163	-44.1	169.1	-180	176	0	115
754	S	27.5	Very low	29.9	Very low	99 Å²	99	128.5 Å²	128.5	69%	0.692	77%	0.766	S	S	*	*			cis	-173.6	149.8	43	52.1	0	0	0	0	115.7
755	S	25.2	Very low	29.6	Very low	97 Å²	97	127.7 Å²	127.7	68%	0.678	77%	0.769	S	S	*	*			trans	57.2	148.2	137.8	68.3	0	0	0	0	123.7
756	L	26.2	Very low	29.5	Very low	172 Å²	172	128.4 Å²	128.4	90%	0.901	78%	0.783	S	S	*	*			trans	86.8	133.2	161.2	-59.4	176.1	0	0	0	119.1
757	S	27.2	Very low	29.1	Very low	109 Å²	109	128.3 Å²	128.3	76%	0.762	79%	0.786	S	S	*	*			trans	-141.1	173.2	170.3	65.1	0	0	0	0	106.3
758	P	39.8	Very low	29	Very low	105 Å²	105	130.3 Å²	130.3	68%	0.682	79%	0.793	S	S	*	*			cis	-129.7	175.6	-17.1	37.9	-22.5	0	0	0	113.1
759	V	26.5	Very low	28.9	Very low	151 Å²	151	129.9 Å²	129.9	92%	0.915	79%	0.794	S	S	*	*			trans	-139	138.2	154.1	178.3	0	0	0	0	109
760	V	27.3	Very low	28.6	Very low	131 Å²	131	128.5 Å²	128.5	79%	0.794	79%	0.789	S	S	*	*			trans	-151.5	139.6	-168.2	172.6	0	0	0	0	107.5
761	A	27.7	Very low	28.3	Very low	84 Å²	84	133.5 Å²	133.5	69%	0.694	79%	0.791	S	S	*	*			cis	-137.8	177.2	1.6	0	0	0	0	0	111.3
762	G	27.6	Very low	28.2	Very low	77 Å²	77	134 Å²	134	79%	0.794	79%	0.792	S	S	*	*			trans	-103.1	141.7	161.4	0	0	0	0	0	111.4
763	T	27.8	Very low	28	Very low	129 Å²	129	131 Å²	131	79%	0.791	79%	0.786	S	S	*	*			trans	-143.2	146.6	-178.5	49.2	0	0	0	0	112.1
764	T	33.1	Very low	28.1	Very low	145 Å²	145	127.5 Å²	127.5	89%	0.89	79%	0.786	S	S	*	*			trans	-132.9	145.7	164.9	45	0	0	0	0	109.2
765	N	26.7	Very low	28.2	Very low	145 Å²	145	130.4 Å²	130.4	78%	0.775	79%	0.792	S	S	*	*			trans	-88.1	146.5	-168.7	-66.9	-43.3	0	0	0	113.6
766	V	30	Very low	28.5	Very low	147 Å²	147	130.8 Å²	130.8	89%	0.891	80%	0.795	S	S	*	*			trans	-140.7	135.6	134.4	-169.9	0	0	0	0	107.9
767	L	25.4	Very low	28.5	Very low	152 Å²	152	127.9 Å²	127.9	80%	0.796	79%	0.789	S	S	*	*			trans	-82.7	148.5	174.9	-82.5	68.5	0	0	0	111.1
768	N	29.2	Very low	28.8	Very low	164 Å²	164	131.5 Å²	131.5	88%	0.877	80%	0.798	S	S	*	*			trans	-155.9	169.4	136.5	-137.8	-20.7	0	0	0	113.2
769	S	30.4	Very low	28.4	Very low	101 Å²	101	131.3 Å²	131.3	71%	0.706	81%	0.806	S	S	*	*			trans	-94.8	152.5	-161.6	-67.4	0	0	0	0	117.1
770	C	26	Very low	28.4	Very low	111 Å²	111	128 Å²	128	75%	0.75	80%	0.803	S	S	*	*			trans	55.9	123.4	139.8	-66.3	0	0	0	0	123.7
771	R	27.5	Very low	28.6	Very low	217 Å²	217	125.2 Å²	125.2	82%	0.819	80%	0.8	S	S	*	*				75.2	116.3	128.6	-72.1	-174.7	173.5	-165.5	-1.1	122.1
772	I	24.7	Very low	28.6	Very low	160 Å²	160	129.6 Å²	129.6	82%	0.821	81%	0.806	S	S	*	*				75.4	134.3	128.3	-59	168.7	0	0	0	118.7
773	G	27.5	Very low	28.7	Very low	62 Å²	62	132.3 Å²	132.3	64%	0.639	80%	0.802	S	S	*	*			trans	103.5	122	177.7	0	0	0	0	0	111.8
774	S	25.9	Very low	28.8	Very low	120 Å²	120	131.1 Å²	131.1	84%	0.839	80%	0.799	S	S	*	*			cis	54.1	108.8	29.3	-56.7	0	0	0	0	111.3
775	I	30.4	Very low	28.7	Very low	160 Å²	160	130.4 Å²	130.4	82%	0.821	79%	0.794	S	S	*	*			cis	-150.9	152.8	21.5	37.9	172.2	0	0	0	113.9
776	S	30.7	Very low	29	Very low	105 Å²	105	129.3 Å²	129.3	73%	0.734	80%	0.795	S	S	*	*			trans	24.2	97.8	148.4	-51.3	0	0	0	0	121.4
777	S	27.5	Very low	29	Very low	111 Å²	111	127.1 Å²	127.1	78%	0.776	79%	0.786	S	S	*	*				33.3	115	126.7	63.9	0	0	0	0	121.2
778	L	32.5	Very low	29.7	Very low	184 Å²	184	125.9 Å²	125.9	96%	0.963	79%	0.787	S	S	*	*				-149.1	168.5	113.3	-153.9	60.1	0	0	0	109.6
779	A	31	Very low	29.7	Very low	101 Å²	101	125.3 Å²	125.3	84%	0.835	78%	0.783	S	S	*	*			trans	-125.1	154.3	-165.8	0	0	0	0	0	114.4
780	G	27.8	Very low	29.7	Very low	83 Å²	83	125.4 Å²	125.4	86%	0.856	78%	0.784	S	S	*	*			trans	106.5	128.9	149.1	0	0	0	0	0	117.5
781	G	30.9	Very low	30.1	Very low	71 Å²	71	125.5 Å²	125.5	73%	0.732	79%	0.786	S	S	*	*			trans	96.2	113.5	179.8	0	0	0	0	0	111.6
782	E	27.8	Very low	30.1	Very low	176 Å²	176	124 Å²	124	82%	0.822	79%	0.79	S	S	*	*				58	125.8	61	-62.9	-143.9	121.6	0	0	113
783	L	29.9	Very low	30.4	Very low	134 Å²	134	120.2 Å²	120.2	70%	0.702	79%	0.791	S	S	*	*			cis	-156.6	163.3	6.8	-115.3	164.8	0	0	0	111.5
784	S	29.7	Very low	30.6	Very low	105 Å²	105	122.6 Å²	122.6	73%	0.734	80%	0.804	S	S	*	*			trans	60.3	104.1	156.8	-58	0	0	0	0	120.7
785	V	30.3	Very low	30.7	Very low	130 Å²	130	120.8 Å²	120.8	79%	0.788	80%	0.804	S	S	*	*			trans	-89.5	161	148.4	-154.6	0	0	0	0	108.8
786	P	34.4	Very low	30.6	Very low	122 Å²	122	117.3 Å²	117.3	79%	0.792	81%	0.808	S	S	*	*				-139.8	132.5	128.9	35.3	-22.8	0	0	0	114.6
787	S	29.5	Very low	30.4	Very low	101 Å²	101	116.1 Å²	116.1	71%	0.706	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-90.3	139.9	161.9	-52.4	0	0	0	0	110.1
788	P	39.5	Very low	30.6	Very low	126 Å²	126	117.7 Å²	117.7	82%	0.818	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-84.1	148	166	33.2	-31.7	0	0	0	111.7
789	L	29.3	Very low	30.5	Very low	152 Å²	152	116.7 Å²	116.7	80%	0.796	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-97.6	155.3	177.6	-110.1	71.4	0	0	0	112.3
790	S	31.4	Very low	30.4	Very low	102 Å²	102	119.6 Å²	119.6	71%	0.713	81%	0.813	S	S	*	*			trans	45.3	132.6	142.2	-50.4	0	0	0	0	119.8
791	S	32.9	Very low	30.8	Very low	113 Å²	113	121.7 Å²	121.7	79%	0.79	81%	0.812	S	S	*	*				-177.8	176.7	61.6	45	0	0	0	0	112.5
792	M	28.8	Very low	30.8	Very low	187 Å²	187	121.9 Å²	121.9	92%	0.921	81%	0.814	S	S	*	*			trans	-70.1	153.5	-172.8	-44.7	90.5	71.3	0	0	115.3
793	G	30.4	Very low	31	Very low	80 Å²	80	120.8 Å²	120.8	83%	0.825	82%	0.819	S	S	*	*			trans	175.6	108.6	164	0	0	0	0	0	112.8
794	A	32.2	Very low	31	Very low	111 Å²	111	117.5 Å²	117.5	92%	0.917	82%	0.818	S	S	*	*			trans	-84.4	152.9	-167	0	0	0	0	0	115.7
795	G	28.3	Very low	31	Very low	82 Å²	82	117.6 Å²	117.6	85%	0.845	83%	0.825	S	S	*	*			trans	131.2	136.7	145.6	0	0	0	0	0	117.9
796	G	28.1	Very low	31	Very low	87 Å²	87	118.2 Å²	118.2	90%	0.897	83%	0.828	S	S	*	*			trans	88.3	94.1	160.7	0	0	0	0	0	116.2
797	G	26.5	Very low	30.7	Very low	81 Å²	81	117.7 Å²	117.7	84%	0.835	83%	0.828	S	S	*	*			trans	-86.4	166.3	-175.4	0	0	0	0	0	116.3
798	V	31.9	Very low	30.8	Very low	144 Å²	144	120.9 Å²	120.9	87%	0.873	84%	0.836	S	S	*	*			trans	-137.3	149.1	157.6	-87.9	0	0	0	0	108.7
799	N	29.9	Very low	30.3	Very low	163 Å²	163	119.8 Å²	119.8	87%	0.872	83%	0.832	S	S	*	*			trans	-75.4	141.7	-167.5	-65.5	-64.4	0	0	0	114
800	L	29.6	Very low	30.5	Very low	162 Å²	162	118.3 Å²	118.3	85%	0.848	83%	0.831	S	S	*	*			trans	-113.4	132.1	154	-106.5	73.4	0	0	0	108.7
801	P	35.7	Very low	30.7	Very low	126 Å²	126	119.5 Å²	119.5	82%	0.818	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-70.4	134.1	164.7	30.2	-32	0	0	0	109.7
802	G	30.9	Very low	30.7	Very low	76 Å²	76	121.6 Å²	121.6	78%	0.784	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-75.7	152.1	-170.3	0	0	0	0	0	115
803	V	30.9	Very low	30.8	Very low	152 Å²	152	120.6 Å²	120.6	92%	0.921	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-77.7	131.1	167	-177.5	0	0	0	0	108.7
804	G	30.1	Very low	30.9	Very low	66 Å²	66	123.2 Å²	123.2	68%	0.68	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-72.5	150.9	-172.4	0	0	0	0	0	114.7
805	A	30.3	Very low	30.9	Very low	107 Å²	107	123.3 Å²	123.3	88%	0.884	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-71.7	137.4	169.6	0	0	0	0	0	111
806	V	30.9	Very low	30.9	Very low	142 Å²	142	127.1 Å²	127.1	86%	0.861	83%	0.831	S	S	*	*			trans	-88.7	110.1	173	-80.8	0	0	0	0	110.5
807	S	27.8	Very low	31.1	Very low	111 Å²	111	127.5 Å²	127.5	78%	0.776	83%	0.826	S	S	*	*			trans	-103.8	125.4	163.2	-174.5	0	0	0	0	108.6
808	L	31.3	Very low	31.4	Very low	169 Å²	169	132 Å²	132	89%	0.885	83%	0.829	S	S	*	*			trans	-96.9	106.9	-177.5	-72.1	170.2	0	0	0	110.2
809	S	29.1	Very low	31.6	Very low	103 Å²	103	131.1 Å²	131.1	72%	0.72	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-90.2	141.4	164.4	-55.1	0	0	0	0	110.2
810	P	34	Very low	32	Very low	120 Å²	120	128.7 Å²	128.7	78%	0.779	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-71.4	141.1	179	29.4	-34.3	0	0	0	111.3	N812	P810-N812 PolarHBondContact O-N 3.25Å
811	P	36.1	Very low	32	Very low	127 Å²	127	128.2 Å²	128.2	83%	0.825	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-77	122.9	178.7	30.6	-33.1	0	0	0	110.7
812	N	32	Very low	32.1	Very low	157 Å²	157	127.6 Å²	127.6	84%	0.84	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-84	144.6	170.4	-151.5	-6	0	0	0	110.2	P810	P810-N812 PolarHBondContact O-N 3.25Å
813	L	31.6	Very low	32.1	Very low	167 Å²	167	131.8 Å²	131.8	87%	0.874	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-72.5	135.5	-173	-70.9	165.6	0	0	0	111.4
814	T	31.1	Very low	32.2	Very low	135 Å²	135	127.3 Å²	127.3	83%	0.828	80%	0.804	S	S	*	*			trans	-114	141.2	170.9	46.1	0	0	0	0	109.9
815	S	32.9	Very low	32.4	Very low	112 Å²	112	133.3 Å²	133.3	78%	0.783	81%	0.814	S	S	*	*			trans	-127.8	122.4	171.2	58.6	0	0	0	0	108.5
816	D	28.4	Very low	32.4	Very low	163 Å²	163	132.6 Å²	132.6	87%	0.872	80%	0.803	S	S	*	*			trans	-69.2	146.4	-173.7	-54.4	-83.4	0	0	0	114.6
817	A	33.2	Very low	32.5	Very low	95 Å²	95	131.9 Å²	131.9	79%	0.785	80%	0.799	S	S	*	*			trans	-159	94.1	147.9	0	0	0	0	0	112.6
818	L	31.2	Very low	32.6	Very low	174 Å²	174	131.9 Å²	131.9	91%	0.911	80%	0.798	S	S	*	*			trans	36.4	118.5	136.6	-56.9	171.1	0	0	0	120.3
819	T	35.9	Very low	32.6	Very low	127 Å²	127	128.4 Å²	128.4	78%	0.779	79%	0.788	S	S	*	*			trans	-82.2	169	150.6	59.5	0	0	0	0	110.5
820	P	38.5	Very low	32.9	Very low	111 Å²	111	129.9 Å²	129.9	72%	0.721	79%	0.793	S	S	*	*				-149.4	154.1	93.1	38	-20.6	0	0	0	117.4
821	N	30.4	Very low	32.8	Very low	152 Å²	152	131.7 Å²	131.7	81%	0.813	79%	0.791	S	S	*	*			trans	41.8	122.1	146.1	-56.5	3.9	0	0	0	121.9
822	S	37.3	Very low	32.6	Very low	113 Å²	113	133.4 Å²	133.4	79%	0.79	79%	0.788	S	S	*	*				-168.2	163.1	97.5	40.9	0	0	0	0	113.1
823	D	31.5	Very low	32.5	Very low	164 Å²	164	133.4 Å²	133.4	88%	0.877	79%	0.788	S	S	*	*			trans	-61.2	165	-170.3	-39.1	-79.5	0	0	0	115
824	G	32.4	Very low	33	Very low	59 Å²	59	130.8 Å²	130.8	61%	0.608	78%	0.781	S	S	*	*			cis	156.8	149.2	-2.7	0	0	0	0	0	112.1
825	H	34	Very low	33.5	Very low	191 Å²	191	129.6 Å²	129.6	88%	0.884	78%	0.776	S	S	*	*			trans	64.8	160.5	169.8	-57.3	-88.2	0	0	0	118.7
826	S	32.1	Very low	33.6	Very low	92 Å²	92	130.2 Å²	130.2	64%	0.643	78%	0.78	S	S	*	*			cis	-169.8	137.4	-35.9	60.3	0	0	0	0	113.5
827	V	31.9	Very low	33.8	Very low	128 Å²	128	129 Å²	129	78%	0.776	78%	0.778	S	S	*	*			trans	47.7	128.9	152.4	-59.9	0	0	0	0	125.1
828	S	30.7	Very low	33.8	Very low	110 Å²	110	130 Å²	130	77%	0.769	78%	0.776	S	S	*	*			trans	64.2	150.6	134.3	66.7	0	0	0	0	122.4
829	S	30.8	Very low	33.6	Very low	97 Å²	97	129.1 Å²	129.1	68%	0.678	77%	0.772	S	S	*	*			cis	-172.9	-177.7	-12.1	53.4	0	0	0	0	112.3
830	T	34.7	Very low	33.1	Very low	133 Å²	133	128.2 Å²	128.2	82%	0.816	77%	0.771	S	S	*	*			trans	83.1	149	167.6	71.9	0	0	0	0	119.6
831	Q	32.1	Very low	32.7	Very low	159 Å²	159	129.1 Å²	129.1	74%	0.743	78%	0.775	S	S	*	*			cis	-164.7	157.5	-36.3	-154.4	-169.6	38.6	0	0	111.2
832	Q	32.3	Very low	32.4	Very low	162 Å²	162	128.3 Å²	128.3	76%	0.757	78%	0.775	S	S	*	*			trans	80.6	91.8	160	-48.6	-169.7	23	0	0	122.1
833	N	30.1	Very low	32	Very low	157 Å²	157	130.2 Å²	130.2	84%	0.84	78%	0.775	S	S	*	*				31.4	161.3	109.3	-77.9	4	0	0	0	122.9
834	P	41.5	Very low	31.7	Very low	113 Å²	113	127.7 Å²	127.7	73%	0.734	77%	0.766	S	S	*	*			cis	-140	-148.2	-20	39.4	-17.8	0	0	0	111.9
835	P	41.8	Very low	31.3	Very low	110 Å²	110	131 Å²	131	71%	0.714	77%	0.774	S	S	*	*			cis	-122.6	159.4	-47	28.5	-11.1	0	0	0	114.3
836	S	34.6	Very low	31	Very low	124 Å²	124	127.1 Å²	127.1	87%	0.867	77%	0.768	S	S	*	*				166.6	145.5	129.7	-76	0	0	0	0	114.1
837	V	32.9	Very low	30.7	Very low	137 Å²	137	128.7 Å²	128.7	83%	0.83	78%	0.779	S	S	*	*			trans	-76	172.8	-177	-77.4	0	0	0	0	115.1
838	P	33.7	Very low	30.4	Very low	116 Å²	116	127 Å²	127	75%	0.753	77%	0.773	S	S	*	*			cis	-135.8	174.2	-22.3	30.7	-11	0	0	0	115.2
839	L	25.9	Very low	30.2	Very low	157 Å²	157	127.3 Å²	127.3	82%	0.822	78%	0.776	S	S	*	*				145.2	146.1	126.2	-163.4	69.1	0	0	0	112.7
840	S	27.2	Very low	30.1	Very low	107 Å²	107	127.5 Å²	127.5	75%	0.748	77%	0.773	S	S	*	*			trans	62.7	111	169.8	-64.2	0	0	0	0	117.7
841	T	28.4	Very low	29.9	Very low	131 Å²	131	128.2 Å²	128.2	80%	0.804	77%	0.769	S	S	*	*			trans	-144	120.8	164.4	-47.9	0	0	0	0	110.8
842	T	24.8	Very low	29.8	Very low	134 Å²	134	125.8 Å²	125.8	82%	0.822	76%	0.758	S	S	*	*			trans	-65.4	135.5	170.2	-46.8	0	0	0	0	110.2
843	I	30	Very low	30.1	Very low	154 Å²	154	124.8 Å²	124.8	79%	0.79	75%	0.752	S	S	*	*			trans	-127.6	140.2	169.1	-64.2	-175.8	0	0	0	110.2
844	T	24	Very low	30.3	Very low	111 Å²	111	120 Å²	120	68%	0.681	73%	0.727	S	S	*	*			trans	-94.3	145.6	-172.1	49.2	0	0	0	0	113.1
845	T	24.1	Very low	29.7	Very low	129 Å²	129	119.4 Å²	119.4	79%	0.791	72%	0.721	S	S	*	*			trans	47.2	101.7	144.6	59.4	0	0	0	0	119
846	S	27.1	Very low	29.2	Very low	108 Å²	108	119.3 Å²	119.3	76%	0.755	71%	0.714	S	S	*	*			trans	-139.5	104.8	145.6	61.4	0	0	0	0	109.5	S848	S846-S848 VanDerWaalsContact C-N 3.28Å; S846-S848 PolarHBondContact O-N 2.84Å
847	S	26	Very low	29.2	Very low	125 Å²	125	123.5 Å²	123.5	87%	0.874	72%	0.717	S	S	*	*			trans	-79	68.8	-173.3	-54.5	0	0	0	0	112.5	S849	S847-S849 PolarHBondContact O-N 2.81Å
848	S	26	Very low	28.9	Very low	92 Å²	92	120.8 Å²	120.8	64%	0.643	72%	0.716	S	S	*	*			trans	-81.2	111.6	170.8	-65.4	0	0	0	0	110.3	S846 T850	S846-S848 VanDerWaalsContact C-N 3.28Å; S846-S848 PolarHBondContact O-N 2.84Å; S848-T850 VanDerWaalsContact C-N 3.3Å; S848-T850 PolarHBondContact O-N 2.97Å
849	S	25.9	Very low	28.7	Very low	118 Å²	118	121 Å²	121	83%	0.825	72%	0.721	S	S	*	*			trans	-70.3	85.3	168.9	-61.6	0	0	0	0	110.2	S847 M851	S847-S849 PolarHBondContact O-N 2.81Å; S849-M851 PolarHBondContact O-N 2.67Å
850	T	29.2	Very low	28.8	Very low	100 Å²	100	119 Å²	119	61%	0.613	72%	0.72	S	S	*	*			trans	-65.2	96.4	176.7	-55	0	0	0	0	110.2	S848 M852	S848-T850 VanDerWaalsContact C-N 3.3Å; S848-T850 PolarHBondContact O-N 2.97Å; T850-M852 HydrophobicContact CG2-CE 4.33Å; T850-M852 HydrophobicContact CG2-CG 4.06Å; T850-M852 PolarHBondContact O-N 3.18Å; T850-M852 VanDerWaalsContact O-N 3.16Å
851	M	29.7	Very low	28.8	Very low	149 Å²	149	117.4 Å²	117.4	73%	0.734	72%	0.72	S	S	*	*			trans	-66.5	109.9	167.4	-68.9	-168.6	-77.1	0	0	108.6	S849	S849-M851 PolarHBondContact O-N 2.67Å
852	M	31.2	Very low	28.7	Very low	107 Å²	107	120.6 Å²	120.6	53%	0.527	73%	0.729	S	S	.	*			trans	-91	118.6	-177	-68.1	-173.9	179.4	0	0	110.9	T850 D854	T850-M852 HydrophobicContact CG2-CE 4.33Å; T850-M852 HydrophobicContact CG2-CG 4.06Å; T850-M852 PolarHBondContact O-N 3.18Å; T850-M852 VanDerWaalsContact O-N 3.16Å; M852-D854 VanDerWaalsContact C-N 3.26Å; M852-D854 PolarHBondContact O-N 2.92Å; M852-D854 VanDerWaalsContact O-N 3.09Å
853	F	39.1	Very low	28.7	Very low	142 Å²	142	118 Å²	118	62%	0.623	73%	0.728	S	S	*	*	S	Bend	trans	-78.9	81.5	159.4	-71.7	-83.2	0	0	0	109	T855	F853-T855 PolarHBondContact O-N 3.38Å
854	D	33	Very low	28.5	Very low	57 Å²	57	114.5 Å²	114.5	31%	0.305	73%	0.73	S	S	.	*			trans	43.3	56.9	165.2	-147.9	-20.9	0	0	0	115.7	M852 N856 Y873	M852-D854 VanDerWaalsContact C-N 3.26Å; M852-D854 PolarHBondContact O-N 2.92Å; M852-D854 VanDerWaalsContact O-N 3.09Å; D854-N856 VanDerWaalsContact C-N 3.25Å; D854-N856 PolarHBondContact O-N 3.31Å; D854-N856 VanDerWaalsContact O-N 3.16Å; D854-Y873 HydrophobicContact CB-CE1 4.44Å; D854-Y873 VanDerWaalsContact OD2-CE1 3.31Å; D854-Y873 WeakPolarHBondContact OD2-CE1 3.39Å; D854-Y873 PolarHBondContact OD2-OH 2.8Å
855	T	29	Very low	28.6	Very low	99 Å²	99	116.8 Å²	116.8	61%	0.607	74%	0.737	S	S	*	*			trans	-87.1	52.1	177.6	54.5	0	0	0	0	112.1	F853	F853-T855 PolarHBondContact O-N 3.38Å
856	N	31.2	Very low	28.9	Very low	108 Å²	108	115.1 Å²	115.1	58%	0.578	73%	0.73	S	S	*	*			trans	-117.4	52.5	-172.3	-148.4	20.5	0	0	0	115.2	D854	D854-N856 VanDerWaalsContact C-N 3.25Å; D854-N856 PolarHBondContact O-N 3.31Å; D854-N856 VanDerWaalsContact O-N 3.16Å
857	F	34.4	Very low	29	Very low	213 Å²	213	117.8 Å²	117.8	93%	0.934	74%	0.736	S	S	*	*			trans	-137.7	97.3	153.9	-104.3	-83.8	0	0	0	108.3
858	G	28	Very low	29.3	Very low	79 Å²	79	118.8 Å²	118.8	81%	0.814	73%	0.73	S	S	*	*			trans	-140.3	49.1	-156.1	0	0	0	0	0	116.4
859	S	28.1	Very low	30.2	Very low	121 Å²	121	119.3 Å²	119.3	85%	0.846	73%	0.733	S	S	*	*			trans	-142	121.3	160	-170.5	0	0	0	0	107.7
860	S	28.2	Very low	31.5	Very low	115 Å²	115	124.2 Å²	124.2	80%	0.804	73%	0.734	S	S	*	*	S	Bend	cis	-152.7	163.6	23	57.3	0	0	0	0	112.9
861	G	28	Very low	33.4	Very low	73 Å²	73	124.5 Å²	124.5	75%	0.753	74%	0.738	S	S	*	*			trans	92.5	95.5	149.3	0	0	0	0	0	119.1
862	M	25.7	Very low	35.9	Very low	199 Å²	199	119.9 Å²	119.9	98%	0.98	72%	0.718	S	S	*	*			trans	44.3	120.9	135.6	-135.2	96.9	75.5	0	0	121
863	G	25	Very low	38.8	Very low	78 Å²	78	115.9 Å²	115.9	80%	0.804	70%	0.698	S	S	*	*			trans	108	100.6	160.4	0	0	0	0	0	113.9
864	G	25.8	Very low	41.3	Very low	81 Å²	81	109.2 Å²	109.2	84%	0.835	67%	0.669	S	S	*	*			trans	-89.9	136.2	-172.5	0	0	0	0	0	114.8
865	I	26.6	Very low	44.2	Very low	160 Å²	160	108.8 Å²	108.8	82%	0.821	66%	0.664	S	S	*	*			trans	-141.3	130.6	154.5	-25.8	174.3	0	0	0	108.3
866	S	28.9	Very low	47.2	Very low	93 Å²	93	105.7 Å²	105.7	65%	0.65	64%	0.644	S	S	*	*			trans	46.2	115.7	165.4	54.5	0	0	0	0	119.4	I868	S866-I868 PolarHBondContact O-N 3.46Å
867	N	29.8	Very low	49.9	Very low	164 Å²	164	105.6 Å²	105.6	88%	0.877	64%	0.635	S	S	*	*			trans	-60.6	104.3	161.9	-72.5	-9.6	0	0	0	110.7	S869	N867-S869 PolarHBondContact O-N 2.87Å; N867-S869 VanDerWaalsContact O-N 3.17Å
868	I	33.4	Very low	52.3	Low	146 Å²	146	97.8 Å²	97.8	75%	0.749	60%	0.603	S	S	*	*			trans	-81.6	88.4	164.7	-59.3	175.7	0	0	0	106.8	S866 R870	S866-I868 PolarHBondContact O-N 3.46Å; I868-R870 PolarHBondContact O-N 3.35Å; I868-R870 VanDerWaalsContact O-N 3.16Å
869	S	43.5	Very low	54.5	Low	103 Å²	103	99.3 Å²	99.3	72%	0.72	59%	0.592	S	S	*	*			trans	-64.3	114	178.2	54.8	0	0	0	0	110.2	N867	N867-S869 PolarHBondContact O-N 2.87Å; N867-S869 VanDerWaalsContact O-N 3.17Å
870	R	54	Low	56.5	Low	221 Å²	221	101.9 Å²	101.9	83%	0.834	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-57.5	146.4	163.9	-72.3	-177.8	173.4	-174.5	-3.1	109.1	I868	I868-R870 PolarHBondContact O-N 3.35Å; I868-R870 VanDerWaalsContact O-N 3.16Å
871	P	69.7	Low	58.8	Low	107 Å²	107	102 Å²	102	70%	0.695	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-59.5	145.7	174.7	26.4	-34.3	0	0	0	110.1
872	P	81.5	Confident	61.2	Low	51 Å²	51	102.8 Å²	102.8	33%	0.331	58%	0.579	S	S	.	*	P	Polyproline II helix	trans	-61.5	139.7	172.2	26.8	-33.2	0	0	0	109.6	F875 P885	P872-F875 HydrophobicContact CB-CZ 4.41Å; P872-F875 HydrophobicContact CG-CE1 3.97Å; P872-F875 HydrophobicContact CG-CZ 3.96Å; P872-F875 WeakPolarHBondContact O-CE2 3.16Å; P872-F875 WeakPolarHBondContact O-CZ 3.17Å; P872-P885 HydrophobicContact CB-CB 3.57Å; P872-P885 HydrophobicContact CG-CB 3.67Å
873	Y	91.1	Very high	63.9	Low	24 Å²	24	96.3 Å²	96.3	9%	0.094	55%	0.552	C	S	.	*			trans	-109.3	-12.3	-177.2	61.6	-98.3	0	0	0	113.9	D854 F888 L1138 S1139 L1140 W1169 G1174 N1176	D854-Y873 HydrophobicContact CB-CE1 4.44Å; D854-Y873 VanDerWaalsContact OD2-CE1 3.31Å; D854-Y873 WeakPolarHBondContact OD2-CE1 3.39Å; D854-Y873 PolarHBondContact OD2-OH 2.8Å; Y873-F888 HydrophobicContact CE1-CE2 4.28Å; Y873-F888 HydrophobicContact CE2-CE2 4.02Å; Y873-F888 HydrophobicContact CE2-CZ 4.09Å; Y873-F888 AromaticContact CZ-CE2 3.65Å; Y873-F888 WeakPolarHBondContact OH-CE2 3.42Å; Y873-L1138 CarbonylContact O-C 3.5Å; Y873-L1138 VanDerWaalsContact O-CA 3.31Å; Y873-L1138 WeakPolarHBondContact O-CA 3.49Å; Y873-S1139 PolarHBondContact O-N 3.44Å; Y873-S1139 PolarHBondContact O-OG 3.47Å; Y873-L1140 VanDerWaalsContact CB-CD2 3.48Å; Y873-L1140 HydrophobicContact CD1-CD1 4.36Å; Y873-L1140 HydrophobicContact CD1-CD2 3.71Å; Y873-L1140 HydrophobicContact CD1-CG 4.21Å; Y873-L1140 HydrophobicContact CD2-CD1 3.75Å; Y873-L1140 HydrophobicContact CD2-CD2 4.05Å; Y873-L1140 HydrophobicContact CD2-CG 3.64Å; Y873-L1140 HydrophobicContact CE1-CD1 4.39Å; Y873-L1140 HydrophobicContact CE1-CD2 4.41Å; Y873-L1140 HydrophobicContact CE2-CD1 3.81Å; Y873-L1140 HydrophobicContact CE2-CG 4.23Å; Y873-L1140 HydrophobicContact CG-CD1 4.03Å; Y873-L1140 HydrophobicContact CG-CD2 3.48Å; Y873-L1140 VanDerWaalsContact CG-CD2 3.48Å; Y873-L1140 HydrophobicContact CG-CG 3.61Å; Y873-W1169 HydrophobicContact CD2-CZ3 4Å; Y873-W1169 AromaticContact CE2-CZ3 3.99Å; Y873-W1169 HydrophobicContact CE2-CZ3 3.99Å; Y873-G1174 WeakPolarHBondContact CE2-O 3.45Å; Y873-N1176 HydrophobicContact CE2-CB 4.17Å; Y873-N1176 VanDerWaalsContact OH-CB 3.28Å; Y873-N1176 WeakPolarHBondContact OH-CB 3.33Å; Y873-N1176 PolarHBondContact OH-N 3.3Å
874	S	93.3	Very high	67	Low	2 Å²	2	95.3 Å²	95.3	1%	0.014	53%	0.53	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	127.6	173.6	178.4	0	0	0	0	109.8	P885 V886 Q1137 L1138 Y1173	S874-P885 WeakPolarHBondContact O-CA 3.31Å; S874-V886 PolarHBondContact O-N 3.27Å; S874-V886 WeakPolarHBondContact OG-CG2 3.21Å; S874-Q1137 WeakPolarHBondContact CA-O 3.33Å; S874-L1138 VanDerWaalsContact OG-CD2 3.3Å; S874-L1138 WeakPolarHBondContact OG-CD2 3.32Å; S874-Y1173 PolarHBondContact OG-O 3.39Å
875	F	92.5	Very high	70	Confident	47 Å²	47	94.4 Å²	94.4	21%	0.206	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	124.3	-179.2	-60.2	-90.4	0	0	0	111	P872 P883 T884 P885 Y1136 Q1137	P872-F875 HydrophobicContact CB-CZ 4.41Å; P872-F875 HydrophobicContact CG-CE1 3.97Å; P872-F875 HydrophobicContact CG-CZ 3.96Å; P872-F875 WeakPolarHBondContact O-CE2 3.16Å; P872-F875 WeakPolarHBondContact O-CZ 3.17Å; F875-P883 HydrophobicContact CB-CB 3.98Å; F875-P883 HydrophobicContact CD1-CB 4.16Å; F875-P883 HydrophobicContact CG-CB 4.34Å; F875-T884 CarbonylContact C-O 3.56Å; F875-T884 VanDerWaalsContact CA-O 3.25Å; F875-T884 WeakPolarHBondContact CA-O 3.38Å; F875-P885 HydrophobicContact CD1-CB 4.42Å; F875-P885 HydrophobicContact CE1-CB 4.41Å; F875-Y1136 CarbonylContact O-C 3.59Å; F875-Y1136 WeakPolarHBondContact O-CA 3.46Å; F875-Q1137 HydrophobicContact CB-CB 4.49Å; F875-Q1137 PolarHBondContact N-O 2.81Å; F875-Q1137 PolarHBondContact O-N 3.42Å
876	L	92.5	Very high	72.9	Confident	34 Å²	34	87.9 Å²	87.9	18%	0.178	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	115.5	166.1	174.1	57.7	0	0	0	109.2	L878 T884 V886 E1134 Y1136	L876-L878 HydrophobicContact CD1-CD1 4.29Å; L876-L878 HydrophobicContact CD2-CD1 3.93Å; L876-L878 HydrophobicContact CG-CD1 3.77Å; L876-T884 PolarHBondContact N-O 2.96Å; L876-T884 PolarHBondContact O-N 2.83Å; L876-T884 PolarHBondContact O-OG1 2.91Å; L876-V886 HydrophobicContact CB-CG2 3.88Å; L876-E1134 HydrophobicContact CD1-CB 3.94Å; L876-E1134 HydrophobicContact CD1-CG 4.13Å; L876-Y1136 HydrophobicContact CB-CD1 4.09Å; L876-Y1136 HydrophobicContact CB-CE1 3.98Å; L876-Y1136 HydrophobicContact CD1-CD1 4.14Å; L876-Y1136 HydrophobicContact CD1-CE1 3.81Å; L876-Y1136 HydrophobicContact CD2-CE1 4.35Å; L876-Y1136 HydrophobicContact CG-CE1 4.26Å
877	R	88	Confident	75.6	Confident	106 Å²	106	87.4 Å²	87.4	40%	0.4	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	130.2	163.9	-64.8	179.9	179.6	-138.1	3.6	108.6	P883 R1135	R877-P883 HydrophobicContact CG-CB 4.01Å; R877-R1135 PolarHBondContact N-O 2.86Å; R877-R1135 PolarHBondContact O-N 2.94Å
878	L	84.6	Confident	78.3	Confident	50 Å²	50	80.8 Å²	80.8	26%	0.262	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	154.9	159.2	-64.1	99.1	0	0	0	108.6	L876 N880 Q881	L876-L878 HydrophobicContact CD1-CD1 4.29Å; L876-L878 HydrophobicContact CD2-CD1 3.93Å; L876-L878 HydrophobicContact CG-CD1 3.77Å; L878-N880 PolarHBondContact O-N 3.49Å; L878-Q881 HydrophobicContact CB-CB 4.49Å; L878-Q881 PolarHBondContact O-N 2.94Å; L878-Q881 VanDerWaalsContact O-N 3.09Å
879	D	73.8	Confident	80.8	Confident	110 Å²	110	77.5 Å²	77.5	59%	0.588	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	130.6	173.8	-68.8	-43.1	0	0	0	111.1	Q881	D879-Q881 VanDerWaalsContact C-N 3.3Å; D879-Q881 PolarHBondContact O-N 3.49Å
880	N	70	Confident	82.5	Confident	176 Å²	176	77.1 Å²	77.1	94%	0.941	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	18.2	-177.5	-50	-45.7	0	0	0	116.7	L878	L878-N880 PolarHBondContact O-N 3.49Å
881	Q	77.8	Confident	84	Confident	117 Å²	117	71.5 Å²	71.5	55%	0.547	40%	0.403	S	S	.	.	S	Bend	trans	-119.9	151	172.8	-66.9	-176	68.4	0	0	112.2	L878 D879	L878-Q881 HydrophobicContact CB-CB 4.49Å; L878-Q881 PolarHBondContact O-N 2.94Å; L878-Q881 VanDerWaalsContact O-N 3.09Å; D879-Q881 VanDerWaalsContact C-N 3.3Å; D879-Q881 PolarHBondContact O-N 3.49Å
882	S	77.9	Confident	84.7	Confident	90 Å²	90	66.4 Å²	66.4	63%	0.629	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-64	145.2	169.5	50.7	0	0	0	0	110.6	T884	S882-T884 PolarHBondContact O-N 3.25Å
883	P	82.4	Confident	85	Confident	63 Å²	63	65.3 Å²	65.3	41%	0.409	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-55.5	124	176	22.2	-32.6	0	0	0	111	F875 R877	F875-P883 HydrophobicContact CB-CB 3.98Å; F875-P883 HydrophobicContact CD1-CB 4.16Å; F875-P883 HydrophobicContact CG-CB 4.34Å; R877-P883 HydrophobicContact CG-CB 4.01Å
884	T	89.6	Confident	84.7	Confident	57 Å²	57	70 Å²	70	35%	0.35	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	130.8	179.1	55	0	0	0	0	109.8	F875 L876 S882 V886	F875-T884 CarbonylContact C-O 3.56Å; F875-T884 VanDerWaalsContact CA-O 3.25Å; F875-T884 WeakPolarHBondContact CA-O 3.38Å; L876-T884 PolarHBondContact N-O 2.96Å; L876-T884 PolarHBondContact O-N 2.83Å; L876-T884 PolarHBondContact O-OG1 2.91Å; S882-T884 PolarHBondContact O-N 3.25Å; T884-V886 PolarHBondContact O-N 2.8Å
885	P	89.3	Confident	84.3	Confident	62 Å²	62	71.2 Å²	71.2	40%	0.403	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	133.3	178.3	29.1	-34.6	0	0	0	110	P872 S874 F875 P887	P872-P885 HydrophobicContact CB-CB 3.57Å; P872-P885 HydrophobicContact CG-CB 3.67Å; S874-P885 WeakPolarHBondContact O-CA 3.31Å; F875-P885 HydrophobicContact CD1-CB 4.42Å; F875-P885 HydrophobicContact CE1-CB 4.41Å; P885-P887 WeakPolarHBondContact O-CD 3.38Å
886	V	88.2	Confident	84.1	Confident	22 Å²	22	75.2 Å²	75.2	13%	0.133	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-80.7	122.8	-177	-172.6	0	0	0	0	110.3	S874 L876 T884 F888 Y1136	S874-V886 PolarHBondContact O-N 3.27Å; S874-V886 WeakPolarHBondContact OG-CG2 3.21Å; L876-V886 HydrophobicContact CB-CG2 3.88Å; T884-V886 PolarHBondContact O-N 2.8Å; V886-F888 HydrophobicContact CB-CE1 4.2Å; V886-F888 HydrophobicContact CG1-CD1 4.27Å; V886-F888 HydrophobicContact CG1-CE1 4.04Å; V886-Y1136 HydrophobicContact CG2-CD1 3.93Å; V886-Y1136 HydrophobicContact CG2-CE1 4.11Å
887	P	85.1	Confident	84	Confident	84 Å²	84	75 Å²	75	55%	0.545	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-77.6	131.7	169.5	31.8	-32.2	0	0	0	109.9	P885	P885-P887 WeakPolarHBondContact O-CD 3.38Å
888	F	87.2	Confident	84.4	Confident	25 Å²	25	70.1 Å²	70.1	11%	0.11	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-97.2	134.9	174.4	-53.8	-52.4	0	0	0	110.9	Y873 V886 A892 F893 Y1173 A1175	Y873-F888 HydrophobicContact CE1-CE2 4.28Å; Y873-F888 HydrophobicContact CE2-CE2 4.02Å; Y873-F888 HydrophobicContact CE2-CZ 4.09Å; Y873-F888 AromaticContact CZ-CE2 3.65Å; Y873-F888 WeakPolarHBondContact OH-CE2 3.42Å; V886-F888 HydrophobicContact CB-CE1 4.2Å; V886-F888 HydrophobicContact CG1-CD1 4.27Å; V886-F888 HydrophobicContact CG1-CE1 4.04Å; F888-A892 HydrophobicContact CB-CB 4.22Å; F888-F893 HydrophobicContact CB-CE2 3.71Å; F888-F893 HydrophobicContact CB-CZ 3.97Å; F888-F893 AromaticContact CD2-CZ 3.92Å; F888-F893 HydrophobicContact CD2-CZ 3.92Å; F888-F893 HydrophobicContact CG-CE2 4.41Å; F888-F893 HydrophobicContact CG-CZ 4.18Å; F888-Y1173 AromaticContact CD1-CD2 3.93Å; F888-Y1173 HydrophobicContact CD1-CD2 3.93Å; F888-Y1173 HydrophobicContact CD1-CE2 4.3Å; F888-Y1173 AromaticContact CE1-CD2 3.84Å; F888-Y1173 HydrophobicContact CE1-CD2 3.84Å; F888-A1175 HydrophobicContact CD1-CB 3.74Å; F888-A1175 HydrophobicContact CD2-CB 4.21Å; F888-A1175 HydrophobicContact CE1-CB 3.77Å; F888-A1175 HydrophobicContact CE2-CB 4.23Å; F888-A1175 HydrophobicContact CG-CB 3.96Å; F888-A1175 HydrophobicContact CZ-CB 4.01Å
889	T	83.9	Confident	84.9	Confident	76 Å²	76	67.8 Å²	67.8	47%	0.466	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-87	157.1	167.8	52.7	0	0	0	0	109.9	D891 A892	T889-D891 WeakPolarHBondContact CB-OD1 3.45Å; T889-D891 PolarHBondContact O-N 3.45Å; T889-D891 PolarHBondContact OG1-OD1 2.79Å; T889-A892 WeakPolarHBondContact O-CB 3.42Å; T889-A892 PolarHBondContact O-N 2.69Å
890	P	80.4	Confident	85.7	Confident	96 Å²	96	66.3 Å²	66.3	62%	0.623	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-59.5	-30.6	-174.3	-27.3	36.6	0	0	0	114.7	A892 F893 F894	P890-A892 PolarHBondContact O-N 2.81Å; P890-F893 PolarHBondContact O-N 2.78Å; P890-F893 VanDerWaalsContact O-N 3.14Å; P890-F894 WeakPolarHBondContact O-CD2 3.43Å; P890-F894 PolarHBondContact O-N 2.58Å
