A0A096M3U5_POEFO Loading...

SKICH domain-containing protein

AlphaFold DB , UniProt , Accession A0A096M3U5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 576 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.1	Very low	34	Very low	237 Å²	237	136.5 Å²	136.5	100%	1.167	85%	0.846	S	S	*	*				0	66.5	0	-80.1	-179.8	164.3	0	0	106.7
2	E	37.4	Very low	34.4	Very low	180 Å²	180	133.3 Å²	133.3	84%	0.841	84%	0.842	S	S	*	*				50.9	99.4	80.4	-75.3	-172.5	154.9	0	0	112.2
3	T	31.2	Very low	34.5	Very low	141 Å²	141	132.9 Å²	132.9	87%	0.865	84%	0.838	S	S	*	*			trans	-141.5	107.7	139.8	34.7	0	0	0	0	106.8
4	L	32.5	Very low	34.5	Very low	161 Å²	161	133.9 Å²	133.9	84%	0.843	83%	0.834	S	S	*	*			trans	-70.7	137.7	171.6	-80.3	149.6	0	0	0	109.3
5	P	39.3	Very low	34.8	Very low	121 Å²	121	131.3 Å²	131.3	79%	0.786	82%	0.82	S	S	*	*			trans	-83.4	129.6	158.7	-0.8	19.6	0	0	0	109.8
6	E	29.8	Very low	35.2	Very low	186 Å²	186	128.1 Å²	128.1	87%	0.869	80%	0.801	S	S	*	*			trans	-44.9	127.3	173	-160.5	166.6	-174.3	0	0	112.6	A8	E6-A8 PolarHBondContact O-N 3.18Å
7	A	34.1	Very low	35.8	Very low	98 Å²	98	125.9 Å²	125.9	81%	0.81	80%	0.798	S	S	*	*			trans	-64	99.8	174.8	0	0	0	0	0	109.7	A9	A7-A9 PolarHBondContact O-N 3.07Å
8	A	32.8	Very low	36.7	Very low	99 Å²	99	131 Å²	131	82%	0.818	80%	0.799	S	S	*	*			trans	-65.2	104.7	162.6	0	0	0	0	0	107.6	E6 A10	E6-A8 PolarHBondContact O-N 3.18Å; A8-A10 PolarHBondContact O-N 2.91Å
9	A	32.5	Very low	38	Very low	93 Å²	93	125.7 Å²	125.7	77%	0.769	77%	0.767	S	S	*	*			trans	-45.1	125.6	173	0	0	0	0	0	110	A7 A11	A7-A9 PolarHBondContact O-N 3.07Å; A9-A11 VanDerWaalsContact C-N 3.32Å; A9-A11 PolarHBondContact O-N 2.98Å
10	A	36.3	Very low	39.3	Very low	102 Å²	102	125 Å²	125	84%	0.843	75%	0.753	S	S	*	*			trans	-55.6	97.4	167.2	0	0	0	0	0	108.7	A8 A12	A8-A10 PolarHBondContact O-N 2.91Å; A10-A12 PolarHBondContact O-N 2.94Å
11	A	30.3	Very low	41.2	Very low	84 Å²	84	123 Å²	123	69%	0.694	75%	0.745	S	S	*	*			trans	-68.5	94.6	157.3	0	0	0	0	0	105.7	A9 T13	A9-A11 VanDerWaalsContact C-N 3.32Å; A9-A11 PolarHBondContact O-N 2.98Å; A11-T13 PolarHBondContact O-N 3.35Å; A11-T13 PolarHBondContact O-OG1 3.33Å
12	A	37.9	Very low	43.5	Very low	97 Å²	97	114 Å²	114	80%	0.802	70%	0.7	S	S	*	*			trans	-58.7	92.7	157.8	0	0	0	0	0	106.5	A10 D14	A10-A12 PolarHBondContact O-N 2.94Å; A12-D14 PolarHBondContact O-N 2.81Å; A12-D14 VanDerWaalsContact O-N 3.11Å
13	T	35.7	Very low	46.1	Very low	129 Å²	129	105.6 Å²	105.6	79%	0.791	66%	0.661	S	S	*	*			trans	-66.3	106.1	169	-4.3	0	0	0	0	106.5	A11	A11-T13 PolarHBondContact O-N 3.35Å; A11-T13 PolarHBondContact O-OG1 3.33Å