891	D	84.3	Confident	86.8	Confident	102 Å²	102	63.3 Å²	63.3	55%	0.545	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-69.7	-6.3	174.6	62.1	-56.5	0	0	0	114.2	T889 F893	T889-D891 WeakPolarHBondContact CB-OD1 3.45Å; T889-D891 PolarHBondContact O-N 3.45Å; T889-D891 PolarHBondContact OG1-OD1 2.79Å; D891-F893 VanDerWaalsContact C-N 3.26Å
892	A	84.5	Confident	87.7	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-65.2	-32.2	165.7	0	0	0	0	0	112.2	F888 T889 P890 R1170 Y1173 A1175 L1177	F888-A892 HydrophobicContact CB-CB 4.22Å; T889-A892 WeakPolarHBondContact O-CB 3.42Å; T889-A892 PolarHBondContact O-N 2.69Å; P890-A892 PolarHBondContact O-N 2.81Å; A892-R1170 VanDerWaalsContact O-CD 3.3Å; A892-R1170 WeakPolarHBondContact O-CD 3.42Å; A892-R1170 WeakPolarHBondContact O-CG 3.47Å; A892-Y1173 HydrophobicContact CB-CE2 3.82Å; A892-A1175 HydrophobicContact CB-CB 3.99Å; A892-L1177 WeakPolarHBondContact O-CD2 3.34Å
893	F	88.3	Confident	88.6	Confident	29 Å²	29	57.6 Å²	57.6	13%	0.127	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-20.9	-174	-53.9	-88.6	0	0	0	113.3	F888 P890 D891 A1175 N1176	F888-F893 HydrophobicContact CB-CE2 3.71Å; F888-F893 HydrophobicContact CB-CZ 3.97Å; F888-F893 AromaticContact CD2-CZ 3.92Å; F888-F893 HydrophobicContact CD2-CZ 3.92Å; F888-F893 HydrophobicContact CG-CE2 4.41Å; F888-F893 HydrophobicContact CG-CZ 4.18Å; P890-F893 PolarHBondContact O-N 2.78Å; P890-F893 VanDerWaalsContact O-N 3.14Å; D891-F893 VanDerWaalsContact C-N 3.26Å; F893-A1175 HydrophobicContact CE1-CB 4.05Å; F893-A1175 HydrophobicContact CZ-CB 4.16Å; F893-N1176 WeakPolarHBondContact CD1-O 3.43Å; F893-N1176 WeakPolarHBondContact CE1-O 3.46Å
894	F	85.3	Confident	89.1	Confident	122 Å²	122	55.8 Å²	55.8	54%	0.535	33%	0.325	S	S	.	.	S	Bend	trans	-129.1	125.3	-176	-58.5	-82	0	0	0	112.1	P890 H900	P890-F894 WeakPolarHBondContact O-CD2 3.43Å; P890-F894 PolarHBondContact O-N 2.58Å; F894-H900 AromaticContact CD1-CE1 3.48Å; F894-H900 VanDerWaalsContact CD1-CE1 3.48Å; F894-H900 WeakPolarHBondContact CD1-CE1 3.3Å; F894-H900 AromaticContact CD1-NE2 3.84Å
895	G	85.6	Confident	89.3	Confident	28 Å²	28	54.9 Å²	54.9	29%	0.289	32%	0.317	S	S	.	.	S	Bend	trans	171.2	166.2	175.8	0	0	0	0	0	112.9	G897 I898	G895-G897 PolarHBondContact O-N 2.93Å; G895-I898 WeakPolarHBondContact O-CB 3.41Å; G895-I898 PolarHBondContact O-N 2.98Å
896	P	87.9	Confident	89.4	Confident	130 Å²	130	53.1 Å²	53.1	84%	0.844	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	123.7	177.8	26.1	-34.1	0	0	0	110.7
897	G	90.9	Very high	89.6	Confident	30 Å²	30	53 Å²	53	31%	0.309	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	13	-176.4	0	0	0	0	0	114.9	G895	G895-G897 PolarHBondContact O-N 2.93Å
898	I	95.1	Very high	90.1	Very high	3 Å²	3	49 Å²	49	2%	0.015	28%	0.278	C	S	.	.			trans	-103.3	115	171.2	-50.5	-50.1	0	0	0	108.4	G895 L1155 R1170 L1177	G895-I898 WeakPolarHBondContact O-CB 3.41Å; G895-I898 PolarHBondContact O-N 2.98Å; I898-L1155 HydrophobicContact CD1-CB 3.85Å; I898-L1155 HydrophobicContact CD1-CD1 4.15Å; I898-L1155 HydrophobicContact CD1-CG 4.48Å; I898-R1170 VanDerWaalsContact CD1-CZ 3.45Å; I898-R1170 VanDerWaalsContact CD1-NE 3.31Å; I898-L1177 HydrophobicContact CG2-CD1 3.93Å; I898-L1177 HydrophobicContact CG2-CD2 3.63Å; I898-L1177 HydrophobicContact CG2-CG 4.4Å
899	P	95.3	Very high	90.4	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.006	29%	0.292	C	S	.	.			trans	-72.9	149	-175.5	30.9	-38.7	0	0	0	112.6	W1156 L1177 F1178 I1212 I1213 Y1214	P899-W1156 VanDerWaalsContact CD-CD1 3.48Å; P899-W1156 HydrophobicContact CG-CD2 3.81Å; P899-W1156 HydrophobicContact CG-CE3 4.29Å; P899-W1156 HydrophobicContact CG-CG 4.03Å; P899-W1156 HydrophobicContact CG-CZ2 4.23Å; P899-L1177 HydrophobicContact CG-CD1 4.04Å; P899-F1178 HydrophobicContact CB-CD1 4.26Å; P899-F1178 HydrophobicContact CB-CE1 3.89Å; P899-F1178 HydrophobicContact CG-CD1 4.27Å; P899-F1178 HydrophobicContact CG-CE1 3.84Å; P899-I1212 HydrophobicContact CB-CG2 3.42Å; P899-I1212 VanDerWaalsContact CB-CG2 3.42Å; P899-I1212 HydrophobicContact CG-CG2 4.38Å; P899-I1213 WeakPolarHBondContact CA-O 3.25Å; P899-Y1214 HydrophobicContact CB-CD1 4.15Å; P899-Y1214 HydrophobicContact CB-CE1 3.87Å; P899-Y1214 HydrophobicContact CG-CE1 4.35Å
900	H	91.5	Very high	90.9	Very high	80 Å²	80	48.2 Å²	48.2	37%	0.37	27%	0.272	S	S	.	.			trans	-107.1	-27.9	179.2	-63.7	-24.1	0	0	0	113.3	F894 I1213	F894-H900 AromaticContact CD1-CE1 3.48Å; F894-H900 VanDerWaalsContact CD1-CE1 3.48Å; F894-H900 WeakPolarHBondContact CD1-CE1 3.3Å; F894-H900 AromaticContact CD1-NE2 3.84Å; H900-I1213 PolarHBondContact N-O 3.06Å
901	Q	93.1	Very high	91.5	Very high	113 Å²	113	46 Å²	46	53%	0.528	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	142.9	-179.1	-171.8	175	15.6	0	0	111.8	I1213	Q901-I1213 HydrophobicContact CB-CB 4.3Å; Q901-I1213 HydrophobicContact CB-CD1 4.35Å; Q901-I1213 PolarHBondContact N-O 2.99Å; Q901-I1213 PolarHBondContact O-N 3.19Å
902	A	96.2	Very high	92	Very high	10 Å²	10	44.1 Å²	44.1	8%	0.083	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	122	162	0	0	0	0	0	110.2	F1178 V1180 Y1210 I1212	A902-F1178 HydrophobicContact CB-CD2 3.85Å; A902-F1178 HydrophobicContact CB-CE1 4.28Å; A902-F1178 HydrophobicContact CB-CE2 3.42Å; A902-F1178 VanDerWaalsContact CB-CE2 3.42Å; A902-F1178 HydrophobicContact CB-CG 4.46Å; A902-F1178 HydrophobicContact CB-CZ 3.66Å; A902-V1180 HydrophobicContact CB-CG2 4.02Å; A902-Y1210 HydrophobicContact CB-CD1 3.97Å; A902-Y1210 HydrophobicContact CB-CG 4.26Å; A902-I1212 HydrophobicContact CB-CD1 3.84Å
903	K	95.5	Very high	92.5	Very high	77 Å²	77	45.6 Å²	45.6	34%	0.335	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	116.6	-177.7	169.9	-173.6	157.5	-149.1	0	109.8	I905 Y1210 E1211 I1213	K903-I905 HydrophobicContact CG-CG2 4.47Å; K903-I905 PolarHBondContact O-N 2.8Å; K903-Y1210 CarbonylContact O-C 3.59Å; K903-Y1210 VanDerWaalsContact O-CA 3.31Å; K903-Y1210 WeakPolarHBondContact O-CA 3.45Å; K903-E1211 HydrophobicContact CB-CB 4.5Å; K903-E1211 WeakPolarHBondContact CD-OE2 3.3Å; K903-E1211 WeakPolarHBondContact CE-OE2 3.42Å; K903-E1211 PolarHBondContact N-O 3.15Å; K903-E1211 IonicContact NZ-OE2 2.72Å; K903-E1211 PolarHBondContact NZ-OE2 2.95Å; K903-E1211 PolarHBondContact O-N 2.85Å; K903-I1213 HydrophobicContact CB-CD1 4.01Å; K903-I1213 HydrophobicContact CB-CG1 4.5Å; K903-I1213 HydrophobicContact CD-CD1 4.14Å
904	A	94.3	Very high	93	Very high	24 Å²	24	44.2 Å²	44.2	20%	0.198	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	126.8	176.5	0	0	0	0	0	110.9	I959 T1208 Y1210	A904-I959 HydrophobicContact CB-CD1 3.91Å; A904-I959 HydrophobicContact CB-CG1 4.32Å; A904-T1208 HydrophobicContact CB-CG2 4.17Å; A904-Y1210 HydrophobicContact CB-CD1 4.07Å; A904-Y1210 HydrophobicContact CB-CE1 3.84Å
905	I	93.3	Very high	93.5	Very high	38 Å²	38	39.5 Å²	39.5	20%	0.195	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	-35.7	-178.9	52.5	165.4	0	0	0	113.1	K903 T960 L1197 V1209 E1211	K903-I905 HydrophobicContact CG-CG2 4.47Å; K903-I905 PolarHBondContact O-N 2.8Å; I905-T960 PolarHBondContact O-N 3.06Å; I905-T960 VanDerWaalsContact O-N 3.11Å; I905-T960 PolarHBondContact O-OG1 2.89Å; I905-L1197 HydrophobicContact CD1-CD2 4.01Å; I905-V1209 HydrophobicContact CD1-CG1 4.05Å; I905-V1209 HydrophobicContact CG1-CB 4.19Å; I905-V1209 HydrophobicContact CG1-CG1 4.05Å; I905-V1209 VanDerWaalsContact CG1-O 3.31Å; I905-V1209 WeakPolarHBondContact CG1-O 3.26Å; I905-V1209 PolarHBondContact N-O 3.22Å; I905-E1211 HydrophobicContact CD1-CB 4.29Å; I905-E1211 HydrophobicContact CG2-CB 3.82Å
906	H	91.8	Very high	94.1	Very high	26 Å²	26	38.4 Å²	38.4	12%	0.12	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	149.1	-179.9	-57.7	-67.1	0	0	0	113.1	L908 T960 V1209	H906-L908 HydrophobicContact CB-CD2 4.36Å; H906-T960 WeakPolarHBondContact CA-O 3.35Å; H906-T960 PolarHBondContact CE1-OG1 3.45Å; H906-T960 PolarHBondContact ND1-O 3.16Å; H906-T960 PolarHBondContact ND1-OG1 3.25Å; H906-V1209 HydrophobicContact CB-CB 3.99Å; H906-V1209 HydrophobicContact CB-CG2 3.92Å; H906-V1209 PolarHBondContact N-O 2.79Å; H906-V1209 PolarHBondContact O-N 3.34Å
907	C	92.7	Very high	94.5	Very high	19 Å²	19	32.7 Å²	32.7	13%	0.128	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	131.1	167.3	-169.1	0	0	0	0	108.6	D909 I959 T960 N961 K962 K1206	C907-D909 PolarHBondContact SG-OD1 3.33Å; C907-I959 HydrophobicContact CB-CG2 3.96Å; C907-T960 PolarHBondContact N-O 2.93Å; C907-N961 WeakPolarHBondContact O-CA 3.42Å; C907-K962 PolarHBondContact O-N 3.38Å; C907-K1206 WeakPolarHBondContact SG-CD 3.45Å
908	L	94.4	Very high	94.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	93.1	-176.7	-52	-178.3	0	0	0	109	H906 H910 I926 T928 W937 K962 K1206 A1207 V1209	H906-L908 HydrophobicContact CB-CD2 4.36Å; L908-H910 PolarHBondContact O-N 3.05Å; L908-I926 HydrophobicContact CD1-CB 4.23Å; L908-I926 HydrophobicContact CD1-CD1 3.88Å; L908-I926 HydrophobicContact CD1-CG2 3.89Å; L908-T928 HydrophobicContact CD1-CG2 4.29Å; L908-W937 HydrophobicContact CB-CD2 3.97Å; L908-W937 HydrophobicContact CB-CE3 4.2Å; L908-W937 HydrophobicContact CB-CG 4.45Å; L908-W937 HydrophobicContact CB-CH2 4.33Å; L908-W937 HydrophobicContact CB-CZ2 4.1Å; L908-W937 HydrophobicContact CB-CZ3 4.37Å; L908-W937 HydrophobicContact CD1-CB 4.31Å; L908-W937 HydrophobicContact CD1-CD2 4.35Å; L908-W937 HydrophobicContact CD1-CG 3.96Å; L908-W937 HydrophobicContact CD2-CB 4.14Å; L908-W937 HydrophobicContact CD2-CD2 4.01Å; L908-W937 HydrophobicContact CD2-CE3 3.98Å; L908-W937 HydrophobicContact CD2-CG 4.08Å; L908-W937 HydrophobicContact CG-CD2 4.33Å; L908-W937 HydrophobicContact CG-CG 4.39Å; L908-K962 HydrophobicContact CD2-CB 3.74Å; L908-K962 HydrophobicContact CD2-CG 4.18Å; L908-K1206 CarbonylContact O-C 3.59Å; L908-K1206 VanDerWaalsContact O-CA 3.25Å; L908-K1206 WeakPolarHBondContact O-CA 3.32Å; L908-K1206 WeakPolarHBondContact O-CB 3.38Å; L908-A1207 HydrophobicContact CB-CB 4.1Å; L908-A1207 WeakPolarHBondContact CB-O 3.43Å; L908-A1207 HydrophobicContact CD1-CB 4.2Å; L908-A1207 PolarHBondContact N-O 2.89Å; L908-A1207 PolarHBondContact O-N 2.9Å; L908-V1209 HydrophobicContact CD1-CG2 3.72Å; L908-V1209 HydrophobicContact CD2-CG2 4.36Å; L908-V1209 HydrophobicContact CG-CG2 3.95Å
909	D	94	Very high	94.8	Very high	79 Å²	79	31.6 Å²	31.6	42%	0.422	18%	0.177	S	C	.	.			trans	-76.7	83.1	-170.2	-57.6	-38.5	0	0	0	111.9	C907 W937 N961	C907-D909 PolarHBondContact SG-OD1 3.33Å; D909-W937 WeakPolarHBondContact O-CH2 3.46Å; D909-N961 PolarHBondContact OD2-ND2 3.06Å
910	H	94	Very high	94.6	Very high	6 Å²	6	32 Å²	32	3%	0.028	18%	0.179	C	C	.	.			trans	-65	-40.6	178.1	-159.9	-27.9	0	0	0	111.3	L908 E912 V914 T928 G930 T933 K935 R1205	L908-H910 PolarHBondContact O-N 3.05Å; H910-E912 PolarHBondContact O-N 3.31Å; H910-V914 HydrophobicContact CB-CG2 3.66Å; H910-T928 PolarHBondContact CD2-O 3.07Å; H910-T928 PolarHBondContact CD2-OG1 3Å; H910-T928 PolarHBondContact NE2-O 2.97Å; H910-G930 PolarHBondContact NE2-N 3.46Å; H910-G930 VanDerWaalsContact NE2-N 3.19Å; H910-T933 PolarHBondContact NE2-O 3.43Å; H910-K935 WeakPolarHBondContact ND1-CD 3.39Å; H910-K935 PolarHBondContact O-NZ 2.83Å; H910-R1205 PolarHBondContact N-O 3.3Å
911	G	92.6	Very high	94.1	Very high	48 Å²	48	31 Å²	31	50%	0.495	18%	0.176	S	C	.	.	S	Bend	trans	80.7	-8.8	-176.8	0	0	0	0	0	114	R1205	G911-R1205 PolarHBondContact N-O 3.18Å
912	E	95.1	Very high	93.5	Very high	64 Å²	64	29.8 Å²	29.8	30%	0.299	19%	0.185	S	C	.	.	S	Bend	trans	-119.6	157.8	164.2	-75.1	-71.8	-174	0	0	109.9	H910 V914 K931 R1205	H910-E912 PolarHBondContact O-N 3.31Å; E912-V914 PolarHBondContact O-N 2.83Å; E912-K931 HydrophobicContact CB-CB 4.06Å; E912-K931 HydrophobicContact CG-CB 3.81Å; E912-K931 WeakPolarHBondContact OE1-CD 3.42Å; E912-R1205 WeakPolarHBondContact O-CA 3.42Å; E912-R1205 WeakPolarHBondContact O-CB 3.48Å
913	V	96.3	Very high	92.7	Very high	30 Å²	30	31.6 Å²	31.6	18%	0.182	20%	0.195	C	C	.	.			trans	-62.1	126.4	-175.8	174.1	0	0	0	0	110.2	C915 G930 Y976 L1187 R1205	V913-C915 PolarHBondContact O-N 3.28Å; V913-C915 VanDerWaalsContact O-N 3.16Å; V913-G930 WeakPolarHBondContact O-CA 3.33Å; V913-Y976 HydrophobicContact CB-CE1 3.9Å; V913-L1187 HydrophobicContact CG1-CD1 3.2Å; V913-R1205 HydrophobicContact CG2-CG 3.81Å
914	V	97.5	Very high	92.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.194	C	C	.	.			trans	-90.4	84.9	-171.5	-170.3	0	0	0	0	111.2	H910 E912 A916 V917 T928 G929 S1188 G1201 S1202 K1206 A1207	H910-V914 HydrophobicContact CB-CG2 3.66Å; E912-V914 PolarHBondContact O-N 2.83Å; V914-A916 VanDerWaalsContact C-N 3.35Å; V914-A916 WeakPolarHBondContact CG1-O 3.4Å; V914-V917 HydrophobicContact CG1-CG1 3.65Å; V914-T928 HydrophobicContact CG1-CG2 4.41Å; V914-G929 WeakPolarHBondContact CA-O 3.43Å; V914-S1188 PolarHBondContact O-OG 3.22Å; V914-G1201 CarbonylContact O-C 3.55Å; V914-G1201 WeakPolarHBondContact O-CA 3.38Å; V914-S1202 PolarHBondContact N-O 2.93Å; V914-K1206 WeakPolarHBondContact CG2-O 3.33Å; V914-A1207 HydrophobicContact CG1-CB 4.36Å
915	C	96.8	Very high	91.9	Very high	23 Å²	23	32.2 Å²	32.2	16%	0.155	20%	0.195	C	C	.	.			trans	-78.1	-13.6	-178.2	-68.8	0	0	0	0	114.3	V913 G929 I977	V913-C915 PolarHBondContact O-N 3.28Å; V913-C915 VanDerWaalsContact O-N 3.16Å; C915-G929 PolarHBondContact N-O 2.93Å; C915-G929 VanDerWaalsContact N-O 3.13Å; C915-I977 WeakPolarHBondContact CB-O 3.47Å
916	A	97.5	Very high	92	Very high	5 Å²	5	30.4 Å²	30.4	4%	0.041	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	144	175.4	0	0	0	0	0	111.8	V914 G929 I977 I980 S1188	V914-A916 VanDerWaalsContact C-N 3.35Å; V914-A916 WeakPolarHBondContact CG1-O 3.4Å; A916-G929 PolarHBondContact N-O 3.43Å; A916-G929 PolarHBondContact O-N 2.8Å; A916-I977 HydrophobicContact CB-CG2 4.42Å; A916-I980 HydrophobicContact CB-CD1 4.16Å; A916-I980 HydrophobicContact CB-CG1 3.99Å; A916-S1188 WeakPolarHBondContact CA-OG 3.41Å; A916-S1188 PolarHBondContact N-OG 3.12Å
917	V	97.5	Very high	92.2	Very high	10 Å²	10	29.4 Å²	29.4	6%	0.061	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	149.9	170.9	-63.3	0	0	0	0	110.1	V914 Y927 T928 D1190 V1199 A1207	V914-V917 HydrophobicContact CG1-CG1 3.65Å; V917-Y927 CarbonylContact C-O 3.57Å; V917-Y927 WeakPolarHBondContact CA-O 3.24Å; V917-T928 HydrophobicContact CG1-CG2 4.26Å; V917-D1190 HydrophobicContact CG2-CB 4.22Å; V917-V1199 HydrophobicContact CB-CG1 3.97Å; V917-V1199 HydrophobicContact CG1-CG1 4.03Å; V917-V1199 HydrophobicContact CG2-CG1 4.17Å; V917-A1207 HydrophobicContact CG1-CB 4.26Å
918	T	96.7	Very high	92.4	Very high	7 Å²	7	28.5 Å²	28.5	4%	0.043	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	155.3	162.8	-168.3	0	0	0	0	112.7	Y927 I980 L982 D1190	T918-Y927 HydrophobicContact CG2-CD2 4.48Å; T918-Y927 PolarHBondContact N-O 3.07Å; T918-Y927 PolarHBondContact O-N 3.15Å; T918-I980 HydrophobicContact CG2-CB 4.13Å; T918-I980 HydrophobicContact CG2-CG2 3.63Å; T918-L982 HydrophobicContact CG2-CD1 4.28Å; T918-L982 HydrophobicContact CG2-CG 4.37Å; T918-D1190 WeakPolarHBondContact CA-OD2 3.46Å; T918-D1190 WeakPolarHBondContact CB-OD2 3.49Å; T918-D1190 PolarHBondContact OG1-OD2 3.44Å
919	I	94.6	Very high	92.5	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.021	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	127.3	-174.2	-50.1	172.9	0	0	0	110.4	N921 D1190 V1199	I919-N921 PolarHBondContact O-N 2.68Å; I919-D1190 HydrophobicContact CG1-CB 4.36Å; I919-D1190 PolarHBondContact N-OD2 3.11Å; I919-D1190 VanDerWaalsContact N-OD2 3.15Å; I919-V1199 HydrophobicContact CD1-CB 4.16Å; I919-V1199 HydrophobicContact CD1-CG2 3.6Å; I919-V1199 HydrophobicContact CG1-CB 4.31Å; I919-V1199 HydrophobicContact CG1-CG2 3.81Å
920	N	91.6	Very high	92.6	Very high	10 Å²	10	24.7 Å²	24.7	5%	0.053	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	105.3	167.8	-173.9	-19.9	0	0	0	110	A922 T923 H924 Q925 Y927 L982	N920-A922 PolarHBondContact O-N 2.94Å; N920-A922 PolarHBondContact OD1-N 2.7Å; N920-T923 WeakPolarHBondContact CB-OG1 3.33Å; N920-T923 PolarHBondContact ND2-OG1 2.92Å; N920-T923 PolarHBondContact O-N 2.82Å; N920-H924 WeakPolarHBondContact O-CA 3.4Å; N920-H924 PolarHBondContact O-N 2.88Å; N920-Q925 HydrophobicContact CB-CB 4.37Å; N920-Q925 PolarHBondContact N-O 3.46Å; N920-Q925 PolarHBondContact O-N 3.05Å; N920-Y927 HydrophobicContact CB-CE2 3.88Å; N920-L982 HydrophobicContact CB-CD1 3.63Å
921	N	81.7	Confident	92.6	Very high	59 Å²	59	26.7 Å²	26.7	32%	0.316	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-17.9	-175.7	-59.7	-60.6	0	0	0	114.4	I919 S1192 L1193	I919-N921 PolarHBondContact O-N 2.68Å; N921-S1192 WeakPolarHBondContact OD1-CA 3.5Å; N921-S1192 WeakPolarHBondContact OD1-CB 3.42Å; N921-L1193 HydrophobicContact CB-CB 3.92Å; N921-L1193 PolarHBondContact OD1-N 3.35Å
922	A	79.7	Confident	92.6	Very high	86 Å²	86	24.4 Å²	24.4	71%	0.711	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-22.1	178	0	0	0	0	0	113.2	N920	N920-A922 PolarHBondContact O-N 2.94Å; N920-A922 PolarHBondContact OD1-N 2.7Å
923	T	79.8	Confident	92.5	Very high	49 Å²	49	22.5 Å²	22.5	30%	0.301	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.4	-5.2	-175.4	59.4	0	0	0	0	113.8	N920 Q925 N940	N920-T923 WeakPolarHBondContact CB-OG1 3.33Å; N920-T923 PolarHBondContact ND2-OG1 2.92Å; N920-T923 PolarHBondContact O-N 2.82Å; T923-Q925 PolarHBondContact O-N 2.97Å; T923-Q925 WeakPolarHBondContact OG1-CB 3.3Å; T923-Q925 WeakPolarHBondContact OG1-CG 3.44Å; T923-Q925 PolarHBondContact OG1-N 2.66Å; T923-Q925 PolarHBondContact OG1-OE1 2.75Å; T923-N940 PolarHBondContact O-ND2 2.95Å
924	H	81.9	Confident	92.6	Very high	68 Å²	68	21 Å²	21	32%	0.315	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	34.5	-167.3	-61.5	-85.9	0	0	0	113.1	N920 L939	N920-H924 WeakPolarHBondContact O-CA 3.4Å; N920-H924 PolarHBondContact O-N 2.88Å; H924-L939 HydrophobicContact CB-CB 4.34Å; H924-L939 WeakPolarHBondContact O-CB 3.29Å; H924-L939 VanDerWaalsContact O-CG 3.32Å; H924-L939 WeakPolarHBondContact O-CG 3.47Å; H924-L939 PolarHBondContact O-N 3.26Å
925	Q	91.2	Very high	92.5	Very high	45 Å²	45	23.3 Å²	23.3	21%	0.21	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	143.3	174.2	-70.6	170.6	-9.1	0	0	111	N920 T923 Y927 L936 W937 D938	N920-Q925 HydrophobicContact CB-CB 4.37Å; N920-Q925 PolarHBondContact N-O 3.46Å; N920-Q925 PolarHBondContact O-N 3.05Å; T923-Q925 PolarHBondContact O-N 2.97Å; T923-Q925 WeakPolarHBondContact OG1-CB 3.3Å; T923-Q925 WeakPolarHBondContact OG1-CG 3.44Å; T923-Q925 PolarHBondContact OG1-N 2.66Å; T923-Q925 PolarHBondContact OG1-OE1 2.75Å; Q925-Y927 HydrophobicContact CB-CE2 4.22Å; Q925-L936 HydrophobicContact CB-CD1 3.78Å; Q925-L936 HydrophobicContact CG-CD1 4.33Å; Q925-W937 CarbonylContact C-O 3.57Å; Q925-W937 VanDerWaalsContact CA-O 3.22Å; Q925-W937 WeakPolarHBondContact CA-O 3.3Å; Q925-D938 HydrophobicContact CG-CB 4.08Å
926	I	94.5	Very high	92.3	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	137.7	178.6	-61	169.1	0	0	0	108.8	L908 T928 W937 L939 V1199 V1209	L908-I926 HydrophobicContact CD1-CB 4.23Å; L908-I926 HydrophobicContact CD1-CD1 3.88Å; L908-I926 HydrophobicContact CD1-CG2 3.89Å; I926-T928 HydrophobicContact CG2-CG2 3.97Å; I926-W937 HydrophobicContact CB-CB 4.46Å; I926-W937 PolarHBondContact N-O 3.31Å; I926-W937 PolarHBondContact O-N 2.86Å; I926-L939 HydrophobicContact CD1-CD1 4.03Å; I926-L939 HydrophobicContact CD1-CD2 3.84Å; I926-L939 HydrophobicContact CD1-CG 4.05Å; I926-V1199 HydrophobicContact CD1-CG2 3.56Å; I926-V1199 HydrophobicContact CG1-CG2 4.07Å; I926-V1199 HydrophobicContact CG2-CG1 3.99Å; I926-V1199 HydrophobicContact CG2-CG2 4.41Å; I926-V1209 HydrophobicContact CD1-CB 4.48Å; I926-V1209 HydrophobicContact CD1-CG1 4.13Å; I926-V1209 HydrophobicContact CD1-CG2 3.5Å; I926-V1209 VanDerWaalsContact CD1-CG2 3.5Å
927	Y	95.8	Very high	92.1	Very high	4 Å²	4	22.8 Å²	22.8	2%	0.016	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	121.5	175.4	-62.5	-104.2	0	0	0	108.3	V917 T918 N920 Q925 V934 K935 L936 L982 L989 L1003	V917-Y927 CarbonylContact C-O 3.57Å; V917-Y927 WeakPolarHBondContact CA-O 3.24Å; T918-Y927 HydrophobicContact CG2-CD2 4.48Å; T918-Y927 PolarHBondContact N-O 3.07Å; T918-Y927 PolarHBondContact O-N 3.15Å; N920-Y927 HydrophobicContact CB-CE2 3.88Å; Q925-Y927 HydrophobicContact CB-CE2 4.22Å; Y927-V934 HydrophobicContact CD1-CG1 4.09Å; Y927-V934 HydrophobicContact CG-CG1 4.49Å; Y927-K935 WeakPolarHBondContact CA-O 3.44Å; Y927-L936 HydrophobicContact CD1-CD1 3.92Å; Y927-L936 HydrophobicContact CD2-CD1 4.07Å; Y927-L936 HydrophobicContact CE1-CD1 3.55Å; Y927-L936 HydrophobicContact CE1-CD2 4.46Å; Y927-L936 HydrophobicContact CE1-CG 4.47Å; Y927-L936 HydrophobicContact CE2-CD1 3.67Å; Y927-L936 HydrophobicContact CG-CD1 4.16Å; Y927-L982 HydrophobicContact CD2-CD1 4.28Å; Y927-L982 HydrophobicContact CE2-CD1 4.16Å; Y927-L982 HydrophobicContact CE2-CD2 4.38Å; Y927-L989 HydrophobicContact CD1-CD1 3.85Å; Y927-L989 HydrophobicContact CD1-CD2 3.78Å; Y927-L989 HydrophobicContact CD1-CG 4.49Å; Y927-L989 HydrophobicContact CE1-CD1 4.14Å; Y927-L989 HydrophobicContact CE1-CD2 4.15Å; Y927-L989 HydrophobicContact CG-CD1 4.13Å; Y927-L1003 HydrophobicContact CE1-CD1 4.12Å; Y927-L1003 HydrophobicContact CE1-CD2 4.27Å; Y927-L1003 WeakPolarHBondContact OH-CD1 3.28Å
928	T	97.6	Very high	91.6	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	116.1	-179.9	62.1	0	0	0	0	110.6	L908 H910 V914 V917 I926 V934 K935 W937 A1207	L908-T928 HydrophobicContact CD1-CG2 4.29Å; H910-T928 PolarHBondContact CD2-O 3.07Å; H910-T928 PolarHBondContact CD2-OG1 3Å; H910-T928 PolarHBondContact NE2-O 2.97Å; V914-T928 HydrophobicContact CG1-CG2 4.41Å; V917-T928 HydrophobicContact CG1-CG2 4.26Å; I926-T928 HydrophobicContact CG2-CG2 3.97Å; T928-V934 WeakPolarHBondContact O-CA 3.35Å; T928-K935 PolarHBondContact N-O 2.98Å; T928-K935 PolarHBondContact O-N 3.5Å; T928-W937 PolarHBondContact OG1-NE1 3.27Å; T928-A1207 HydrophobicContact CG2-CB 3.72Å
929	G	96.8	Very high	90.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	123.4	177	0	0	0	0	0	111.9	V914 C915 A916	V914-G929 WeakPolarHBondContact CA-O 3.43Å; C915-G929 PolarHBondContact N-O 2.93Å; C915-G929 VanDerWaalsContact N-O 3.13Å; A916-G929 PolarHBondContact N-O 3.43Å; A916-G929 PolarHBondContact O-N 2.8Å
930	G	94.8	Very high	90.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.16	C	C	.	.			trans	-124.8	-140.5	173.2	0	0	0	0	0	110.8	H910 V913 G932 T933 I977	H910-G930 PolarHBondContact NE2-N 3.46Å; H910-G930 VanDerWaalsContact NE2-N 3.19Å; V913-G930 WeakPolarHBondContact O-CA 3.33Å; G930-G932 PolarHBondContact O-N 3.36Å; G930-T933 PolarHBondContact N-O 3.15Å; G930-I977 WeakPolarHBondContact O-CB 3.47Å; G930-I977 PolarHBondContact O-N 2.89Å
931	K	94.5	Very high	88.7	Confident	48 Å²	48	30.3 Å²	30.3	21%	0.209	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-80.5	116.2	178.7	-156.6	-179.1	173.4	-178.3	0	110.6	E912 T933 R973 K975 Y976	E912-K931 HydrophobicContact CB-CB 4.06Å; E912-K931 HydrophobicContact CG-CB 3.81Å; E912-K931 WeakPolarHBondContact OE1-CD 3.42Å; K931-T933 PolarHBondContact O-N 3.24Å; K931-T933 PolarHBondContact O-OG1 3.49Å; K931-R973 WeakPolarHBondContact CE-O 3.31Å; K931-R973 WeakPolarHBondContact CG-O 3.11Å; K931-K975 CarbonylContact C-O 3.23Å; K931-K975 WeakPolarHBondContact CA-O 3.49Å; K931-Y976 HydrophobicContact CB-CD1 4.11Å; K931-Y976 HydrophobicContact CB-CE1 3.82Å; K931-Y976 HydrophobicContact CD-CE1 4.46Å; K931-Y976 HydrophobicContact CD-CE2 4.45Å; K931-Y976 HydrophobicContact CG-CD1 4.43Å; K931-Y976 HydrophobicContact CG-CE1 4.13Å; K931-Y976 HydrophobicContact CG-CE2 4.31Å
932	G	91.9	Very high	87.2	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.193	C	C	.	.	S	Bend	trans	61.5	-18.5	-174.5	0	0	0	0	0	117.1	G930 C970 L971 Q972 K975	G930-G932 PolarHBondContact O-N 3.36Å; G932-C970 PolarHBondContact O-N 3.33Å; G932-L971 WeakPolarHBondContact CA-O 3.31Å; G932-L971 PolarHBondContact O-N 3.27Å; G932-L971 VanDerWaalsContact O-N 3.09Å; G932-Q972 WeakPolarHBondContact CA-O 3.41Å; G932-K975 PolarHBondContact N-O 3.41Å
933	T	95	Very high	85.4	Confident	23 Å²	23	33.2 Å²	33.2	14%	0.141	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	135.3	-158.3	51.5	0	0	0	0	113.7	H910 G930 K931 L968 I977	H910-T933 PolarHBondContact NE2-O 3.43Å; G930-T933 PolarHBondContact N-O 3.15Å; K931-T933 PolarHBondContact O-N 3.24Å; K931-T933 PolarHBondContact O-OG1 3.49Å; T933-L968 VanDerWaalsContact CA-O 3.3Å; T933-L968 WeakPolarHBondContact CA-O 3.38Å; T933-I977 VanDerWaalsContact C-CD1 3.47Å
934	V	96.6	Very high	83.1	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	124	165.6	-176.2	0	0	0	0	108.6	Y927 T928 S967 L968 I977 I980 L989 V991	Y927-V934 HydrophobicContact CD1-CG1 4.09Å; Y927-V934 HydrophobicContact CG-CG1 4.49Å; T928-V934 WeakPolarHBondContact O-CA 3.35Å; V934-S967 CarbonylContact O-C 3.59Å; V934-S967 WeakPolarHBondContact O-CA 3.21Å; V934-L968 HydrophobicContact CB-CB 4.26Å; V934-L968 HydrophobicContact CB-CD1 4.42Å; V934-L968 HydrophobicContact CB-CG 4.44Å; V934-L968 PolarHBondContact N-O 3.41Å; V934-L968 PolarHBondContact O-N 3.49Å; V934-I977 HydrophobicContact CG2-CD1 3.49Å; V934-I977 VanDerWaalsContact CG2-CD1 3.49Å; V934-I980 HydrophobicContact CB-CD1 4.39Å; V934-I980 HydrophobicContact CG1-CD1 3.85Å; V934-I980 HydrophobicContact CG2-CD1 3.67Å; V934-I980 HydrophobicContact CG2-CG1 4.35Å; V934-L989 HydrophobicContact CG1-CD2 4.39Å; V934-V991 HydrophobicContact CG2-CG1 4.08Å; V934-V991 HydrophobicContact CG2-CG2 4.01Å
935	K	95.2	Very high	80.7	Confident	47 Å²	47	40 Å²	40	20%	0.204	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	139.7	171.3	-73.1	-175.8	-179.6	175.9	0	111	H910 Y927 T928 W937 C964	H910-K935 WeakPolarHBondContact ND1-CD 3.39Å; H910-K935 PolarHBondContact O-NZ 2.83Å; Y927-K935 WeakPolarHBondContact CA-O 3.44Å; T928-K935 PolarHBondContact N-O 2.98Å; T928-K935 PolarHBondContact O-N 3.5Å; K935-W937 HydrophobicContact CB-CZ2 3.85Å; K935-W937 HydrophobicContact CD-CH2 4.3Å; K935-W937 HydrophobicContact CD-CZ2 3.83Å; K935-W937 PolarHBondContact O-NE1 2.95Å; K935-C964 HydrophobicContact CD-CB 4.38Å
936	L	93.9	Very high	77.9	Confident	13 Å²	13	46 Å²	46	7%	0.068	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	129.3	177.6	-177.1	57	0	0	0	110.6	Q925 Y927 I965 T966	Q925-L936 HydrophobicContact CB-CD1 3.78Å; Q925-L936 HydrophobicContact CG-CD1 4.33Å; Y927-L936 HydrophobicContact CD1-CD1 3.92Å; Y927-L936 HydrophobicContact CD2-CD1 4.07Å; Y927-L936 HydrophobicContact CE1-CD1 3.55Å; Y927-L936 HydrophobicContact CE1-CD2 4.46Å; Y927-L936 HydrophobicContact CE1-CG 4.47Å; Y927-L936 HydrophobicContact CE2-CD1 3.67Å; Y927-L936 HydrophobicContact CG-CD1 4.16Å; L936-I965 HydrophobicContact CD2-CD1 4.44Å; L936-I965 HydrophobicContact CG-CD1 4.13Å; L936-I965 PolarHBondContact O-N 3.38Å; L936-T966 HydrophobicContact CB-CG2 3.8Å; L936-T966 HydrophobicContact CD2-CG2 3.82Å; L936-T966 HydrophobicContact CG-CG2 4.37Å; L936-T966 PolarHBondContact N-O 3.03Å
937	W	92.7	Very high	74.8	Confident	5 Å²	5	50.3 Å²	50.3	2%	0.019	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	138.1	179.9	-41	83	0	0	0	108.7	L908 D909 Q925 I926 T928 K935 K962 C964	L908-W937 HydrophobicContact CB-CD2 3.97Å; L908-W937 HydrophobicContact CB-CE3 4.2Å; L908-W937 HydrophobicContact CB-CG 4.45Å; L908-W937 HydrophobicContact CB-CH2 4.33Å; L908-W937 HydrophobicContact CB-CZ2 4.1Å; L908-W937 HydrophobicContact CB-CZ3 4.37Å; L908-W937 HydrophobicContact CD1-CB 4.31Å; L908-W937 HydrophobicContact CD1-CD2 4.35Å; L908-W937 HydrophobicContact CD1-CG 3.96Å; L908-W937 HydrophobicContact CD2-CB 4.14Å; L908-W937 HydrophobicContact CD2-CD2 4.01Å; L908-W937 HydrophobicContact CD2-CE3 3.98Å; L908-W937 HydrophobicContact CD2-CG 4.08Å; L908-W937 HydrophobicContact CG-CD2 4.33Å; L908-W937 HydrophobicContact CG-CG 4.39Å; D909-W937 WeakPolarHBondContact O-CH2 3.46Å; Q925-W937 CarbonylContact C-O 3.57Å; Q925-W937 VanDerWaalsContact CA-O 3.22Å; Q925-W937 WeakPolarHBondContact CA-O 3.3Å; I926-W937 HydrophobicContact CB-CB 4.46Å; I926-W937 PolarHBondContact N-O 3.31Å; I926-W937 PolarHBondContact O-N 2.86Å; T928-W937 PolarHBondContact OG1-NE1 3.27Å; K935-W937 HydrophobicContact CB-CZ2 3.85Å; K935-W937 HydrophobicContact CD-CH2 4.3Å; K935-W937 HydrophobicContact CD-CZ2 3.83Å; K935-W937 PolarHBondContact O-NE1 2.95Å; W937-K962 HydrophobicContact CE3-CB 4.31Å; W937-K962 VanDerWaalsContact CZ3-O 3.3Å; W937-K962 WeakPolarHBondContact CZ3-O 3.48Å; W937-C964 HydrophobicContact CD2-CB 4.35Å; W937-C964 HydrophobicContact CE3-CB 3.92Å; W937-C964 HydrophobicContact CH2-CB 3.87Å; W937-C964 HydrophobicContact CZ2-CB 4.3Å; W937-C964 HydrophobicContact CZ3-CB 3.67Å
938	D	87.9	Confident	71.7	Confident	25 Å²	25	56.7 Å²	56.7	13%	0.134	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.3	175.8	163.1	45.6	0	0	0	110	Q925 N940 S941 K962 I965	Q925-D938 HydrophobicContact CG-CB 4.08Å; D938-N940 VanDerWaalsContact C-N 3.29Å; D938-N940 PolarHBondContact O-N 2.92Å; D938-N940 WeakPolarHBondContact OD1-CB 3.4Å; D938-N940 PolarHBondContact OD1-N 3.15Å; D938-N940 PolarHBondContact OD1-ND2 3.07Å; D938-S941 PolarHBondContact O-OG 2.97Å; D938-S941 WeakPolarHBondContact OD2-CA 3.44Å; D938-S941 WeakPolarHBondContact OD2-CB 3.4Å; D938-S941 PolarHBondContact OD2-N 3.33Å; D938-S941 PolarHBondContact OD2-OG 2.79Å; D938-K962 WeakPolarHBondContact O-CE 3.4Å; D938-K962 PolarHBondContact O-NZ 3.37Å; D938-I965 HydrophobicContact CB-CD1 3.42Å; D938-I965 VanDerWaalsContact CB-CD1 3.42Å; D938-I965 HydrophobicContact CB-CG1 4.3Å
939	L	82.5	Confident	68.5	Low	26 Å²	26	63.2 Å²	63.2	14%	0.136	36%	0.363	C	S	.	.	S	Bend	trans	-71.2	-23.9	178.2	-63.4	-176.7	0	0	0	112.8	H924 I926 K962 L1197 V1209	H924-L939 HydrophobicContact CB-CB 4.34Å; H924-L939 WeakPolarHBondContact O-CB 3.29Å; H924-L939 VanDerWaalsContact O-CG 3.32Å; H924-L939 WeakPolarHBondContact O-CG 3.47Å; H924-L939 PolarHBondContact O-N 3.26Å; I926-L939 HydrophobicContact CD1-CD1 4.03Å; I926-L939 HydrophobicContact CD1-CD2 3.84Å; I926-L939 HydrophobicContact CD1-CG 4.05Å; L939-K962 PolarHBondContact O-NZ 3.41Å; L939-L1197 HydrophobicContact CD1-CD1 3.64Å; L939-V1209 HydrophobicContact CD1-CG1 4.38Å; L939-V1209 HydrophobicContact CD2-CG1 4.47Å
940	N	76.7	Confident	65.3	Low	98 Å²	98	69 Å²	69	52%	0.524	40%	0.402	S	S	.	.	S	Bend	trans	-79.3	-25	-177.6	-52.9	-67.9	0	0	0	113.7	T923 D938 T942	T923-N940 PolarHBondContact O-ND2 2.95Å; D938-N940 VanDerWaalsContact C-N 3.29Å; D938-N940 PolarHBondContact O-N 2.92Å; D938-N940 WeakPolarHBondContact OD1-CB 3.4Å; D938-N940 PolarHBondContact OD1-N 3.15Å; D938-N940 PolarHBondContact OD1-ND2 3.07Å; N940-T942 PolarHBondContact O-N 3.45Å
941	S	62.9	Low	62.2	Low	39 Å²	39	74.9 Å²	74.9	27%	0.273	44%	0.442	S	S	.	.			trans	-63	91.2	179.9	56.4	0	0	0	0	113	D938 T943 K962	D938-S941 PolarHBondContact O-OG 2.97Å; D938-S941 WeakPolarHBondContact OD2-CA 3.44Å; D938-S941 WeakPolarHBondContact OD2-CB 3.4Å; D938-S941 PolarHBondContact OD2-N 3.33Å; D938-S941 PolarHBondContact OD2-OG 2.79Å; S941-T943 PolarHBondContact O-N 3.42Å; S941-K962 PolarHBondContact O-NZ 2.85Å; S941-K962 PolarHBondContact OG-NZ 3.5Å
942	T	48.8	Very low	59.1	Low	129 Å²	129	75.7 Å²	75.7	79%	0.791	47%	0.465	S	S	*	.			trans	-70.4	106.8	169.9	50.8	0	0	0	0	109.3	N940 S944	N940-T942 PolarHBondContact O-N 3.45Å; T942-S944 PolarHBondContact O-N 3.26Å
943	T	42.9	Very low	56.2	Low	78 Å²	78	81.7 Å²	81.7	48%	0.479	51%	0.507	S	S	.	.			trans	-60.8	106.9	179.4	-47.2	0	0	0	0	110.1	S941 N945	S941-T943 PolarHBondContact O-N 3.42Å; T943-N945 PolarHBondContact O-N 3.47Å
944	S	31.3	Very low	53.1	Low	110 Å²	110	85.3 Å²	85.3	77%	0.769	53%	0.533	S	S	*	.	S	Bend	trans	-76	31.3	-167.2	63.9	0	0	0	0	115.1	T942	T942-S944 PolarHBondContact O-N 3.26Å
945	N	31.4	Very low	50	Low	148 Å²	148	91.4 Å²	91.4	79%	0.791	58%	0.575	S	S	*	*			trans	-112.8	20.2	-177.3	-76.3	-9.7	0	0	0	113.1	T943	T943-N945 PolarHBondContact O-N 3.47Å
946	Q	33.1	Very low	47	Very low	172 Å²	172	97 Å²	97	80%	0.804	60%	0.602	S	S	*	*	S	Bend	trans	-107.6	129	161.3	-66.3	-170.5	6.2	0	0	109.1
947	S	28.1	Very low	44.4	Very low	91 Å²	91	100.5 Å²	100.5	64%	0.636	63%	0.628	S	S	*	*			trans	-72.9	148.3	178.9	50.7	0	0	0	0	110.9	N949	S947-N949 PolarHBondContact O-N 3.02Å
948	P	31.5	Very low	42.4	Very low	139 Å²	139	107.3 Å²	107.3	90%	0.903	66%	0.663	S	S	*	*	S	Bend	trans	-77.6	32.7	-173	34	-38.6	0	0	0	113.5
949	N	29.6	Very low	41.1	Very low	137 Å²	137	109.8 Å²	109.8	73%	0.733	68%	0.676	S	S	*	*			trans	-129	45.9	-166	-155.8	28.5	0	0	0	113.1	S947	S947-N949 PolarHBondContact O-N 3.02Å
950	C	31.1	Very low	40.3	Very low	122 Å²	122	111.4 Å²	111.4	82%	0.824	69%	0.687	S	S	*	*			trans	-136.6	43.6	173.6	-80.9	0	0	0	0	111.5	G952	C950-G952 VanDerWaalsContact C-N 3.28Å; C950-G952 PolarHBondContact O-N 2.93Å
951	S	29.7	Very low	39.8	Very low	122 Å²	122	111.2 Å²	111.2	85%	0.853	69%	0.686	S	S	*	*			trans	-76	72.9	176.9	58.3	0	0	0	0	111.9
952	G	29.2	Very low	40.4	Very low	66 Å²	66	110.2 Å²	110.2	68%	0.68	68%	0.677	S	S	*	*			trans	154.3	85.1	171.7	0	0	0	0	0	115.5	C950	C950-G952 VanDerWaalsContact C-N 3.28Å; C950-G952 PolarHBondContact O-N 2.93Å
953	S	30.3	Very low	41.4	Very low	125 Å²	125	108.3 Å²	108.3	87%	0.874	67%	0.665	S	S	*	*			trans	-159.9	155.6	155.1	-85	0	0	0	0	111.1
954	S	30.6	Very low	43.2	Very low	100 Å²	100	106.7 Å²	106.7	70%	0.699	66%	0.656	S	S	*	*			trans	-58.6	154.1	-170.6	48.8	0	0	0	0	115.7	Q956	S954-Q956 PolarHBondContact O-N 3.38Å
955	S	31.2	Very low	45.7	Very low	127 Å²	127	105.9 Å²	105.9	89%	0.888	64%	0.642	S	S	*	*			trans	-62.6	90	174.5	53.7	0	0	0	0	113.6
956	Q	32.7	Very low	48.3	Very low	165 Å²	165	101 Å²	101	77%	0.771	62%	0.618	S	S	*	*			trans	-115.7	136.6	156.2	-75	-175.9	-27.1	0	0	108.7	S954 I958	S954-Q956 PolarHBondContact O-N 3.38Å; Q956-I958 PolarHBondContact O-N 2.92Å
957	S	38.9	Very low	50.9	Low	87 Å²	87	95.6 Å²	95.6	61%	0.608	60%	0.599	S	S	*	*			trans	-76.6	88.5	-178.8	54.1	0	0	0	0	110.9	I959	S957-I959 PolarHBondContact O-N 3.42Å
958	I	49.2	Very low	54	Low	147 Å²	147	91.5 Å²	91.5	75%	0.754	57%	0.57	S	S	*	*			trans	-65.4	104.9	166.4	-58.4	175.3	0	0	0	107.3	Q956 T960	Q956-I958 PolarHBondContact O-N 2.92Å; I958-T960 PolarHBondContact O-N 3.01Å
959	I	61.4	Low	56.9	Low	77 Å²	77	89.3 Å²	89.3	40%	0.395	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-61.4	124.9	170.1	-60.2	174.3	0	0	0	107	A904 C907 S957	A904-I959 HydrophobicContact CB-CD1 3.91Å; A904-I959 HydrophobicContact CB-CG1 4.32Å; C907-I959 HydrophobicContact CB-CG2 3.96Å; S957-I959 PolarHBondContact O-N 3.42Å
960	T	66	Low	59.7	Low	60 Å²	60	83.2 Å²	83.2	37%	0.368	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	120	-175.8	49.5	0	0	0	0	111	I905 H906 C907 I958 K962	I905-T960 PolarHBondContact O-N 3.06Å; I905-T960 VanDerWaalsContact O-N 3.11Å; I905-T960 PolarHBondContact O-OG1 2.89Å; H906-T960 WeakPolarHBondContact CA-O 3.35Å; H906-T960 PolarHBondContact CE1-OG1 3.45Å; H906-T960 PolarHBondContact ND1-O 3.16Å; H906-T960 PolarHBondContact ND1-OG1 3.25Å; C907-T960 PolarHBondContact N-O 2.93Å; I958-T960 PolarHBondContact O-N 3.01Å; T960-K962 PolarHBondContact O-N 3.43Å
961	N	65.6	Low	62.5	Low	94 Å²	94	78 Å²	78	50%	0.503	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	123.5	175.8	-64	34.9	0	0	0	109.2	C907 D909	C907-N961 WeakPolarHBondContact O-CA 3.42Å; D909-N961 PolarHBondContact OD2-ND2 3.06Å
962	K	74.9	Confident	65.2	Low	19 Å²	19	77.9 Å²	77.9	8%	0.083	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-87.9	148.6	178.7	-78.8	-79.9	-171.3	158.8	0	110.8	C907 L908 W937 D938 L939 S941 T960	C907-K962 PolarHBondContact O-N 3.38Å; L908-K962 HydrophobicContact CD2-CB 3.74Å; L908-K962 HydrophobicContact CD2-CG 4.18Å; W937-K962 HydrophobicContact CE3-CB 4.31Å; W937-K962 VanDerWaalsContact CZ3-O 3.3Å; W937-K962 WeakPolarHBondContact CZ3-O 3.48Å; D938-K962 WeakPolarHBondContact O-CE 3.4Å; D938-K962 PolarHBondContact O-NZ 3.37Å; L939-K962 PolarHBondContact O-NZ 3.41Å; S941-K962 PolarHBondContact O-NZ 2.85Å; S941-K962 PolarHBondContact OG-NZ 3.5Å; T960-K962 PolarHBondContact O-N 3.43Å
963	T	71.6	Confident	67.9	Low	88 Å²	88	83 Å²	83	54%	0.54	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-82.3	131.8	167.9	48.6	0	0	0	0	110.7	I965	T963-I965 PolarHBondContact O-N 3.3Å
964	C	80.8	Confident	70.7	Confident	44 Å²	44	79.2 Å²	79.2	30%	0.297	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-61.1	130.7	168.9	173.5	0	0	0	0	110.1	K935 W937 T966	K935-C964 HydrophobicContact CD-CB 4.38Å; W937-C964 HydrophobicContact CD2-CB 4.35Å; W937-C964 HydrophobicContact CE3-CB 3.92Å; W937-C964 HydrophobicContact CH2-CB 3.87Å; W937-C964 HydrophobicContact CZ2-CB 4.3Å; W937-C964 HydrophobicContact CZ3-CB 3.67Å; C964-T966 PolarHBondContact SG-O 3Å
965	I	83	Confident	73.7	Confident	93 Å²	93	76.2 Å²	76.2	48%	0.477	41%	0.408	S	S	.	.			trans	-76.5	-48.8	178.3	-46.1	171.4	0	0	0	110.4	L936 D938 T963	L936-I965 HydrophobicContact CD2-CD1 4.44Å; L936-I965 HydrophobicContact CG-CD1 4.13Å; L936-I965 PolarHBondContact O-N 3.38Å; D938-I965 HydrophobicContact CB-CD1 3.42Å; D938-I965 VanDerWaalsContact CB-CD1 3.42Å; D938-I965 HydrophobicContact CB-CG1 4.3Å; T963-I965 PolarHBondContact O-N 3.3Å
966	T	85.8	Confident	76.8	Confident	47 Å²	47	71.4 Å²	71.4	29%	0.288	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	154.5	-174.3	-177.3	0	0	0	0	110.6	L936 C964 L968 P1008	L936-T966 HydrophobicContact CB-CG2 3.8Å; L936-T966 HydrophobicContact CD2-CG2 3.82Å; L936-T966 HydrophobicContact CG-CG2 4.37Å; L936-T966 PolarHBondContact N-O 3.03Å; C964-T966 PolarHBondContact SG-O 3Å; T966-L968 HydrophobicContact CG2-CD2 4.38Å; T966-P1008 HydrophobicContact CG2-CG 4.01Å
967	S	88.8	Confident	79.9	Confident	58 Å²	58	63.5 Å²	63.5	41%	0.406	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	119.5	-177.8	-178.1	0	0	0	0	109.4	V934	V934-S967 CarbonylContact O-C 3.59Å; V934-S967 WeakPolarHBondContact O-CA 3.21Å
968	L	91.7	Very high	82.6	Confident	5 Å²	5	63.1 Å²	63.1	3%	0.026	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	111.2	-179.2	-41.2	-176.5	0	0	0	108.6	T933 V934 T966 C970 L989 W1001 P1008	T933-L968 VanDerWaalsContact CA-O 3.3Å; T933-L968 WeakPolarHBondContact CA-O 3.38Å; V934-L968 HydrophobicContact CB-CB 4.26Å; V934-L968 HydrophobicContact CB-CD1 4.42Å; V934-L968 HydrophobicContact CB-CG 4.44Å; V934-L968 PolarHBondContact N-O 3.41Å; V934-L968 PolarHBondContact O-N 3.49Å; T966-L968 HydrophobicContact CG2-CD2 4.38Å; L968-C970 VanDerWaalsContact CB-SG 3.57Å; L968-C970 PolarHBondContact O-N 2.94Å; L968-C970 VanDerWaalsContact O-N 3.1Å; L968-C970 PolarHBondContact O-SG 3.26Å; L968-L989 HydrophobicContact CD1-CD2 3.92Å; L968-W1001 HydrophobicContact CB-CD2 4.34Å; L968-W1001 HydrophobicContact CB-CE3 4.29Å; L968-W1001 HydrophobicContact CB-CH2 3.95Å; L968-W1001 HydrophobicContact CB-CZ2 3.98Å; L968-W1001 HydrophobicContact CB-CZ3 4.09Å; L968-W1001 HydrophobicContact CD1-CD2 4.15Å; L968-W1001 HydrophobicContact CD1-CE3 4.14Å; L968-W1001 HydrophobicContact CD1-CG 4.42Å; L968-W1001 HydrophobicContact CD2-CE3 4.13Å; L968-W1001 HydrophobicContact CD2-CZ3 3.98Å; L968-W1001 HydrophobicContact CG-CE3 4.41Å; L968-W1001 HydrophobicContact CG-CZ3 4.45Å; L968-P1008 HydrophobicContact CD2-CB 3.86Å; L968-P1008 HydrophobicContact CD2-CG 3.35Å
969	E	91.9	Very high	84.9	Confident	93 Å²	93	56.9 Å²	56.9	44%	0.435	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	94.5	172.1	-172.2	165.5	162.1	0	0	109.2	R973 W1001	E969-R973 VanDerWaalsContact CD-NH2 3.26Å; E969-R973 WeakPolarHBondContact OE1-CG 3.05Å; E969-R973 IonicContact OE1-CZ 2.66Å; E969-R973 IonicContact OE1-NE 2.67Å; E969-R973 PolarHBondContact OE1-NE 2.93Å; E969-R973 IonicContact OE1-NH2 3.21Å; E969-R973 PolarHBondContact OE1-NH2 2.99Å; E969-R973 IonicContact OE2-CZ 2.75Å; E969-R973 IonicContact OE2-NE 2.75Å; E969-R973 PolarHBondContact OE2-NE 3.31Å; E969-R973 IonicContact OE2-NH2 2.78Å; E969-R973 PolarHBondContact OE2-NH2 3.02Å; E969-W1001 WeakPolarHBondContact O-CZ2 3.44Å
970	C	89	Confident	86.5	Confident	9 Å²	9	53.3 Å²	53.3	6%	0.061	27%	0.271	C	S	.	.			trans	-95.9	-28.7	-169.1	-62.3	0	0	0	0	113.1	G932 L968 I977 V991 S999 W1001	G932-C970 PolarHBondContact O-N 3.33Å; L968-C970 VanDerWaalsContact CB-SG 3.57Å; L968-C970 PolarHBondContact O-N 2.94Å; L968-C970 VanDerWaalsContact O-N 3.1Å; L968-C970 PolarHBondContact O-SG 3.26Å; C970-I977 HydrophobicContact CB-CD1 4.2Å; C970-V991 HydrophobicContact CB-CB 4.31Å; C970-V991 HydrophobicContact CB-CG1 3.85Å; C970-S999 WeakPolarHBondContact O-CB 3.49Å; C970-S999 PolarHBondContact O-OG 2.75Å; C970-W1001 PolarHBondContact SG-NE1 3.24Å
971	L	89.4	Confident	88	Confident	13 Å²	13	53.8 Å²	53.8	7%	0.068	27%	0.267	C	S	.	.	S	Bend	trans	-140.4	169.5	-178.2	-63.8	179.1	0	0	0	109.2	G932 R973 I977	G932-L971 WeakPolarHBondContact CA-O 3.31Å; G932-L971 PolarHBondContact O-N 3.27Å; G932-L971 VanDerWaalsContact O-N 3.09Å; L971-R973 PolarHBondContact O-N 3.35Å; L971-I977 HydrophobicContact CD1-CG1 3.98Å; L971-I977 HydrophobicContact CG-CG1 4.49Å
972	Q	86.5	Confident	89.3	Confident	119 Å²	119	50.4 Å²	50.4	56%	0.556	25%	0.249	S	C	*	.			trans	-54.1	138.1	172.7	-64.2	173.8	-26.5	0	0	111.1	G932 D974 K975	G932-Q972 WeakPolarHBondContact CA-O 3.41Å; Q972-D974 VanDerWaalsContact CB-OD1 3.25Å; Q972-D974 WeakPolarHBondContact CB-OD1 3.05Å; Q972-D974 PolarHBondContact O-N 3.44Å; Q972-K975 HydrophobicContact CB-CG 4.14Å; Q972-K975 PolarHBondContact O-N 3.02Å; Q972-K975 VanDerWaalsContact OE1-CE 3.24Å
973	R	86.2	Confident	90.2	Very high	174 Å²	174	49.9 Å²	49.9	66%	0.657	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	2.2	-172	-54.8	-169.9	-168	108.7	5.7	115.5	K931 E969 L971	K931-R973 WeakPolarHBondContact CE-O 3.31Å; K931-R973 WeakPolarHBondContact CG-O 3.11Å; E969-R973 VanDerWaalsContact CD-NH2 3.26Å; E969-R973 WeakPolarHBondContact OE1-CG 3.05Å; E969-R973 IonicContact OE1-CZ 2.66Å; E969-R973 IonicContact OE1-NE 2.67Å; E969-R973 PolarHBondContact OE1-NE 2.93Å; E969-R973 IonicContact OE1-NH2 3.21Å; E969-R973 PolarHBondContact OE1-NH2 2.99Å; E969-R973 IonicContact OE2-CZ 2.75Å; E969-R973 IonicContact OE2-NE 2.75Å; E969-R973 PolarHBondContact OE2-NE 3.31Å; E969-R973 IonicContact OE2-NH2 2.78Å; E969-R973 PolarHBondContact OE2-NH2 3.02Å; L971-R973 PolarHBondContact O-N 3.35Å
974	D	90.4	Very high	91	Very high	45 Å²	45	52.2 Å²	52.2	24%	0.241	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-21	173.5	71.2	-49.1	0	0	0	113.8	Q972	Q972-D974 VanDerWaalsContact CB-OD1 3.25Å; Q972-D974 WeakPolarHBondContact CB-OD1 3.05Å; Q972-D974 PolarHBondContact O-N 3.44Å
975	K	92.9	Very high	91.2	Very high	36 Å²	36	54.2 Å²	54.2	16%	0.157	26%	0.26	C	S	.	.	S	Bend	trans	-91.1	145.1	-176.3	-47.5	-52.5	-177	-155.2	0	111.9	K931 G932 Q972 E994	K931-K975 CarbonylContact C-O 3.23Å; K931-K975 WeakPolarHBondContact CA-O 3.49Å; G932-K975 PolarHBondContact N-O 3.41Å; Q972-K975 HydrophobicContact CB-CG 4.14Å; Q972-K975 PolarHBondContact O-N 3.02Å; Q972-K975 VanDerWaalsContact OE1-CE 3.24Å; K975-E994 HydrophobicContact CB-CB 4.03Å; K975-E994 VanDerWaalsContact CD-O 3.29Å; K975-E994 WeakPolarHBondContact CD-O 3.27Å; K975-E994 VanDerWaalsContact CG-O 3.28Å; K975-E994 WeakPolarHBondContact CG-O 3.48Å
976	Y	95.7	Very high	91.4	Very high	26 Å²	26	50.3 Å²	50.3	10%	0.102	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-84.9	139.7	169.9	-71.9	-87.5	0	0	0	112.6	V292 V913 K931 G993 E994	V292-Y976 HydrophobicContact CG1-CE2 4.43Å; V292-Y976 HydrophobicContact CG2-CD2 3.65Å; V292-Y976 HydrophobicContact CG2-CE2 3.81Å; V913-Y976 HydrophobicContact CB-CE1 3.9Å; K931-Y976 HydrophobicContact CB-CD1 4.11Å; K931-Y976 HydrophobicContact CB-CE1 3.82Å; K931-Y976 HydrophobicContact CD-CE1 4.46Å; K931-Y976 HydrophobicContact CD-CE2 4.45Å; K931-Y976 HydrophobicContact CG-CD1 4.43Å; K931-Y976 HydrophobicContact CG-CE1 4.13Å; K931-Y976 HydrophobicContact CG-CE2 4.31Å; Y976-G993 WeakPolarHBondContact O-CA 3.36Å; Y976-E994 PolarHBondContact N-OE2 3.06Å; Y976-E994 PolarHBondContact O-N 3.05Å
977	I	97.2	Very high	91.5	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	130.8	162.5	-64.5	173.8	0	0	0	107.5	C915 A916 G930 T933 V934 C970 L971 I980 V991	C915-I977 WeakPolarHBondContact CB-O 3.47Å; A916-I977 HydrophobicContact CB-CG2 4.42Å; G930-I977 WeakPolarHBondContact O-CB 3.47Å; G930-I977 PolarHBondContact O-N 2.89Å; T933-I977 VanDerWaalsContact C-CD1 3.47Å; V934-I977 HydrophobicContact CG2-CD1 3.49Å; V934-I977 VanDerWaalsContact CG2-CD1 3.49Å; C970-I977 HydrophobicContact CB-CD1 4.2Å; L971-I977 HydrophobicContact CD1-CG1 3.98Å; L971-I977 HydrophobicContact CG-CG1 4.49Å; I977-I980 HydrophobicContact CG2-CD1 4.11Å; I977-I980 HydrophobicContact CG2-CG1 3.72Å; I977-V991 HydrophobicContact CB-CG1 4.47Å; I977-V991 HydrophobicContact CD1-CG1 3.82Å; I977-V991 HydrophobicContact CG1-CG1 4.01Å; I977-V991 HydrophobicContact CG2-CG1 3.68Å
978	R	96.5	Very high	91.7	Very high	79 Å²	79	53.1 Å²	53.1	30%	0.298	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	-22.2	-175.1	-57.3	-60.7	-64.1	-98.5	-7.6	112.9	G992 E994 Y1022	R978-G992 PolarHBondContact N-O 2.88Å; R978-E994 HydrophobicContact CG-CG 4.03Å; R978-E994 IonicContact CZ-OE1 3.7Å; R978-E994 IonicContact NH1-OE1 2.77Å; R978-E994 PolarHBondContact NH1-OE1 3.3Å; R978-Y1022 WeakPolarHBondContact CB-O 3.47Å
979	S	96.8	Very high	91.8	Very high	15 Å²	15	52.9 Å²	52.9	11%	0.105	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	144.9	174.7	-149.6	0	0	0	0	111.9	G992 L1024	S979-G992 PolarHBondContact N-O 2.86Å; S979-G992 PolarHBondContact O-N 3.47Å; S979-L1024 PolarHBondContact OG-N 3.42Å
980	I	96.6	Very high	92	Very high	3 Å²	3	48.5 Å²	48.5	2%	0.015	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	132.9	174.7	-56.2	173.7	0	0	0	106.6	A916 T918 V934 I977 L989 V990 V991	A916-I980 HydrophobicContact CB-CD1 4.16Å; A916-I980 HydrophobicContact CB-CG1 3.99Å; T918-I980 HydrophobicContact CG2-CB 4.13Å; T918-I980 HydrophobicContact CG2-CG2 3.63Å; V934-I980 HydrophobicContact CB-CD1 4.39Å; V934-I980 HydrophobicContact CG1-CD1 3.85Å; V934-I980 HydrophobicContact CG2-CD1 3.67Å; V934-I980 HydrophobicContact CG2-CG1 4.35Å; I977-I980 HydrophobicContact CG2-CD1 4.11Å; I977-I980 HydrophobicContact CG2-CG1 3.72Å; I980-L989 HydrophobicContact CG2-CD1 3.46Å; I980-L989 VanDerWaalsContact CG2-CD1 3.46Å; I980-L989 HydrophobicContact CG2-CD2 4.17Å; I980-L989 HydrophobicContact CG2-CG 3.84Å; I980-V990 WeakPolarHBondContact CA-O 3.49Å; I980-V991 HydrophobicContact CG1-CG1 4.48Å; I980-V991 HydrophobicContact CG2-CG2 4.48Å
981	K	95.8	Very high	92.4	Very high	69 Å²	69	48 Å²	48	30%	0.3	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	142.2	170.8	-66.4	-64.8	175.3	-174.5	0	110.9	V990 L1024 V1026	K981-V990 PolarHBondContact N-O 3.44Å; K981-V990 PolarHBondContact O-N 3.35Å; K981-L1024 WeakPolarHBondContact CE-O 3.14Å; K981-L1024 HydrophobicContact CG-CB 3.98Å; K981-L1024 VanDerWaalsContact CG-O 3.32Å; K981-L1024 WeakPolarHBondContact CG-O 3.49Å; K981-V1026 HydrophobicContact CB-CG2 3.76Å
982	L	94.2	Very high	92.7	Very high	24 Å²	24	47.4 Å²	47.4	13%	0.126	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	151	169.1	-73	159.8	0	0	0	110.1	T918 N920 Y927 T988 L989 L1003	T918-L982 HydrophobicContact CG2-CD1 4.28Å; T918-L982 HydrophobicContact CG2-CG 4.37Å; N920-L982 HydrophobicContact CB-CD1 3.63Å; Y927-L982 HydrophobicContact CD2-CD1 4.28Å; Y927-L982 HydrophobicContact CE2-CD1 4.16Å; Y927-L982 HydrophobicContact CE2-CD2 4.38Å; L982-T988 WeakPolarHBondContact CA-O 3.36Å; L982-L989 HydrophobicContact CD2-CB 4.46Å; L982-L989 HydrophobicContact CD2-CD1 3.47Å; L982-L989 VanDerWaalsContact CD2-CD1 3.47Å; L982-L989 HydrophobicContact CG-CD1 3.77Å; L982-L1003 HydrophobicContact CD2-CD1 3.49Å; L982-L1003 VanDerWaalsContact CD2-CD1 3.49Å
983	T	92.6	Very high	93	Very high	8 Å²	8	41.8 Å²	41.8	5%	0.049	19%	0.186	C	C	.	.			trans	-70.7	156.8	158.9	47.2	0	0	0	0	110.7	D985 G986 T988 V1026 I1047	T983-D985 VanDerWaalsContact CB-OD1 3.32Å; T983-D985 WeakPolarHBondContact CB-OD1 3.35Å; T983-D985 PolarHBondContact O-N 3.19Å; T983-D985 VanDerWaalsContact O-N 3.15Å; T983-D985 PolarHBondContact OG1-OD1 2.92Å; T983-G986 PolarHBondContact O-N 2.96Å; T983-T988 HydrophobicContact CG2-CG2 4.44Å; T983-T988 PolarHBondContact N-O 2.76Å; T983-T988 WeakPolarHBondContact OG1-CB 3.29Å; T983-T988 PolarHBondContact OG1-N 3.31Å; T983-T988 PolarHBondContact OG1-O 2.82Å; T983-V1026 HydrophobicContact CG2-CG1 4.25Å; T983-I1047 HydrophobicContact CG2-CD1 4.37Å
984	Q	88.4	Confident	93.4	Very high	136 Å²	136	34.8 Å²	34.8	64%	0.636	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-18.4	-175.6	-63.1	-66.2	-16.4	0	0	113.7	G986 S1030	Q984-G986 VanDerWaalsContact C-N 3.3Å; Q984-S1030 WeakPolarHBondContact CB-OG 3.15Å; Q984-S1030 PolarHBondContact N-OG 2.87Å
985	D	85.7	Confident	93.6	Very high	86 Å²	86	33.5 Å²	33.5	46%	0.46	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-5.3	172.2	71.1	-12.8	0	0	0	113.7	T983 R987	T983-D985 VanDerWaalsContact CB-OD1 3.32Å; T983-D985 WeakPolarHBondContact CB-OD1 3.35Å; T983-D985 PolarHBondContact O-N 3.19Å; T983-D985 VanDerWaalsContact O-N 3.15Å; T983-D985 PolarHBondContact OG1-OD1 2.92Å; D985-R987 HydrophobicContact CB-CG 4.41Å; D985-R987 PolarHBondContact O-N 2.73Å; D985-R987 PolarHBondContact OD1-N 3.17Å; D985-R987 WeakPolarHBondContact OD2-CB 3.28Å; D985-R987 WeakPolarHBondContact OD2-CD 3.32Å
986	G	87.5	Confident	93.5	Very high	11 Å²	11	34 Å²	34	11%	0.113	16%	0.163	C	C	.	.	S	Bend	trans	69.4	7.3	-176.3	0	0	0	0	0	115	T983 Q984 L1003	T983-G986 PolarHBondContact O-N 2.96Å; Q984-G986 VanDerWaalsContact C-N 3.3Å; G986-L1003 WeakPolarHBondContact O-CD1 3.31Å
987	R	87.7	Confident	93.3	Very high	154 Å²	154	34.5 Å²	34.5	58%	0.581	17%	0.167	S	C	*	.			trans	-100.7	-13.1	-170.9	-62.2	177.5	178.8	175	-3.2	115.1	D985 L1003	D985-R987 HydrophobicContact CB-CG 4.41Å; D985-R987 PolarHBondContact O-N 2.73Å; D985-R987 PolarHBondContact OD1-N 3.17Å; D985-R987 WeakPolarHBondContact OD2-CB 3.28Å; D985-R987 WeakPolarHBondContact OD2-CD 3.32Å; R987-L1003 PolarHBondContact O-N 3.33Å
988	T	91.9	Very high	93.2	Very high	10 Å²	10	34.5 Å²	34.5	6%	0.061	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	128.3	177.5	-56.7	0	0	0	0	109.9	L982 T983 I1000 W1001 K1011 I1047	L982-T988 WeakPolarHBondContact CA-O 3.36Å; T983-T988 HydrophobicContact CG2-CG2 4.44Å; T983-T988 PolarHBondContact N-O 2.76Å; T983-T988 WeakPolarHBondContact OG1-CB 3.29Å; T983-T988 PolarHBondContact OG1-N 3.31Å; T983-T988 PolarHBondContact OG1-O 2.82Å; T988-I1000 HydrophobicContact CG2-CG2 3.39Å; T988-W1001 WeakPolarHBondContact CA-O 3.48Å; T988-K1011 HydrophobicContact CG2-CD 4.44Å; T988-K1011 PolarHBondContact OG1-NZ 3Å; T988-I1047 HydrophobicContact CG2-CG2 4.28Å
989	L	94.7	Very high	93.1	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	129.7	174.1	-165.1	77.3	0	0	0	108.7	Y927 V934 L968 I980 L982 V991 I1000 W1001 L1003	Y927-L989 HydrophobicContact CD1-CD1 3.85Å; Y927-L989 HydrophobicContact CD1-CD2 3.78Å; Y927-L989 HydrophobicContact CD1-CG 4.49Å; Y927-L989 HydrophobicContact CE1-CD1 4.14Å; Y927-L989 HydrophobicContact CE1-CD2 4.15Å; Y927-L989 HydrophobicContact CG-CD1 4.13Å; V934-L989 HydrophobicContact CG1-CD2 4.39Å; L968-L989 HydrophobicContact CD1-CD2 3.92Å; I980-L989 HydrophobicContact CG2-CD1 3.46Å; I980-L989 VanDerWaalsContact CG2-CD1 3.46Å; I980-L989 HydrophobicContact CG2-CD2 4.17Å; I980-L989 HydrophobicContact CG2-CG 3.84Å; L982-L989 HydrophobicContact CD2-CB 4.46Å; L982-L989 HydrophobicContact CD2-CD1 3.47Å; L982-L989 VanDerWaalsContact CD2-CD1 3.47Å; L982-L989 HydrophobicContact CG-CD1 3.77Å; L989-V991 HydrophobicContact CD2-CG2 3.79Å; L989-V991 HydrophobicContact CG-CG2 4.04Å; L989-I1000 CarbonylContact O-C 3.57Å; L989-I1000 WeakPolarHBondContact O-CA 3.45Å; L989-W1001 HydrophobicContact CB-CB 4.21Å; L989-W1001 PolarHBondContact N-O 3.16Å; L989-W1001 PolarHBondContact O-N 2.75Å; L989-L1003 HydrophobicContact CB-CD1 4.07Å; L989-L1003 HydrophobicContact CB-CD2 4.46Å; L989-L1003 HydrophobicContact CB-CG 4.35Å
990	V	96	Very high	93	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	125.3	171.8	-169.1	0	0	0	0	108.8	I980 K981 I1000 L1024	I980-V990 WeakPolarHBondContact CA-O 3.49Å; K981-V990 PolarHBondContact N-O 3.44Å; K981-V990 PolarHBondContact O-N 3.35Å; V990-I1000 HydrophobicContact CG1-CG1 4.38Å; V990-I1000 HydrophobicContact CG2-CG1 4.49Å; V990-L1024 HydrophobicContact CB-CD1 4.41Å; V990-L1024 HydrophobicContact CG1-CD1 3.98Å
991	V	96.9	Very high	92.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	130.8	-174.4	-176.4	0	0	0	0	109.6	V934 C970 I977 I980 L989 L998 S999	V934-V991 HydrophobicContact CG2-CG1 4.08Å; V934-V991 HydrophobicContact CG2-CG2 4.01Å; C970-V991 HydrophobicContact CB-CB 4.31Å; C970-V991 HydrophobicContact CB-CG1 3.85Å; I977-V991 HydrophobicContact CB-CG1 4.47Å; I977-V991 HydrophobicContact CD1-CG1 3.82Å; I977-V991 HydrophobicContact CG1-CG1 4.01Å; I977-V991 HydrophobicContact CG2-CG1 3.68Å; I980-V991 HydrophobicContact CG1-CG1 4.48Å; I980-V991 HydrophobicContact CG2-CG2 4.48Å; L989-V991 HydrophobicContact CD2-CG2 3.79Å; L989-V991 HydrophobicContact CG-CG2 4.04Å; V991-L998 CarbonylContact O-C 3.49Å; V991-L998 VanDerWaalsContact O-CA 3.32Å; V991-L998 WeakPolarHBondContact O-CA 3.39Å; V991-S999 PolarHBondContact N-O 2.95Å; V991-S999 PolarHBondContact O-N 2.72Å
992	G	95.5	Very high	92.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	154	178	0	0	0	0	0	111.8	R978 S979	R978-G992 PolarHBondContact N-O 2.88Å; S979-G992 PolarHBondContact N-O 2.86Å; S979-G992 PolarHBondContact O-N 3.47Å
993	G	94.8	Very high	92.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.2	-149.4	-177.9	0	0	0	0	0	114.4	Y976 S995 A1020 C1021	Y976-G993 WeakPolarHBondContact O-CA 3.36Å; G993-S995 PolarHBondContact O-N 3.15Å; G993-A1020 WeakPolarHBondContact O-CA 3.3Å; G993-C1021 CarbonylContact C-O 3.51Å; G993-C1021 WeakPolarHBondContact CA-O 3.43Å; G993-C1021 PolarHBondContact N-O 3.15Å; G993-C1021 PolarHBondContact O-N 2.98Å
994	E	94.5	Very high	91.7	Very high	28 Å²	28	32.5 Å²	32.5	13%	0.131	18%	0.175	C	C	.	.	S	Bend	trans	-77.3	48.3	-177.4	-68.2	164.7	-177.9	0	0	112.6	K975 Y976 R978	K975-E994 HydrophobicContact CB-CB 4.03Å; K975-E994 VanDerWaalsContact CD-O 3.29Å; K975-E994 WeakPolarHBondContact CD-O 3.27Å; K975-E994 VanDerWaalsContact CG-O 3.28Å; K975-E994 WeakPolarHBondContact CG-O 3.48Å; Y976-E994 PolarHBondContact N-OE2 3.06Å; Y976-E994 PolarHBondContact O-N 3.05Å; R978-E994 HydrophobicContact CG-CG 4.03Å; R978-E994 IonicContact CZ-OE1 3.7Å; R978-E994 IonicContact NH1-OE1 2.77Å; R978-E994 PolarHBondContact NH1-OE1 3.3Å
995	S	93.3	Very high	91	Very high	17 Å²	17	32.1 Å²	32.1	12%	0.119	17%	0.173	C	C	.	.	S	Bend	trans	-147.7	156.2	179	-174	0	0	0	0	109.9	G993 I997 F1016 P1019	G993-S995 PolarHBondContact O-N 3.15Å; S995-I997 PolarHBondContact O-N 2.74Å; S995-I997 VanDerWaalsContact O-N 3.15Å; S995-F1016 WeakPolarHBondContact O-CZ 3.4Å; S995-P1019 CarbonylContact C-O 3.58Å; S995-P1019 WeakPolarHBondContact CA-O 3.23Å; S995-P1019 PolarHBondContact N-O 3.48Å
996	S	91.2	Very high	90.3	Very high	46 Å²	46	33.7 Å²	33.7	32%	0.322	20%	0.198	S	C	.	.	S	Bend	trans	-80.1	22	175.7	62.6	0	0	0	0	113.6	T1015 F1016 A1018 P1019	S996-T1015 WeakPolarHBondContact O-CA 3.3Å; S996-F1016 WeakPolarHBondContact O-CD1 3.4Å; S996-F1016 PolarHBondContact O-N 2.98Å; S996-A1018 WeakPolarHBondContact CA-O 3.34Å; S996-A1018 WeakPolarHBondContact CB-O 3.47Å; S996-P1019 PolarHBondContact N-O 2.75Å
997	I	92.4	Very high	89.8	Confident	38 Å²	38	35.9 Å²	35.9	20%	0.195	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	135.4	-174.3	-62.1	174.6	0	0	0	109.5	S995 E1013 L1014 T1015	S995-I997 PolarHBondContact O-N 2.74Å; S995-I997 VanDerWaalsContact O-N 3.15Å; I997-E1013 HydrophobicContact CG2-CB 3.68Å; I997-E1013 HydrophobicContact CG2-CG 3.75Å; I997-L1014 WeakPolarHBondContact CA-O 3.34Å; I997-T1015 HydrophobicContact CG1-CG2 4.27Å
998	L	94.4	Very high	89.5	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	127.3	163	-49.7	177.5	0	0	0	109.1	V991 E1013 L1014 F1016 C1021 L1024	V991-L998 CarbonylContact O-C 3.49Å; V991-L998 VanDerWaalsContact O-CA 3.32Å; V991-L998 WeakPolarHBondContact O-CA 3.39Å; L998-E1013 CarbonylContact O-C 3.46Å; L998-E1013 WeakPolarHBondContact O-CA 3.48Å; L998-L1014 HydrophobicContact CB-CB 4.21Å; L998-L1014 PolarHBondContact N-O 3.32Å; L998-L1014 PolarHBondContact O-N 2.98Å; L998-F1016 HydrophobicContact CD2-CE1 3.71Å; L998-F1016 HydrophobicContact CD2-CZ 4.36Å; L998-F1016 HydrophobicContact CG-CD1 4.15Å; L998-F1016 HydrophobicContact CG-CE1 3.78Å; L998-C1021 HydrophobicContact CD2-CB 3.76Å; L998-L1024 HydrophobicContact CD1-CD2 4.04Å; L998-L1024 HydrophobicContact CD2-CD2 4.04Å
999	S	94.7	Very high	89.1	Confident	6 Å²	6	33.2 Å²	33.2	4%	0.042	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	116.8	-176.4	-55.6	0	0	0	0	109.7	C970 V991	C970-S999 WeakPolarHBondContact O-CB 3.49Å; C970-S999 PolarHBondContact O-OG 2.75Å; V991-S999 PolarHBondContact N-O 2.95Å; V991-S999 PolarHBondContact O-N 2.72Å
1000	I	94.2	Very high	88.7	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.015	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	128.2	179.1	-55.5	178.6	0	0	0	108.7	T988 L989 V990 K1011 S1012 L1014 I1047	T988-I1000 HydrophobicContact CG2-CG2 3.39Å; L989-I1000 CarbonylContact O-C 3.57Å; L989-I1000 WeakPolarHBondContact O-CA 3.45Å; V990-I1000 HydrophobicContact CG1-CG1 4.38Å; V990-I1000 HydrophobicContact CG2-CG1 4.49Å; I1000-K1011 HydrophobicContact CG2-CB 4.17Å; I1000-K1011 HydrophobicContact CG2-CD 4.1Å; I1000-K1011 WeakPolarHBondContact O-CA 3.47Å; I1000-K1011 WeakPolarHBondContact O-CB 3.45Å; I1000-K1011 PolarHBondContact O-N 2.66Å; I1000-S1012 WeakPolarHBondContact CA-O 3.43Å; I1000-S1012 WeakPolarHBondContact CB-O 3.47Å; I1000-S1012 PolarHBondContact N-O 2.81Å; I1000-S1012 PolarHBondContact O-N 2.67Å; I1000-L1014 HydrophobicContact CD1-CD1 3.75Å; I1000-L1014 HydrophobicContact CD1-CD2 4.25Å; I1000-L1014 HydrophobicContact CD1-CG 3.81Å; I1000-L1014 HydrophobicContact CG1-CG 4.47Å; I1000-I1047 HydrophobicContact CD1-CG2 4.46Å