14	D	35.5	Very low	49	Very low	146 Å²	146	102.3 Å²	102.3	78%	0.781	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-47.6	131.6	156.4	-91.6	-33.5	0	0	0	108.2	A12	A12-D14 PolarHBondContact O-N 2.81Å; A12-D14 VanDerWaalsContact O-N 3.11Å
15	P	38	Very low	52	Low	95 Å²	95	95.6 Å²	95.6	62%	0.617	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-61.7	124.8	178.5	23.8	-30.3	0	0	0	108.3	A17	P15-A17 PolarHBondContact O-N 3.22Å
16	P	42	Very low	54.4	Low	81 Å²	81	93.3 Å²	93.3	53%	0.526	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-64	127.3	-175.6	24.4	-32.3	0	0	0	109.2	R18 T19	P16-R18 PolarHBondContact O-N 3.06Å; P16-T19 PolarHBondContact O-N 3.46Å; P16-T19 PolarHBondContact O-OG1 2.94Å; P16-T19 VanDerWaalsContact O-OG1 3.11Å
17	A	44.8	Very low	57.3	Low	90 Å²	90	90.5 Å²	90.5	74%	0.744	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	0.4	178.6	0	0	0	0	0	115.4	P15	P15-A17 PolarHBondContact O-N 3.22Å
18	R	52.5	Low	60.1	Low	218 Å²	218	87.1 Å²	87.1	82%	0.823	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-7.7	-179.9	-66.3	-174.4	178	176.6	-0	114.6	P16	P16-R18 PolarHBondContact O-N 3.06Å
19	T	61	Low	62.9	Low	30 Å²	30	84.9 Å²	84.9	18%	0.184	52%	0.52	C	S	.	.	S	Bend	trans	-82.2	-16.7	-178	38.6	0	0	0	0	114.6	P16	P16-T19 PolarHBondContact O-N 3.46Å; P16-T19 PolarHBondContact O-OG1 2.94Å; P16-T19 VanDerWaalsContact O-OG1 3.11Å
20	F	63.3	Low	65.5	Low	112 Å²	112	90.2 Å²	90.2	49%	0.491	52%	0.522	S	S	.	.	S	Bend	trans	-100.1	-0.4	-172.5	-58	-72.5	0	0	0	115.1	V115 R116 G117	F20-V115 HydrophobicContact CD1-CB 4.45Å; F20-V115 WeakPolarHBondContact CD1-O 3.44Å; F20-R116 CarbonylContact C-O 3.57Å; F20-R116 VanDerWaalsContact C-O 3.3Å; F20-R116 CarbonylContact O-C 3.56Å; F20-G117 WeakPolarHBondContact O-CA 3.4Å
21	S	79.7	Confident	68	Low	84 Å²	84	86.4 Å²	86.4	59%	0.587	49%	0.489	S	S	*	.	S	Bend	trans	-122.3	25.3	-178.9	-52.5	0	0	0	0	112.6	V23	S21-V23 VanDerWaalsContact C-N 3.32Å
22	Q	87.6	Confident	70.9	Confident	48 Å²	48	83.6 Å²	83.6	22%	0.224	46%	0.461	C	S	.	.	S	Bend	trans	-79.1	-23.9	178	-65.1	178.2	-13.6	0	0	111.5	N45 F48 R116	Q22-N45 WeakPolarHBondContact O-CB 3.42Å; Q22-N45 PolarHBondContact O-N 2.84Å; Q22-F48 HydrophobicContact CB-CB 4.39Å; Q22-F48 HydrophobicContact CB-CD2 4.05Å; Q22-F48 HydrophobicContact CB-CG 4.25Å; Q22-R116 HydrophobicContact CB-CB 4.4Å; Q22-R116 PolarHBondContact N-O 3.19Å