1001	W	93.4	Very high	88.1	Confident	25 Å²	25	41.4 Å²	41.4	10%	0.095	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	142.1	177.8	-67.1	69.3	0	0	0	111.3	L968 E969 C970 T988 L989 P1008 H1009 P1010	L968-W1001 HydrophobicContact CB-CD2 4.34Å; L968-W1001 HydrophobicContact CB-CE3 4.29Å; L968-W1001 HydrophobicContact CB-CH2 3.95Å; L968-W1001 HydrophobicContact CB-CZ2 3.98Å; L968-W1001 HydrophobicContact CB-CZ3 4.09Å; L968-W1001 HydrophobicContact CD1-CD2 4.15Å; L968-W1001 HydrophobicContact CD1-CE3 4.14Å; L968-W1001 HydrophobicContact CD1-CG 4.42Å; L968-W1001 HydrophobicContact CD2-CE3 4.13Å; L968-W1001 HydrophobicContact CD2-CZ3 3.98Å; L968-W1001 HydrophobicContact CG-CE3 4.41Å; L968-W1001 HydrophobicContact CG-CZ3 4.45Å; E969-W1001 WeakPolarHBondContact O-CZ2 3.44Å; C970-W1001 PolarHBondContact SG-NE1 3.24Å; T988-W1001 WeakPolarHBondContact CA-O 3.48Å; L989-W1001 HydrophobicContact CB-CB 4.21Å; L989-W1001 PolarHBondContact N-O 3.16Å; L989-W1001 PolarHBondContact O-N 2.75Å; W1001-P1008 HydrophobicContact CE3-CB 4.45Å; W1001-H1009 CarbonylContact C-O 3.54Å; W1001-H1009 WeakPolarHBondContact CA-O 3.31Å; W1001-P1010 HydrophobicContact CD2-CB 4.38Å; W1001-P1010 HydrophobicContact CE3-CB 4.48Å; W1001-P1010 HydrophobicContact CH2-CB 4.32Å; W1001-P1010 HydrophobicContact CH2-CG 4.42Å; W1001-P1010 HydrophobicContact CZ2-CB 4.22Å; W1001-P1010 HydrophobicContact CZ3-CB 4.46Å; W1001-P1010 HydrophobicContact CZ3-CG 4.48Å
1002	D	90.9	Very high	87.5	Confident	42 Å²	42	42.6 Å²	42.6	23%	0.225	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	131.6	168.7	-149	-59.9	0	0	0	109.7	G1004 P1008 H1009 K1011	D1002-G1004 WeakPolarHBondContact OD1-CA 3.48Å; D1002-G1004 PolarHBondContact OD1-N 3.11Å; D1002-P1008 WeakPolarHBondContact O-CA 3.08Å; D1002-H1009 PolarHBondContact N-O 3.03Å; D1002-H1009 PolarHBondContact O-N 2.97Å; D1002-K1011 HydrophobicContact CB-CB 4.25Å; D1002-K1011 HydrophobicContact CB-CD 3.94Å; D1002-K1011 HydrophobicContact CB-CG 4.3Å; D1002-K1011 WeakPolarHBondContact OD2-CD 3.19Å; D1002-K1011 WeakPolarHBondContact OD2-CE 3.43Å; D1002-K1011 IonicContact OD2-NZ 3.29Å; D1002-K1011 PolarHBondContact OD2-NZ 2.75Å
1003	L	88.5	Confident	87.2	Confident	29 Å²	29	48.7 Å²	48.7	15%	0.152	29%	0.289	C	S	.	.			trans	-114.4	3.9	178.3	-50.7	176.1	0	0	0	111.4	Y927 L982 G986 R987 L989 Q1005 P1008	Y927-L1003 HydrophobicContact CE1-CD1 4.12Å; Y927-L1003 HydrophobicContact CE1-CD2 4.27Å; Y927-L1003 WeakPolarHBondContact OH-CD1 3.28Å; L982-L1003 HydrophobicContact CD2-CD1 3.49Å; L982-L1003 VanDerWaalsContact CD2-CD1 3.49Å; G986-L1003 WeakPolarHBondContact O-CD1 3.31Å; R987-L1003 PolarHBondContact O-N 3.33Å; L989-L1003 HydrophobicContact CB-CD1 4.07Å; L989-L1003 HydrophobicContact CB-CD2 4.46Å; L989-L1003 HydrophobicContact CB-CG 4.35Å; L1003-Q1005 PolarHBondContact O-N 2.92Å; L1003-P1008 HydrophobicContact CD2-CB 3.71Å
1004	G	79	Confident	87	Confident	50 Å²	50	48.9 Å²	48.9	52%	0.515	29%	0.29	S	S	.	.	S	Bend	trans	-74.6	3.6	179.8	0	0	0	0	0	114.9	D1002	D1002-G1004 WeakPolarHBondContact OD1-CA 3.48Å; D1002-G1004 PolarHBondContact OD1-N 3.11Å
1005	Q	74	Confident	86.7	Confident	128 Å²	128	52 Å²	52	60%	0.598	31%	0.311	S	S	*	.	S	Bend	trans	-123.9	160.5	177	-60.6	-172.9	33.7	0	0	110.3	L1003 S1007	L1003-Q1005 PolarHBondContact O-N 2.92Å; Q1005-S1007 PolarHBondContact O-N 3.4Å; Q1005-S1007 VanDerWaalsContact O-N 3.15Å
1006	A	70.7	Confident	86.4	Confident	119 Å²	119	52.3 Å²	52.3	98%	0.983	31%	0.31	S	S	*	.	S	Bend	trans	-60.3	-25.6	-178.5	0	0	0	0	0	113.7
1007	S	76.7	Confident	86	Confident	58 Å²	58	56 Å²	56	41%	0.406	33%	0.331	S	S	.	.	S	Bend	trans	-109.5	131.9	165.9	40.8	0	0	0	0	110.2	Q1005 H1009	Q1005-S1007 PolarHBondContact O-N 3.4Å; Q1005-S1007 VanDerWaalsContact O-N 3.15Å; S1007-H1009 PolarHBondContact O-CD2 3.27Å; S1007-H1009 PolarHBondContact O-NE2 3.21Å; S1007-H1009 PolarHBondContact OG-NE2 3.15Å
1008	P	82	Confident	85.8	Confident	26 Å²	26	54.3 Å²	54.3	17%	0.169	32%	0.323	C	S	.	.			trans	-71.5	135.9	174	28.7	-33.8	0	0	0	110.8	T966 L968 W1001 D1002 L1003	T966-P1008 HydrophobicContact CG2-CG 4.01Å; L968-P1008 HydrophobicContact CD2-CB 3.86Å; L968-P1008 HydrophobicContact CD2-CG 3.35Å; W1001-P1008 HydrophobicContact CE3-CB 4.45Å; D1002-P1008 WeakPolarHBondContact O-CA 3.08Å; L1003-P1008 HydrophobicContact CD2-CB 3.71Å
1009	H	83.8	Confident	85.6	Confident	81 Å²	81	58.4 Å²	58.4	38%	0.375	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	143.5	-174.5	-71.5	-65	0	0	0	112.8	W1001 D1002 S1007 K1011	W1001-H1009 CarbonylContact C-O 3.54Å; W1001-H1009 WeakPolarHBondContact CA-O 3.31Å; D1002-H1009 PolarHBondContact N-O 3.03Å; D1002-H1009 PolarHBondContact O-N 2.97Å; S1007-H1009 PolarHBondContact O-CD2 3.27Å; S1007-H1009 PolarHBondContact O-NE2 3.21Å; S1007-H1009 PolarHBondContact OG-NE2 3.15Å; H1009-K1011 PolarHBondContact O-N 3.11Å
1010	P	85.5	Confident	85.6	Confident	94 Å²	94	58.4 Å²	58.4	61%	0.61	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.9	122.9	174.8	28.5	-33.2	0	0	0	109.5	W1001	W1001-P1010 HydrophobicContact CD2-CB 4.38Å; W1001-P1010 HydrophobicContact CE3-CB 4.48Å; W1001-P1010 HydrophobicContact CH2-CB 4.32Å; W1001-P1010 HydrophobicContact CH2-CG 4.42Å; W1001-P1010 HydrophobicContact CZ2-CB 4.22Å; W1001-P1010 HydrophobicContact CZ3-CB 4.46Å; W1001-P1010 HydrophobicContact CZ3-CG 4.48Å
1011	K	83	Confident	85.7	Confident	79 Å²	79	58.3 Å²	58.3	34%	0.343	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-38.3	-171.8	-168.3	176.1	-172.2	154.7	0	111.9	T988 I1000 D1002 H1009 R1050	T988-K1011 HydrophobicContact CG2-CD 4.44Å; T988-K1011 PolarHBondContact OG1-NZ 3Å; I1000-K1011 HydrophobicContact CG2-CB 4.17Å; I1000-K1011 HydrophobicContact CG2-CD 4.1Å; I1000-K1011 WeakPolarHBondContact O-CA 3.47Å; I1000-K1011 WeakPolarHBondContact O-CB 3.45Å; I1000-K1011 PolarHBondContact O-N 2.66Å; D1002-K1011 HydrophobicContact CB-CB 4.25Å; D1002-K1011 HydrophobicContact CB-CD 3.94Å; D1002-K1011 HydrophobicContact CB-CG 4.3Å; D1002-K1011 WeakPolarHBondContact OD2-CD 3.19Å; D1002-K1011 WeakPolarHBondContact OD2-CE 3.43Å; D1002-K1011 IonicContact OD2-NZ 3.29Å; D1002-K1011 PolarHBondContact OD2-NZ 2.75Å; H1009-K1011 PolarHBondContact O-N 3.11Å; K1011-R1050 PolarHBondContact O-NH1 3.06Å
1012	S	85.4	Confident	85.8	Confident	25 Å²	25	60.1 Å²	60.1	18%	0.175	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.2	164.4	170.8	42.8	0	0	0	0	111.9	I1000 R1050	I1000-S1012 WeakPolarHBondContact CA-O 3.43Å; I1000-S1012 WeakPolarHBondContact CB-O 3.47Å; I1000-S1012 PolarHBondContact N-O 2.81Å; I1000-S1012 PolarHBondContact O-N 2.67Å; S1012-R1050 PolarHBondContact OG-NH1 3.45Å
1013	E	89.6	Confident	86.1	Confident	128 Å²	128	58.7 Å²	58.7	60%	0.598	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.4	143.6	169.3	-72.4	172.5	-162.5	0	0	110.3	I997 L998	I997-E1013 HydrophobicContact CG2-CB 3.68Å; I997-E1013 HydrophobicContact CG2-CG 3.75Å; L998-E1013 CarbonylContact O-C 3.46Å; L998-E1013 WeakPolarHBondContact O-CA 3.48Å
1014	L	89.8	Confident	86.5	Confident	5 Å²	5	57.3 Å²	57.3	3%	0.026	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	109	170.5	-55.5	-180	0	0	0	109.2	I997 L998 I1000 W1045 R1050	I997-L1014 WeakPolarHBondContact CA-O 3.34Å; L998-L1014 HydrophobicContact CB-CB 4.21Å; L998-L1014 PolarHBondContact N-O 3.32Å; L998-L1014 PolarHBondContact O-N 2.98Å; I1000-L1014 HydrophobicContact CD1-CD1 3.75Å; I1000-L1014 HydrophobicContact CD1-CD2 4.25Å; I1000-L1014 HydrophobicContact CD1-CG 3.81Å; I1000-L1014 HydrophobicContact CG1-CG 4.47Å; L1014-W1045 HydrophobicContact CB-CD2 4.41Å; L1014-W1045 HydrophobicContact CB-CE3 3.99Å; L1014-W1045 HydrophobicContact CB-CZ3 4.02Å; L1014-W1045 HydrophobicContact CD1-CB 3.83Å; L1014-W1045 HydrophobicContact CD1-CD2 3.84Å; L1014-W1045 HydrophobicContact CD1-CE3 3.79Å; L1014-W1045 HydrophobicContact CD1-CG 3.85Å; L1014-W1045 HydrophobicContact CD2-CE3 4.31Å; L1014-W1045 HydrophobicContact CG-CE3 4.26Å; L1014-R1050 HydrophobicContact CD2-CB 3.72Å; L1014-R1050 WeakPolarHBondContact CD2-O 3.31Å
1015	T	88.2	Confident	87.4	Confident	94 Å²	94	55.2 Å²	55.2	58%	0.577	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	136.3	-179.2	-41.2	0	0	0	0	111.5	S996 I997 W1045	S996-T1015 WeakPolarHBondContact O-CA 3.3Å; I997-T1015 HydrophobicContact CG1-CG2 4.27Å; T1015-W1045 WeakPolarHBondContact O-CH2 3.38Å
1016	F	86.7	Confident	88.4	Confident	22 Å²	22	50 Å²	50	10%	0.096	30%	0.299	C	S	.	.			trans	-130.6	168.2	177.9	58.1	-86.2	0	0	0	112.4	S995 S996 L998 A1018 C1021 W1045	S995-F1016 WeakPolarHBondContact O-CZ 3.4Å; S996-F1016 WeakPolarHBondContact O-CD1 3.4Å; S996-F1016 PolarHBondContact O-N 2.98Å; L998-F1016 HydrophobicContact CD2-CE1 3.71Å; L998-F1016 HydrophobicContact CD2-CZ 4.36Å; L998-F1016 HydrophobicContact CG-CD1 4.15Å; L998-F1016 HydrophobicContact CG-CE1 3.78Å; F1016-A1018 HydrophobicContact CD2-CB 3.85Å; F1016-A1018 VanDerWaalsContact CD2-O 3.31Å; F1016-A1018 WeakPolarHBondContact CD2-O 3.44Å; F1016-A1018 HydrophobicContact CE2-CB 3.97Å; F1016-A1018 WeakPolarHBondContact CE2-O 3.42Å; F1016-C1021 HydrophobicContact CE1-CB 4.28Å; F1016-C1021 HydrophobicContact CE2-CB 4.34Å; F1016-C1021 HydrophobicContact CZ-CB 3.63Å; F1016-W1045 HydrophobicContact CB-CH2 3.92Å; F1016-W1045 HydrophobicContact CB-CZ2 3.73Å; F1016-W1045 HydrophobicContact CD1-CZ2 4.47Å; F1016-W1045 HydrophobicContact CG-CZ2 4.44Å
1017	T	84.2	Confident	89.5	Confident	124 Å²	124	44.8 Å²	44.8	76%	0.761	26%	0.255	S	S	*	.	S	Bend	trans	-86.7	-11.2	-170.9	52.7	0	0	0	0	114.7
1018	A	88.4	Confident	90.2	Very high	2 Å²	2	44.9 Å²	44.9	2%	0.017	25%	0.254	C	S	.	.	S	Bend	trans	-87.7	150.6	173.8	0	0	0	0	0	110.8	S996 F1016 A1020 C1037 N1039	S996-A1018 WeakPolarHBondContact CA-O 3.34Å; S996-A1018 WeakPolarHBondContact CB-O 3.47Å; F1016-A1018 HydrophobicContact CD2-CB 3.85Å; F1016-A1018 VanDerWaalsContact CD2-O 3.31Å; F1016-A1018 WeakPolarHBondContact CD2-O 3.44Å; F1016-A1018 HydrophobicContact CE2-CB 3.97Å; F1016-A1018 WeakPolarHBondContact CE2-O 3.42Å; A1018-A1020 VanDerWaalsContact C-N 3.32Å; A1018-A1020 PolarHBondContact O-N 2.85Å; A1018-C1037 HydrophobicContact CB-CB 3.73Å; A1018-N1039 HydrophobicContact CB-CB 4.32Å
1019	P	89.8	Confident	90.6	Very high	86 Å²	86	47.7 Å²	47.7	56%	0.558	27%	0.268	S	S	*	.	S	Bend	trans	-74.9	-15.2	-177	29.2	-36	0	0	0	114.7	S995 S996 S1038	S995-P1019 CarbonylContact C-O 3.58Å; S995-P1019 WeakPolarHBondContact CA-O 3.23Å; S995-P1019 PolarHBondContact N-O 3.48Å; S996-P1019 PolarHBondContact N-O 2.75Å; P1019-S1038 WeakPolarHBondContact CD-OG 3.43Å; P1019-S1038 WeakPolarHBondContact CG-OG 3.39Å
1020	A	94.1	Very high	91	Very high	7 Å²	7	45.2 Å²	45.2	6%	0.058	26%	0.259	C	S	.	.			trans	-152.1	155.4	179.2	0	0	0	0	0	113.2	G993 A1018 Y1022 S1038	G993-A1020 WeakPolarHBondContact O-CA 3.3Å; A1018-A1020 VanDerWaalsContact C-N 3.32Å; A1018-A1020 PolarHBondContact O-N 2.85Å; A1020-Y1022 HydrophobicContact CB-CE1 4.09Å; A1020-S1038 PolarHBondContact O-N 3.3Å
1021	C	95.6	Very high	91.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	123.9	167.9	176.1	0	0	0	0	109.2	G993 L998 F1016 A1023 C1036	G993-C1021 CarbonylContact C-O 3.51Å; G993-C1021 WeakPolarHBondContact CA-O 3.43Å; G993-C1021 PolarHBondContact N-O 3.15Å; G993-C1021 PolarHBondContact O-N 2.98Å; L998-C1021 HydrophobicContact CD2-CB 3.76Å; F1016-C1021 HydrophobicContact CE1-CB 4.28Å; F1016-C1021 HydrophobicContact CE2-CB 4.34Å; F1016-C1021 HydrophobicContact CZ-CB 3.63Å; C1021-A1023 PolarHBondContact SG-O 3.49Å; C1021-A1023 VanDerWaalsContact SG-O 3.37Å; C1021-C1036 CarbonylContact C-O 3.48Å; C1021-C1036 WeakPolarHBondContact CA-O 3.41Å
1022	Y	96.1	Very high	91.9	Very high	63 Å²	63	45.2 Å²	45.2	25%	0.247	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-38.5	-177.3	-61.7	-41.9	0	0	0	113.2	R978 A1020 C1036 S1038 A1063	R978-Y1022 WeakPolarHBondContact CB-O 3.47Å; A1020-Y1022 HydrophobicContact CB-CE1 4.09Å; Y1022-C1036 PolarHBondContact N-O 2.89Å; Y1022-S1038 WeakPolarHBondContact OH-CB 3.49Å; Y1022-A1063 WeakPolarHBondContact CD2-O 3.26Å
1023	A	97	Very high	92.3	Very high	12 Å²	12	44 Å²	44	10%	0.099	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	150.8	-179.7	0	0	0	0	0	113	C1021 C1036 S1064 V1066	C1021-A1023 PolarHBondContact SG-O 3.49Å; C1021-A1023 VanDerWaalsContact SG-O 3.37Å; A1023-C1036 HydrophobicContact CB-CB 4.14Å; A1023-C1036 PolarHBondContact O-N 3.41Å; A1023-S1064 VanDerWaalsContact CB-O 3.29Å; A1023-S1064 WeakPolarHBondContact CB-O 3.39Å; A1023-V1066 HydrophobicContact CB-CG1 3.95Å
1024	L	97.4	Very high	92.7	Very high	1 Å²	1	38 Å²	38	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	142.2	175.8	-66.7	172.8	0	0	0	111	S979 K981 V990 L998 F1034	S979-L1024 PolarHBondContact OG-N 3.42Å; K981-L1024 WeakPolarHBondContact CE-O 3.14Å; K981-L1024 HydrophobicContact CG-CB 3.98Å; K981-L1024 VanDerWaalsContact CG-O 3.32Å; K981-L1024 WeakPolarHBondContact CG-O 3.49Å; V990-L1024 HydrophobicContact CB-CD1 4.41Å; V990-L1024 HydrophobicContact CG1-CD1 3.98Å; L998-L1024 HydrophobicContact CD1-CD2 4.04Å; L998-L1024 HydrophobicContact CD2-CD2 4.04Å; L1024-F1034 WeakPolarHBondContact CA-O 3.39Å
1025	A	96.8	Very high	93	Very high	6 Å²	6	37.8 Å²	37.8	5%	0.05	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	150.7	163.5	0	0	0	0	0	110.2	C1033 F1034 V1066 I1068	A1025-C1033 CarbonylContact O-C 3.57Å; A1025-C1033 WeakPolarHBondContact O-CA 3.35Å; A1025-F1034 HydrophobicContact CB-CB 4.43Å; A1025-F1034 PolarHBondContact N-O 3.22Å; A1025-F1034 PolarHBondContact O-N 2.87Å; A1025-V1066 HydrophobicContact CB-CG1 4.04Å; A1025-V1066 HydrophobicContact CB-CG2 4.12Å; A1025-I1068 HydrophobicContact CB-CD1 3.7Å; A1025-I1068 HydrophobicContact CB-CG1 4Å
1026	V	95.4	Very high	93.4	Very high	19 Å²	19	33.3 Å²	33.3	12%	0.115	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	135.1	-179.3	175.2	0	0	0	0	108.6	K981 T983 L1032 I1047 I1068	K981-V1026 HydrophobicContact CB-CG2 3.76Å; T983-V1026 HydrophobicContact CG2-CG1 4.25Å; V1026-L1032 WeakPolarHBondContact CA-O 3.44Å; V1026-I1047 HydrophobicContact CG1-CD1 4.07Å; V1026-I1068 WeakPolarHBondContact O-CD1 3.3Å
1027	S	93.9	Very high	93.7	Very high	9 Å²	9	32.7 Å²	32.7	6%	0.063	19%	0.185	C	C	.	.			trans	-61.7	150.5	-178.1	58.8	0	0	0	0	112.3	D1029 S1030 K1031 L1032	S1027-D1029 VanDerWaalsContact CB-OD1 3.28Å; S1027-D1029 WeakPolarHBondContact CB-OD1 3.29Å; S1027-D1029 PolarHBondContact O-N 3.21Å; S1027-D1029 VanDerWaalsContact O-N 3.11Å; S1027-D1029 PolarHBondContact OG-OD1 3.36Å; S1027-S1030 WeakPolarHBondContact O-CA 3.42Å; S1027-S1030 PolarHBondContact O-N 3.35Å; S1027-K1031 PolarHBondContact OG-N 3.13Å; S1027-L1032 PolarHBondContact N-O 3.32Å; S1027-L1032 PolarHBondContact OG-N 2.93Å; S1027-L1032 PolarHBondContact OG-O 3.46Å
1028	P	91.7	Very high	94.2	Very high	60 Å²	60	28 Å²	28	39%	0.39	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-29.7	176.3	-28	35.6	0	0	0	113.9	S1030	P1028-S1030 VanDerWaalsContact C-N 3.29Å; P1028-S1030 PolarHBondContact O-N 2.9Å
1029	D	90.5	Very high	94.4	Very high	85 Å²	85	31 Å²	31	46%	0.455	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	3.5	175.9	80.9	-25.9	0	0	0	114.4	S1027 K1031	S1027-D1029 VanDerWaalsContact CB-OD1 3.28Å; S1027-D1029 WeakPolarHBondContact CB-OD1 3.29Å; S1027-D1029 PolarHBondContact O-N 3.21Å; S1027-D1029 VanDerWaalsContact O-N 3.11Å; S1027-D1029 PolarHBondContact OG-OD1 3.36Å; D1029-K1031 PolarHBondContact O-N 2.92Å; D1029-K1031 VanDerWaalsContact O-N 3.12Å; D1029-K1031 PolarHBondContact OD1-N 2.9Å; D1029-K1031 WeakPolarHBondContact OD2-CD 3.37Å; D1029-K1031 WeakPolarHBondContact OD2-CG 3.49Å; D1029-K1031 IonicContact OD2-NZ 2.73Å; D1029-K1031 PolarHBondContact OD2-NZ 3.28Å
1030	S	92	Very high	94.5	Very high	28 Å²	28	26.9 Å²	26.9	20%	0.196	15%	0.147	C	C	.	.	S	Bend	trans	55.9	20	178.9	-59.6	0	0	0	0	116.3	Q984 S1027 P1028	Q984-S1030 WeakPolarHBondContact CB-OG 3.15Å; Q984-S1030 PolarHBondContact N-OG 2.87Å; S1027-S1030 WeakPolarHBondContact O-CA 3.42Å; S1027-S1030 PolarHBondContact O-N 3.35Å; P1028-S1030 VanDerWaalsContact C-N 3.29Å; P1028-S1030 PolarHBondContact O-N 2.9Å
1031	K	92.1	Very high	94.6	Very high	121 Å²	121	27.7 Å²	27.7	53%	0.526	15%	0.15	S	C	.	.	S	Bend	trans	-92.4	-32.4	176.6	-58.8	-167.6	-164.1	81	0	113.6	S1027 D1029 I1047	S1027-K1031 PolarHBondContact OG-N 3.13Å; D1029-K1031 PolarHBondContact O-N 2.92Å; D1029-K1031 VanDerWaalsContact O-N 3.12Å; D1029-K1031 PolarHBondContact OD1-N 2.9Å; D1029-K1031 WeakPolarHBondContact OD2-CD 3.37Å; D1029-K1031 WeakPolarHBondContact OD2-CG 3.49Å; D1029-K1031 IonicContact OD2-NZ 2.73Å; D1029-K1031 PolarHBondContact OD2-NZ 3.28Å; K1031-I1047 PolarHBondContact O-N 3.18Å
1032	L	94.3	Very high	94.6	Very high	52 Å²	52	27.7 Å²	27.7	27%	0.272	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	140.8	-173.6	-60.3	-180	0	0	0	112.1	V1026 S1027 F1034 V1044 W1045	V1026-L1032 WeakPolarHBondContact CA-O 3.44Å; S1027-L1032 PolarHBondContact N-O 3.32Å; S1027-L1032 PolarHBondContact OG-N 2.93Å; S1027-L1032 PolarHBondContact OG-O 3.46Å; L1032-F1034 HydrophobicContact CB-CE2 4.04Å; L1032-F1034 HydrophobicContact CB-CZ 4.26Å; L1032-F1034 HydrophobicContact CD1-CZ 4.26Å; L1032-V1044 HydrophobicContact CD1-CG1 4.31Å; L1032-W1045 CarbonylContact C-O 3.55Å; L1032-W1045 VanDerWaalsContact CA-O 3.23Å; L1032-W1045 WeakPolarHBondContact CA-O 3.48Å
1033	C	95.7	Very high	94.6	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.007	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	137.6	167.6	-173.8	0	0	0	0	109.9	A1025 W1045 I1047	A1025-C1033 CarbonylContact O-C 3.57Å; A1025-C1033 WeakPolarHBondContact O-CA 3.35Å; C1033-W1045 HydrophobicContact CB-CB 4.33Å; C1033-W1045 PolarHBondContact N-O 3Å; C1033-W1045 PolarHBondContact O-N 3.06Å; C1033-I1047 HydrophobicContact CB-CD1 3.94Å; C1033-I1047 HydrophobicContact CB-CG1 3.84Å
1034	F	96.7	Very high	94.5	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.009	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	123.7	177.2	-60.7	-91.2	0	0	0	108.8	L1024 A1025 L1032 I1042 G1043 V1044 Y1056 I1068 L1075 L1089	L1024-F1034 WeakPolarHBondContact CA-O 3.39Å; A1025-F1034 HydrophobicContact CB-CB 4.43Å; A1025-F1034 PolarHBondContact N-O 3.22Å; A1025-F1034 PolarHBondContact O-N 2.87Å; L1032-F1034 HydrophobicContact CB-CE2 4.04Å; L1032-F1034 HydrophobicContact CB-CZ 4.26Å; L1032-F1034 HydrophobicContact CD1-CZ 4.26Å; F1034-I1042 HydrophobicContact CB-CG2 4.28Å; F1034-G1043 CarbonylContact C-O 3.57Å; F1034-G1043 VanDerWaalsContact CA-O 3.32Å; F1034-G1043 WeakPolarHBondContact CA-O 3.49Å; F1034-V1044 HydrophobicContact CD1-CB 4.45Å; F1034-V1044 HydrophobicContact CD1-CG1 4.18Å; F1034-V1044 HydrophobicContact CD1-CG2 3.87Å; F1034-V1044 HydrophobicContact CE1-CB 4.35Å; F1034-V1044 HydrophobicContact CE1-CG1 3.69Å; F1034-V1044 HydrophobicContact CE1-CG2 3.86Å; F1034-V1044 HydrophobicContact CZ-CG1 4.23Å; F1034-Y1056 HydrophobicContact CE1-CE2 4.22Å; F1034-I1068 HydrophobicContact CD2-CD1 3.62Å; F1034-I1068 HydrophobicContact CD2-CG1 4.35Å; F1034-I1068 HydrophobicContact CE2-CD1 3.75Å; F1034-I1068 HydrophobicContact CE2-CG1 4.47Å; F1034-L1075 HydrophobicContact CB-CD1 4.27Å; F1034-L1075 HydrophobicContact CD1-CD1 3.98Å; F1034-L1075 HydrophobicContact CD1-CD2 3.72Å; F1034-L1075 HydrophobicContact CD2-CD1 4.22Å; F1034-L1075 HydrophobicContact CE1-CD1 4.41Å; F1034-L1075 HydrophobicContact CE1-CD2 4.23Å; F1034-L1075 HydrophobicContact CG-CD1 3.88Å; F1034-L1075 HydrophobicContact CG-CD2 4.32Å; F1034-L1089 HydrophobicContact CD1-CD2 4.45Å; F1034-L1089 HydrophobicContact CE1-CD2 3.41Å; F1034-L1089 VanDerWaalsContact CE1-CD2 3.41Å; F1034-L1089 HydrophobicContact CZ-CD1 4.07Å; F1034-L1089 HydrophobicContact CZ-CD2 3.58Å; F1034-L1089 HydrophobicContact CZ-CG 4.47Å
1035	S	96.1	Very high	94.4	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	116.1	-175.5	68.1	0	0	0	0	112.1	C1037 I1042 G1043 W1045	S1035-C1037 PolarHBondContact O-N 3.01Å; S1035-I1042 WeakPolarHBondContact O-CA 3.46Å; S1035-G1043 PolarHBondContact N-O 2.94Å; S1035-G1043 PolarHBondContact O-N 3.06Å; S1035-W1045 PolarHBondContact OG-NE1 2.99Å
1036	C	96.2	Very high	94.2	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	104.3	175.9	-80.2	0	0	0	0	110.9	C1021 Y1022 A1023 A1063 V1066	C1021-C1036 CarbonylContact C-O 3.48Å; C1021-C1036 WeakPolarHBondContact CA-O 3.41Å; Y1022-C1036 PolarHBondContact N-O 2.89Å; A1023-C1036 HydrophobicContact CB-CB 4.14Å; A1023-C1036 PolarHBondContact O-N 3.41Å; C1036-A1063 HydrophobicContact CB-CB 3.78Å; C1036-A1063 WeakPolarHBondContact CB-O 3.44Å; C1036-V1066 WeakPolarHBondContact SG-CB 3.34Å; C1036-V1066 VanDerWaalsContact SG-CG1 3.5Å
1037	C	94.8	Very high	94	Very high	8 Å²	8	25.9 Å²	25.9	5%	0.054	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	149.1	-177.3	-62.2	0	0	0	0	111.8	A1018 S1035 N1039 G1040 N1041 A1063	A1018-C1037 HydrophobicContact CB-CB 3.73Å; S1035-C1037 PolarHBondContact O-N 3.01Å; C1037-N1039 VanDerWaalsContact CB-OD1 3.23Å; C1037-N1039 WeakPolarHBondContact CB-OD1 3.25Å; C1037-N1039 PolarHBondContact O-N 3Å; C1037-G1040 PolarHBondContact O-N 2.98Å; C1037-G1040 VanDerWaalsContact O-N 3.08Å; C1037-N1041 VanDerWaalsContact CB-O 3.26Å; C1037-N1041 WeakPolarHBondContact CB-O 3.44Å; C1037-N1041 PolarHBondContact N-O 3.02Å; C1037-A1063 PolarHBondContact O-N 3.14Å
1038	S	94.5	Very high	93.7	Very high	25 Å²	25	32.7 Å²	32.7	18%	0.175	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-2.2	178.3	70.5	0	0	0	0	115.2	P1019 A1020 Y1022	P1019-S1038 WeakPolarHBondContact CD-OG 3.43Å; P1019-S1038 WeakPolarHBondContact CG-OG 3.39Å; A1020-S1038 PolarHBondContact O-N 3.3Å; Y1022-S1038 WeakPolarHBondContact OH-CB 3.49Å
1039	N	91.6	Very high	93.6	Very high	65 Å²	65	34.4 Å²	34.4	35%	0.348	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	22.1	174.7	69.9	-5	0	0	0	112.8	A1018 C1037 N1041	A1018-N1039 HydrophobicContact CB-CB 4.32Å; C1037-N1039 VanDerWaalsContact CB-OD1 3.23Å; C1037-N1039 WeakPolarHBondContact CB-OD1 3.25Å; C1037-N1039 PolarHBondContact O-N 3Å; N1039-N1041 PolarHBondContact O-N 3.1Å; N1039-N1041 PolarHBondContact O-ND2 3.42Å; N1039-N1041 WeakPolarHBondContact OD1-CB 3.34Å; N1039-N1041 PolarHBondContact OD1-N 2.96Å; N1039-N1041 PolarHBondContact OD1-ND2 2.99Å; N1039-N1041 VanDerWaalsContact OD1-ND2 3.16Å
1040	G	93	Very high	93.5	Very high	1 Å²	1	36 Å²	36	1%	0.01	18%	0.177	C	C	.	.	S	Bend	trans	77.4	-4.2	175.8	0	0	0	0	0	116.1	C1037 H1059 E1061	C1037-G1040 PolarHBondContact O-N 2.98Å; C1037-G1040 VanDerWaalsContact O-N 3.08Å; G1040-H1059 WeakPolarHBondContact O-CB 3.38Å; G1040-E1061 WeakPolarHBondContact CA-O 3.41Å; G1040-E1061 PolarHBondContact N-O 2.88Å
1041	N	95.2	Very high	93.4	Very high	24 Å²	24	39 Å²	39	13%	0.128	19%	0.19	C	C	.	.			trans	-87.2	149.2	179.3	-67.2	-91.8	0	0	0	111.3	C1037 N1039 Q1055 Y1056 Q1057	C1037-N1041 VanDerWaalsContact CB-O 3.26Å; C1037-N1041 WeakPolarHBondContact CB-O 3.44Å; C1037-N1041 PolarHBondContact N-O 3.02Å; N1039-N1041 PolarHBondContact O-N 3.1Å; N1039-N1041 PolarHBondContact O-ND2 3.42Å; N1039-N1041 WeakPolarHBondContact OD1-CB 3.34Å; N1039-N1041 PolarHBondContact OD1-N 2.96Å; N1039-N1041 PolarHBondContact OD1-ND2 2.99Å; N1039-N1041 VanDerWaalsContact OD1-ND2 3.16Å; N1041-Q1055 HydrophobicContact CB-CG 3.8Å; N1041-Q1055 PolarHBondContact OD1-NE2 3.45Å; N1041-Y1056 WeakPolarHBondContact CA-O 3.43Å; N1041-Q1057 VanDerWaalsContact OD1-CG 3.3Å; N1041-Q1057 WeakPolarHBondContact OD1-CG 3.35Å
1042	I	96.2	Very high	93.5	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	108.8	171.5	-45.9	172.5	0	0	0	108.2	F1034 S1035 Q1055 Y1056 L1075 S1077 W1087	F1034-I1042 HydrophobicContact CB-CG2 4.28Å; S1035-I1042 WeakPolarHBondContact O-CA 3.46Å; I1042-Q1055 CarbonylContact O-C 3.55Å; I1042-Q1055 WeakPolarHBondContact O-CA 3.41Å; I1042-Y1056 HydrophobicContact CB-CD2 4.43Å; I1042-Y1056 PolarHBondContact N-O 2.88Å; I1042-Y1056 PolarHBondContact O-N 2.95Å; I1042-L1075 HydrophobicContact CD1-CD2 4.16Å; I1042-L1075 HydrophobicContact CG2-CD2 4.21Å; I1042-S1077 WeakPolarHBondContact CD1-OG 3.36Å; I1042-W1087 HydrophobicContact CD1-CZ2 4.03Å
1043	G	94.8	Very high	93.4	Very high	2 Å²	2	38 Å²	38	2%	0.021	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	136.6	173.5	0	0	0	0	0	110.8	F1034 S1035	F1034-G1043 CarbonylContact C-O 3.57Å; F1034-G1043 VanDerWaalsContact CA-O 3.32Å; F1034-G1043 WeakPolarHBondContact CA-O 3.49Å; S1035-G1043 PolarHBondContact N-O 2.94Å; S1035-G1043 PolarHBondContact O-N 3.06Å
1044	V	95.5	Very high	93.3	Very high	5 Å²	5	43.6 Å²	43.6	3%	0.03	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	110.4	175.8	-172.4	0	0	0	0	108.3	L1032 F1034 V1053 R1054 Y1056	L1032-V1044 HydrophobicContact CD1-CG1 4.31Å; F1034-V1044 HydrophobicContact CD1-CB 4.45Å; F1034-V1044 HydrophobicContact CD1-CG1 4.18Å; F1034-V1044 HydrophobicContact CD1-CG2 3.87Å; F1034-V1044 HydrophobicContact CE1-CB 4.35Å; F1034-V1044 HydrophobicContact CE1-CG1 3.69Å; F1034-V1044 HydrophobicContact CE1-CG2 3.86Å; F1034-V1044 HydrophobicContact CZ-CG1 4.23Å; V1044-V1053 PolarHBondContact O-N 3.48Å; V1044-R1054 HydrophobicContact CB-CB 4.14Å; V1044-R1054 WeakPolarHBondContact CB-O 3.45Å; V1044-R1054 HydrophobicContact CG2-CB 4.19Å; V1044-R1054 PolarHBondContact N-O 3.29Å; V1044-R1054 PolarHBondContact O-N 3.25Å; V1044-Y1056 HydrophobicContact CG2-CD2 3.92Å; V1044-Y1056 HydrophobicContact CG2-CE2 3.61Å
1045	W	94.9	Very high	93.1	Very high	12 Å²	12	46.8 Å²	46.8	5%	0.045	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	137.7	-170.8	-55.5	89.3	0	0	0	111.6	L1014 T1015 F1016 L1032 C1033 S1035 I1051 L1052	L1014-W1045 HydrophobicContact CB-CD2 4.41Å; L1014-W1045 HydrophobicContact CB-CE3 3.99Å; L1014-W1045 HydrophobicContact CB-CZ3 4.02Å; L1014-W1045 HydrophobicContact CD1-CB 3.83Å; L1014-W1045 HydrophobicContact CD1-CD2 3.84Å; L1014-W1045 HydrophobicContact CD1-CE3 3.79Å; L1014-W1045 HydrophobicContact CD1-CG 3.85Å; L1014-W1045 HydrophobicContact CD2-CE3 4.31Å; L1014-W1045 HydrophobicContact CG-CE3 4.26Å; T1015-W1045 WeakPolarHBondContact O-CH2 3.38Å; F1016-W1045 HydrophobicContact CB-CH2 3.92Å; F1016-W1045 HydrophobicContact CB-CZ2 3.73Å; F1016-W1045 HydrophobicContact CD1-CZ2 4.47Å; F1016-W1045 HydrophobicContact CG-CZ2 4.44Å; L1032-W1045 CarbonylContact C-O 3.55Å; L1032-W1045 VanDerWaalsContact CA-O 3.23Å; L1032-W1045 WeakPolarHBondContact CA-O 3.48Å; C1033-W1045 HydrophobicContact CB-CB 4.33Å; C1033-W1045 PolarHBondContact N-O 3Å; C1033-W1045 PolarHBondContact O-N 3.06Å; S1035-W1045 PolarHBondContact OG-NE1 2.99Å; W1045-I1051 WeakPolarHBondContact CA-O 3.25Å; W1045-L1052 HydrophobicContact CD2-CD1 4.04Å; W1045-L1052 HydrophobicContact CE3-CB 3.93Å; W1045-L1052 HydrophobicContact CE3-CD1 4.27Å; W1045-L1052 HydrophobicContact CH2-CB 3.99Å; W1045-L1052 HydrophobicContact CH2-CD1 4.03Å; W1045-L1052 HydrophobicContact CH2-CG 4.43Å; W1045-L1052 HydrophobicContact CZ2-CD1 3.76Å; W1045-L1052 HydrophobicContact CZ3-CB 3.65Å; W1045-L1052 HydrophobicContact CZ3-CD1 4.28Å
1046	D	93.4	Very high	93	Very high	28 Å²	28	47.3 Å²	47.3	15%	0.15	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	117.2	163.9	-174.2	-40.9	0	0	0	108.6	H1048 N1049 R1050 I1051 V1053	D1046-H1048 VanDerWaalsContact C-N 3.31Å; D1046-H1048 PolarHBondContact O-N 3.13Å; D1046-H1048 WeakPolarHBondContact OD1-CA 3.17Å; D1046-H1048 WeakPolarHBondContact OD1-CB 3.32Å; D1046-H1048 PolarHBondContact OD1-N 3.36Å; D1046-N1049 HydrophobicContact CB-CB 4.15Å; D1046-N1049 PolarHBondContact OD1-N 3.46Å; D1046-N1049 PolarHBondContact OD2-ND2 3.48Å; D1046-R1050 WeakPolarHBondContact O-CA 3.48Å; D1046-R1050 PolarHBondContact O-N 2.74Å; D1046-I1051 HydrophobicContact CB-CG1 3.95Å; D1046-I1051 PolarHBondContact N-O 3.4Å; D1046-V1053 HydrophobicContact CB-CG2 3.68Å
1047	I	90.8	Very high	92.9	Very high	16 Å²	16	53.9 Å²	53.9	8%	0.082	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-29.8	-176.7	-59.3	173	0	0	0	111.1	T983 T988 I1000 V1026 K1031 C1033	T983-I1047 HydrophobicContact CG2-CD1 4.37Å; T988-I1047 HydrophobicContact CG2-CG2 4.28Å; I1000-I1047 HydrophobicContact CD1-CG2 4.46Å; V1026-I1047 HydrophobicContact CG1-CD1 4.07Å; K1031-I1047 PolarHBondContact O-N 3.18Å; C1033-I1047 HydrophobicContact CB-CD1 3.94Å; C1033-I1047 HydrophobicContact CB-CG1 3.84Å
1048	H	88.1	Confident	92.4	Very high	152 Å²	152	55 Å²	55	70%	0.704	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-49.4	-178.1	-175.5	89.8	0	0	0	111.7	D1046	D1046-H1048 VanDerWaalsContact C-N 3.31Å; D1046-H1048 PolarHBondContact O-N 3.13Å; D1046-H1048 WeakPolarHBondContact OD1-CA 3.17Å; D1046-H1048 WeakPolarHBondContact OD1-CB 3.32Å; D1046-H1048 PolarHBondContact OD1-N 3.36Å
1049	N	89	Confident	92.4	Very high	96 Å²	96	54.3 Å²	54.3	51%	0.513	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-13.5	-179.6	-66.5	-60.2	0	0	0	113.3	D1046 I1051	D1046-N1049 HydrophobicContact CB-CB 4.15Å; D1046-N1049 PolarHBondContact OD1-N 3.46Å; D1046-N1049 PolarHBondContact OD2-ND2 3.48Å; N1049-I1051 VanDerWaalsContact C-N 3.34Å; N1049-I1051 HydrophobicContact CB-CD1 4.19Å; N1049-I1051 HydrophobicContact CB-CG1 3.98Å; N1049-I1051 PolarHBondContact O-N 3.43Å
1050	R	89	Confident	92.5	Very high	117 Å²	117	55.5 Å²	55.5	44%	0.442	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	34.8	174.6	-47	164.5	-150.7	-111.9	16.7	113.6	K1011 S1012 L1014 D1046	K1011-R1050 PolarHBondContact O-NH1 3.06Å; S1012-R1050 PolarHBondContact OG-NH1 3.45Å; L1014-R1050 HydrophobicContact CD2-CB 3.72Å; L1014-R1050 WeakPolarHBondContact CD2-O 3.31Å; D1046-R1050 WeakPolarHBondContact O-CA 3.48Å; D1046-R1050 PolarHBondContact O-N 2.74Å
1051	I	90.4	Very high	92.6	Very high	92 Å²	92	58.9 Å²	58.9	47%	0.472	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	147.4	-175.9	55.6	173.3	0	0	0	111.8	W1045 D1046 N1049 V1053	W1045-I1051 WeakPolarHBondContact CA-O 3.25Å; D1046-I1051 HydrophobicContact CB-CG1 3.95Å; D1046-I1051 PolarHBondContact N-O 3.4Å; N1049-I1051 VanDerWaalsContact C-N 3.34Å; N1049-I1051 HydrophobicContact CB-CD1 4.19Å; N1049-I1051 HydrophobicContact CB-CG1 3.98Å; N1049-I1051 PolarHBondContact O-N 3.43Å; I1051-V1053 HydrophobicContact CG1-CG2 4.28Å; I1051-V1053 PolarHBondContact O-N 3Å
1052	L	93.1	Very high	92.4	Very high	80 Å²	80	58 Å²	58	42%	0.419	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	109.8	163.7	-175.6	66.3	0	0	0	108.2	W1045 R1054	W1045-L1052 HydrophobicContact CD2-CD1 4.04Å; W1045-L1052 HydrophobicContact CE3-CB 3.93Å; W1045-L1052 HydrophobicContact CE3-CD1 4.27Å; W1045-L1052 HydrophobicContact CH2-CB 3.99Å; W1045-L1052 HydrophobicContact CH2-CD1 4.03Å; W1045-L1052 HydrophobicContact CH2-CG 4.43Å; W1045-L1052 HydrophobicContact CZ2-CD1 3.76Å; W1045-L1052 HydrophobicContact CZ3-CB 3.65Å; W1045-L1052 HydrophobicContact CZ3-CD1 4.28Å; L1052-R1054 WeakPolarHBondContact CD1-O 3.31Å
1053	V	93	Very high	92.4	Very high	73 Å²	73	58 Å²	58	44%	0.442	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-43.1	-179.4	-172.4	0	0	0	0	110.6	V1044 D1046 I1051	V1044-V1053 PolarHBondContact O-N 3.48Å; D1046-V1053 HydrophobicContact CB-CG2 3.68Å; I1051-V1053 HydrophobicContact CG1-CG2 4.28Å; I1051-V1053 PolarHBondContact O-N 3Å
1054	R	92.3	Very high	92.5	Very high	117 Å²	117	58.6 Å²	58.6	44%	0.442	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	167.1	177.4	-64.5	-168.1	-173	-79.4	5	110.8	V1044 L1052 H1092	V1044-R1054 HydrophobicContact CB-CB 4.14Å; V1044-R1054 WeakPolarHBondContact CB-O 3.45Å; V1044-R1054 HydrophobicContact CG2-CB 4.19Å; V1044-R1054 PolarHBondContact N-O 3.29Å; V1044-R1054 PolarHBondContact O-N 3.25Å; L1052-R1054 WeakPolarHBondContact CD1-O 3.31Å; R1054-H1092 PolarHBondContact NE-CD2 3.08Å; R1054-H1092 PolarHBondContact NE-CE1 3.04Å; R1054-H1092 VanDerWaalsContact NE-CE1 3.29Å; R1054-H1092 PolarHBondContact NE-ND1 2.99Å; R1054-H1092 PolarHBondContact NE-NE2 3.49Å; R1054-H1092 PolarHBondContact NH2-CD2 3.43Å; R1054-H1092 PolarHBondContact NH2-NE2 3.45Å; R1054-H1092 VanDerWaalsContact NH2-NE2 3.13Å
1055	Q	93	Very high	92.6	Very high	70 Å²	70	58.8 Å²	58.8	33%	0.327	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	117.7	168.5	-176.3	179.2	-53.3	0	0	107.9	N1041 I1042	N1041-Q1055 HydrophobicContact CB-CG 3.8Å; N1041-Q1055 PolarHBondContact OD1-NE2 3.45Å; I1042-Q1055 CarbonylContact O-C 3.55Å; I1042-Q1055 WeakPolarHBondContact O-CA 3.41Å
1056	Y	95.2	Very high	92.7	Very high	11 Å²	11	59 Å²	59	4%	0.043	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	127	171	-58.1	-46	0	0	0	108.7	F1034 N1041 I1042 V1044 L1075 W1087 L1089 H1092	F1034-Y1056 HydrophobicContact CE1-CE2 4.22Å; N1041-Y1056 WeakPolarHBondContact CA-O 3.43Å; I1042-Y1056 HydrophobicContact CB-CD2 4.43Å; I1042-Y1056 PolarHBondContact N-O 2.88Å; I1042-Y1056 PolarHBondContact O-N 2.95Å; V1044-Y1056 HydrophobicContact CG2-CD2 3.92Å; V1044-Y1056 HydrophobicContact CG2-CE2 3.61Å; Y1056-L1075 HydrophobicContact CD2-CD2 4.06Å; Y1056-L1075 HydrophobicContact CE2-CD2 4.07Å; Y1056-W1087 HydrophobicContact CD1-CE3 4.39Å; Y1056-W1087 HydrophobicContact CD2-CB 4.49Å; Y1056-W1087 HydrophobicContact CD2-CD2 4.39Å; Y1056-W1087 HydrophobicContact CD2-CG 4.36Å; Y1056-W1087 HydrophobicContact CE2-CB 4.47Å; Y1056-W1087 HydrophobicContact CG-CD2 4.29Å; Y1056-W1087 HydrophobicContact CG-CE3 4.03Å; Y1056-W1087 HydrophobicContact CG-CZ3 4.49Å; Y1056-L1089 HydrophobicContact CE2-CD2 3.92Å; Y1056-H1092 HydrophobicContact CE1-CB 3.98Å; Y1056-H1092 PolarHBondContact OH-ND1 3.41Å
1057	Q	93.1	Very high	92.9	Very high	138 Å²	138	60 Å²	60	65%	0.645	31%	0.312	S	S	*	.			trans	-111.9	136.2	179.2	-44.1	-164.3	-14.5	0	0	108.1	N1041	N1041-Q1057 VanDerWaalsContact OD1-CG 3.3Å; N1041-Q1057 WeakPolarHBondContact OD1-CG 3.35Å
1058	G	85.6	Confident	93.1	Very high	32 Å²	32	59.9 Å²	59.9	33%	0.33	31%	0.312	S	S	.	.			trans	174.5	-45.7	174.2	0	0	0	0	0	114.7	A1060 R1085	G1058-A1060 PolarHBondContact O-N 3.42Å; G1058-R1085 PolarHBondContact O-NH1 3.05Å; G1058-R1085 PolarHBondContact O-NH2 3.06Å
1059	H	94.2	Very high	93.3	Very high	10 Å²	10	55.9 Å²	55.9	5%	0.046	29%	0.291	C	S	.	.			trans	-62.7	132.6	177.5	-66.3	-84.4	0	0	0	110.1	G1040 E1061 S1077 G1079 D1081 T1083 R1085	G1040-H1059 WeakPolarHBondContact O-CB 3.38Å; H1059-E1061 VanDerWaalsContact C-N 3.34Å; H1059-E1061 WeakPolarHBondContact CB-O 3.46Å; H1059-S1077 PolarHBondContact NE2-OG 3.35Å; H1059-G1079 PolarHBondContact CE1-N 2.95Å; H1059-D1081 WeakPolarHBondContact CA-OD2 2.95Å; H1059-D1081 IonicContact CE1-OD1 3.75Å; H1059-D1081 IonicContact CG-OD1 3.19Å; H1059-D1081 IonicContact CG-OD2 2.7Å; H1059-D1081 IonicContact ND1-OD1 2.95Å; H1059-D1081 PolarHBondContact ND1-OD1 2.87Å; H1059-D1081 IonicContact ND1-OD2 3.35Å; H1059-T1083 PolarHBondContact CE1-O 3.36Å; H1059-T1083 VanDerWaalsContact CE1-O 3.3Å; H1059-T1083 PolarHBondContact CE1-OG1 3.19Å; H1059-T1083 PolarHBondContact ND1-OG1 3.21Å; H1059-T1083 VanDerWaalsContact ND1-OG1 3.11Å; H1059-R1085 PolarHBondContact ND1-NE 2.71Å
1060	A	93.6	Very high	93.3	Very high	89 Å²	89	54.5 Å²	54.5	74%	0.736	29%	0.287	S	S	*	.	S	Bend	trans	-76.7	-25	-178	0	0	0	0	0	112.7	G1058 D1081	G1058-A1060 PolarHBondContact O-N 3.42Å; A1060-D1081 HydrophobicContact CB-CB 4.05Å; A1060-D1081 PolarHBondContact N-OD2 2.93Å
1061	E	93.8	Very high	93.2	Very high	72 Å²	72	52.8 Å²	52.8	34%	0.336	29%	0.287	S	S	.	.	S	Bend	trans	-125	178.3	175.7	-58.7	-175	-166	0	0	109.8	G1040 H1059 A1063 L1080 D1081 Q1103	G1040-E1061 WeakPolarHBondContact CA-O 3.41Å; G1040-E1061 PolarHBondContact N-O 2.88Å; H1059-E1061 VanDerWaalsContact C-N 3.34Å; H1059-E1061 WeakPolarHBondContact CB-O 3.46Å; E1061-A1063 PolarHBondContact O-N 3.34Å; E1061-L1080 HydrophobicContact CB-CB 3.93Å; E1061-D1081 HydrophobicContact CB-CB 4.19Å; E1061-D1081 HydrophobicContact CG-CB 4.32Å; E1061-Q1103 PolarHBondContact OE2-NE2 2.92Å
1062	G	92.1	Very high	93.2	Very high	5 Å²	5	49.7 Å²	49.7	5%	0.052	28%	0.277	C	S	.	.			trans	-47.7	131.9	-178.1	0	0	0	0	0	113.9	S1064 L1080	G1062-S1064 PolarHBondContact O-N 3.48Å; G1062-L1080 WeakPolarHBondContact O-CG 3.37Å; G1062-L1080 PolarHBondContact O-N 3.41Å
1063	A	96.8	Very high	93.2	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	122.6	169.3	0	0	0	0	0	107.6	Y1022 C1036 C1037 E1061	Y1022-A1063 WeakPolarHBondContact CD2-O 3.26Å; C1036-A1063 HydrophobicContact CB-CB 3.78Å; C1036-A1063 WeakPolarHBondContact CB-O 3.44Å; C1037-A1063 PolarHBondContact O-N 3.14Å; E1061-A1063 PolarHBondContact O-N 3.34Å
1064	S	96.7	Very high	93.2	Very high	16 Å²	16	47.9 Å²	47.9	11%	0.112	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-39.2	-170.4	55.3	0	0	0	0	112.8	A1023 G1062 G1078 I1104	A1023-S1064 VanDerWaalsContact CB-O 3.29Å; A1023-S1064 WeakPolarHBondContact CB-O 3.39Å; G1062-S1064 PolarHBondContact O-N 3.48Å; S1064-G1078 PolarHBondContact N-O 3.25Å; S1064-G1078 PolarHBondContact OG-O 3.03Å; S1064-G1078 VanDerWaalsContact OG-O 3.13Å; S1064-I1104 VanDerWaalsContact CB-O 3.24Å; S1064-I1104 WeakPolarHBondContact CB-O 3.49Å; S1064-I1104 PolarHBondContact OG-O 3.34Å
1065	C	97.1	Very high	93.4	Very high	9 Å²	9	42.3 Å²	42.3	6%	0.061	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	154.4	-171	54.3	0	0	0	0	111.7	S1077 G1078 L1107	C1065-S1077 WeakPolarHBondContact O-CA 2.93Å; C1065-G1078 PolarHBondContact O-N 3.45Å; C1065-L1107 HydrophobicContact CB-CG 4.18Å
1066	V	97.4	Very high	93.6	Very high	15 Å²	15	39.3 Å²	39.3	9%	0.091	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	143.3	-177.1	54.2	0	0	0	0	111.4	A1023 A1025 C1036 L1075 W1076	A1023-V1066 HydrophobicContact CB-CG1 3.95Å; A1025-V1066 HydrophobicContact CB-CG1 4.04Å; A1025-V1066 HydrophobicContact CB-CG2 4.12Å; C1036-V1066 WeakPolarHBondContact SG-CB 3.34Å; C1036-V1066 VanDerWaalsContact SG-CG1 3.5Å; V1066-L1075 HydrophobicContact CG2-CD1 3.46Å; V1066-L1075 VanDerWaalsContact CG2-CD1 3.46Å; V1066-L1075 HydrophobicContact CG2-CD2 4.24Å; V1066-L1075 HydrophobicContact CG2-CG 3.85Å; V1066-W1076 CarbonylContact C-O 3.59Å; V1066-W1076 VanDerWaalsContact CA-O 3.27Å; V1066-W1076 WeakPolarHBondContact CA-O 3.26Å; V1066-W1076 WeakPolarHBondContact CG2-O 3.4Å
1067	D	96.9	Very high	93.8	Very high	50 Å²	50	38.8 Å²	38.8	27%	0.267	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	161.4	171.9	-161.6	10	0	0	0	111.1	W1076 L1107 G1108 Y1109	D1067-W1076 PolarHBondContact N-O 2.89Å; D1067-W1076 PolarHBondContact O-N 2.93Å; D1067-L1107 HydrophobicContact CB-CD1 3.52Å; D1067-G1108 WeakPolarHBondContact OD2-CA 3.46Å; D1067-Y1109 PolarHBondContact OD2-N 2.67Å
1068	I	94.5	Very high	94	Very high	14 Å²	14	32.2 Å²	32.2	7%	0.072	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	131.7	-173.5	-62.7	162.1	0	0	0	108.8	A1025 V1026 F1034 L1075 L1089	A1025-I1068 HydrophobicContact CB-CD1 3.7Å; A1025-I1068 HydrophobicContact CB-CG1 4Å; V1026-I1068 WeakPolarHBondContact O-CD1 3.3Å; F1034-I1068 HydrophobicContact CD2-CD1 3.62Å; F1034-I1068 HydrophobicContact CD2-CG1 4.35Å; F1034-I1068 HydrophobicContact CE2-CD1 3.75Å; F1034-I1068 HydrophobicContact CE2-CG1 4.47Å; I1068-L1075 HydrophobicContact CD1-CD1 4.34Å; I1068-L1075 HydrophobicContact CG1-CD1 3.45Å; I1068-L1075 VanDerWaalsContact CG1-CD1 3.45Å; I1068-L1089 HydrophobicContact CG2-CD1 4.31Å
1069	R	92.1	Very high	94.4	Very high	68 Å²	68	30.7 Å²	30.7	26%	0.257	18%	0.179	S	C	.	.			trans	-61.1	136.2	172	-174.2	164	87.1	154.1	5.3	109.2	D1071 G1072 R1074 Y1109 D1114	R1069-D1071 WeakPolarHBondContact CB-OD1 3.37Å; R1069-D1071 VanDerWaalsContact CG-OD1 3.32Å; R1069-D1071 WeakPolarHBondContact CG-OD1 3.49Å; R1069-D1071 IonicContact CZ-OD1 2.73Å; R1069-D1071 IonicContact CZ-OD2 3.91Å; R1069-D1071 VanDerWaalsContact NE-CG 3.32Å; R1069-D1071 IonicContact NE-OD1 2.72Å; R1069-D1071 PolarHBondContact NE-OD1 2.98Å; R1069-D1071 IonicContact NE-OD2 2.8Å; R1069-D1071 PolarHBondContact NE-OD2 2.86Å; R1069-D1071 IonicContact NH2-OD1 3.39Å; R1069-D1071 IonicContact NH2-OD2 3.95Å; R1069-D1071 PolarHBondContact NH2-OD2 3.07Å; R1069-D1071 PolarHBondContact O-N 3.09Å; R1069-G1072 PolarHBondContact O-N 3.32Å; R1069-R1074 HydrophobicContact CB-CB 3.91Å; R1069-R1074 PolarHBondContact N-O 3.43Å; R1069-Y1109 HydrophobicContact CB-CD1 4.38Å; R1069-Y1109 HydrophobicContact CB-CE1 4.23Å; R1069-Y1109 WeakPolarHBondContact CD-OH 3.37Å; R1069-Y1109 HydrophobicContact CG-CD1 4.11Å; R1069-Y1109 HydrophobicContact CG-CE1 3.54Å; R1069-D1114 IonicContact NH1-OD1 3.3Å; R1069-D1114 PolarHBondContact NH1-OD1 3.22Å
1070	P	89.1	Confident	94.5	Very high	67 Å²	67	32 Å²	32	44%	0.435	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-23.1	-173	-30.1	34.5	0	0	0	116.5	G1072 P1111	P1070-G1072 PolarHBondContact O-N 3.41Å; P1070-P1111 HydrophobicContact CG-CB 4.44Å
1071	D	88.4	Confident	94.6	Very high	81 Å²	81	28.9 Å²	28.9	43%	0.433	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-6.2	175	77.6	-28	0	0	0	114.3	R1069 T1073	R1069-D1071 WeakPolarHBondContact CB-OD1 3.37Å; R1069-D1071 VanDerWaalsContact CG-OD1 3.32Å; R1069-D1071 WeakPolarHBondContact CG-OD1 3.49Å; R1069-D1071 IonicContact CZ-OD1 2.73Å; R1069-D1071 IonicContact CZ-OD2 3.91Å; R1069-D1071 VanDerWaalsContact NE-CG 3.32Å; R1069-D1071 IonicContact NE-OD1 2.72Å; R1069-D1071 PolarHBondContact NE-OD1 2.98Å; R1069-D1071 IonicContact NE-OD2 2.8Å; R1069-D1071 PolarHBondContact NE-OD2 2.86Å; R1069-D1071 IonicContact NH2-OD1 3.39Å; R1069-D1071 IonicContact NH2-OD2 3.95Å; R1069-D1071 PolarHBondContact NH2-OD2 3.07Å; R1069-D1071 PolarHBondContact O-N 3.09Å; D1071-T1073 PolarHBondContact O-N 3.03Å; D1071-T1073 PolarHBondContact OD1-N 2.85Å; D1071-T1073 VanDerWaalsContact OD1-N 3.1Å; D1071-T1073 PolarHBondContact OD1-OG1 3.45Å; D1071-T1073 VanDerWaalsContact OD1-OG1 3.11Å; D1071-T1073 WeakPolarHBondContact OD2-CB 3.42Å; D1071-T1073 VanDerWaalsContact OD2-CG2 3.24Å; D1071-T1073 WeakPolarHBondContact OD2-CG2 3.35Å; D1071-T1073 PolarHBondContact OD2-OG1 3.37Å
1072	G	90	Very high	94.8	Very high	27 Å²	27	29.6 Å²	29.6	28%	0.278	16%	0.159	S	C	.	.	S	Bend	trans	70.9	9.4	-179.5	0	0	0	0	0	115	R1069 P1070 L1089	R1069-G1072 PolarHBondContact O-N 3.32Å; P1070-G1072 PolarHBondContact O-N 3.41Å; G1072-L1089 WeakPolarHBondContact O-CD1 3.36Å
1073	T	91.8	Very high	95	Very high	50 Å²	50	29.7 Å²	29.7	31%	0.307	16%	0.159	S	C	.	.	S	Bend	trans	-95	-17.2	-177.3	71.7	0	0	0	0	113.8	D1071 L1089	D1071-T1073 PolarHBondContact O-N 3.03Å; D1071-T1073 PolarHBondContact OD1-N 2.85Å; D1071-T1073 VanDerWaalsContact OD1-N 3.1Å; D1071-T1073 PolarHBondContact OD1-OG1 3.45Å; D1071-T1073 VanDerWaalsContact OD1-OG1 3.11Å; D1071-T1073 WeakPolarHBondContact OD2-CB 3.42Å; D1071-T1073 VanDerWaalsContact OD2-CG2 3.24Å; D1071-T1073 WeakPolarHBondContact OD2-CG2 3.35Å; D1071-T1073 PolarHBondContact OD2-OG1 3.37Å; T1073-L1089 PolarHBondContact O-N 3.02Å
1074	R	94	Very high	95.1	Very high	65 Å²	65	29.7 Å²	29.7	25%	0.245	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	137.1	-175.6	-60	-65.9	173.3	-116.2	27.5	111.7	R1069 W1087 D1088 I1095	R1069-R1074 HydrophobicContact CB-CB 3.91Å; R1069-R1074 PolarHBondContact N-O 3.43Å; R1074-W1087 WeakPolarHBondContact CA-O 3.32Å; R1074-D1088 IonicContact CZ-OD2 3.48Å; R1074-D1088 IonicContact NH1-OD1 2.78Å; R1074-D1088 PolarHBondContact NH1-OD1 3.38Å; R1074-D1088 IonicContact NH1-OD2 3.8Å; R1074-D1088 PolarHBondContact NH1-OD2 3.47Å; R1074-D1088 IonicContact NH2-OD2 2.79Å; R1074-D1088 PolarHBondContact NH2-OD2 3.4Å; R1074-I1095 VanDerWaalsContact CZ-CD1 3.43Å; R1074-I1095 VanDerWaalsContact NE-CD1 3.26Å
1075	L	97.1	Very high	95.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	139.4	169	-169.7	74.9	0	0	0	108.6	F1034 I1042 Y1056 V1066 I1068 C1086 W1087 L1089	F1034-L1075 HydrophobicContact CB-CD1 4.27Å; F1034-L1075 HydrophobicContact CD1-CD1 3.98Å; F1034-L1075 HydrophobicContact CD1-CD2 3.72Å; F1034-L1075 HydrophobicContact CD2-CD1 4.22Å; F1034-L1075 HydrophobicContact CE1-CD1 4.41Å; F1034-L1075 HydrophobicContact CE1-CD2 4.23Å; F1034-L1075 HydrophobicContact CG-CD1 3.88Å; F1034-L1075 HydrophobicContact CG-CD2 4.32Å; I1042-L1075 HydrophobicContact CD1-CD2 4.16Å; I1042-L1075 HydrophobicContact CG2-CD2 4.21Å; Y1056-L1075 HydrophobicContact CD2-CD2 4.06Å; Y1056-L1075 HydrophobicContact CE2-CD2 4.07Å; V1066-L1075 HydrophobicContact CG2-CD1 3.46Å; V1066-L1075 VanDerWaalsContact CG2-CD1 3.46Å; V1066-L1075 HydrophobicContact CG2-CD2 4.24Å; V1066-L1075 HydrophobicContact CG2-CG 3.85Å; I1068-L1075 HydrophobicContact CD1-CD1 4.34Å; I1068-L1075 HydrophobicContact CG1-CD1 3.45Å; I1068-L1075 VanDerWaalsContact CG1-CD1 3.45Å; L1075-C1086 CarbonylContact O-C 3.58Å; L1075-C1086 WeakPolarHBondContact O-CA 2.98Å; L1075-W1087 HydrophobicContact CB-CB 4.16Å; L1075-W1087 HydrophobicContact CB-CG 4.49Å; L1075-W1087 HydrophobicContact CD2-CG 4.47Å; L1075-W1087 PolarHBondContact N-O 3.16Å; L1075-W1087 VanDerWaalsContact N-O 3.12Å; L1075-W1087 PolarHBondContact O-N 3.26Å; L1075-L1089 HydrophobicContact CB-CD1 4.24Å; L1075-L1089 HydrophobicContact CB-CD2 3.85Å; L1075-L1089 HydrophobicContact CB-CG 4.07Å; L1075-L1089 HydrophobicContact CD2-CD2 4.46Å
1076	W	97.3	Very high	95	Very high	7 Å²	7	29.7 Å²	29.7	3%	0.027	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	134.8	170.9	-70.1	94.4	0	0	0	109.6	V1066 D1067 V1084 R1085 C1086 L1107 Y1109 L1116 P1130	V1066-W1076 CarbonylContact C-O 3.59Å; V1066-W1076 VanDerWaalsContact CA-O 3.27Å; V1066-W1076 WeakPolarHBondContact CA-O 3.26Å; V1066-W1076 WeakPolarHBondContact CG2-O 3.4Å; D1067-W1076 PolarHBondContact N-O 2.89Å; D1067-W1076 PolarHBondContact O-N 2.93Å; W1076-V1084 HydrophobicContact CE3-CG1 3.72Å; W1076-V1084 HydrophobicContact CZ3-CG1 4.03Å; W1076-R1085 WeakPolarHBondContact CA-O 3.46Å; W1076-C1086 HydrophobicContact CD2-CB 4.01Å; W1076-C1086 VanDerWaalsContact CE2-SG 3.6Å; W1076-C1086 HydrophobicContact CE3-CB 3.76Å; W1076-C1086 HydrophobicContact CH2-CB 3.77Å; W1076-C1086 HydrophobicContact CZ2-CB 3.99Å; W1076-C1086 HydrophobicContact CZ3-CB 3.66Å; W1076-L1107 HydrophobicContact CB-CD1 4.35Å; W1076-Y1109 AromaticContact CD1-CD2 3.57Å; W1076-Y1109 HydrophobicContact CG-CD2 4.45Å; W1076-Y1109 AromaticContact NE1-CD2 3.39Å; W1076-Y1109 AromaticContact NE1-CE2 3.45Å; W1076-L1116 HydrophobicContact CB-CD1 3.96Å; W1076-L1116 HydrophobicContact CD2-CD1 4.13Å; W1076-L1116 HydrophobicContact CD2-CD2 4.17Å; W1076-L1116 HydrophobicContact CE3-CD2 3.79Å; W1076-L1116 HydrophobicContact CG-CD1 3.86Å; W1076-L1116 HydrophobicContact CZ3-CD2 4.17Å; W1076-P1130 HydrophobicContact CH2-CB 4.28Å; W1076-P1130 HydrophobicContact CZ2-CB 4.09Å; W1076-P1130 HydrophobicContact CZ2-CG 4.32Å
1077	S	97.7	Very high	95	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	143.2	177.6	60.5	0	0	0	0	112	I1042 H1059 C1065 V1084 R1085 W1087 L1107	I1042-S1077 WeakPolarHBondContact CD1-OG 3.36Å; H1059-S1077 PolarHBondContact NE2-OG 3.35Å; C1065-S1077 WeakPolarHBondContact O-CA 2.93Å; S1077-V1084 CarbonylContact O-C 3.56Å; S1077-V1084 WeakPolarHBondContact O-CA 3.48Å; S1077-R1085 PolarHBondContact N-O 2.82Å; S1077-R1085 PolarHBondContact O-N 3.15Å; S1077-W1087 PolarHBondContact OG-NE1 2.93Å; S1077-L1107 VanDerWaalsContact C-CD2 3.5Å
1078	G	97.3	Very high	94.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	144.9	173.1	0	0	0	0	0	110.4	S1064 C1065 L1107	S1064-G1078 PolarHBondContact N-O 3.25Å; S1064-G1078 PolarHBondContact OG-O 3.03Å; S1064-G1078 VanDerWaalsContact OG-O 3.13Å; C1065-G1078 PolarHBondContact O-N 3.45Å; G1078-L1107 VanDerWaalsContact N-CD2 3.25Å
1079	G	95.4	Very high	94.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	158.7	178.7	0	0	0	0	0	113.7	H1059 D1081 K1082 T1083 I1104	H1059-G1079 PolarHBondContact CE1-N 2.95Å; G1079-D1081 PolarHBondContact O-N 3.02Å; G1079-K1082 PolarHBondContact O-N 3.5Å; G1079-T1083 PolarHBondContact N-O 3.27Å; G1079-I1104 PolarHBondContact O-N 2.71Å
1080	L	96.4	Very high	94.7	Very high	36 Å²	36	34.2 Å²	34.2	19%	0.188	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-17.7	162.9	-56.8	-179.1	0	0	0	111.4	E1061 G1062 K1082 Q1103 F1105	E1061-L1080 HydrophobicContact CB-CB 3.93Å; G1062-L1080 WeakPolarHBondContact O-CG 3.37Å; G1062-L1080 PolarHBondContact O-N 3.41Å; L1080-K1082 PolarHBondContact O-N 3.4Å; L1080-Q1103 HydrophobicContact CD2-CB 4.31Å; L1080-Q1103 WeakPolarHBondContact O-CG 3.42Å; L1080-Q1103 PolarHBondContact O-NE2 3.42Å; L1080-F1105 HydrophobicContact CD2-CD1 4.01Å; L1080-F1105 HydrophobicContact CD2-CE1 3.77Å
1081	D	95.4	Very high	94.8	Very high	24 Å²	24	36.4 Å²	36.4	13%	0.128	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	10.3	170.3	78.1	-20.6	0	0	0	114.4	H1059 A1060 E1061 G1079 T1083 R1085	H1059-D1081 WeakPolarHBondContact CA-OD2 2.95Å; H1059-D1081 IonicContact CE1-OD1 3.75Å; H1059-D1081 IonicContact CG-OD1 3.19Å; H1059-D1081 IonicContact CG-OD2 2.7Å; H1059-D1081 IonicContact ND1-OD1 2.95Å; H1059-D1081 PolarHBondContact ND1-OD1 2.87Å; H1059-D1081 IonicContact ND1-OD2 3.35Å; A1060-D1081 HydrophobicContact CB-CB 4.05Å; A1060-D1081 PolarHBondContact N-OD2 2.93Å; E1061-D1081 HydrophobicContact CB-CB 4.19Å; E1061-D1081 HydrophobicContact CG-CB 4.32Å; G1079-D1081 PolarHBondContact O-N 3.02Å; D1081-T1083 WeakPolarHBondContact O-CG2 3.37Å; D1081-T1083 PolarHBondContact O-N 3.42Å; D1081-T1083 WeakPolarHBondContact OD1-CB 3.41Å; D1081-T1083 PolarHBondContact OD1-N 3.03Å; D1081-T1083 PolarHBondContact OD1-OG1 3.01Å; D1081-T1083 PolarHBondContact OD2-OG1 3.26Å; D1081-T1083 VanDerWaalsContact OD2-OG1 3.09Å; D1081-R1085 IonicContact OD2-CZ 2.93Å; D1081-R1085 IonicContact OD2-NE 3.13Å; D1081-R1085 IonicContact OD2-NH2 3.85Å; D1081-R1085 PolarHBondContact OD2-NH2 3.19Å
1082	K	96.9	Very high	94.8	Very high	87 Å²	87	35.9 Å²	35.9	38%	0.378	17%	0.169	S	C	.	.	S	Bend	trans	63.8	14.4	-179.7	-45	-171.3	170.3	-167	0	114.9	G1079 L1080 L1100 S1101 A1102 Q1103	G1079-K1082 PolarHBondContact O-N 3.5Å; L1080-K1082 PolarHBondContact O-N 3.4Å; K1082-L1100 PolarHBondContact O-N 2.97Å; K1082-S1101 PolarHBondContact NZ-O 3.48Å; K1082-A1102 WeakPolarHBondContact CB-O 3.25Å; K1082-A1102 WeakPolarHBondContact CG-O 3.29Å; K1082-Q1103 HydrophobicContact CG-CG 4.48Å
1083	T	97.5	Very high	94.8	Very high	8 Å²	8	37.5 Å²	37.5	5%	0.049	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	138.3	179.7	73.2	0	0	0	0	112.2	H1059 G1079 D1081 R1085 Q1097 D1099 I1104	H1059-T1083 PolarHBondContact CE1-O 3.36Å; H1059-T1083 VanDerWaalsContact CE1-O 3.3Å; H1059-T1083 PolarHBondContact CE1-OG1 3.19Å; H1059-T1083 PolarHBondContact ND1-OG1 3.21Å; H1059-T1083 VanDerWaalsContact ND1-OG1 3.11Å; G1079-T1083 PolarHBondContact N-O 3.27Å; D1081-T1083 WeakPolarHBondContact O-CG2 3.37Å; D1081-T1083 PolarHBondContact O-N 3.42Å; D1081-T1083 WeakPolarHBondContact OD1-CB 3.41Å; D1081-T1083 PolarHBondContact OD1-N 3.03Å; D1081-T1083 PolarHBondContact OD1-OG1 3.01Å; D1081-T1083 PolarHBondContact OD2-OG1 3.26Å; D1081-T1083 VanDerWaalsContact OD2-OG1 3.09Å; T1083-R1085 PolarHBondContact OG1-NE 3.38Å; T1083-R1085 PolarHBondContact OG1-NH2 3.03Å; T1083-Q1097 HydrophobicContact CG2-CG 4.19Å; T1083-D1099 WeakPolarHBondContact CG2-OD1 3.19Å; T1083-I1104 WeakPolarHBondContact O-CD1 3.41Å
1084	V	97.5	Very high	94.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	129.8	160.2	175	0	0	0	0	108.1	W1076 S1077 Q1097 V1098 L1100 I1104 L1116 V1118 F1128	W1076-V1084 HydrophobicContact CE3-CG1 3.72Å; W1076-V1084 HydrophobicContact CZ3-CG1 4.03Å; S1077-V1084 CarbonylContact O-C 3.56Å; S1077-V1084 WeakPolarHBondContact O-CA 3.48Å; V1084-Q1097 CarbonylContact O-C 3.57Å; V1084-Q1097 WeakPolarHBondContact O-CA 3.24Å; V1084-V1098 HydrophobicContact CB-CB 4.36Å; V1084-V1098 PolarHBondContact N-O 3.35Å; V1084-V1098 PolarHBondContact O-N 2.91Å; V1084-L1100 HydrophobicContact CG2-CD1 3.85Å; V1084-I1104 HydrophobicContact CG2-CD1 3.56Å; V1084-I1104 HydrophobicContact CG2-CG1 4.33Å; V1084-L1116 HydrophobicContact CG1-CD2 3.63Å; V1084-V1118 HydrophobicContact CG2-CG1 4.06Å; V1084-V1118 HydrophobicContact CG2-CG2 4.17Å; V1084-F1128 HydrophobicContact CB-CZ 4.46Å; V1084-F1128 HydrophobicContact CG1-CZ 4.36Å; V1084-F1128 HydrophobicContact CG2-CZ 4.35Å
1085	R	97.1	Very high	94.8	Very high	20 Å²	20	39.3 Å²	39.3	8%	0.075	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	138.1	-177.4	-63.9	177.2	-169.8	-125.2	7.5	111.2	G1058 H1059 W1076 S1077 D1081 T1083 W1087 S1096 Q1097	G1058-R1085 PolarHBondContact O-NH1 3.05Å; G1058-R1085 PolarHBondContact O-NH2 3.06Å; H1059-R1085 PolarHBondContact ND1-NE 2.71Å; W1076-R1085 WeakPolarHBondContact CA-O 3.46Å; S1077-R1085 PolarHBondContact N-O 2.82Å; S1077-R1085 PolarHBondContact O-N 3.15Å; D1081-R1085 IonicContact OD2-CZ 2.93Å; D1081-R1085 IonicContact OD2-NE 3.13Å; D1081-R1085 IonicContact OD2-NH2 3.85Å; D1081-R1085 PolarHBondContact OD2-NH2 3.19Å; T1083-R1085 PolarHBondContact OG1-NE 3.38Å; T1083-R1085 PolarHBondContact OG1-NH2 3.03Å; R1085-W1087 HydrophobicContact CB-CZ2 3.91Å; R1085-W1087 HydrophobicContact CG-CZ2 4.49Å; R1085-S1096 WeakPolarHBondContact CA-O 3.48Å; R1085-Q1097 HydrophobicContact CG-CG 4.16Å
1086	C	96.2	Very high	94.7	Very high	5 Å²	5	41.4 Å²	41.4	3%	0.034	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	134.6	171.5	-166.8	0	0	0	0	110	L1075 W1076 I1095 S1096	L1075-C1086 CarbonylContact O-C 3.58Å; L1075-C1086 WeakPolarHBondContact O-CA 2.98Å; W1076-C1086 HydrophobicContact CD2-CB 4.01Å; W1076-C1086 VanDerWaalsContact CE2-SG 3.6Å; W1076-C1086 HydrophobicContact CE3-CB 3.76Å; W1076-C1086 HydrophobicContact CH2-CB 3.77Å; W1076-C1086 HydrophobicContact CZ2-CB 3.99Å; W1076-C1086 HydrophobicContact CZ3-CB 3.66Å; C1086-I1095 PolarHBondContact O-N 3.42Å; C1086-S1096 VanDerWaalsContact CB-OG 3.23Å; C1086-S1096 WeakPolarHBondContact CB-OG 3.23Å; C1086-S1096 PolarHBondContact N-O 3.39Å
1087	W	95.9	Very high	94.5	Very high	7 Å²	7	44.9 Å²	44.9	3%	0.027	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	139.4	-178.5	-43.3	82.1	0	0	0	111.1	I1042 Y1056 R1074 L1075 S1077 R1085 L1089 C1093 Q1094	I1042-W1087 HydrophobicContact CD1-CZ2 4.03Å; Y1056-W1087 HydrophobicContact CD1-CE3 4.39Å; Y1056-W1087 HydrophobicContact CD2-CB 4.49Å; Y1056-W1087 HydrophobicContact CD2-CD2 4.39Å; Y1056-W1087 HydrophobicContact CD2-CG 4.36Å; Y1056-W1087 HydrophobicContact CE2-CB 4.47Å; Y1056-W1087 HydrophobicContact CG-CD2 4.29Å; Y1056-W1087 HydrophobicContact CG-CE3 4.03Å; Y1056-W1087 HydrophobicContact CG-CZ3 4.49Å; R1074-W1087 WeakPolarHBondContact CA-O 3.32Å; L1075-W1087 HydrophobicContact CB-CB 4.16Å; L1075-W1087 HydrophobicContact CB-CG 4.49Å; L1075-W1087 HydrophobicContact CD2-CG 4.47Å; L1075-W1087 PolarHBondContact N-O 3.16Å; L1075-W1087 VanDerWaalsContact N-O 3.12Å; L1075-W1087 PolarHBondContact O-N 3.26Å; S1077-W1087 PolarHBondContact OG-NE1 2.93Å; R1085-W1087 HydrophobicContact CB-CZ2 3.91Å; R1085-W1087 HydrophobicContact CG-CZ2 4.49Å; W1087-L1089 PolarHBondContact O-N 2.9Å; W1087-C1093 CarbonylContact C-O 3.6Å; W1087-C1093 WeakPolarHBondContact CA-O 3.43Å; W1087-Q1094 HydrophobicContact CE3-CB 3.84Å; W1087-Q1094 HydrophobicContact CE3-CG 4.37Å; W1087-Q1094 HydrophobicContact CH2-CB 4.48Å; W1087-Q1094 HydrophobicContact CZ3-CB 3.76Å; W1087-Q1094 HydrophobicContact CZ3-CG 4.27Å
1088	D	94.1	Very high	94.4	Very high	15 Å²	15	46.1 Å²	46.1	8%	0.08	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	116.8	170.1	-160.2	-52.4	0	0	0	109.2	R1074 R1090 E1091 H1092 C1093 I1095	R1074-D1088 IonicContact CZ-OD2 3.48Å; R1074-D1088 IonicContact NH1-OD1 2.78Å; R1074-D1088 PolarHBondContact NH1-OD1 3.38Å; R1074-D1088 IonicContact NH1-OD2 3.8Å; R1074-D1088 PolarHBondContact NH1-OD2 3.47Å; R1074-D1088 IonicContact NH2-OD2 2.79Å; R1074-D1088 PolarHBondContact NH2-OD2 3.4Å; D1088-R1090 PolarHBondContact O-N 3.39Å; D1088-R1090 WeakPolarHBondContact OD1-CA 3.37Å; D1088-R1090 WeakPolarHBondContact OD1-CB 3.25Å; D1088-R1090 PolarHBondContact OD1-N 3.09Å; D1088-E1091 HydrophobicContact CB-CB 4.04Å; D1088-E1091 PolarHBondContact OD1-N 3.44Å; D1088-H1092 WeakPolarHBondContact O-CA 3.35Å; D1088-H1092 PolarHBondContact O-N 3.45Å; D1088-C1093 PolarHBondContact N-O 3.28Å; D1088-I1095 HydrophobicContact CB-CD1 3.76Å; D1088-I1095 HydrophobicContact CB-CG1 3.9Å
1089	L	92.9	Very high	94.3	Very high	27 Å²	27	51.2 Å²	51.2	14%	0.141	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-10.1	179.7	-71.4	-179.4	0	0	0	113.8	F1034 Y1056 I1068 G1072 T1073 L1075 W1087 H1092	F1034-L1089 HydrophobicContact CD1-CD2 4.45Å; F1034-L1089 HydrophobicContact CE1-CD2 3.41Å; F1034-L1089 VanDerWaalsContact CE1-CD2 3.41Å; F1034-L1089 HydrophobicContact CZ-CD1 4.07Å; F1034-L1089 HydrophobicContact CZ-CD2 3.58Å; F1034-L1089 HydrophobicContact CZ-CG 4.47Å; Y1056-L1089 HydrophobicContact CE2-CD2 3.92Å; I1068-L1089 HydrophobicContact CG2-CD1 4.31Å; G1072-L1089 WeakPolarHBondContact O-CD1 3.36Å; T1073-L1089 PolarHBondContact O-N 3.02Å; L1075-L1089 HydrophobicContact CB-CD1 4.24Å; L1075-L1089 HydrophobicContact CB-CD2 3.85Å; L1075-L1089 HydrophobicContact CB-CG 4.07Å; L1075-L1089 HydrophobicContact CD2-CD2 4.46Å; W1087-L1089 PolarHBondContact O-N 2.9Å; L1089-H1092 PolarHBondContact O-CE1 3.03Å; L1089-H1092 PolarHBondContact O-ND1 3.03Å
1090	R	91.5	Very high	94.2	Very high	192 Å²	192	52.1 Å²	52.1	73%	0.725	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-47.4	177.5	169.7	-173	155.3	144	1.6	112	D1088 H1092	D1088-R1090 PolarHBondContact O-N 3.39Å; D1088-R1090 WeakPolarHBondContact OD1-CA 3.37Å; D1088-R1090 WeakPolarHBondContact OD1-CB 3.25Å; D1088-R1090 PolarHBondContact OD1-N 3.09Å; R1090-H1092 VanDerWaalsContact C-N 3.35Å; R1090-H1092 PolarHBondContact O-CD2 3.01Å; R1090-H1092 PolarHBondContact O-NE2 3.23Å