23	V	91	Very high	73.2	Confident	3 Å²	3	81.2 Å²	81.2	2%	0.018	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	128.6	172.8	-176.6	0	0	0	0	109.3	S21 F42 T43 L44 F48 Y108 R116 G117	S21-V23 VanDerWaalsContact C-N 3.32Å; V23-F42 HydrophobicContact CG1-CB 3.96Å; V23-F42 HydrophobicContact CG1-CD2 3.62Å; V23-F42 HydrophobicContact CG1-CE2 4.45Å; V23-F42 HydrophobicContact CG1-CG 4.08Å; V23-T43 WeakPolarHBondContact CA-O 3.45Å; V23-L44 HydrophobicContact CB-CD2 4.18Å; V23-L44 HydrophobicContact CG1-CD2 3.96Å; V23-L44 HydrophobicContact CG2-CD2 3.41Å; V23-L44 VanDerWaalsContact CG2-CD2 3.41Å; V23-F48 HydrophobicContact CG2-CD1 4.38Å; V23-F48 HydrophobicContact CG2-CE1 4.15Å; V23-Y108 HydrophobicContact CB-CD2 4.31Å; V23-Y108 HydrophobicContact CB-CG 4.06Å; V23-Y108 HydrophobicContact CG1-CD2 3.76Å; V23-Y108 HydrophobicContact CG1-CE2 4.49Å; V23-Y108 HydrophobicContact CG1-CG 3.95Å; V23-Y108 HydrophobicContact CG2-CD1 3.76Å; V23-Y108 HydrophobicContact CG2-CD2 3.93Å; V23-Y108 HydrophobicContact CG2-CE1 4.13Å; V23-Y108 HydrophobicContact CG2-CE2 4.26Å; V23-Y108 HydrophobicContact CG2-CG 3.65Å; V23-R116 HydrophobicContact CG2-CB 3.99Å; V23-R116 PolarHBondContact N-O 2.87Å; V23-G117 VanDerWaalsContact O-CA 3.29Å; V23-G117 WeakPolarHBondContact O-CA 3.45Å
24	V	92.7	Very high	75.4	Confident	71 Å²	71	75.9 Å²	75.9	43%	0.43	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	120	-179.1	-176.9	0	0	0	0	109.5	M26 F42 T43	V24-M26 HydrophobicContact CG1-SD 3.91Å; V24-F42 CarbonylContact O-C 3.35Å; V24-F42 WeakPolarHBondContact O-CA 3.49Å; V24-F42 WeakPolarHBondContact O-CB 3.35Å; V24-T43 PolarHBondContact N-O 2.95Å; V24-T43 PolarHBondContact O-N 3.43Å
25	F	94.3	Very high	77.5	Confident	21 Å²	21	72.7 Å²	72.7	9%	0.092	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	135.1	173.8	-68.5	-84.8	0	0	0	110.3	I28 R41 F42 V56 F106	F25-I28 HydrophobicContact CB-CD1 4.14Å; F25-I28 HydrophobicContact CB-CG1 3.95Å; F25-R41 WeakPolarHBondContact CA-O 3.27Å; F25-F42 HydrophobicContact CD1-CB 3.85Å; F25-F42 HydrophobicContact CE1-CB 4.1Å; F25-F42 HydrophobicContact CE1-CD1 4.25Å; F25-F42 HydrophobicContact CE1-CG 4.39Å; F25-F42 HydrophobicContact CG-CB 4.34Å; F25-V56 HydrophobicContact CE1-CG1 3.82Å; F25-V56 HydrophobicContact CZ-CG1 3.94Å; F25-F106 HydrophobicContact CD1-CB 3.85Å; F25-F106 HydrophobicContact CD1-CG 4.42Å; F25-F106 HydrophobicContact CD2-CB 4.45Å; F25-F106 HydrophobicContact CE1-CB 3.51Å; F25-F106 HydrophobicContact CE1-CG 4.28Å; F25-F106 HydrophobicContact CE2-CB 4.15Å; F25-F106 HydrophobicContact CG-CB 4.31Å; F25-F106 HydrophobicContact CZ-CB 3.68Å