1091	E	89.8	Confident	94	Very high	113 Å²	113	54.5 Å²	54.5	53%	0.528	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-7.7	179.5	-52.7	-58.6	145.6	0	0	112.2	D1088 C1093	D1088-E1091 HydrophobicContact CB-CB 4.04Å; D1088-E1091 PolarHBondContact OD1-N 3.44Å; E1091-C1093 VanDerWaalsContact C-N 3.35Å; E1091-C1093 PolarHBondContact O-N 2.93Å
1092	H	89.7	Confident	94	Very high	71 Å²	71	53.6 Å²	53.6	33%	0.329	27%	0.27	S	S	.	.			trans	62.2	32.2	169	-54.9	-62.6	0	0	0	115.5	R1054 Y1056 D1088 L1089 R1090	R1054-H1092 PolarHBondContact NE-CD2 3.08Å; R1054-H1092 PolarHBondContact NE-CE1 3.04Å; R1054-H1092 VanDerWaalsContact NE-CE1 3.29Å; R1054-H1092 PolarHBondContact NE-ND1 2.99Å; R1054-H1092 PolarHBondContact NE-NE2 3.49Å; R1054-H1092 PolarHBondContact NH2-CD2 3.43Å; R1054-H1092 PolarHBondContact NH2-NE2 3.45Å; R1054-H1092 VanDerWaalsContact NH2-NE2 3.13Å; Y1056-H1092 HydrophobicContact CE1-CB 3.98Å; Y1056-H1092 PolarHBondContact OH-ND1 3.41Å; D1088-H1092 WeakPolarHBondContact O-CA 3.35Å; D1088-H1092 PolarHBondContact O-N 3.45Å; L1089-H1092 PolarHBondContact O-CE1 3.03Å; L1089-H1092 PolarHBondContact O-ND1 3.03Å; R1090-H1092 VanDerWaalsContact C-N 3.35Å; R1090-H1092 PolarHBondContact O-CD2 3.01Å; R1090-H1092 PolarHBondContact O-NE2 3.23Å
1093	C	89.3	Confident	94	Very high	61 Å²	61	51.1 Å²	51.1	41%	0.412	26%	0.26	S	S	.	.	S	Bend	trans	-127.1	160.7	-175.6	61.2	0	0	0	0	112.3	W1087 D1088 E1091	W1087-C1093 CarbonylContact C-O 3.6Å; W1087-C1093 WeakPolarHBondContact CA-O 3.43Å; D1088-C1093 PolarHBondContact N-O 3.28Å; E1091-C1093 VanDerWaalsContact C-N 3.35Å; E1091-C1093 PolarHBondContact O-N 2.93Å
1094	Q	93.5	Very high	94	Very high	70 Å²	70	50.7 Å²	50.7	33%	0.327	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	126.6	168.8	-169	179.8	-56.9	0	0	109.1	W1087	W1087-Q1094 HydrophobicContact CE3-CB 3.84Å; W1087-Q1094 HydrophobicContact CE3-CG 4.37Å; W1087-Q1094 HydrophobicContact CH2-CB 4.48Å; W1087-Q1094 HydrophobicContact CZ3-CB 3.76Å; W1087-Q1094 HydrophobicContact CZ3-CG 4.27Å
1095	I	93.2	Very high	94	Very high	82 Å²	82	52.4 Å²	52.4	42%	0.421	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-47.1	179.8	-57.4	160.1	0	0	0	110.6	R1074 C1086 D1088	R1074-I1095 VanDerWaalsContact CZ-CD1 3.43Å; R1074-I1095 VanDerWaalsContact NE-CD1 3.26Å; C1086-I1095 PolarHBondContact O-N 3.42Å; D1088-I1095 HydrophobicContact CB-CD1 3.76Å; D1088-I1095 HydrophobicContact CB-CG1 3.9Å
1096	S	93.3	Very high	94	Very high	44 Å²	44	51.8 Å²	51.8	31%	0.308	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	154.9	-174.5	64	0	0	0	0	111.3	R1085 C1086	R1085-S1096 WeakPolarHBondContact CA-O 3.48Å; C1086-S1096 VanDerWaalsContact CB-OG 3.23Å; C1086-S1096 WeakPolarHBondContact CB-OG 3.23Å; C1086-S1096 PolarHBondContact N-O 3.39Å
1097	Q	94.3	Very high	94.1	Very high	80 Å²	80	52.1 Å²	52.1	37%	0.374	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	139.6	172.5	-168	171.1	-54.5	0	0	108	T1083 V1084 R1085 D1099	T1083-Q1097 HydrophobicContact CG2-CG 4.19Å; V1084-Q1097 CarbonylContact O-C 3.57Å; V1084-Q1097 WeakPolarHBondContact O-CA 3.24Å; R1085-Q1097 HydrophobicContact CG-CG 4.16Å; Q1097-D1099 PolarHBondContact NE2-OD1 2.89Å
1098	V	94.8	Very high	94.1	Very high	26 Å²	26	51.9 Å²	51.9	16%	0.158	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	113.2	171.1	-177.2	0	0	0	0	106.7	V1084 L1100 F1128	V1084-V1098 HydrophobicContact CB-CB 4.36Å; V1084-V1098 PolarHBondContact N-O 3.35Å; V1084-V1098 PolarHBondContact O-N 2.91Å; V1098-L1100 HydrophobicContact CG1-CD2 3.91Å; V1098-F1128 HydrophobicContact CB-CE2 4.5Å; V1098-F1128 HydrophobicContact CB-CZ 4.41Å; V1098-F1128 HydrophobicContact CG1-CE2 4.45Å; V1098-F1128 HydrophobicContact CG1-CZ 4.2Å; V1098-F1128 HydrophobicContact CG2-CE2 4.15Å
1099	D	94.7	Very high	94.3	Very high	108 Å²	108	51.7 Å²	51.7	58%	0.578	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	133.9	177.1	-46.2	-50	0	0	0	109	T1083 Q1097	T1083-D1099 WeakPolarHBondContact CG2-OD1 3.19Å; Q1097-D1099 PolarHBondContact NE2-OD1 2.89Å
1100	L	94.7	Very high	94.4	Very high	19 Å²	19	50.5 Å²	50.5	10%	0.099	26%	0.257	C	S	.	.			trans	-120.3	170.6	-177.6	-58.9	-179.7	0	0	0	111	K1082 V1084 V1098 I1104 V1118 L1120	K1082-L1100 PolarHBondContact O-N 2.97Å; V1084-L1100 HydrophobicContact CG2-CD1 3.85Å; V1098-L1100 HydrophobicContact CG1-CD2 3.91Å; L1100-I1104 HydrophobicContact CD1-CD1 4.2Å; L1100-I1104 HydrophobicContact CD1-CG1 4.13Å; L1100-V1118 HydrophobicContact CD1-CG1 3.98Å; L1100-L1120 HydrophobicContact CD1-CD2 3.96Å
1101	S	91.5	Very high	94.6	Very high	85 Å²	85	43.5 Å²	43.5	59%	0.594	24%	0.236	S	C	*	.	S	Bend	trans	-73.3	-32.5	-173.4	51.5	0	0	0	0	114.5	K1082	K1082-S1101 PolarHBondContact NZ-O 3.48Å
1102	A	96.1	Very high	94.6	Very high	5 Å²	5	42.7 Å²	42.7	4%	0.041	24%	0.239	C	C	.	.	S	Bend	trans	-129.5	170.8	-171.1	0	0	0	0	0	111.4	K1082 L1120 E1121 T1122	K1082-A1102 WeakPolarHBondContact CB-O 3.25Å; K1082-A1102 WeakPolarHBondContact CG-O 3.29Å; A1102-L1120 HydrophobicContact CB-CB 4.43Å; A1102-E1121 HydrophobicContact CB-CB 4.25Å; A1102-T1122 HydrophobicContact CB-CG2 3.77Å
1103	Q	96.7	Very high	94.4	Very high	35 Å²	35	40.6 Å²	40.6	16%	0.164	24%	0.237	C	C	.	.			trans	-63.7	151.7	173.3	-57.4	-164.1	-31.5	0	0	110.5	E1061 L1080 K1082 F1105 L1120 E1121	E1061-Q1103 PolarHBondContact OE2-NE2 2.92Å; L1080-Q1103 HydrophobicContact CD2-CB 4.31Å; L1080-Q1103 WeakPolarHBondContact O-CG 3.42Å; L1080-Q1103 PolarHBondContact O-NE2 3.42Å; K1082-Q1103 HydrophobicContact CG-CG 4.48Å; Q1103-F1105 HydrophobicContact CB-CE1 3.94Å; Q1103-F1105 HydrophobicContact CB-CZ 4.46Å; Q1103-L1120 CarbonylContact O-C 3.41Å; Q1103-L1120 WeakPolarHBondContact O-CA 3.2Å; Q1103-E1121 HydrophobicContact CB-CB 3.95Å; Q1103-E1121 WeakPolarHBondContact CG-OE2 3.36Å; Q1103-E1121 PolarHBondContact N-OE2 3.45Å; Q1103-E1121 WeakPolarHBondContact O-CB 3.27Å; Q1103-E1121 PolarHBondContact O-N 3.16Å
1104	I	97.8	Very high	94.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	130	178.4	-60.2	142.3	0	0	0	108.1	S1064 G1079 T1083 V1084 L1100 V1118 L1120	S1064-I1104 VanDerWaalsContact CB-O 3.24Å; S1064-I1104 WeakPolarHBondContact CB-O 3.49Å; S1064-I1104 PolarHBondContact OG-O 3.34Å; G1079-I1104 PolarHBondContact O-N 2.71Å; T1083-I1104 WeakPolarHBondContact O-CD1 3.41Å; V1084-I1104 HydrophobicContact CG2-CD1 3.56Å; V1084-I1104 HydrophobicContact CG2-CG1 4.33Å; L1100-I1104 HydrophobicContact CD1-CD1 4.2Å; L1100-I1104 HydrophobicContact CD1-CG1 4.13Å; I1104-V1118 HydrophobicContact CB-CG1 4.42Å; I1104-V1118 HydrophobicContact CG1-CG1 4.04Å; I1104-V1118 HydrophobicContact CG2-CG1 3.55Å; I1104-L1120 HydrophobicContact CB-CD2 4.43Å; I1104-L1120 HydrophobicContact CG1-CD2 3.69Å
1105	F	96.4	Very high	94.6	Very high	36 Å²	36	38.5 Å²	38.5	16%	0.158	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-30.3	177.3	-64.5	-22.5	0	0	0	113	V299 L1080 Q1103 G1119 E1121 C1144 L1146	V299-F1105 HydrophobicContact CG1-CE2 4Å; V299-F1105 HydrophobicContact CG1-CZ 4.36Å; V299-F1105 HydrophobicContact CG2-CE1 4.46Å; V299-F1105 HydrophobicContact CG2-CE2 3.96Å; V299-F1105 HydrophobicContact CG2-CZ 3.54Å; L1080-F1105 HydrophobicContact CD2-CD1 4.01Å; L1080-F1105 HydrophobicContact CD2-CE1 3.77Å; Q1103-F1105 HydrophobicContact CB-CE1 3.94Å; Q1103-F1105 HydrophobicContact CB-CZ 4.46Å; F1105-G1119 PolarHBondContact N-O 3.14Å; F1105-E1121 HydrophobicContact CD2-CB 4.37Å; F1105-E1121 HydrophobicContact CE1-CB 4.25Å; F1105-E1121 VanDerWaalsContact CE2-CA 3.48Å; F1105-E1121 HydrophobicContact CE2-CB 3.7Å; F1105-E1121 HydrophobicContact CE2-CG 4.11Å; F1105-E1121 HydrophobicContact CZ-CB 3.6Å; F1105-E1121 HydrophobicContact CZ-CG 3.86Å; F1105-C1144 HydrophobicContact CD2-CB 3.98Å; F1105-C1144 HydrophobicContact CE2-CB 3.83Å; F1105-L1146 HydrophobicContact CD2-CD2 4.07Å
1106	S	97.5	Very high	94.8	Very high	6 Å²	6	34.6 Å²	34.6	4%	0.042	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	152	178.3	56.1	0	0	0	0	112	V1118 G1119 V1145	S1106-V1118 CarbonylContact O-C 3.53Å; S1106-G1119 PolarHBondContact N-O 3.17Å; S1106-G1119 VanDerWaalsContact N-O 3.15Å; S1106-G1119 PolarHBondContact O-N 3.14Å; S1106-G1119 WeakPolarHBondContact OG-CA 3.43Å; S1106-V1145 PolarHBondContact OG-O 3.43Å
1107	L	97.6	Very high	95	Very high	12 Å²	12	32.5 Å²	32.5	6%	0.063	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	159.8	167.7	67.5	79.9	0	0	0	110	C1065 D1067 W1076 S1077 G1078 L1116 A1117 V1118	C1065-L1107 HydrophobicContact CB-CG 4.18Å; D1067-L1107 HydrophobicContact CB-CD1 3.52Å; W1076-L1107 HydrophobicContact CB-CD1 4.35Å; S1077-L1107 VanDerWaalsContact C-CD2 3.5Å; G1078-L1107 VanDerWaalsContact N-CD2 3.25Å; L1107-L1116 HydrophobicContact CD1-CD1 4.3Å; L1107-A1117 CarbonylContact C-O 3.59Å; L1107-A1117 WeakPolarHBondContact CA-O 3.41Å; L1107-V1118 HydrophobicContact CB-CG2 4.39Å
1108	G	97.2	Very high	95.2	Very high	2 Å²	2	28.7 Å²	28.7	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	147.1	168.8	0	0	0	0	0	110.6	D1067 L1116 A1117 F1150	D1067-G1108 WeakPolarHBondContact OD2-CA 3.46Å; G1108-L1116 WeakPolarHBondContact O-CA 3.34Å; G1108-L1116 WeakPolarHBondContact O-CD1 3.5Å; G1108-A1117 PolarHBondContact N-O 3.44Å; G1108-A1117 PolarHBondContact O-N 2.7Å; G1108-F1150 VanDerWaalsContact O-CE2 3.3Å; G1108-F1150 WeakPolarHBondContact O-CE2 3.25Å
1109	Y	96.8	Very high	95.3	Very high	12 Å²	12	27.5 Å²	27.5	5%	0.047	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	136.9	174.4	-169.1	-84.6	0	0	0	109.9	D1067 R1069 W1076 P1111 D1114 L1116	D1067-Y1109 PolarHBondContact OD2-N 2.67Å; R1069-Y1109 HydrophobicContact CB-CD1 4.38Å; R1069-Y1109 HydrophobicContact CB-CE1 4.23Å; R1069-Y1109 WeakPolarHBondContact CD-OH 3.37Å; R1069-Y1109 HydrophobicContact CG-CD1 4.11Å; R1069-Y1109 HydrophobicContact CG-CE1 3.54Å; W1076-Y1109 AromaticContact CD1-CD2 3.57Å; W1076-Y1109 HydrophobicContact CG-CD2 4.45Å; W1076-Y1109 AromaticContact NE1-CD2 3.39Å; W1076-Y1109 AromaticContact NE1-CE2 3.45Å; Y1109-P1111 WeakPolarHBondContact O-CD 3.49Å; Y1109-D1114 PolarHBondContact OH-OD1 3.01Å; Y1109-L1116 HydrophobicContact CD2-CB 4.5Å; Y1109-L1116 HydrophobicContact CD2-CD1 3.96Å
1110	C	96.5	Very high	95.4	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.014	14%	0.135	C	C	.	.			trans	-69.7	125.3	-177.8	178.7	0	0	0	0	111.1	T1112 G1113 W1115 F1150	C1110-T1112 VanDerWaalsContact C-N 3.26Å; C1110-T1112 PolarHBondContact O-N 3.48Å; C1110-G1113 WeakPolarHBondContact CB-O 3.44Å; C1110-W1115 HydrophobicContact CB-CB 3.99Å; C1110-W1115 WeakPolarHBondContact CB-O 3.43Å; C1110-W1115 PolarHBondContact N-O 2.95Å; C1110-F1150 HydrophobicContact CB-CD1 3.89Å; C1110-F1150 HydrophobicContact CB-CE1 3.59Å; C1110-F1150 HydrophobicContact CB-CE2 4.38Å; C1110-F1150 HydrophobicContact CB-CG 4.41Å; C1110-F1150 HydrophobicContact CB-CZ 3.87Å
1111	P	94.1	Very high	95.5	Very high	44 Å²	44	22.9 Å²	22.9	29%	0.286	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-24.6	-176.4	-29.5	38.9	0	0	0	115.5	P1070 Y1109 F1150	P1070-P1111 HydrophobicContact CG-CB 4.44Å; Y1109-P1111 WeakPolarHBondContact O-CD 3.49Å; P1111-F1150 HydrophobicContact CG-CB 4.27Å
1112	T	91.3	Very high	95.6	Very high	97 Å²	97	21.2 Å²	21.2	60%	0.595	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.1	0.5	-171.4	54.2	0	0	0	0	114.6	C1110 S1153 G1154	C1110-T1112 VanDerWaalsContact C-N 3.26Å; C1110-T1112 PolarHBondContact O-N 3.48Å; T1112-S1153 VanDerWaalsContact CG2-O 3.28Å; T1112-S1153 WeakPolarHBondContact CG2-O 3.37Å; T1112-S1153 PolarHBondContact OG1-O 3.41Å; T1112-G1154 WeakPolarHBondContact OG1-CA 3.31Å
1113	G	84.4	Confident	95.5	Very high	26 Å²	26	24 Å²	24	27%	0.268	14%	0.137	S	C	.	.	S	Bend	trans	-159.5	160	177.2	0	0	0	0	0	113.9	C1110 W1115	C1110-G1113 WeakPolarHBondContact CB-O 3.44Å; G1113-W1115 PolarHBondContact O-N 3.37Å
1114	D	91.9	Very high	95.4	Very high	61 Å²	61	23.4 Å²	23.4	33%	0.326	13%	0.134	S	C	.	.	S	Bend	trans	-73.9	71.5	180	-64.2	-80.6	0	0	0	112.8	R1069 Y1109 G1129 P1130 R1132	R1069-D1114 IonicContact NH1-OD1 3.3Å; R1069-D1114 PolarHBondContact NH1-OD1 3.22Å; Y1109-D1114 PolarHBondContact OH-OD1 3.01Å; D1114-G1129 VanDerWaalsContact O-CA 3.25Å; D1114-G1129 WeakPolarHBondContact O-CA 3.34Å; D1114-P1130 HydrophobicContact CB-CG 4.16Å; D1114-R1132 PolarHBondContact O-NE 3.25Å
1115	W	95.6	Very high	95.4	Very high	27 Å²	27	23.4 Å²	23.4	10%	0.102	13%	0.134	C	C	.	.			trans	-134.1	140.4	173.4	-63.7	107.1	0	0	0	110.5	C1110 G1113 V1127 R1132 E1134 Y1136 P1172	C1110-W1115 HydrophobicContact CB-CB 3.99Å; C1110-W1115 WeakPolarHBondContact CB-O 3.43Å; C1110-W1115 PolarHBondContact N-O 2.95Å; G1113-W1115 PolarHBondContact O-N 3.37Å; W1115-V1127 HydrophobicContact CB-CG1 4.44Å; W1115-V1127 HydrophobicContact CE3-CG1 4.31Å; W1115-R1132 VanDerWaalsContact CH2-CD 3.41Å; W1115-E1134 HydrophobicContact CH2-CB 4.25Å; W1115-E1134 WeakPolarHBondContact CH2-OE2 3.42Å; W1115-Y1136 AromaticContact CH2-CE2 3.86Å; W1115-Y1136 HydrophobicContact CH2-CE2 3.86Å; W1115-Y1136 HydrophobicContact CZ3-CD2 4.32Å; W1115-Y1136 HydrophobicContact CZ3-CE2 4.04Å; W1115-P1172 HydrophobicContact CD2-CB 3.59Å; W1115-P1172 HydrophobicContact CD2-CG 4.36Å; W1115-P1172 VanDerWaalsContact CE2-CB 3.49Å; W1115-P1172 HydrophobicContact CE3-CB 3.98Å; W1115-P1172 HydrophobicContact CG-CB 4Å; W1115-P1172 HydrophobicContact CH2-CB 4.2Å; W1115-P1172 HydrophobicContact CH2-CG 4.25Å; W1115-P1172 HydrophobicContact CZ2-CB 3.83Å; W1115-P1172 HydrophobicContact CZ2-CG 3.7Å; W1115-P1172 HydrophobicContact CZ3-CB 4.26Å
1116	L	97	Very high	95.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	129.2	171.7	-173.5	82.9	0	0	0	107.3	W1076 V1084 L1107 G1108 Y1109 V1118 V1127 F1128	W1076-L1116 HydrophobicContact CB-CD1 3.96Å; W1076-L1116 HydrophobicContact CD2-CD1 4.13Å; W1076-L1116 HydrophobicContact CD2-CD2 4.17Å; W1076-L1116 HydrophobicContact CE3-CD2 3.79Å; W1076-L1116 HydrophobicContact CG-CD1 3.86Å; W1076-L1116 HydrophobicContact CZ3-CD2 4.17Å; V1084-L1116 HydrophobicContact CG1-CD2 3.63Å; L1107-L1116 HydrophobicContact CD1-CD1 4.3Å; G1108-L1116 WeakPolarHBondContact O-CA 3.34Å; G1108-L1116 WeakPolarHBondContact O-CD1 3.5Å; Y1109-L1116 HydrophobicContact CD2-CB 4.5Å; Y1109-L1116 HydrophobicContact CD2-CD1 3.96Å; L1116-V1118 HydrophobicContact CD2-CG2 3.74Å; L1116-V1118 HydrophobicContact CG-CG2 4.02Å; L1116-V1127 CarbonylContact O-C 3.59Å; L1116-V1127 VanDerWaalsContact O-CA 3.32Å; L1116-V1127 WeakPolarHBondContact O-CA 3.49Å; L1116-F1128 HydrophobicContact CD2-CE2 3.88Å; L1116-F1128 HydrophobicContact CD2-CZ 3.89Å; L1116-F1128 PolarHBondContact N-O 3.01Å; L1116-F1128 PolarHBondContact O-N 3.48Å
1117	A	97.9	Very high	95.4	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	140.5	170.1	0	0	0	0	0	109.7	L1107 G1108 V1125 E1126 V1127 L1148 F1150 F1157	L1107-A1117 CarbonylContact C-O 3.59Å; L1107-A1117 WeakPolarHBondContact CA-O 3.41Å; G1108-A1117 PolarHBondContact N-O 3.44Å; G1108-A1117 PolarHBondContact O-N 2.7Å; A1117-V1125 HydrophobicContact CB-CG1 4.41Å; A1117-E1126 CarbonylContact C-O 3.54Å; A1117-E1126 WeakPolarHBondContact CA-O 3.38Å; A1117-V1127 HydrophobicContact CB-CG1 4.35Å; A1117-V1127 HydrophobicContact CB-CG2 3.91Å; A1117-L1148 HydrophobicContact CB-CD1 3.74Å; A1117-L1148 HydrophobicContact CB-CD2 3.86Å; A1117-L1148 HydrophobicContact CB-CG 4.46Å; A1117-F1150 HydrophobicContact CB-CE2 3.61Å; A1117-F1150 HydrophobicContact CB-CZ 3.8Å; A1117-F1157 HydrophobicContact CB-CD2 4.41Å; A1117-F1157 HydrophobicContact CB-CE1 4.46Å; A1117-F1157 HydrophobicContact CB-CE2 4.13Å; A1117-F1157 HydrophobicContact CB-CZ 4.15Å
1118	V	98.2	Very high	95.3	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	116	-168.2	-174.2	0	0	0	0	109.1	V1084 L1100 I1104 S1106 L1107 L1116 L1120 V1125 E1126 F1128	V1084-V1118 HydrophobicContact CG2-CG1 4.06Å; V1084-V1118 HydrophobicContact CG2-CG2 4.17Å; L1100-V1118 HydrophobicContact CD1-CG1 3.98Å; I1104-V1118 HydrophobicContact CB-CG1 4.42Å; I1104-V1118 HydrophobicContact CG1-CG1 4.04Å; I1104-V1118 HydrophobicContact CG2-CG1 3.55Å; S1106-V1118 CarbonylContact O-C 3.53Å; L1107-V1118 HydrophobicContact CB-CG2 4.39Å; L1116-V1118 HydrophobicContact CD2-CG2 3.74Å; L1116-V1118 HydrophobicContact CG-CG2 4.02Å; V1118-L1120 HydrophobicContact CG1-CD2 4.13Å; V1118-V1125 CarbonylContact O-C 3.13Å; V1118-V1125 WeakPolarHBondContact O-CA 3.43Å; V1118-E1126 PolarHBondContact N-O 3.33Å; V1118-E1126 PolarHBondContact O-N 2.92Å; V1118-F1128 HydrophobicContact CG2-CE1 3.76Å; V1118-F1128 HydrophobicContact CG2-CZ 3.93Å
1119	G	97.6	Very high	94.9	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	125	175.1	0	0	0	0	0	111.6	F1105 S1106	F1105-G1119 PolarHBondContact N-O 3.14Å; S1106-G1119 PolarHBondContact N-O 3.17Å; S1106-G1119 VanDerWaalsContact N-O 3.15Å; S1106-G1119 PolarHBondContact O-N 3.14Å; S1106-G1119 WeakPolarHBondContact OG-CA 3.43Å
1120	L	97.4	Very high	94.4	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	170	-174.4	-61.9	-178	0	0	0	113.2	L1100 A1102 Q1103 I1104 V1118 T1122 Q1124 V1145	L1100-L1120 HydrophobicContact CD1-CD2 3.96Å; A1102-L1120 HydrophobicContact CB-CB 4.43Å; Q1103-L1120 CarbonylContact O-C 3.41Å; Q1103-L1120 WeakPolarHBondContact O-CA 3.2Å; I1104-L1120 HydrophobicContact CB-CD2 4.43Å; I1104-L1120 HydrophobicContact CG1-CD2 3.69Å; V1118-L1120 HydrophobicContact CG1-CD2 4.13Å; L1120-T1122 VanDerWaalsContact C-N 3.26Å; L1120-T1122 CarbonylContact C-O 3.52Å; L1120-T1122 WeakPolarHBondContact CB-OG1 3.28Å; L1120-Q1124 HydrophobicContact CD1-CB 4.25Å; L1120-Q1124 PolarHBondContact N-O 3.4Å; L1120-Q1124 VanDerWaalsContact N-O 3.12Å; L1120-V1145 PolarHBondContact O-N 3.21Å
1121	E	95.9	Very high	93.8	Very high	29 Å²	29	28.5 Å²	28.5	14%	0.136	19%	0.187	C	C	.	.	S	Bend	trans	-60.8	-34.5	163.4	169.1	-171.8	-142.3	0	0	112.2	A1102 Q1103 F1105 C1144	A1102-E1121 HydrophobicContact CB-CB 4.25Å; Q1103-E1121 HydrophobicContact CB-CB 3.95Å; Q1103-E1121 WeakPolarHBondContact CG-OE2 3.36Å; Q1103-E1121 PolarHBondContact N-OE2 3.45Å; Q1103-E1121 WeakPolarHBondContact O-CB 3.27Å; Q1103-E1121 PolarHBondContact O-N 3.16Å; F1105-E1121 HydrophobicContact CD2-CB 4.37Å; F1105-E1121 HydrophobicContact CE1-CB 4.25Å; F1105-E1121 VanDerWaalsContact CE2-CA 3.48Å; F1105-E1121 HydrophobicContact CE2-CB 3.7Å; F1105-E1121 HydrophobicContact CE2-CG 4.11Å; F1105-E1121 HydrophobicContact CZ-CB 3.6Å; F1105-E1121 HydrophobicContact CZ-CG 3.86Å; E1121-C1144 VanDerWaalsContact O-CA 3.31Å; E1121-C1144 WeakPolarHBondContact O-CA 3.46Å; E1121-C1144 VanDerWaalsContact O-CB 3.31Å; E1121-C1144 WeakPolarHBondContact O-CB 3.44Å; E1121-C1144 PolarHBondContact O-SG 3.16Å
1122	T	94.4	Very high	93.5	Very high	50 Å²	50	31.3 Å²	31.3	31%	0.307	19%	0.192	S	C	.	.	S	Bend	trans	-70.3	170.5	166.8	47.4	0	0	0	0	111.5	A1102 L1120 Q1124	A1102-T1122 HydrophobicContact CB-CG2 3.77Å; L1120-T1122 VanDerWaalsContact C-N 3.26Å; L1120-T1122 CarbonylContact C-O 3.52Å; L1120-T1122 WeakPolarHBondContact CB-OG1 3.28Å; T1122-Q1124 PolarHBondContact O-N 2.99Å
1123	D	93.1	Very high	93.2	Very high	63 Å²	63	29.7 Å²	29.7	34%	0.337	18%	0.183	S	C	.	.	S	Bend	trans	-64.5	23.7	173.7	64.7	-40.2	0	0	0	115.3	H1141	D1123-H1141 WeakPolarHBondContact CB-O 3.44Å
1124	Q	95.6	Very high	93.5	Very high	23 Å²	23	31.5 Å²	31.5	11%	0.107	19%	0.185	C	C	.	.			trans	-125.6	138.4	-160.3	-55.6	-63.7	-40.7	0	0	112.3	L1120 T1122 Q1137 L1138	L1120-Q1124 HydrophobicContact CD1-CB 4.25Å; L1120-Q1124 PolarHBondContact N-O 3.4Å; L1120-Q1124 VanDerWaalsContact N-O 3.12Å; T1122-Q1124 PolarHBondContact O-N 2.99Å; Q1124-Q1137 VanDerWaalsContact OE1-CG 3.32Å; Q1124-L1138 WeakPolarHBondContact CA-O 3.25Å
1125	V	97.5	Very high	93.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	126.4	162	-174	0	0	0	0	108.9	A1117 V1118 V1127 Q1137 L1138 V1145 L1148 F1157	A1117-V1125 HydrophobicContact CB-CG1 4.41Å; V1118-V1125 CarbonylContact O-C 3.13Å; V1118-V1125 WeakPolarHBondContact O-CA 3.43Å; V1125-V1127 HydrophobicContact CG1-CG2 4.3Å; V1125-Q1137 WeakPolarHBondContact O-CA 3.31Å; V1125-L1138 HydrophobicContact CB-CB 4.21Å; V1125-L1138 HydrophobicContact CB-CD1 4.35Å; V1125-L1138 HydrophobicContact CG1-CD1 4.47Å; V1125-L1138 PolarHBondContact N-O 2.95Å; V1125-L1138 PolarHBondContact O-N 3.39Å; V1125-V1145 HydrophobicContact CG2-CG1 4.06Å; V1125-V1145 HydrophobicContact CG2-CG2 4.06Å; V1125-L1148 HydrophobicContact CG1-CD1 3.79Å; V1125-F1157 HydrophobicContact CG1-CE2 4.14Å; V1125-F1157 HydrophobicContact CG1-CZ 4.44Å
1126	E	96.4	Very high	93.5	Very high	17 Å²	17	31.7 Å²	31.7	8%	0.079	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	136.1	167.3	-77.1	-164.9	-150.3	0	0	110.6	A1117 V1118 F1128 R1135 Y1136	A1117-E1126 CarbonylContact C-O 3.54Å; A1117-E1126 WeakPolarHBondContact CA-O 3.38Å; V1118-E1126 PolarHBondContact N-O 3.33Å; V1118-E1126 PolarHBondContact O-N 2.92Å; E1126-F1128 HydrophobicContact CB-CD1 4.21Å; E1126-F1128 HydrophobicContact CB-CE1 4.36Å; E1126-R1135 IonicContact OE2-NH1 3.82Å; E1126-Y1136 CarbonylContact C-O 3.56Å; E1126-Y1136 WeakPolarHBondContact CA-O 3.39Å
1127	V	96.9	Very high	93.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	118.1	174.7	-168.7	0	0	0	0	109.6	W1115 L1116 A1117 V1125 R1135 Y1136 L1138 F1157 P1172	W1115-V1127 HydrophobicContact CB-CG1 4.44Å; W1115-V1127 HydrophobicContact CE3-CG1 4.31Å; L1116-V1127 CarbonylContact O-C 3.59Å; L1116-V1127 VanDerWaalsContact O-CA 3.32Å; L1116-V1127 WeakPolarHBondContact O-CA 3.49Å; A1117-V1127 HydrophobicContact CB-CG1 4.35Å; A1117-V1127 HydrophobicContact CB-CG2 3.91Å; V1125-V1127 HydrophobicContact CG1-CG2 4.3Å; V1127-R1135 CarbonylContact O-C 3.54Å; V1127-R1135 WeakPolarHBondContact O-CA 3.26Å; V1127-Y1136 PolarHBondContact N-O 3.39Å; V1127-Y1136 PolarHBondContact O-N 3.44Å; V1127-L1138 HydrophobicContact CG2-CD1 4.04Å; V1127-F1157 HydrophobicContact CG2-CE1 4.16Å; V1127-F1157 HydrophobicContact CG2-CZ 3.77Å; V1127-P1172 HydrophobicContact CG1-CB 4.39Å
1128	F	95.5	Very high	93.3	Very high	9 Å²	9	33.2 Å²	33.2	4%	0.039	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	158.4	-176.9	57.4	-97.8	0	0	0	112.1	V1084 V1098 L1116 V1118 E1126 R1135	V1084-F1128 HydrophobicContact CB-CZ 4.46Å; V1084-F1128 HydrophobicContact CG1-CZ 4.36Å; V1084-F1128 HydrophobicContact CG2-CZ 4.35Å; V1098-F1128 HydrophobicContact CB-CE2 4.5Å; V1098-F1128 HydrophobicContact CB-CZ 4.41Å; V1098-F1128 HydrophobicContact CG1-CE2 4.45Å; V1098-F1128 HydrophobicContact CG1-CZ 4.2Å; V1098-F1128 HydrophobicContact CG2-CE2 4.15Å; L1116-F1128 HydrophobicContact CD2-CE2 3.88Å; L1116-F1128 HydrophobicContact CD2-CZ 3.89Å; L1116-F1128 PolarHBondContact N-O 3.01Å; L1116-F1128 PolarHBondContact O-N 3.48Å; V1118-F1128 HydrophobicContact CG2-CE1 3.76Å; V1118-F1128 HydrophobicContact CG2-CZ 3.93Å; E1126-F1128 HydrophobicContact CB-CD1 4.21Å; E1126-F1128 HydrophobicContact CB-CE1 4.36Å; F1128-R1135 HydrophobicContact CB-CB 4.18Å; F1128-R1135 HydrophobicContact CB-CG 3.78Å
1129	G	90	Very high	93.1	Very high	5 Å²	5	34.8 Å²	34.8	5%	0.052	20%	0.199	C	C	.	.			trans	-114.6	149	-179.7	0	0	0	0	0	113.4	D1114 G1131 R1132	D1114-G1129 VanDerWaalsContact O-CA 3.25Å; D1114-G1129 WeakPolarHBondContact O-CA 3.34Å; G1129-G1131 PolarHBondContact O-N 3.22Å; G1129-G1131 VanDerWaalsContact O-N 3.13Å; G1129-R1132 PolarHBondContact O-N 3.08Å
1130	P	85.7	Confident	92.9	Very high	59 Å²	59	36.5 Å²	36.5	38%	0.383	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	117.8	174.5	24.9	-33.6	0	0	0	110.8	W1076 D1114 R1132	W1076-P1130 HydrophobicContact CH2-CB 4.28Å; W1076-P1130 HydrophobicContact CZ2-CB 4.09Å; W1076-P1130 HydrophobicContact CZ2-CG 4.32Å; D1114-P1130 HydrophobicContact CB-CG 4.16Å; P1130-R1132 VanDerWaalsContact C-N 3.3Å; P1130-R1132 PolarHBondContact O-N 2.91Å
1131	G	83.1	Confident	92.8	Very high	88 Å²	88	36.9 Å²	36.9	91%	0.907	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.8	7.3	-177.8	0	0	0	0	0	115.5	G1129	G1129-G1131 PolarHBondContact O-N 3.22Å; G1129-G1131 VanDerWaalsContact O-N 3.13Å
1132	R	87.4	Confident	92.7	Very high	102 Å²	102	42.2 Å²	42.2	39%	0.385	24%	0.235	S	C	.	.			trans	-90.1	139.5	172.3	-59.7	-172.3	-175.6	-85.5	-10.4	110.5	D1114 W1115 G1129 P1130 E1134	D1114-R1132 PolarHBondContact O-NE 3.25Å; W1115-R1132 VanDerWaalsContact CH2-CD 3.41Å; G1129-R1132 PolarHBondContact O-N 3.08Å; P1130-R1132 VanDerWaalsContact C-N 3.3Å; P1130-R1132 PolarHBondContact O-N 2.91Å; R1132-E1134 VanDerWaalsContact C-N 3.3Å
1133	P	86.7	Confident	92.8	Very high	64 Å²	64	41.5 Å²	41.5	42%	0.416	23%	0.232	S	C	.	.	S	Bend	trans	-80.7	-13.3	171.3	34.4	-35.6	0	0	0	112.6
1134	E	89.7	Confident	92.9	Very high	63 Å²	63	38.8 Å²	38.8	29%	0.294	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	124.5	178.8	-67.7	157.7	-146.6	0	0	110.7	L876 W1115 R1132	L876-E1134 HydrophobicContact CD1-CB 3.94Å; L876-E1134 HydrophobicContact CD1-CG 4.13Å; W1115-E1134 HydrophobicContact CH2-CB 4.25Å; W1115-E1134 WeakPolarHBondContact CH2-OE2 3.42Å; R1132-E1134 VanDerWaalsContact C-N 3.3Å
1135	R	93.2	Very high	93	Very high	70 Å²	70	37.7 Å²	37.7	26%	0.264	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	128.8	163.4	-48.3	-162.9	-170.8	-173.7	4.3	110.2	R877 E1126 V1127 F1128	R877-R1135 PolarHBondContact N-O 2.86Å; R877-R1135 PolarHBondContact O-N 2.94Å; E1126-R1135 IonicContact OE2-NH1 3.82Å; V1127-R1135 CarbonylContact O-C 3.54Å; V1127-R1135 WeakPolarHBondContact O-CA 3.26Å; F1128-R1135 HydrophobicContact CB-CB 4.18Å; F1128-R1135 HydrophobicContact CB-CG 3.78Å
1136	Y	95.2	Very high	92.9	Very high	23 Å²	23	39.6 Å²	39.6	9%	0.09	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	135.9	170.5	-57.3	-82	0	0	0	109.5	F875 L876 V886 W1115 E1126 V1127 P1172	F875-Y1136 CarbonylContact O-C 3.59Å; F875-Y1136 WeakPolarHBondContact O-CA 3.46Å; L876-Y1136 HydrophobicContact CB-CD1 4.09Å; L876-Y1136 HydrophobicContact CB-CE1 3.98Å; L876-Y1136 HydrophobicContact CD1-CD1 4.14Å; L876-Y1136 HydrophobicContact CD1-CE1 3.81Å; L876-Y1136 HydrophobicContact CD2-CE1 4.35Å; L876-Y1136 HydrophobicContact CG-CE1 4.26Å; V886-Y1136 HydrophobicContact CG2-CD1 3.93Å; V886-Y1136 HydrophobicContact CG2-CE1 4.11Å; W1115-Y1136 AromaticContact CH2-CE2 3.86Å; W1115-Y1136 HydrophobicContact CH2-CE2 3.86Å; W1115-Y1136 HydrophobicContact CZ3-CD2 4.32Å; W1115-Y1136 HydrophobicContact CZ3-CE2 4.04Å; E1126-Y1136 CarbonylContact C-O 3.56Å; E1126-Y1136 WeakPolarHBondContact CA-O 3.39Å; V1127-Y1136 PolarHBondContact N-O 3.39Å; V1127-Y1136 PolarHBondContact O-N 3.44Å; Y1136-P1172 HydrophobicContact CD2-CB 4.2Å; Y1136-P1172 HydrophobicContact CE2-CB 4Å; Y1136-P1172 HydrophobicContact CE2-CG 3.89Å
1137	Q	94.5	Very high	93	Very high	30 Å²	30	39.7 Å²	39.7	14%	0.14	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	125.8	174.1	-179.9	-167.5	-8.4	0	0	108.2	S874 F875 Q1124 V1125	S874-Q1137 WeakPolarHBondContact CA-O 3.33Å; F875-Q1137 HydrophobicContact CB-CB 4.49Å; F875-Q1137 PolarHBondContact N-O 2.81Å; F875-Q1137 PolarHBondContact O-N 3.42Å; Q1124-Q1137 VanDerWaalsContact OE1-CG 3.32Å; V1125-Q1137 WeakPolarHBondContact O-CA 3.31Å
1138	L	95.8	Very high	93	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	122.9	-173.3	-43.6	175.7	0	0	0	110.4	Y873 S874 Q1124 V1125 V1127 F1157 W1169	Y873-L1138 CarbonylContact O-C 3.5Å; Y873-L1138 VanDerWaalsContact O-CA 3.31Å; Y873-L1138 WeakPolarHBondContact O-CA 3.49Å; S874-L1138 VanDerWaalsContact OG-CD2 3.3Å; S874-L1138 WeakPolarHBondContact OG-CD2 3.32Å; Q1124-L1138 WeakPolarHBondContact CA-O 3.25Å; V1125-L1138 HydrophobicContact CB-CB 4.21Å; V1125-L1138 HydrophobicContact CB-CD1 4.35Å; V1125-L1138 HydrophobicContact CG1-CD1 4.47Å; V1125-L1138 PolarHBondContact N-O 2.95Å; V1125-L1138 PolarHBondContact O-N 3.39Å; V1127-L1138 HydrophobicContact CG2-CD1 4.04Å; L1138-F1157 HydrophobicContact CD1-CZ 3.85Å; L1138-W1169 HydrophobicContact CB-CE3 4.37Å; L1138-W1169 HydrophobicContact CB-CH2 3.76Å; L1138-W1169 HydrophobicContact CB-CZ2 4.37Å; L1138-W1169 HydrophobicContact CB-CZ3 3.79Å; L1138-W1169 HydrophobicContact CD1-CD2 3.96Å; L1138-W1169 HydrophobicContact CD1-CE3 3.78Å; L1138-W1169 HydrophobicContact CD1-CG 4.39Å; L1138-W1169 HydrophobicContact CD1-CZ3 4.07Å; L1138-W1169 HydrophobicContact CG-CZ3 4.38Å
1139	S	93.5	Very high	93.1	Very high	33 Å²	33	41.7 Å²	41.7	23%	0.231	23%	0.234	C	C	.	.			trans	-128.2	69.8	-173.2	67.1	0	0	0	0	112	Y873	Y873-S1139 PolarHBondContact O-N 3.44Å; Y873-S1139 PolarHBondContact O-OG 3.47Å
1140	L	94.1	Very high	93.5	Very high	37 Å²	37	41.7 Å²	41.7	19%	0.194	23%	0.233	C	C	.	.			trans	-111.5	-15	166.6	-68.8	179.2	0	0	0	113.5	Y873 Y1167 W1169 N1176	Y873-L1140 VanDerWaalsContact CB-CD2 3.48Å; Y873-L1140 HydrophobicContact CD1-CD1 4.36Å; Y873-L1140 HydrophobicContact CD1-CD2 3.71Å; Y873-L1140 HydrophobicContact CD1-CG 4.21Å; Y873-L1140 HydrophobicContact CD2-CD1 3.75Å; Y873-L1140 HydrophobicContact CD2-CD2 4.05Å; Y873-L1140 HydrophobicContact CD2-CG 3.64Å; Y873-L1140 HydrophobicContact CE1-CD1 4.39Å; Y873-L1140 HydrophobicContact CE1-CD2 4.41Å; Y873-L1140 HydrophobicContact CE2-CD1 3.81Å; Y873-L1140 HydrophobicContact CE2-CG 4.23Å; Y873-L1140 HydrophobicContact CG-CD1 4.03Å; Y873-L1140 HydrophobicContact CG-CD2 3.48Å; Y873-L1140 VanDerWaalsContact CG-CD2 3.48Å; Y873-L1140 HydrophobicContact CG-CG 3.61Å; L1140-Y1167 HydrophobicContact CB-CD1 4.36Å; L1140-Y1167 HydrophobicContact CB-CD2 4.44Å; L1140-Y1167 HydrophobicContact CB-CE1 3.85Å; L1140-Y1167 HydrophobicContact CB-CE2 3.94Å; L1140-Y1167 HydrophobicContact CD1-CD1 4.19Å; L1140-Y1167 HydrophobicContact CD1-CE1 4.02Å; L1140-Y1167 WeakPolarHBondContact O-CE2 3.38Å; L1140-Y1167 VanDerWaalsContact O-CZ 3.24Å; L1140-Y1167 PolarHBondContact O-OH 3.29Å; L1140-W1169 HydrophobicContact CB-CH2 3.65Å; L1140-W1169 HydrophobicContact CB-CZ2 4.29Å; L1140-W1169 HydrophobicContact CB-CZ3 4.47Å; L1140-W1169 HydrophobicContact CD1-CH2 3.75Å; L1140-W1169 HydrophobicContact CD1-CZ3 3.76Å; L1140-W1169 HydrophobicContact CG-CH2 3.77Å; L1140-W1169 HydrophobicContact CG-CZ3 4.12Å; L1140-N1176 HydrophobicContact CD1-CB 3.75Å
1141	H	95.6	Very high	94.1	Very high	8 Å²	8	38.9 Å²	38.9	4%	0.037	22%	0.215	C	C	.	.			trans	-68	154.1	170.3	-82.5	-66.5	0	0	0	109.9	D1123 S1143 V1145 S1159 G1161 D1163 Y1167	D1123-H1141 WeakPolarHBondContact CB-O 3.44Å; H1141-S1143 WeakPolarHBondContact CB-O 3.23Å; H1141-V1145 HydrophobicContact CB-CG2 4.34Å; H1141-S1159 PolarHBondContact NE2-OG 2.76Å; H1141-G1161 PolarHBondContact CE1-N 2.96Å; H1141-G1161 VanDerWaalsContact CE1-N 3.35Å; H1141-D1163 WeakPolarHBondContact CA-OD2 3.44Å; H1141-D1163 WeakPolarHBondContact CB-OD2 3.44Å; H1141-D1163 IonicContact CE1-OD1 3.64Å; H1141-D1163 IonicContact CE1-OD2 2.67Å; H1141-D1163 IonicContact CG-OD2 3.57Å; H1141-D1163 IonicContact ND1-OD1 3.03Å; H1141-D1163 PolarHBondContact ND1-OD1 3Å; H1141-D1163 IonicContact ND1-OD2 2.64Å; H1141-D1163 PolarHBondContact ND1-OD2 3.2Å; H1141-Y1167 AromaticContact CE1-CD2 3.57Å; H1141-Y1167 AromaticContact CE1-CE2 4Å; H1141-Y1167 AromaticContact ND1-CD2 3.82Å; H1141-Y1167 AromaticContact ND1-CE2 3.77Å; H1141-Y1167 AromaticContact NE2-CD2 3.75Å
1142	E	94.1	Very high	94.6	Very high	142 Å²	142	37.3 Å²	37.3	66%	0.664	18%	0.184	S	C	*	.	S	Bend	trans	-104.5	-1	173.3	-56.6	175.1	133.2	0	0	111	D1163 K1181	E1142-D1163 HydrophobicContact CB-CB 3.87Å; E1142-D1163 PolarHBondContact N-OD2 2.98Å; E1142-K1181 IonicContact OE2-NZ 2.91Å; E1142-K1181 PolarHBondContact OE2-NZ 3.33Å
1143	S	95.1	Very high	95	Very high	34 Å²	34	34.3 Å²	34.3	24%	0.238	18%	0.178	C	C	.	.	S	Bend	trans	-165.7	-177.1	-176	-155.9	0	0	0	0	111.2	H1141	H1141-S1143 WeakPolarHBondContact CB-O 3.23Å
1144	C	95.3	Very high	95.4	Very high	6 Å²	6	31.4 Å²	31.4	4%	0.041	16%	0.16	C	C	.	.			trans	-50.4	138.8	-171.9	-35.9	0	0	0	0	114.3	V299 F1105 E1121 L1146 G1161 K1162	V299-C1144 HydrophobicContact CG1-CB 4.34Å; V299-C1144 WeakPolarHBondContact CG1-SG 3.41Å; F1105-C1144 HydrophobicContact CD2-CB 3.98Å; F1105-C1144 HydrophobicContact CE2-CB 3.83Å; E1121-C1144 VanDerWaalsContact O-CA 3.31Å; E1121-C1144 WeakPolarHBondContact O-CA 3.46Å; E1121-C1144 VanDerWaalsContact O-CB 3.31Å; E1121-C1144 WeakPolarHBondContact O-CB 3.44Å; E1121-C1144 PolarHBondContact O-SG 3.16Å; C1144-L1146 HydrophobicContact CB-CD2 3.86Å; C1144-L1146 PolarHBondContact O-N 2.95Å; C1144-G1161 VanDerWaalsContact O-CA 3.3Å; C1144-G1161 WeakPolarHBondContact O-CA 3.37Å; C1144-K1162 HydrophobicContact CB-CB 4.32Å; C1144-K1162 PolarHBondContact O-N 2.95Å
1145	V	97.6	Very high	95.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	94.1	-179.1	-168.8	0	0	0	0	110.9	S1106 L1120 V1125 H1141 T1160	S1106-V1145 PolarHBondContact OG-O 3.43Å; L1120-V1145 PolarHBondContact O-N 3.21Å; V1125-V1145 HydrophobicContact CG2-CG1 4.06Å; V1125-V1145 HydrophobicContact CG2-CG2 4.06Å; H1141-V1145 HydrophobicContact CB-CG2 4.34Å; V1145-T1160 CarbonylContact C-O 3.57Å
1146	L	96.6	Very high	95.9	Very high	40 Å²	40	27.8 Å²	27.8	21%	0.209	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	-29.1	-166.8	-53.2	-175.9	0	0	0	113.7	F1105 C1144 T1160 K1162 L1187	F1105-L1146 HydrophobicContact CD2-CD2 4.07Å; C1144-L1146 HydrophobicContact CB-CD2 3.86Å; C1144-L1146 PolarHBondContact O-N 2.95Å; L1146-T1160 PolarHBondContact N-O 3Å; L1146-K1162 HydrophobicContact CD1-CB 4.04Å; L1146-K1162 HydrophobicContact CD2-CB 4.46Å; L1146-K1162 HydrophobicContact CG-CB 4.34Å; L1146-L1187 HydrophobicContact CD1-CD2 3.64Å
1147	S	97.4	Very high	96	Very high	20 Å²	20	26.7 Å²	26.7	14%	0.14	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	152.2	178.3	-146.7	0	0	0	0	112	S1159 T1160 S1188 C1189	S1147-S1159 CarbonylContact O-C 3.45Å; S1147-S1159 VanDerWaalsContact O-CA 3.3Å; S1147-S1159 WeakPolarHBondContact O-CA 3.39Å; S1147-T1160 WeakPolarHBondContact CB-OG1 3.22Å; S1147-T1160 PolarHBondContact N-O 3.42Å; S1147-T1160 PolarHBondContact O-N 2.96Å; S1147-S1188 WeakPolarHBondContact OG-CA 3.41Å; S1147-C1189 PolarHBondContact OG-N 3.09Å
1148	L	97.5	Very high	96.2	Very high	13 Å²	13	25.2 Å²	25.2	7%	0.068	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	134.3	177	-166.3	151	0	0	0	109.2	A1117 V1125 F1150 F1157 A1158	A1117-L1148 HydrophobicContact CB-CD1 3.74Å; A1117-L1148 HydrophobicContact CB-CD2 3.86Å; A1117-L1148 HydrophobicContact CB-CG 4.46Å; V1125-L1148 HydrophobicContact CG1-CD1 3.79Å; L1148-F1150 HydrophobicContact CD2-CD2 4.19Å; L1148-F1150 HydrophobicContact CD2-CE2 4.17Å; L1148-F1157 HydrophobicContact CD1-CD2 4.14Å; L1148-F1157 HydrophobicContact CD1-CE2 4.1Å; L1148-F1157 HydrophobicContact CD2-CD2 4.12Å; L1148-F1157 HydrophobicContact CG-CD2 4.07Å; L1148-A1158 VanDerWaalsContact CA-O 3.3Å; L1148-A1158 WeakPolarHBondContact CA-O 3.49Å
1149	K	97.9	Very high	96.3	Very high	38 Å²	38	25.2 Å²	25.2	17%	0.165	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	124	177.2	179.3	67.4	175	78.8	0	110.6	H1152 F1157 A1158 D1190 I1191	K1149-H1152 PolarHBondContact NZ-CE1 2.97Å; K1149-H1152 VanDerWaalsContact NZ-CE1 3.27Å; K1149-H1152 PolarHBondContact NZ-NE2 3.45Å; K1149-F1157 CarbonylContact O-C 3.53Å; K1149-F1157 WeakPolarHBondContact O-CA 3.25Å; K1149-A1158 PolarHBondContact N-O 2.65Å; K1149-A1158 PolarHBondContact O-N 3.07Å; K1149-D1190 WeakPolarHBondContact CE-OD1 3.33Å; K1149-I1191 HydrophobicContact CB-CD1 4.21Å; K1149-I1191 HydrophobicContact CB-CG1 4.37Å; K1149-I1191 HydrophobicContact CG-CB 4.07Å; K1149-I1191 HydrophobicContact CG-CD1 3.86Å; K1149-I1191 HydrophobicContact CG-CG1 3.78Å; K1149-I1191 WeakPolarHBondContact O-CD1 3.38Å
1150	F	97.9	Very high	96.5	Very high	5 Å²	5	23.6 Å²	23.6	2%	0.022	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	142.9	167.8	-85.5	-91	0	0	0	111.6	G1108 C1110 P1111 A1117 L1148 F1157 T1171	G1108-F1150 VanDerWaalsContact O-CE2 3.3Å; G1108-F1150 WeakPolarHBondContact O-CE2 3.25Å; C1110-F1150 HydrophobicContact CB-CD1 3.89Å; C1110-F1150 HydrophobicContact CB-CE1 3.59Å; C1110-F1150 HydrophobicContact CB-CE2 4.38Å; C1110-F1150 HydrophobicContact CB-CG 4.41Å; C1110-F1150 HydrophobicContact CB-CZ 3.87Å; P1111-F1150 HydrophobicContact CG-CB 4.27Å; A1117-F1150 HydrophobicContact CB-CE2 3.61Å; A1117-F1150 HydrophobicContact CB-CZ 3.8Å; L1148-F1150 HydrophobicContact CD2-CD2 4.19Å; L1148-F1150 HydrophobicContact CD2-CE2 4.17Å; F1150-F1157 HydrophobicContact CB-CB 4.35Å; F1150-F1157 HydrophobicContact CD1-CB 3.69Å; F1150-F1157 HydrophobicContact CD1-CD1 4.3Å; F1150-F1157 HydrophobicContact CD1-CG 4.38Å; F1150-F1157 HydrophobicContact CD2-CB 4.17Å; F1150-F1157 HydrophobicContact CE1-CB 3.91Å; F1150-F1157 AromaticContact CE1-CD1 3.66Å; F1150-F1157 HydrophobicContact CE1-CD1 3.66Å; F1150-F1157 HydrophobicContact CE1-CG 4.09Å; F1150-F1157 HydrophobicContact CE2-CB 4.37Å; F1150-F1157 HydrophobicContact CE2-CG 4.48Å; F1150-F1157 HydrophobicContact CG-CB 3.82Å; F1150-F1157 HydrophobicContact CZ-CB 4.25Å; F1150-F1157 AromaticContact CZ-CD1 3.82Å; F1150-F1157 HydrophobicContact CZ-CD1 3.82Å; F1150-F1157 HydrophobicContact CZ-CE1 4.43Å; F1150-F1157 HydrophobicContact CZ-CG 4.14Å; F1150-T1171 HydrophobicContact CE1-CG2 3.92Å; F1150-T1171 WeakPolarHBondContact CE1-OG1 3.34Å
1151	A	97.3	Very high	96.6	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.116	C	C	.	.			trans	-64.9	150.6	160.5	0	0	0	0	0	109.6	S1153 G1154 W1156 D1195	A1151-S1153 VanDerWaalsContact C-N 3.32Å; A1151-S1153 PolarHBondContact O-N 3.1Å; A1151-G1154 VanDerWaalsContact O-CA 3.32Å; A1151-G1154 WeakPolarHBondContact O-CA 3.24Å; A1151-G1154 PolarHBondContact O-N 3.27Å; A1151-W1156 HydrophobicContact CB-CD2 3.78Å; A1151-W1156 VanDerWaalsContact CB-CE2 3.49Å; A1151-W1156 HydrophobicContact CB-CG 3.95Å; A1151-W1156 HydrophobicContact CB-CZ2 4Å; A1151-W1156 VanDerWaalsContact CB-O 3.26Å; A1151-W1156 WeakPolarHBondContact CB-O 3.3Å; A1151-W1156 PolarHBondContact N-O 3.43Å; A1151-D1195 HydrophobicContact CB-CB 4.41Å; A1151-D1195 WeakPolarHBondContact CB-OD2 3.35Å
1152	H	95	Very high	96.6	Very high	55 Å²	55	24.7 Å²	24.7	26%	0.255	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-25.8	-175.2	-59.6	91.5	0	0	0	112.9	K1149 G1154 I1191 S1192 L1193 D1195	K1149-H1152 PolarHBondContact NZ-CE1 2.97Å; K1149-H1152 VanDerWaalsContact NZ-CE1 3.27Å; K1149-H1152 PolarHBondContact NZ-NE2 3.45Å; H1152-G1154 PolarHBondContact O-N 3.43Å; H1152-I1191 PolarHBondContact CE1-O 3.11Å; H1152-I1191 VanDerWaalsContact CE1-O 3.32Å; H1152-S1192 PolarHBondContact CE1-O 3.11Å; H1152-S1192 VanDerWaalsContact CE1-O 3.27Å; H1152-S1192 PolarHBondContact ND1-O 3.04Å; H1152-L1193 WeakPolarHBondContact ND1-CA 3.4Å; H1152-D1195 IonicContact CG-OD1 2.61Å; H1152-D1195 VanDerWaalsContact N-CG 3.3Å; H1152-D1195 PolarHBondContact N-OD1 3.36Å; H1152-D1195 PolarHBondContact N-OD2 3.27Å; H1152-D1195 VanDerWaalsContact N-OD2 3.08Å; H1152-D1195 IonicContact ND1-OD1 3.15Å; H1152-D1195 PolarHBondContact ND1-OD1 2.97Å
1153	S	94.6	Very high	96.6	Very high	38 Å²	38	18.6 Å²	18.6	27%	0.266	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-23.5	161.5	54.3	0	0	0	0	113.7	T1112 A1151 L1155 D1195	T1112-S1153 VanDerWaalsContact CG2-O 3.28Å; T1112-S1153 WeakPolarHBondContact CG2-O 3.37Å; T1112-S1153 PolarHBondContact OG1-O 3.41Å; A1151-S1153 VanDerWaalsContact C-N 3.32Å; A1151-S1153 PolarHBondContact O-N 3.1Å; S1153-L1155 PolarHBondContact O-N 3.18Å; S1153-L1155 VanDerWaalsContact O-N 3.09Å; S1153-D1195 VanDerWaalsContact CB-OD2 3.28Å; S1153-D1195 WeakPolarHBondContact CB-OD2 3.29Å; S1153-D1195 PolarHBondContact N-OD2 3.14Å; S1153-D1195 PolarHBondContact OG-OD2 3.2Å
1154	G	95.6	Very high	96.7	Very high	3 Å²	3	20.3 Å²	20.3	3%	0.031	10%	0.104	C	C	.	.	S	Bend	trans	66.5	-1.4	-174.4	0	0	0	0	0	115	T1112 A1151 H1152 W1156 T1171	T1112-G1154 WeakPolarHBondContact OG1-CA 3.31Å; A1151-G1154 VanDerWaalsContact O-CA 3.32Å; A1151-G1154 WeakPolarHBondContact O-CA 3.24Å; A1151-G1154 PolarHBondContact O-N 3.27Å; H1152-G1154 PolarHBondContact O-N 3.43Å; G1154-W1156 PolarHBondContact O-N 2.76Å; G1154-T1171 WeakPolarHBondContact O-CB 3.36Å; G1154-T1171 WeakPolarHBondContact O-CG2 3.38Å; G1154-T1171 PolarHBondContact O-OG1 2.7Å
1155	L	95.3	Very high	96.8	Very high	57 Å²	57	20 Å²	20	30%	0.298	10%	0.102	S	C	.	.	S	Bend	trans	-68	-26	-179.4	-66	175.7	0	0	0	112.9	I898 S1153 R1170 T1171	I898-L1155 HydrophobicContact CD1-CB 3.85Å; I898-L1155 HydrophobicContact CD1-CD1 4.15Å; I898-L1155 HydrophobicContact CD1-CG 4.48Å; S1153-L1155 PolarHBondContact O-N 3.18Å; S1153-L1155 VanDerWaalsContact O-N 3.09Å; L1155-R1170 PolarHBondContact O-NH1 3.17Å; L1155-T1171 WeakPolarHBondContact O-CB 3.38Å; L1155-T1171 PolarHBondContact O-N 3.31Å; L1155-T1171 PolarHBondContact O-OG1 2.83Å
1156	W	96.9	Very high	96.8	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	166.3	178.4	67	-84.1	0	0	0	112	P899 A1151 G1154 A1158 A1168 W1169 T1171 L1177 F1178 I1191 L1198 I1212 Y1214	P899-W1156 VanDerWaalsContact CD-CD1 3.48Å; P899-W1156 HydrophobicContact CG-CD2 3.81Å; P899-W1156 HydrophobicContact CG-CE3 4.29Å; P899-W1156 HydrophobicContact CG-CG 4.03Å; P899-W1156 HydrophobicContact CG-CZ2 4.23Å; A1151-W1156 HydrophobicContact CB-CD2 3.78Å; A1151-W1156 VanDerWaalsContact CB-CE2 3.49Å; A1151-W1156 HydrophobicContact CB-CG 3.95Å; A1151-W1156 HydrophobicContact CB-CZ2 4Å; A1151-W1156 VanDerWaalsContact CB-O 3.26Å; A1151-W1156 WeakPolarHBondContact CB-O 3.3Å; A1151-W1156 PolarHBondContact N-O 3.43Å; G1154-W1156 PolarHBondContact O-N 2.76Å; W1156-A1158 HydrophobicContact CZ3-CB 4.3Å; W1156-A1168 HydrophobicContact CE3-CB 3.93Å; W1156-A1168 HydrophobicContact CZ3-CB 4.05Å; W1156-W1169 CarbonylContact C-O 3.54Å; W1156-W1169 WeakPolarHBondContact CA-O 3.21Å; W1156-W1169 VanDerWaalsContact CB-O 3.26Å; W1156-W1169 WeakPolarHBondContact CB-O 3.41Å; W1156-T1171 PolarHBondContact N-OG1 2.85Å; W1156-L1177 HydrophobicContact CB-CD1 3.67Å; W1156-L1177 HydrophobicContact CG-CD1 4.35Å; W1156-F1178 HydrophobicContact CZ3-CZ 4.33Å; W1156-I1191 HydrophobicContact CH2-CD1 3.91Å; W1156-I1191 HydrophobicContact CZ3-CD1 4.01Å; W1156-L1198 HydrophobicContact CH2-CD1 4.19Å; W1156-L1198 HydrophobicContact CZ3-CD1 4.26Å; W1156-I1212 HydrophobicContact CH2-CD1 4.35Å; W1156-I1212 HydrophobicContact CH2-CG1 4.34Å; W1156-I1212 HydrophobicContact CZ2-CG2 4.21Å; W1156-Y1214 WeakPolarHBondContact CZ2-OH 3.22Å; W1156-Y1214 PolarHBondContact NE1-OH 3.02Å
1157	F	98.2	Very high	96.8	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	152.9	172.6	64.3	-88.8	0	0	0	111.7	A1117 V1125 V1127 L1138 L1148 K1149 F1150 A1168 W1169	A1117-F1157 HydrophobicContact CB-CD2 4.41Å; A1117-F1157 HydrophobicContact CB-CE1 4.46Å; A1117-F1157 HydrophobicContact CB-CE2 4.13Å; A1117-F1157 HydrophobicContact CB-CZ 4.15Å; V1125-F1157 HydrophobicContact CG1-CE2 4.14Å; V1125-F1157 HydrophobicContact CG1-CZ 4.44Å; V1127-F1157 HydrophobicContact CG2-CE1 4.16Å; V1127-F1157 HydrophobicContact CG2-CZ 3.77Å; L1138-F1157 HydrophobicContact CD1-CZ 3.85Å; L1148-F1157 HydrophobicContact CD1-CD2 4.14Å; L1148-F1157 HydrophobicContact CD1-CE2 4.1Å; L1148-F1157 HydrophobicContact CD2-CD2 4.12Å; L1148-F1157 HydrophobicContact CG-CD2 4.07Å; K1149-F1157 CarbonylContact O-C 3.53Å; K1149-F1157 WeakPolarHBondContact O-CA 3.25Å; F1150-F1157 HydrophobicContact CB-CB 4.35Å; F1150-F1157 HydrophobicContact CD1-CB 3.69Å; F1150-F1157 HydrophobicContact CD1-CD1 4.3Å; F1150-F1157 HydrophobicContact CD1-CG 4.38Å; F1150-F1157 HydrophobicContact CD2-CB 4.17Å; F1150-F1157 HydrophobicContact CE1-CB 3.91Å; F1150-F1157 AromaticContact CE1-CD1 3.66Å; F1150-F1157 HydrophobicContact CE1-CD1 3.66Å; F1150-F1157 HydrophobicContact CE1-CG 4.09Å; F1150-F1157 HydrophobicContact CE2-CB 4.37Å; F1150-F1157 HydrophobicContact CE2-CG 4.48Å; F1150-F1157 HydrophobicContact CG-CB 3.82Å; F1150-F1157 HydrophobicContact CZ-CB 4.25Å; F1150-F1157 AromaticContact CZ-CD1 3.82Å; F1150-F1157 HydrophobicContact CZ-CD1 3.82Å; F1150-F1157 HydrophobicContact CZ-CE1 4.43Å; F1150-F1157 HydrophobicContact CZ-CG 4.14Å; F1157-A1168 WeakPolarHBondContact O-CA 3.37Å; F1157-W1169 HydrophobicContact CD1-CB 4.03Å; F1157-W1169 HydrophobicContact CD2-CB 4.08Å; F1157-W1169 AromaticContact CD2-CD1 3.71Å; F1157-W1169 HydrophobicContact CD2-CG 4.21Å; F1157-W1169 HydrophobicContact CE1-CB 3.65Å; F1157-W1169 HydrophobicContact CE1-CG 4.45Å; F1157-W1169 HydrophobicContact CE2-CB 3.71Å; F1157-W1169 AromaticContact CE2-CD1 3.37Å; F1157-W1169 AromaticContact CE2-CG 3.66Å; F1157-W1169 HydrophobicContact CE2-CG 3.66Å; F1157-W1169 HydrophobicContact CG-CB 4.23Å; F1157-W1169 HydrophobicContact CZ-CB 3.48Å; F1157-W1169 VanDerWaalsContact CZ-CB 3.48Å; F1157-W1169 AromaticContact CZ-CG 3.81Å; F1157-W1169 HydrophobicContact CZ-CG 3.81Å; F1157-W1169 PolarHBondContact N-O 2.59Å; F1157-W1169 PolarHBondContact O-N 3.46Å
1158	A	98.3	Very high	96.8	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	145.3	172.4	0	0	0	0	0	110.9	L1148 K1149 W1156 L1166 Y1167 I1191 L1198	L1148-A1158 VanDerWaalsContact CA-O 3.3Å; L1148-A1158 WeakPolarHBondContact CA-O 3.49Å; K1149-A1158 PolarHBondContact N-O 2.65Å; K1149-A1158 PolarHBondContact O-N 3.07Å; W1156-A1158 HydrophobicContact CZ3-CB 4.3Å; A1158-L1166 HydrophobicContact CB-CD1 3.94Å; A1158-Y1167 CarbonylContact C-O 3.6Å; A1158-Y1167 VanDerWaalsContact CA-O 3.29Å; A1158-Y1167 WeakPolarHBondContact CA-O 3.31Å; A1158-I1191 HydrophobicContact CB-CD1 4.13Å; A1158-L1198 HydrophobicContact CB-CD1 3.79Å
1159	S	98.3	Very high	96.8	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	150.2	161.7	72	0	0	0	0	111.4	H1141 S1147 L1166 Y1167 W1169	H1141-S1159 PolarHBondContact NE2-OG 2.76Å; S1147-S1159 CarbonylContact O-C 3.45Å; S1147-S1159 VanDerWaalsContact O-CA 3.3Å; S1147-S1159 WeakPolarHBondContact O-CA 3.39Å; S1159-L1166 WeakPolarHBondContact O-CA 2.85Å; S1159-Y1167 PolarHBondContact N-O 3.49Å; S1159-Y1167 PolarHBondContact O-N 3.45Å; S1159-W1169 PolarHBondContact OG-NE1 3.06Å
1160	T	98.1	Very high	96.7	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	141.8	-179.1	76.3	0	0	0	0	111.8	V1145 L1146 S1147 C1165 L1166 V1186 C1189	V1145-T1160 CarbonylContact C-O 3.57Å; L1146-T1160 PolarHBondContact N-O 3Å; S1147-T1160 WeakPolarHBondContact CB-OG1 3.22Å; S1147-T1160 PolarHBondContact N-O 3.42Å; S1147-T1160 PolarHBondContact O-N 2.96Å; T1160-C1165 WeakPolarHBondContact CA-O 3.36Å; T1160-L1166 HydrophobicContact CG2-CD1 3.87Å; T1160-V1186 WeakPolarHBondContact CB-O 3.46Å; T1160-V1186 HydrophobicContact CG2-CB 4.42Å; T1160-V1186 HydrophobicContact CG2-CG1 3.68Å; T1160-V1186 PolarHBondContact OG1-O 3.4Å; T1160-C1189 HydrophobicContact CG2-CB 3.8Å
1161	G	95.3	Very high	96.6	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	162	-169.2	0	0	0	0	0	116	H1141 C1144 D1163 H1164 C1165 V1186	H1141-G1161 PolarHBondContact CE1-N 2.96Å; H1141-G1161 VanDerWaalsContact CE1-N 3.35Å; C1144-G1161 VanDerWaalsContact O-CA 3.3Å; C1144-G1161 WeakPolarHBondContact O-CA 3.37Å; G1161-D1163 VanDerWaalsContact C-OD1 3.28Å; G1161-D1163 VanDerWaalsContact CA-OD1 3.23Å; G1161-D1163 WeakPolarHBondContact CA-OD1 3.29Å; G1161-D1163 PolarHBondContact O-N 3.05Å; G1161-H1164 PolarHBondContact O-N 2.92Å; G1161-C1165 PolarHBondContact N-O 3.44Å; G1161-V1186 PolarHBondContact O-N 3.47Å
1162	K	95.7	Very high	96.5	Very high	68 Å²	68	18.7 Å²	18.7	30%	0.296	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-26.3	170.5	-174	-178.6	173.8	-160.6	0	111.7	V299 C1144 L1146 H1164 S1185	V299-K1162 HydrophobicContact CG1-CD 4.31Å; V299-K1162 PolarHBondContact O-NZ 2.93Å; C1144-K1162 HydrophobicContact CB-CB 4.32Å; C1144-K1162 PolarHBondContact O-N 2.95Å; L1146-K1162 HydrophobicContact CD1-CB 4.04Å; L1146-K1162 HydrophobicContact CD2-CB 4.46Å; L1146-K1162 HydrophobicContact CG-CB 4.34Å; K1162-H1164 PolarHBondContact O-CE1 3.31Å; K1162-H1164 PolarHBondContact O-N 3.33Å; K1162-H1164 VanDerWaalsContact O-N 3.15Å; K1162-H1164 PolarHBondContact O-ND1 2.84Å; K1162-S1185 WeakPolarHBondContact O-CB 3.45Å; K1162-S1185 PolarHBondContact O-OG 2.86Å
1163	D	94.5	Very high	96.3	Very high	13 Å²	13	18.4 Å²	18.4	7%	0.07	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	6.3	173.5	64.8	-1.4	0	0	0	115.9	H1141 E1142 G1161 C1165 K1181	H1141-D1163 WeakPolarHBondContact CA-OD2 3.44Å; H1141-D1163 WeakPolarHBondContact CB-OD2 3.44Å; H1141-D1163 IonicContact CE1-OD1 3.64Å; H1141-D1163 IonicContact CE1-OD2 2.67Å; H1141-D1163 IonicContact CG-OD2 3.57Å; H1141-D1163 IonicContact ND1-OD1 3.03Å; H1141-D1163 PolarHBondContact ND1-OD1 3Å; H1141-D1163 IonicContact ND1-OD2 2.64Å; H1141-D1163 PolarHBondContact ND1-OD2 3.2Å; E1142-D1163 HydrophobicContact CB-CB 3.87Å; E1142-D1163 PolarHBondContact N-OD2 2.98Å; G1161-D1163 VanDerWaalsContact C-OD1 3.28Å; G1161-D1163 VanDerWaalsContact CA-OD1 3.23Å; G1161-D1163 WeakPolarHBondContact CA-OD1 3.29Å; G1161-D1163 PolarHBondContact O-N 3.05Å; D1163-C1165 PolarHBondContact O-N 3.24Å; D1163-C1165 WeakPolarHBondContact OD1-CB 3.36Å; D1163-C1165 PolarHBondContact OD1-N 3.45Å; D1163-K1181 VanDerWaalsContact O-CE 3.3Å; D1163-K1181 WeakPolarHBondContact O-CE 3.31Å; D1163-K1181 PolarHBondContact O-NZ 3.01Å
1164	H	97.2	Very high	96.3	Very high	70 Å²	70	16.6 Å²	16.6	32%	0.324	8%	0.078	S	C	.	.	S	Bend	trans	70.4	12.5	179.5	-34.4	-17.9	0	0	0	113.7	G1161 K1162 K1181 E1182 S1184 S1185	G1161-H1164 PolarHBondContact O-N 2.92Å; K1162-H1164 PolarHBondContact O-CE1 3.31Å; K1162-H1164 PolarHBondContact O-N 3.33Å; K1162-H1164 VanDerWaalsContact O-N 3.15Å; K1162-H1164 PolarHBondContact O-ND1 2.84Å; H1164-K1181 HydrophobicContact CB-CG 4.4Å; H1164-K1181 WeakPolarHBondContact O-CA 3.24Å; H1164-E1182 WeakPolarHBondContact CB-O 3.41Å; H1164-E1182 PolarHBondContact O-N 3.46Å; H1164-S1184 WeakPolarHBondContact CA-O 3.43Å; H1164-S1184 VanDerWaalsContact CB-O 3.26Å; H1164-S1184 WeakPolarHBondContact CB-O 3.34Å; H1164-S1184 VanDerWaalsContact CG-C 3.45Å; H1164-S1184 VanDerWaalsContact ND1-C 3.31Å; H1164-S1185 PolarHBondContact ND1-N 2.99Å; H1164-S1185 VanDerWaalsContact ND1-N 3.15Å
1165	C	97	Very high	96.2	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	140.4	-177.8	-61.3	0	0	0	0	112.3	T1160 G1161 D1163 Y1167 V1180	T1160-C1165 WeakPolarHBondContact CA-O 3.36Å; G1161-C1165 PolarHBondContact N-O 3.44Å; D1163-C1165 PolarHBondContact O-N 3.24Å; D1163-C1165 WeakPolarHBondContact OD1-CB 3.36Å; D1163-C1165 PolarHBondContact OD1-N 3.45Å; C1165-Y1167 HydrophobicContact CB-CD2 4.1Å; C1165-Y1167 HydrophobicContact CB-CE2 3.62Å; C1165-V1180 WeakPolarHBondContact CA-O 3.31Å
1166	L	97.8	Very high	96.2	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	124	160.5	161.6	67.4	0	0	0	107	A1158 S1159 T1160 F1178 Q1179 V1180 L1198 T1200 Y1210	A1158-L1166 HydrophobicContact CB-CD1 3.94Å; S1159-L1166 WeakPolarHBondContact O-CA 2.85Å; T1160-L1166 HydrophobicContact CG2-CD1 3.87Å; L1166-F1178 HydrophobicContact CD2-CE2 4.39Å; L1166-F1178 HydrophobicContact CG-CE2 4.48Å; L1166-Q1179 WeakPolarHBondContact O-CA 3.16Å; L1166-V1180 HydrophobicContact CB-CB 4.32Å; L1166-V1180 HydrophobicContact CD2-CB 4.31Å; L1166-V1180 HydrophobicContact CD2-CG2 4.42Å; L1166-V1180 PolarHBondContact N-O 3.25Å; L1166-V1180 PolarHBondContact O-N 3.29Å; L1166-L1198 HydrophobicContact CD1-CD1 4.16Å; L1166-L1198 HydrophobicContact CD1-CD2 4.27Å; L1166-L1198 HydrophobicContact CD2-CD1 4.36Å; L1166-L1198 HydrophobicContact CD2-CD2 3.69Å; L1166-T1200 HydrophobicContact CD2-CG2 4.06Å; L1166-Y1210 HydrophobicContact CD2-CD2 4.43Å; L1166-Y1210 HydrophobicContact CD2-CE2 4.28Å
1167	Y	97.7	Very high	96.1	Very high	12 Å²	12	16.1 Å²	16.1	5%	0.047	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	143.5	172.7	-70.5	-75.8	0	0	0	110.3	L1140 H1141 A1158 S1159 C1165 W1169 Q1179	L1140-Y1167 HydrophobicContact CB-CD1 4.36Å; L1140-Y1167 HydrophobicContact CB-CD2 4.44Å; L1140-Y1167 HydrophobicContact CB-CE1 3.85Å; L1140-Y1167 HydrophobicContact CB-CE2 3.94Å; L1140-Y1167 HydrophobicContact CD1-CD1 4.19Å; L1140-Y1167 HydrophobicContact CD1-CE1 4.02Å; L1140-Y1167 WeakPolarHBondContact O-CE2 3.38Å; L1140-Y1167 VanDerWaalsContact O-CZ 3.24Å; L1140-Y1167 PolarHBondContact O-OH 3.29Å; H1141-Y1167 AromaticContact CE1-CD2 3.57Å; H1141-Y1167 AromaticContact CE1-CE2 4Å; H1141-Y1167 AromaticContact ND1-CD2 3.82Å; H1141-Y1167 AromaticContact ND1-CE2 3.77Å; H1141-Y1167 AromaticContact NE2-CD2 3.75Å; A1158-Y1167 CarbonylContact C-O 3.6Å; A1158-Y1167 VanDerWaalsContact CA-O 3.29Å; A1158-Y1167 WeakPolarHBondContact CA-O 3.31Å; S1159-Y1167 PolarHBondContact N-O 3.49Å; S1159-Y1167 PolarHBondContact O-N 3.45Å; C1165-Y1167 HydrophobicContact CB-CD2 4.1Å; C1165-Y1167 HydrophobicContact CB-CE2 3.62Å; Y1167-W1169 HydrophobicContact CD2-CZ2 4.29Å; Y1167-W1169 HydrophobicContact CG-CZ2 4.14Å; Y1167-Q1179 HydrophobicContact CD1-CB 3.82Å; Y1167-Q1179 HydrophobicContact CD1-CG 3.81Å; Y1167-Q1179 HydrophobicContact CE1-CB 3.74Å; Y1167-Q1179 HydrophobicContact CE1-CG 3.4Å; Y1167-Q1179 VanDerWaalsContact CE1-CG 3.4Å; Y1167-Q1179 PolarHBondContact OH-NE2 3.07Å
1168	A	97.8	Very high	95.9	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.5	167.3	0	0	0	0	0	110.7	W1156 F1157 L1177 F1178	W1156-A1168 HydrophobicContact CE3-CB 3.93Å; W1156-A1168 HydrophobicContact CZ3-CB 4.05Å; F1157-A1168 WeakPolarHBondContact O-CA 3.37Å; A1168-L1177 HydrophobicContact CB-CB 4.23Å; A1168-L1177 PolarHBondContact O-N 2.92Å; A1168-F1178 HydrophobicContact CB-CD1 3.69Å; A1168-F1178 HydrophobicContact CB-CD2 3.94Å; A1168-F1178 HydrophobicContact CB-CE1 3.4Å; A1168-F1178 HydrophobicContact CB-CE2 3.65Å; A1168-F1178 HydrophobicContact CB-CG 3.95Å; A1168-F1178 HydrophobicContact CB-CZ 3.37Å; A1168-F1178 PolarHBondContact N-O 3.45Å
1169	W	97.4	Very high	95.8	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	135.7	-167.2	-55.7	97.2	0	0	0	111.5	Y873 L1138 L1140 W1156 F1157 S1159 Y1167 A1175	Y873-W1169 HydrophobicContact CD2-CZ3 4Å; Y873-W1169 AromaticContact CE2-CZ3 3.99Å; Y873-W1169 HydrophobicContact CE2-CZ3 3.99Å; L1138-W1169 HydrophobicContact CB-CE3 4.37Å; L1138-W1169 HydrophobicContact CB-CH2 3.76Å; L1138-W1169 HydrophobicContact CB-CZ2 4.37Å; L1138-W1169 HydrophobicContact CB-CZ3 3.79Å; L1138-W1169 HydrophobicContact CD1-CD2 3.96Å; L1138-W1169 HydrophobicContact CD1-CE3 3.78Å; L1138-W1169 HydrophobicContact CD1-CG 4.39Å; L1138-W1169 HydrophobicContact CD1-CZ3 4.07Å; L1138-W1169 HydrophobicContact CG-CZ3 4.38Å; L1140-W1169 HydrophobicContact CB-CH2 3.65Å; L1140-W1169 HydrophobicContact CB-CZ2 4.29Å; L1140-W1169 HydrophobicContact CB-CZ3 4.47Å; L1140-W1169 HydrophobicContact CD1-CH2 3.75Å; L1140-W1169 HydrophobicContact CD1-CZ3 3.76Å; L1140-W1169 HydrophobicContact CG-CH2 3.77Å; L1140-W1169 HydrophobicContact CG-CZ3 4.12Å; W1156-W1169 CarbonylContact C-O 3.54Å; W1156-W1169 WeakPolarHBondContact CA-O 3.21Å; W1156-W1169 VanDerWaalsContact CB-O 3.26Å; W1156-W1169 WeakPolarHBondContact CB-O 3.41Å; F1157-W1169 HydrophobicContact CD1-CB 4.03Å; F1157-W1169 HydrophobicContact CD2-CB 4.08Å; F1157-W1169 AromaticContact CD2-CD1 3.71Å; F1157-W1169 HydrophobicContact CD2-CG 4.21Å; F1157-W1169 HydrophobicContact CE1-CB 3.65Å; F1157-W1169 HydrophobicContact CE1-CG 4.45Å; F1157-W1169 HydrophobicContact CE2-CB 3.71Å; F1157-W1169 AromaticContact CE2-CD1 3.37Å; F1157-W1169 AromaticContact CE2-CG 3.66Å; F1157-W1169 HydrophobicContact CE2-CG 3.66Å; F1157-W1169 HydrophobicContact CG-CB 4.23Å; F1157-W1169 HydrophobicContact CZ-CB 3.48Å; F1157-W1169 VanDerWaalsContact CZ-CB 3.48Å; F1157-W1169 AromaticContact CZ-CG 3.81Å; F1157-W1169 HydrophobicContact CZ-CG 3.81Å; F1157-W1169 PolarHBondContact N-O 2.59Å; F1157-W1169 PolarHBondContact O-N 3.46Å; S1159-W1169 PolarHBondContact OG-NE1 3.06Å; Y1167-W1169 HydrophobicContact CD2-CZ2 4.29Å; Y1167-W1169 HydrophobicContact CG-CZ2 4.14Å; W1169-A1175 CarbonylContact C-O 3.56Å; W1169-A1175 WeakPolarHBondContact CA-O 3.47Å
1170	R	96.2	Very high	95.7	Very high	42 Å²	42	22.6 Å²	22.6	16%	0.158	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	123.1	174	-170.8	66.5	174.1	93.9	5.4	111.5	A892 I898 L1155 P1172 Y1173 G1174 A1175 L1177	A892-R1170 VanDerWaalsContact O-CD 3.3Å; A892-R1170 WeakPolarHBondContact O-CD 3.42Å; A892-R1170 WeakPolarHBondContact O-CG 3.47Å; I898-R1170 VanDerWaalsContact CD1-CZ 3.45Å; I898-R1170 VanDerWaalsContact CD1-NE 3.31Å; L1155-R1170 PolarHBondContact O-NH1 3.17Å; R1170-P1172 CarbonylContact O-C 3.59Å; R1170-Y1173 HydrophobicContact CB-CD2 4.45Å; R1170-Y1173 HydrophobicContact CB-CE2 3.84Å; R1170-Y1173 HydrophobicContact CG-CD2 4.43Å; R1170-Y1173 HydrophobicContact CG-CE2 3.47Å; R1170-Y1173 VanDerWaalsContact CG-CE2 3.47Å; R1170-Y1173 WeakPolarHBondContact CG-OH 3.3Å; R1170-Y1173 PolarHBondContact O-N 3.49Å; R1170-G1174 VanDerWaalsContact O-CA 3.32Å; R1170-G1174 WeakPolarHBondContact O-CA 3.48Å; R1170-G1174 PolarHBondContact O-N 3.39Å; R1170-A1175 HydrophobicContact CB-CB 3.86Å; R1170-A1175 PolarHBondContact N-O 3.34Å; R1170-L1177 HydrophobicContact CB-CD1 4.36Å; R1170-L1177 HydrophobicContact CB-CD2 4.13Å; R1170-L1177 HydrophobicContact CB-CG 4.33Å
1171	T	95.5	Very high	95.6	Very high	13 Å²	13	27.9 Å²	27.9	8%	0.08	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	136.3	176.1	-49.6	0	0	0	0	111.2	F1150 G1154 L1155 W1156	F1150-T1171 HydrophobicContact CE1-CG2 3.92Å; F1150-T1171 WeakPolarHBondContact CE1-OG1 3.34Å; G1154-T1171 WeakPolarHBondContact O-CB 3.36Å; G1154-T1171 WeakPolarHBondContact O-CG2 3.38Å; G1154-T1171 PolarHBondContact O-OG1 2.7Å; L1155-T1171 WeakPolarHBondContact O-CB 3.38Å; L1155-T1171 PolarHBondContact O-N 3.31Å; L1155-T1171 PolarHBondContact O-OG1 2.83Å; W1156-T1171 PolarHBondContact N-OG1 2.85Å