26	M	91.6	Very high	79.8	Confident	73 Å²	73	70.5 Å²	70.5	36%	0.36	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	146.6	-173.3	-56.9	-62.5	-67.4	0	0	110.4	V24 I28 R41 T43	V24-M26 HydrophobicContact CG1-SD 3.91Å; M26-I28 VanDerWaalsContact C-N 3.34Å; M26-I28 WeakPolarHBondContact O-CD1 3.25Å; M26-I28 PolarHBondContact O-N 2.99Å; M26-R41 HydrophobicContact CB-CB 4.45Å; M26-R41 PolarHBondContact N-O 3.28Å; M26-T43 HydrophobicContact CG-CG2 4.16Å
27	D	90.1	Very high	82.1	Confident	127 Å²	127	70.7 Å²	70.7	68%	0.679	38%	0.382	S	S	*	.	S	Bend	trans	52.2	44.7	172	-52.8	-33.7	0	0	0	114.3	P29	D27-P29 VanDerWaalsContact O-CD 3.31Å; D27-P29 WeakPolarHBondContact O-CD 3.32Å
28	I	93.5	Very high	84.4	Confident	26 Å²	26	66.8 Å²	66.8	13%	0.133	35%	0.349	C	S	.	.			trans	-83.3	111.4	179.5	-53.8	-58.8	0	0	0	109.3	F25 M26 C40 F106 F122	F25-I28 HydrophobicContact CB-CD1 4.14Å; F25-I28 HydrophobicContact CB-CG1 3.95Å; M26-I28 VanDerWaalsContact C-N 3.34Å; M26-I28 WeakPolarHBondContact O-CD1 3.25Å; M26-I28 PolarHBondContact O-N 2.99Å; I28-C40 HydrophobicContact CD1-CB 4.27Å; I28-F106 HydrophobicContact CD1-CD2 3.85Å; I28-F106 HydrophobicContact CD1-CE2 3.94Å; I28-F106 HydrophobicContact CG2-CE2 4.49Å; I28-F122 HydrophobicContact CG2-CD1 3.7Å; I28-F122 HydrophobicContact CG2-CE1 4.38Å; I28-F122 HydrophobicContact CG2-CG 4.47Å
29	P	89.8	Confident	86.3	Confident	52 Å²	52	59.5 Å²	59.5	34%	0.338	33%	0.329	S	S	.	.			trans	-71.2	158.1	176.8	33.4	-34.3	0	0	0	110.7	D27 S31 Y32 F122	D27-P29 VanDerWaalsContact O-CD 3.31Å; D27-P29 WeakPolarHBondContact O-CD 3.32Å; P29-S31 PolarHBondContact O-N 3.21Å; P29-Y32 WeakPolarHBondContact CD-OH 3.42Å; P29-Y32 HydrophobicContact CG-CD1 3.75Å; P29-Y32 HydrophobicContact CG-CD2 4.4Å; P29-Y32 HydrophobicContact CG-CE1 3.29Å; P29-Y32 HydrophobicContact CG-CE2 3.99Å; P29-Y32 HydrophobicContact CG-CG 4.32Å; P29-Y32 VanDerWaalsContact CG-CZ 3.46Å; P29-F122 VanDerWaalsContact O-CB 3.28Å; P29-F122 WeakPolarHBondContact O-CB 3.49Å
30	Y	87.9	Confident	87.8	Confident	206 Å²	206	58.1 Å²	58.1	81%	0.808	32%	0.32	S	S	*	.	S	Bend	trans	-65.5	-18.3	175.9	-67.5	-76	0	0	0	113.6	F122 C123	Y30-F122 WeakPolarHBondContact O-CA 3.44Å; Y30-C123 PolarHBondContact O-N 2.93Å; Y30-C123 VanDerWaalsContact O-N 3.1Å; Y30-C123 PolarHBondContact O-SG 3.47Å; Y30-C123 VanDerWaalsContact O-SG 3.41Å
31	S	89.8	Confident	89.2	Confident	22 Å²	22	57.9 Å²	57.9	15%	0.154	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	146.9	-179.2	63.2	0	0	0	0	112.4	P29 C123 Q130	P29-S31 PolarHBondContact O-N 3.21Å; S31-C123 CarbonylContact C-O 3.59Å; S31-C123 VanDerWaalsContact CA-O 3.24Å; S31-C123 WeakPolarHBondContact CA-O 3.32Å; S31-Q130 VanDerWaalsContact CB-NE2 3.26Å; S31-Q130 PolarHBondContact OG-NE2 3.35Å