1172	P	93.8	Very high	95.6	Very high	21 Å²	21	28.5 Å²	28.5	14%	0.136	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	cis	-95.8	-18.4	-6.4	37.1	-35.2	0	0	0	114.2	W1115 V1127 Y1136 R1170 G1174	W1115-P1172 HydrophobicContact CD2-CB 3.59Å; W1115-P1172 HydrophobicContact CD2-CG 4.36Å; W1115-P1172 VanDerWaalsContact CE2-CB 3.49Å; W1115-P1172 HydrophobicContact CE3-CB 3.98Å; W1115-P1172 HydrophobicContact CG-CB 4Å; W1115-P1172 HydrophobicContact CH2-CB 4.2Å; W1115-P1172 HydrophobicContact CH2-CG 4.25Å; W1115-P1172 HydrophobicContact CZ2-CB 3.83Å; W1115-P1172 HydrophobicContact CZ2-CG 3.7Å; W1115-P1172 HydrophobicContact CZ3-CB 4.26Å; V1127-P1172 HydrophobicContact CG1-CB 4.39Å; Y1136-P1172 HydrophobicContact CD2-CB 4.2Å; Y1136-P1172 HydrophobicContact CE2-CB 4Å; Y1136-P1172 HydrophobicContact CE2-CG 3.89Å; R1170-P1172 CarbonylContact O-C 3.59Å; P1172-G1174 VanDerWaalsContact C-N 3.28Å; P1172-G1174 PolarHBondContact O-N 2.88Å
1173	Y	91.6	Very high	95.6	Very high	49 Å²	49	31.8 Å²	31.8	19%	0.192	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-3.5	-167.4	46.4	-109.6	0	0	0	115	S874 F888 A892 R1170 A1175	S874-Y1173 PolarHBondContact OG-O 3.39Å; F888-Y1173 AromaticContact CD1-CD2 3.93Å; F888-Y1173 HydrophobicContact CD1-CD2 3.93Å; F888-Y1173 HydrophobicContact CD1-CE2 4.3Å; F888-Y1173 AromaticContact CE1-CD2 3.84Å; F888-Y1173 HydrophobicContact CE1-CD2 3.84Å; A892-Y1173 HydrophobicContact CB-CE2 3.82Å; R1170-Y1173 HydrophobicContact CB-CD2 4.45Å; R1170-Y1173 HydrophobicContact CB-CE2 3.84Å; R1170-Y1173 HydrophobicContact CG-CD2 4.43Å; R1170-Y1173 HydrophobicContact CG-CE2 3.47Å; R1170-Y1173 VanDerWaalsContact CG-CE2 3.47Å; R1170-Y1173 WeakPolarHBondContact CG-OH 3.3Å; R1170-Y1173 PolarHBondContact O-N 3.49Å; Y1173-A1175 HydrophobicContact CD2-CB 4.2Å; Y1173-A1175 HydrophobicContact CE2-CB 3.96Å
1174	G	93.9	Very high	95.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.16	C	C	.	.			trans	65.7	48.9	171	0	0	0	0	0	114.7	Y873 R1170 P1172	Y873-G1174 WeakPolarHBondContact CE2-O 3.45Å; R1170-G1174 VanDerWaalsContact O-CA 3.32Å; R1170-G1174 WeakPolarHBondContact O-CA 3.48Å; R1170-G1174 PolarHBondContact O-N 3.39Å; P1172-G1174 VanDerWaalsContact C-N 3.28Å; P1172-G1174 PolarHBondContact O-N 2.88Å
1175	A	93.7	Very high	95.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.153	C	C	.	.			trans	-67.5	135.4	161.6	0	0	0	0	0	109.2	F888 A892 F893 W1169 R1170 Y1173 L1177	F888-A1175 HydrophobicContact CD1-CB 3.74Å; F888-A1175 HydrophobicContact CD2-CB 4.21Å; F888-A1175 HydrophobicContact CE1-CB 3.77Å; F888-A1175 HydrophobicContact CE2-CB 4.23Å; F888-A1175 HydrophobicContact CG-CB 3.96Å; F888-A1175 HydrophobicContact CZ-CB 4.01Å; A892-A1175 HydrophobicContact CB-CB 3.99Å; F893-A1175 HydrophobicContact CE1-CB 4.05Å; F893-A1175 HydrophobicContact CZ-CB 4.16Å; W1169-A1175 CarbonylContact C-O 3.56Å; W1169-A1175 WeakPolarHBondContact CA-O 3.47Å; R1170-A1175 HydrophobicContact CB-CB 3.86Å; R1170-A1175 PolarHBondContact N-O 3.34Å; Y1173-A1175 HydrophobicContact CD2-CB 4.2Å; Y1173-A1175 HydrophobicContact CE2-CB 3.96Å; A1175-L1177 PolarHBondContact O-N 2.98Å
1176	N	95.3	Very high	95.6	Very high	31 Å²	31	30.5 Å²	30.5	17%	0.166	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	118.6	178.6	-177.6	19	0	0	0	110.3	Y873 F893 L1140 F1178	Y873-N1176 HydrophobicContact CE2-CB 4.17Å; Y873-N1176 VanDerWaalsContact OH-CB 3.28Å; Y873-N1176 WeakPolarHBondContact OH-CB 3.33Å; Y873-N1176 PolarHBondContact OH-N 3.3Å; F893-N1176 WeakPolarHBondContact CD1-O 3.43Å; F893-N1176 WeakPolarHBondContact CE1-O 3.46Å; L1140-N1176 HydrophobicContact CD1-CB 3.75Å; N1176-F1178 PolarHBondContact OD1-O 3.48Å
1177	L	94.9	Very high	95.5	Very high	20 Å²	20	31.7 Å²	31.7	11%	0.105	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-43.1	-177.4	-59.4	179.5	0	0	0	111.5	A892 I898 P899 W1156 A1168 R1170 A1175	A892-L1177 WeakPolarHBondContact O-CD2 3.34Å; I898-L1177 HydrophobicContact CG2-CD1 3.93Å; I898-L1177 HydrophobicContact CG2-CD2 3.63Å; I898-L1177 HydrophobicContact CG2-CG 4.4Å; P899-L1177 HydrophobicContact CG-CD1 4.04Å; W1156-L1177 HydrophobicContact CB-CD1 3.67Å; W1156-L1177 HydrophobicContact CG-CD1 4.35Å; A1168-L1177 HydrophobicContact CB-CB 4.23Å; A1168-L1177 PolarHBondContact O-N 2.92Å; R1170-L1177 HydrophobicContact CB-CD1 4.36Å; R1170-L1177 HydrophobicContact CB-CD2 4.13Å; R1170-L1177 HydrophobicContact CB-CG 4.33Å; A1175-L1177 PolarHBondContact O-N 2.98Å
1178	F	95.2	Very high	95.5	Very high	16 Å²	16	31.5 Å²	31.5	7%	0.07	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	154.2	168.9	62	-103.8	0	0	0	111.1	P899 A902 W1156 L1166 A1168 N1176 V1180 I1212	P899-F1178 HydrophobicContact CB-CD1 4.26Å; P899-F1178 HydrophobicContact CB-CE1 3.89Å; P899-F1178 HydrophobicContact CG-CD1 4.27Å; P899-F1178 HydrophobicContact CG-CE1 3.84Å; A902-F1178 HydrophobicContact CB-CD2 3.85Å; A902-F1178 HydrophobicContact CB-CE1 4.28Å; A902-F1178 HydrophobicContact CB-CE2 3.42Å; A902-F1178 VanDerWaalsContact CB-CE2 3.42Å; A902-F1178 HydrophobicContact CB-CG 4.46Å; A902-F1178 HydrophobicContact CB-CZ 3.66Å; W1156-F1178 HydrophobicContact CZ3-CZ 4.33Å; L1166-F1178 HydrophobicContact CD2-CE2 4.39Å; L1166-F1178 HydrophobicContact CG-CE2 4.48Å; A1168-F1178 HydrophobicContact CB-CD1 3.69Å; A1168-F1178 HydrophobicContact CB-CD2 3.94Å; A1168-F1178 HydrophobicContact CB-CE1 3.4Å; A1168-F1178 HydrophobicContact CB-CE2 3.65Å; A1168-F1178 HydrophobicContact CB-CG 3.95Å; A1168-F1178 HydrophobicContact CB-CZ 3.37Å; A1168-F1178 PolarHBondContact N-O 3.45Å; N1176-F1178 PolarHBondContact OD1-O 3.48Å; F1178-V1180 HydrophobicContact CD2-CG2 4.28Å; F1178-I1212 HydrophobicContact CE1-CD1 4.31Å; F1178-I1212 HydrophobicContact CZ-CD1 3.89Å
1179	Q	95.6	Very high	95.5	Very high	92 Å²	92	32.1 Å²	32.1	43%	0.43	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	139.1	169.6	180	-179.9	11.9	0	0	109.7	L1166 Y1167	L1166-Q1179 WeakPolarHBondContact O-CA 3.16Å; Y1167-Q1179 HydrophobicContact CD1-CB 3.82Å; Y1167-Q1179 HydrophobicContact CD1-CG 3.81Å; Y1167-Q1179 HydrophobicContact CE1-CB 3.74Å; Y1167-Q1179 HydrophobicContact CE1-CG 3.4Å; Y1167-Q1179 VanDerWaalsContact CE1-CG 3.4Å; Y1167-Q1179 PolarHBondContact OH-NE2 3.07Å
1180	V	96.8	Very high	95.5	Very high	27 Å²	27	32.8 Å²	32.8	16%	0.164	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	134.1	165.8	-178.5	0	0	0	0	108.3	A902 C1165 L1166 F1178 Y1210	A902-V1180 HydrophobicContact CB-CG2 4.02Å; C1165-V1180 WeakPolarHBondContact CA-O 3.31Å; L1166-V1180 HydrophobicContact CB-CB 4.32Å; L1166-V1180 HydrophobicContact CD2-CB 4.31Å; L1166-V1180 HydrophobicContact CD2-CG2 4.42Å; L1166-V1180 PolarHBondContact N-O 3.25Å; L1166-V1180 PolarHBondContact O-N 3.29Å; F1178-V1180 HydrophobicContact CD2-CG2 4.28Å; V1180-Y1210 HydrophobicContact CG1-CE1 3.83Å; V1180-Y1210 HydrophobicContact CG2-CE1 4.31Å
1181	K	96	Very high	95.6	Very high	112 Å²	112	30.8 Å²	30.8	49%	0.487	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	121.1	172	-161.4	152.9	-168.1	146.2	0	109.2	E1142 D1163 H1164	E1142-K1181 IonicContact OE2-NZ 2.91Å; E1142-K1181 PolarHBondContact OE2-NZ 3.33Å; D1163-K1181 VanDerWaalsContact O-CE 3.3Å; D1163-K1181 WeakPolarHBondContact O-CE 3.31Å; D1163-K1181 PolarHBondContact O-NZ 3.01Å; H1164-K1181 HydrophobicContact CB-CG 4.4Å; H1164-K1181 WeakPolarHBondContact O-CA 3.24Å
1182	E	95.2	Very high	95.5	Very high	13 Å²	13	30.2 Å²	30.2	6%	0.061	16%	0.156	C	C	.	.			trans	-91	176.9	175.9	-70.7	-149	-119	0	0	111.7	H1164 S1184 V1186 T1200 K1206 T1208 Y1210	H1164-E1182 WeakPolarHBondContact CB-O 3.41Å; H1164-E1182 PolarHBondContact O-N 3.46Å; E1182-S1184 VanDerWaalsContact C-N 3.27Å; E1182-S1184 PolarHBondContact O-N 3.5Å; E1182-V1186 HydrophobicContact CB-CG2 3.86Å; E1182-V1186 HydrophobicContact CG-CG2 3.98Å; E1182-T1200 VanDerWaalsContact OE1-CB 3.29Å; E1182-T1200 WeakPolarHBondContact OE1-CB 3.47Å; E1182-T1200 PolarHBondContact OE1-OG1 3.32Å; E1182-K1206 IonicContact OE2-NZ 3.52Å; E1182-K1206 PolarHBondContact OE2-NZ 2.98Å; E1182-T1208 PolarHBondContact OE2-OG1 3.46Å; E1182-Y1210 WeakPolarHBondContact CG-OH 3.44Å
1183	N	93.7	Very high	95.5	Very high	137 Å²	137	34.1 Å²	34.1	73%	0.733	18%	0.176	S	C	*	.	S	Bend	trans	-77.1	-10.8	-177.7	-61.6	-11.7	0	0	0	113.5
1184	S	96	Very high	95.5	Very high	30 Å²	30	35.1 Å²	35.1	21%	0.21	18%	0.184	C	C	.	.	S	Bend	trans	-160.4	174.6	-176	-159.9	0	0	0	0	111.6	H1164 E1182 V1186	H1164-S1184 WeakPolarHBondContact CA-O 3.43Å; H1164-S1184 VanDerWaalsContact CB-O 3.26Å; H1164-S1184 WeakPolarHBondContact CB-O 3.34Å; H1164-S1184 VanDerWaalsContact CG-C 3.45Å; H1164-S1184 VanDerWaalsContact ND1-C 3.31Å; E1182-S1184 VanDerWaalsContact C-N 3.27Å; E1182-S1184 PolarHBondContact O-N 3.5Å; S1184-V1186 PolarHBondContact O-N 3.44Å
1185	S	96.1	Very high	95.6	Very high	25 Å²	25	35.6 Å²	35.6	18%	0.175	19%	0.187	C	C	.	.			trans	-54.6	129.2	-179.7	-57.2	0	0	0	0	111.4	K1162 H1164 G1203	K1162-S1185 WeakPolarHBondContact O-CB 3.45Å; K1162-S1185 PolarHBondContact O-OG 2.86Å; H1164-S1185 PolarHBondContact ND1-N 2.99Å; H1164-S1185 VanDerWaalsContact ND1-N 3.15Å; S1185-G1203 PolarHBondContact O-N 3.05Å
1186	V	97.6	Very high	95.6	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	106.3	-177	-175	0	0	0	0	109	T1160 G1161 E1182 S1184 T1200	T1160-V1186 WeakPolarHBondContact CB-O 3.46Å; T1160-V1186 HydrophobicContact CG2-CB 4.42Å; T1160-V1186 HydrophobicContact CG2-CG1 3.68Å; T1160-V1186 PolarHBondContact OG1-O 3.4Å; G1161-V1186 PolarHBondContact O-N 3.47Å; E1182-V1186 HydrophobicContact CB-CG2 3.86Å; E1182-V1186 HydrophobicContact CG-CG2 3.98Å; S1184-V1186 PolarHBondContact O-N 3.44Å; V1186-T1200 HydrophobicContact CG1-CG2 3.86Å
1187	L	96.6	Very high	95.7	Very high	26 Å²	26	40.6 Å²	40.6	14%	0.136	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	-29.7	-162.3	-57.2	174.7	0	0	0	113.7	V913 L1146 G1201	V913-L1187 HydrophobicContact CG1-CD1 3.2Å; L1146-L1187 HydrophobicContact CD1-CD2 3.64Å; L1187-G1201 PolarHBondContact N-O 3.32Å
1188	S	97.5	Very high	95.8	Very high	8 Å²	8	39.7 Å²	39.7	6%	0.056	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	150.4	-176	57.1	0	0	0	0	111.3	V914 A916 S1147 T1200 G1201	V914-S1188 PolarHBondContact O-OG 3.22Å; A916-S1188 WeakPolarHBondContact CA-OG 3.41Å; A916-S1188 PolarHBondContact N-OG 3.12Å; S1147-S1188 WeakPolarHBondContact OG-CA 3.41Å; S1188-T1200 CarbonylContact O-C 3.55Å; S1188-T1200 WeakPolarHBondContact O-CA 3.38Å; S1188-G1201 PolarHBondContact N-O 2.94Å; S1188-G1201 PolarHBondContact O-N 2.89Å
1189	C	97.7	Very high	95.9	Very high	13 Å²	13	39 Å²	39	9%	0.088	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	154.3	170.5	65.2	0	0	0	0	112.4	S1147 T1160 V1199	S1147-C1189 PolarHBondContact OG-N 3.09Å; T1160-C1189 HydrophobicContact CG2-CB 3.8Å; C1189-V1199 CarbonylContact C-O 3.53Å; C1189-V1199 WeakPolarHBondContact CA-O 3.43Å
1190	D	97.7	Very high	96	Very high	13 Å²	13	34.6 Å²	34.6	7%	0.07	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	157.2	165.6	-159.2	12.9	0	0	0	109.9	V917 T918 I919 K1149 L1198 V1199	V917-D1190 HydrophobicContact CG2-CB 4.22Å; T918-D1190 WeakPolarHBondContact CA-OD2 3.46Å; T918-D1190 WeakPolarHBondContact CB-OD2 3.49Å; T918-D1190 PolarHBondContact OG1-OD2 3.44Å; I919-D1190 HydrophobicContact CG1-CB 4.36Å; I919-D1190 PolarHBondContact N-OD2 3.11Å; I919-D1190 VanDerWaalsContact N-OD2 3.15Å; K1149-D1190 WeakPolarHBondContact CE-OD1 3.33Å; D1190-L1198 WeakPolarHBondContact O-CA 3.44Å; D1190-V1199 PolarHBondContact N-O 3.38Å; D1190-V1199 PolarHBondContact O-N 2.73Å
1191	I	96.8	Very high	96	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	143.5	-175.9	-60.3	175.2	0	0	0	108.1	K1149 H1152 W1156 A1158 L1197 L1198	K1149-I1191 HydrophobicContact CB-CD1 4.21Å; K1149-I1191 HydrophobicContact CB-CG1 4.37Å; K1149-I1191 HydrophobicContact CG-CB 4.07Å; K1149-I1191 HydrophobicContact CG-CD1 3.86Å; K1149-I1191 HydrophobicContact CG-CG1 3.78Å; K1149-I1191 WeakPolarHBondContact O-CD1 3.38Å; H1152-I1191 PolarHBondContact CE1-O 3.11Å; H1152-I1191 VanDerWaalsContact CE1-O 3.32Å; W1156-I1191 HydrophobicContact CH2-CD1 3.91Å; W1156-I1191 HydrophobicContact CZ3-CD1 4.01Å; A1158-I1191 HydrophobicContact CB-CD1 4.13Å; I1191-L1197 CarbonylContact C-O 3.54Å; I1191-L1197 WeakPolarHBondContact CA-O 3.45Å; I1191-L1198 HydrophobicContact CD1-CD1 4.32Å; I1191-L1198 HydrophobicContact CG1-CB 4.46Å; I1191-L1198 HydrophobicContact CG1-CD1 4.15Å; I1191-L1198 HydrophobicContact CG1-CG 4.13Å
1192	S	94.9	Very high	96.1	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.149	C	C	.	.			trans	-72.9	158	178	61.8	0	0	0	0	112.8	N921 H1152 D1194 D1195 K1196 L1197	N921-S1192 WeakPolarHBondContact OD1-CA 3.5Å; N921-S1192 WeakPolarHBondContact OD1-CB 3.42Å; H1152-S1192 PolarHBondContact CE1-O 3.11Å; H1152-S1192 VanDerWaalsContact CE1-O 3.27Å; H1152-S1192 PolarHBondContact ND1-O 3.04Å; S1192-D1194 VanDerWaalsContact CB-OD1 3.29Å; S1192-D1194 WeakPolarHBondContact CB-OD1 3.39Å; S1192-D1194 PolarHBondContact O-N 2.94Å; S1192-D1194 VanDerWaalsContact O-N 3.15Å; S1192-D1194 PolarHBondContact OG-OD1 3.32Å; S1192-D1195 WeakPolarHBondContact O-CA 3.35Å; S1192-D1195 PolarHBondContact O-N 3.07Å; S1192-K1196 PolarHBondContact OG-N 3.31Å; S1192-L1197 PolarHBondContact N-O 3.49Å; S1192-L1197 PolarHBondContact OG-N 3.21Å; S1192-L1197 PolarHBondContact OG-O 3.43Å
1193	L	92.6	Very high	96	Very high	104 Å²	104	28.4 Å²	28.4	55%	0.545	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-21.1	-177.1	-151.5	79.8	0	0	0	113.8	N921 H1152	N921-L1193 HydrophobicContact CB-CB 3.92Å; N921-L1193 PolarHBondContact OD1-N 3.35Å; H1152-L1193 WeakPolarHBondContact ND1-CA 3.4Å
1194	D	92.7	Very high	96	Very high	69 Å²	69	23.9 Å²	23.9	37%	0.369	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	8.4	176.3	71.6	-25.4	0	0	0	113.3	S1192 K1196	S1192-D1194 VanDerWaalsContact CB-OD1 3.29Å; S1192-D1194 WeakPolarHBondContact CB-OD1 3.39Å; S1192-D1194 PolarHBondContact O-N 2.94Å; S1192-D1194 VanDerWaalsContact O-N 3.15Å; S1192-D1194 PolarHBondContact OG-OD1 3.32Å; D1194-K1196 WeakPolarHBondContact O-CG 3.45Å; D1194-K1196 PolarHBondContact O-N 3.35Å; D1194-K1196 PolarHBondContact OD1-N 2.9Å; D1194-K1196 WeakPolarHBondContact OD2-CG 3.43Å; D1194-K1196 IonicContact OD2-NZ 3.35Å; D1194-K1196 PolarHBondContact OD2-NZ 3.36Å
1195	D	95.6	Very high	96	Very high	11 Å²	11	29.2 Å²	29.2	6%	0.059	15%	0.148	C	C	.	.	S	Bend	trans	54.1	16.7	-179.8	-58.8	-24.6	0	0	0	115.6	A1151 H1152 S1153 S1192 Y1214	A1151-D1195 HydrophobicContact CB-CB 4.41Å; A1151-D1195 WeakPolarHBondContact CB-OD2 3.35Å; H1152-D1195 IonicContact CG-OD1 2.61Å; H1152-D1195 VanDerWaalsContact N-CG 3.3Å; H1152-D1195 PolarHBondContact N-OD1 3.36Å; H1152-D1195 PolarHBondContact N-OD2 3.27Å; H1152-D1195 VanDerWaalsContact N-OD2 3.08Å; H1152-D1195 IonicContact ND1-OD1 3.15Å; H1152-D1195 PolarHBondContact ND1-OD1 2.97Å; S1153-D1195 VanDerWaalsContact CB-OD2 3.28Å; S1153-D1195 WeakPolarHBondContact CB-OD2 3.29Å; S1153-D1195 PolarHBondContact N-OD2 3.14Å; S1153-D1195 PolarHBondContact OG-OD2 3.2Å; S1192-D1195 WeakPolarHBondContact O-CA 3.35Å; S1192-D1195 PolarHBondContact O-N 3.07Å; D1195-Y1214 VanDerWaalsContact CB-OH 3.29Å; D1195-Y1214 WeakPolarHBondContact CB-OH 3.36Å; D1195-Y1214 WeakPolarHBondContact O-CE2 3.46Å; D1195-Y1214 PolarHBondContact O-OH 3.35Å
1196	K	94	Very high	96	Very high	114 Å²	114	29.6 Å²	29.6	50%	0.496	15%	0.147	S	C	.	.			trans	-89.2	-22.3	179.8	-61.1	-159.9	-157.5	83.4	0	114.8	S1192 D1194 I1212	S1192-K1196 PolarHBondContact OG-N 3.31Å; D1194-K1196 WeakPolarHBondContact O-CG 3.45Å; D1194-K1196 PolarHBondContact O-N 3.35Å; D1194-K1196 PolarHBondContact OD1-N 2.9Å; D1194-K1196 WeakPolarHBondContact OD2-CG 3.43Å; D1194-K1196 IonicContact OD2-NZ 3.35Å; D1194-K1196 PolarHBondContact OD2-NZ 3.36Å; K1196-I1212 PolarHBondContact O-N 3.19Å
1197	L	95.8	Very high	96	Very high	22 Å²	22	29.6 Å²	29.6	12%	0.115	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	134.3	-179.3	-64	173	0	0	0	110.3	I905 L939 I1191 S1192 V1209 Y1210	I905-L1197 HydrophobicContact CD1-CD2 4.01Å; L939-L1197 HydrophobicContact CD1-CD1 3.64Å; I1191-L1197 CarbonylContact C-O 3.54Å; I1191-L1197 WeakPolarHBondContact CA-O 3.45Å; S1192-L1197 PolarHBondContact N-O 3.49Å; S1192-L1197 PolarHBondContact OG-N 3.21Å; S1192-L1197 PolarHBondContact OG-O 3.43Å; L1197-V1209 HydrophobicContact CD2-CG1 4.44Å; L1197-Y1210 WeakPolarHBondContact CA-O 3.48Å
1198	L	97.2	Very high	96	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	132.7	170	-176.6	157.8	0	0	0	108.2	W1156 A1158 L1166 D1190 I1191 T1200 Y1210 I1212	W1156-L1198 HydrophobicContact CH2-CD1 4.19Å; W1156-L1198 HydrophobicContact CZ3-CD1 4.26Å; A1158-L1198 HydrophobicContact CB-CD1 3.79Å; L1166-L1198 HydrophobicContact CD1-CD1 4.16Å; L1166-L1198 HydrophobicContact CD1-CD2 4.27Å; L1166-L1198 HydrophobicContact CD2-CD1 4.36Å; L1166-L1198 HydrophobicContact CD2-CD2 3.69Å; D1190-L1198 WeakPolarHBondContact O-CA 3.44Å; I1191-L1198 HydrophobicContact CD1-CD1 4.32Å; I1191-L1198 HydrophobicContact CG1-CB 4.46Å; I1191-L1198 HydrophobicContact CG1-CD1 4.15Å; I1191-L1198 HydrophobicContact CG1-CG 4.13Å; L1198-T1200 HydrophobicContact CD2-CG2 3.68Å; L1198-Y1210 HydrophobicContact CD2-CD2 3.94Å; L1198-Y1210 PolarHBondContact N-O 2.93Å; L1198-Y1210 PolarHBondContact O-N 3.19Å; L1198-I1212 HydrophobicContact CB-CD1 3.82Å; L1198-I1212 HydrophobicContact CB-CG1 4.15Å; L1198-I1212 HydrophobicContact CD1-CD1 4.4Å
1199	V	97.4	Very high	95.9	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.006	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	134.6	176.9	177.7	0	0	0	0	109.2	V917 I919 I926 C1189 D1190 A1207 T1208 V1209	V917-V1199 HydrophobicContact CB-CG1 3.97Å; V917-V1199 HydrophobicContact CG1-CG1 4.03Å; V917-V1199 HydrophobicContact CG2-CG1 4.17Å; I919-V1199 HydrophobicContact CD1-CB 4.16Å; I919-V1199 HydrophobicContact CD1-CG2 3.6Å; I919-V1199 HydrophobicContact CG1-CB 4.31Å; I919-V1199 HydrophobicContact CG1-CG2 3.81Å; I926-V1199 HydrophobicContact CD1-CG2 3.56Å; I926-V1199 HydrophobicContact CG1-CG2 4.07Å; I926-V1199 HydrophobicContact CG2-CG1 3.99Å; I926-V1199 HydrophobicContact CG2-CG2 4.41Å; C1189-V1199 CarbonylContact C-O 3.53Å; C1189-V1199 WeakPolarHBondContact CA-O 3.43Å; D1190-V1199 PolarHBondContact N-O 3.38Å; D1190-V1199 PolarHBondContact O-N 2.73Å; V1199-A1207 HydrophobicContact CG1-CB 4.41Å; V1199-T1208 WeakPolarHBondContact CA-O 3.19Å; V1199-V1209 HydrophobicContact CG2-CG1 4.12Å; V1199-V1209 HydrophobicContact CG2-CG2 4.27Å
1200	T	98.3	Very high	95.9	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	149.3	172.7	58.9	0	0	0	0	111.3	L1166 E1182 V1186 S1188 L1198 A1207 T1208 Y1210	L1166-T1200 HydrophobicContact CD2-CG2 4.06Å; E1182-T1200 VanDerWaalsContact OE1-CB 3.29Å; E1182-T1200 WeakPolarHBondContact OE1-CB 3.47Å; E1182-T1200 PolarHBondContact OE1-OG1 3.32Å; V1186-T1200 HydrophobicContact CG1-CG2 3.86Å; S1188-T1200 CarbonylContact O-C 3.55Å; S1188-T1200 WeakPolarHBondContact O-CA 3.38Å; L1198-T1200 HydrophobicContact CD2-CG2 3.68Å; T1200-A1207 CarbonylContact O-C 3.49Å; T1200-A1207 WeakPolarHBondContact O-CA 3.43Å; T1200-A1207 WeakPolarHBondContact O-CB 3.48Å; T1200-T1208 PolarHBondContact N-O 2.95Å; T1200-T1208 PolarHBondContact O-N 2.69Å; T1200-T1208 WeakPolarHBondContact OG1-CB 3.36Å; T1200-T1208 PolarHBondContact OG1-O 3.12Å; T1200-Y1210 HydrophobicContact CG2-CD2 4.39Å; T1200-Y1210 HydrophobicContact CG2-CE2 3.91Å
1201	G	97.7	Very high	95.8	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	130.2	166.8	0	0	0	0	0	110.9	V914 L1187 S1188	V914-G1201 CarbonylContact O-C 3.55Å; V914-G1201 WeakPolarHBondContact O-CA 3.38Å; L1187-G1201 PolarHBondContact N-O 3.32Å; S1188-G1201 PolarHBondContact N-O 2.94Å; S1188-G1201 PolarHBondContact O-N 2.89Å
1202	S	96.2	Very high	95.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	154.3	-167.7	177.6	0	0	0	0	114.1	V914 D1204 R1205 K1206	V914-S1202 PolarHBondContact N-O 2.93Å; S1202-D1204 WeakPolarHBondContact CB-OD1 3.28Å; S1202-D1204 PolarHBondContact O-N 3.46Å; S1202-D1204 PolarHBondContact OG-N 2.82Å; S1202-D1204 PolarHBondContact OG-OD1 3.29Å; S1202-D1204 PolarHBondContact OG-OD2 3.48Å; S1202-R1205 PolarHBondContact O-N 3.38Å; S1202-K1206 PolarHBondContact N-O 2.99Å
1203	G	94.4	Very high	95.8	Very high	23 Å²	23	34.4 Å²	34.4	24%	0.237	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-18.9	174	0	0	0	0	0	115	S1185 R1205	S1185-G1203 PolarHBondContact O-N 3.05Å; G1203-R1205 PolarHBondContact O-N 3.07Å
1204	D	93.9	Very high	95.9	Very high	41 Å²	41	34.6 Å²	34.6	22%	0.219	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-5.6	174.8	54.5	26.3	0	0	0	113.9	S1202 K1206	S1202-D1204 WeakPolarHBondContact CB-OD1 3.28Å; S1202-D1204 PolarHBondContact O-N 3.46Å; S1202-D1204 PolarHBondContact OG-N 2.82Å; S1202-D1204 PolarHBondContact OG-OD1 3.29Å; S1202-D1204 PolarHBondContact OG-OD2 3.48Å; D1204-K1206 WeakPolarHBondContact OD1-CE 3.35Å; D1204-K1206 WeakPolarHBondContact OD1-CG 3.5Å; D1204-K1206 PolarHBondContact OD1-N 3.49Å; D1204-K1206 WeakPolarHBondContact OD2-CE 3.49Å; D1204-K1206 IonicContact OD2-NZ 3.88Å
1205	R	96	Very high	96	Very high	142 Å²	142	32.9 Å²	32.9	54%	0.536	15%	0.151	S	C	.	.	S	Bend	trans	84.1	26.7	175.2	-49.6	162.2	-67.2	-170	-1.8	115.4	H910 G911 E912 V913 S1202 G1203	H910-R1205 PolarHBondContact N-O 3.3Å; G911-R1205 PolarHBondContact N-O 3.18Å; E912-R1205 WeakPolarHBondContact O-CA 3.42Å; E912-R1205 WeakPolarHBondContact O-CB 3.48Å; V913-R1205 HydrophobicContact CG2-CG 3.81Å; S1202-R1205 PolarHBondContact O-N 3.38Å; G1203-R1205 PolarHBondContact O-N 3.07Å
1206	K	95.6	Very high	96	Very high	33 Å²	33	34.1 Å²	34.1	14%	0.143	16%	0.156	C	C	.	.			trans	-123.2	169.7	166	51.9	155	-170.1	134	0	111	C907 L908 V914 E1182 S1202 D1204 T1208	C907-K1206 WeakPolarHBondContact SG-CD 3.45Å; L908-K1206 CarbonylContact O-C 3.59Å; L908-K1206 VanDerWaalsContact O-CA 3.25Å; L908-K1206 WeakPolarHBondContact O-CA 3.32Å; L908-K1206 WeakPolarHBondContact O-CB 3.38Å; V914-K1206 WeakPolarHBondContact CG2-O 3.33Å; E1182-K1206 IonicContact OE2-NZ 3.52Å; E1182-K1206 PolarHBondContact OE2-NZ 2.98Å; S1202-K1206 PolarHBondContact N-O 2.99Å; D1204-K1206 WeakPolarHBondContact OD1-CE 3.35Å; D1204-K1206 WeakPolarHBondContact OD1-CG 3.5Å; D1204-K1206 PolarHBondContact OD1-N 3.49Å; D1204-K1206 WeakPolarHBondContact OD2-CE 3.49Å; D1204-K1206 IonicContact OD2-NZ 3.88Å; K1206-T1208 PolarHBondContact NZ-OG1 3.49Å
1207	A	97	Very high	96.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	145.2	158.1	0	0	0	0	0	110	L908 V914 V917 T928 V1199 T1200	L908-A1207 HydrophobicContact CB-CB 4.1Å; L908-A1207 WeakPolarHBondContact CB-O 3.43Å; L908-A1207 HydrophobicContact CD1-CB 4.2Å; L908-A1207 PolarHBondContact N-O 2.89Å; L908-A1207 PolarHBondContact O-N 2.9Å; V914-A1207 HydrophobicContact CG1-CB 4.36Å; V917-A1207 HydrophobicContact CG1-CB 4.26Å; T928-A1207 HydrophobicContact CG2-CB 3.72Å; V1199-A1207 HydrophobicContact CG1-CB 4.41Å; T1200-A1207 CarbonylContact O-C 3.49Å; T1200-A1207 WeakPolarHBondContact O-CA 3.43Å; T1200-A1207 WeakPolarHBondContact O-CB 3.48Å
1208	T	96.8	Very high	96.2	Very high	6 Å²	6	30.1 Å²	30.1	4%	0.037	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	136.9	178	-47.8	0	0	0	0	109.4	A904 E1182 V1199 T1200 K1206 Y1210	A904-T1208 HydrophobicContact CB-CG2 4.17Å; E1182-T1208 PolarHBondContact OE2-OG1 3.46Å; V1199-T1208 WeakPolarHBondContact CA-O 3.19Å; T1200-T1208 PolarHBondContact N-O 2.95Å; T1200-T1208 PolarHBondContact O-N 2.69Å; T1200-T1208 WeakPolarHBondContact OG1-CB 3.36Å; T1200-T1208 PolarHBondContact OG1-O 3.12Å; K1206-T1208 PolarHBondContact NZ-OG1 3.49Å; T1208-Y1210 HydrophobicContact CG2-CD2 4.3Å; T1208-Y1210 HydrophobicContact CG2-CE1 4.18Å; T1208-Y1210 HydrophobicContact CG2-CE2 3.58Å
1209	V	96.6	Very high	96.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	126.7	177.6	-169.7	0	0	0	0	109.2	I905 H906 L908 I926 L939 L1197 V1199	I905-V1209 HydrophobicContact CD1-CG1 4.05Å; I905-V1209 HydrophobicContact CG1-CB 4.19Å; I905-V1209 HydrophobicContact CG1-CG1 4.05Å; I905-V1209 VanDerWaalsContact CG1-O 3.31Å; I905-V1209 WeakPolarHBondContact CG1-O 3.26Å; I905-V1209 PolarHBondContact N-O 3.22Å; H906-V1209 HydrophobicContact CB-CB 3.99Å; H906-V1209 HydrophobicContact CB-CG2 3.92Å; H906-V1209 PolarHBondContact N-O 2.79Å; H906-V1209 PolarHBondContact O-N 3.34Å; L908-V1209 HydrophobicContact CD1-CG2 3.72Å; L908-V1209 HydrophobicContact CD2-CG2 4.36Å; L908-V1209 HydrophobicContact CG-CG2 3.95Å; I926-V1209 HydrophobicContact CD1-CB 4.48Å; I926-V1209 HydrophobicContact CD1-CG1 4.13Å; I926-V1209 HydrophobicContact CD1-CG2 3.5Å; I926-V1209 VanDerWaalsContact CD1-CG2 3.5Å; L939-V1209 HydrophobicContact CD1-CG1 4.38Å; L939-V1209 HydrophobicContact CD2-CG1 4.47Å; L1197-V1209 HydrophobicContact CD2-CG1 4.44Å; V1199-V1209 HydrophobicContact CG2-CG1 4.12Å; V1199-V1209 HydrophobicContact CG2-CG2 4.27Å
1210	Y	97	Very high	96	Very high	10 Å²	10	34 Å²	34	4%	0.039	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	131.1	179.6	-62	-89.6	0	0	0	111	A902 K903 A904 L1166 V1180 E1182 L1197 L1198 T1200 T1208	A902-Y1210 HydrophobicContact CB-CD1 3.97Å; A902-Y1210 HydrophobicContact CB-CG 4.26Å; K903-Y1210 CarbonylContact O-C 3.59Å; K903-Y1210 VanDerWaalsContact O-CA 3.31Å; K903-Y1210 WeakPolarHBondContact O-CA 3.45Å; A904-Y1210 HydrophobicContact CB-CD1 4.07Å; A904-Y1210 HydrophobicContact CB-CE1 3.84Å; L1166-Y1210 HydrophobicContact CD2-CD2 4.43Å; L1166-Y1210 HydrophobicContact CD2-CE2 4.28Å; V1180-Y1210 HydrophobicContact CG1-CE1 3.83Å; V1180-Y1210 HydrophobicContact CG2-CE1 4.31Å; E1182-Y1210 WeakPolarHBondContact CG-OH 3.44Å; L1197-Y1210 WeakPolarHBondContact CA-O 3.48Å; L1198-Y1210 HydrophobicContact CD2-CD2 3.94Å; L1198-Y1210 PolarHBondContact N-O 2.93Å; L1198-Y1210 PolarHBondContact O-N 3.19Å; T1200-Y1210 HydrophobicContact CG2-CD2 4.39Å; T1200-Y1210 HydrophobicContact CG2-CE2 3.91Å; T1208-Y1210 HydrophobicContact CG2-CD2 4.3Å; T1208-Y1210 HydrophobicContact CG2-CE1 4.18Å; T1208-Y1210 HydrophobicContact CG2-CE2 3.58Å
1211	E	96.2	Very high	95.9	Very high	77 Å²	77	36.4 Å²	36.4	36%	0.36	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	124.7	160.8	-179.6	177.1	-142.7	0	0	108.2	K903 I905	K903-E1211 HydrophobicContact CB-CB 4.5Å; K903-E1211 WeakPolarHBondContact CD-OE2 3.3Å; K903-E1211 WeakPolarHBondContact CE-OE2 3.42Å; K903-E1211 PolarHBondContact N-O 3.15Å; K903-E1211 IonicContact NZ-OE2 2.72Å; K903-E1211 PolarHBondContact NZ-OE2 2.95Å; K903-E1211 PolarHBondContact O-N 2.85Å; I905-E1211 HydrophobicContact CD1-CB 4.29Å; I905-E1211 HydrophobicContact CG2-CB 3.82Å
1212	I	96.4	Very high	95.7	Very high	8 Å²	8	39.2 Å²	39.2	4%	0.041	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	120.4	177.2	-56.3	-57.1	0	0	0	108.9	P899 A902 W1156 F1178 K1196 L1198 Y1214	P899-I1212 HydrophobicContact CB-CG2 3.42Å; P899-I1212 VanDerWaalsContact CB-CG2 3.42Å; P899-I1212 HydrophobicContact CG-CG2 4.38Å; A902-I1212 HydrophobicContact CB-CD1 3.84Å; W1156-I1212 HydrophobicContact CH2-CD1 4.35Å; W1156-I1212 HydrophobicContact CH2-CG1 4.34Å; W1156-I1212 HydrophobicContact CZ2-CG2 4.21Å; F1178-I1212 HydrophobicContact CE1-CD1 4.31Å; F1178-I1212 HydrophobicContact CZ-CD1 3.89Å; K1196-I1212 PolarHBondContact O-N 3.19Å; L1198-I1212 HydrophobicContact CB-CD1 3.82Å; L1198-I1212 HydrophobicContact CB-CG1 4.15Å; L1198-I1212 HydrophobicContact CD1-CD1 4.4Å; I1212-Y1214 HydrophobicContact CB-CE2 4.01Å; I1212-Y1214 HydrophobicContact CG2-CD2 4.13Å; I1212-Y1214 HydrophobicContact CG2-CE1 4.38Å; I1212-Y1214 HydrophobicContact CG2-CE2 3.48Å; I1212-Y1214 VanDerWaalsContact CG2-CE2 3.48Å
1213	I	94.9	Very high	95.7	Very high	61 Å²	61	42.5 Å²	42.5	31%	0.313	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	130	-179.8	-53.9	179.7	0	0	0	108.7	P899 H900 Q901 K903	P899-I1213 WeakPolarHBondContact CA-O 3.25Å; H900-I1213 PolarHBondContact N-O 3.06Å; Q901-I1213 HydrophobicContact CB-CB 4.3Å; Q901-I1213 HydrophobicContact CB-CD1 4.35Å; Q901-I1213 PolarHBondContact N-O 2.99Å; Q901-I1213 PolarHBondContact O-N 3.19Å; K903-I1213 HydrophobicContact CB-CD1 4.01Å; K903-I1213 HydrophobicContact CB-CG1 4.5Å; K903-I1213 HydrophobicContact CD-CD1 4.14Å
1214	Y	93.4	Very high	95.8	Very high	109 Å²	109	44.3 Å²	44.3	43%	0.427	19%	0.192	S	C	.	.			trans	-120	0	177.9	-64.9	-87.6	0	0	0	110.4	P899 W1156 D1195 I1212	P899-Y1214 HydrophobicContact CB-CD1 4.15Å; P899-Y1214 HydrophobicContact CB-CE1 3.87Å; P899-Y1214 HydrophobicContact CG-CE1 4.35Å; W1156-Y1214 WeakPolarHBondContact CZ2-OH 3.22Å; W1156-Y1214 PolarHBondContact NE1-OH 3.02Å; D1195-Y1214 VanDerWaalsContact CB-OH 3.29Å; D1195-Y1214 WeakPolarHBondContact CB-OH 3.36Å; D1195-Y1214 WeakPolarHBondContact O-CE2 3.46Å; D1195-Y1214 PolarHBondContact O-OH 3.35Å; I1212-Y1214 HydrophobicContact CB-CE2 4.01Å; I1212-Y1214 HydrophobicContact CG2-CD2 4.13Å; I1212-Y1214 HydrophobicContact CG2-CE1 4.38Å; I1212-Y1214 HydrophobicContact CG2-CE2 3.48Å; I1212-Y1214 VanDerWaalsContact CG2-CE2 3.48Å

Retrieved 1,214 of 1,214 residues in 1618.7 ms (Link to these results)

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