32	Y	90.1	Very high	89.9	Confident	24 Å²	24	53.9 Å²	53.9	9%	0.094	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	147.1	165.7	-67.3	-73.6	0	0	0	111.2	P29 I38 F106 F122 C123 F124 R125	P29-Y32 WeakPolarHBondContact CD-OH 3.42Å; P29-Y32 HydrophobicContact CG-CD1 3.75Å; P29-Y32 HydrophobicContact CG-CD2 4.4Å; P29-Y32 HydrophobicContact CG-CE1 3.29Å; P29-Y32 HydrophobicContact CG-CE2 3.99Å; P29-Y32 HydrophobicContact CG-CG 4.32Å; P29-Y32 VanDerWaalsContact CG-CZ 3.46Å; Y32-I38 HydrophobicContact CD1-CG2 3.03Å; Y32-I38 HydrophobicContact CD2-CG2 3.92Å; Y32-I38 HydrophobicContact CE1-CG2 3.21Å; Y32-I38 HydrophobicContact CE2-CG2 4.07Å; Y32-I38 HydrophobicContact CG-CG2 3.38Å; Y32-F106 AromaticContact CE2-CE2 3.84Å; Y32-F106 HydrophobicContact CE2-CE2 3.84Å; Y32-F106 AromaticContact CE2-CZ 3.97Å; Y32-F106 HydrophobicContact CE2-CZ 3.97Å; Y32-F122 HydrophobicContact CD2-CB 4.38Å; Y32-F122 AromaticContact CD2-CD2 3.53Å; Y32-F122 HydrophobicContact CD2-CD2 3.53Å; Y32-F122 AromaticContact CD2-CE2 3.89Å; Y32-F122 HydrophobicContact CD2-CE2 3.89Å; Y32-F122 AromaticContact CD2-CG 3.95Å; Y32-F122 HydrophobicContact CD2-CG 3.95Å; Y32-F122 HydrophobicContact CE2-CB 4.38Å; Y32-F122 HydrophobicContact CE2-CD1 4.13Å; Y32-F122 AromaticContact CE2-CD2 3.81Å; Y32-F122 HydrophobicContact CE2-CD2 3.81Å; Y32-F122 HydrophobicContact CE2-CE1 4.35Å; Y32-F122 HydrophobicContact CE2-CE2 4.05Å; Y32-F122 AromaticContact CE2-CG 3.85Å; Y32-F122 HydrophobicContact CE2-CG 3.85Å; Y32-F122 HydrophobicContact CE2-CZ 4.31Å; Y32-C123 PolarHBondContact N-O 3.02Å; Y32-F124 CarbonylContact O-C 3.46Å; Y32-F124 VanDerWaalsContact O-CA 3.25Å; Y32-F124 WeakPolarHBondContact O-CA 3.45Å; Y32-R125 PolarHBondContact O-N 2.97Å
33	P	87	Confident	90.1	Very high	47 Å²	47	53.6 Å²	53.6	31%	0.305	29%	0.289	S	S	.	.			trans	-64.6	131.8	173.9	23.1	-30.5	0	0	0	111.1	S35	P33-S35 PolarHBondContact O-N 3.1Å
34	P	81.3	Confident	89.9	Confident	18 Å²	18	54.9 Å²	54.9	12%	0.117	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.6	-176.5	-24.7	32.9	0	0	0	115	F124	P34-F124 HydrophobicContact CG-CB 4.31Å
35	S	79.7	Confident	89.5	Confident	79 Å²	79	55.7 Å²	55.7	55%	0.552	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.5	42.9	-175.1	-60.3	0	0	0	0	112.5	P33 E93	P33-S35 PolarHBondContact O-N 3.1Å; S35-E93 WeakPolarHBondContact CA-OE1 3.48Å; S35-E93 WeakPolarHBondContact CB-OE1 3.39Å; S35-E93 VanDerWaalsContact O-CD 3.32Å
36	S	86.6	Confident	88.2	Confident	48 Å²	48	60.7 Å²	60.7	34%	0.336	34%	0.336	S	S	.	.	S	Bend	trans	-146.1	147.7	172.9	-60.1	0	0	0	0	111.8	L96	S36-L96 WeakPolarHBondContact O-CD1 3.26Å
37	P	91.1	Very high	87.4	Confident	85 Å²	85	61.5 Å²	61.5	55%	0.552	35%	0.354	S	S	*	.			trans	-62.3	142.8	172.3	28.1	-34.6	0	0	0	110.1	F91	P37-F91 VanDerWaalsContact CA-O 3.3Å; P37-F91 WeakPolarHBondContact CA-O 3.39Å; P37-F91 WeakPolarHBondContact CB-O 3.36Å
38	I	92.1	Very high	87	Confident	8 Å²	8	56.9 Å²	56.9	4%	0.041	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	145.6	178	1.8	165	0	0	0	110.6	Y32 I58 A90 F91 L96 F106 F124	Y32-I38 HydrophobicContact CD1-CG2 3.03Å; Y32-I38 HydrophobicContact CD2-CG2 3.92Å; Y32-I38 HydrophobicContact CE1-CG2 3.21Å; Y32-I38 HydrophobicContact CE2-CG2 4.07Å; Y32-I38 HydrophobicContact CG-CG2 3.38Å; I38-I58 HydrophobicContact CD1-CD1 3.84Å; I38-A90 CarbonylContact O-C 3.57Å; I38-A90 WeakPolarHBondContact O-CA 3.37Å; I38-F91 HydrophobicContact CD1-CB 4.34Å; I38-F91 HydrophobicContact CG1-CB 4.15Å; I38-F91 PolarHBondContact N-O 3.29Å; I38-F91 PolarHBondContact O-N 3.12Å; I38-L96 HydrophobicContact CD1-CD1 3.76Å; I38-L96 HydrophobicContact CD1-CD2 3.47Å; I38-L96 VanDerWaalsContact CD1-CD2 3.47Å; I38-L96 HydrophobicContact CD1-CG 4.21Å; I38-L96 HydrophobicContact CG1-CD1 3.3Å; I38-L96 HydrophobicContact CG1-CD2 3.71Å; I38-L96 HydrophobicContact CG1-CG 4.12Å; I38-F106 HydrophobicContact CD1-CZ 4.36Å; I38-F124 HydrophobicContact CD1-CE1 3.46Å; I38-F124 VanDerWaalsContact CD1-CE1 3.46Å; I38-F124 HydrophobicContact CD1-CZ 3.57Å; I38-F124 HydrophobicContact CG1-CE1 4.28Å
39	T	92.5	Very high	86.4	Confident	66 Å²	66	64.1 Å²	64.1	41%	0.405	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	116	171	-59.2	0	0	0	0	108.5	Q88 A89	T39-Q88 HydrophobicContact CG2-CB 3.91Å; T39-Q88 HydrophobicContact CG2-CG 4.44Å; T39-A89 WeakPolarHBondContact CA-O 3.33Å
40	C	92.4	Very high	86.2	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.007	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	138.5	173.3	67.8	0	0	0	0	109.7	I28 Q88 A89 F106	I28-C40 HydrophobicContact CD1-CB 4.27Å; C40-Q88 WeakPolarHBondContact O-CA 3.44Å; C40-A89 PolarHBondContact N-O 3.39Å; C40-A89 PolarHBondContact O-N 2.85Å; C40-F106 HydrophobicContact CB-CD1 4.22Å; C40-F106 HydrophobicContact CB-CD2 3.76Å; C40-F106 HydrophobicContact CB-CE1 4.03Å; C40-F106 HydrophobicContact CB-CE2 3.56Å; C40-F106 HydrophobicContact CB-CG 4.11Å; C40-F106 HydrophobicContact CB-CZ 3.71Å
41	R	93.6	Very high	86.2	Confident	106 Å²	106	55.4 Å²	55.4	40%	0.4	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	141.2	176.9	-58.5	-170.9	176	140.3	1.4	109.7	F25 M26 M86 R87 Q88	F25-R41 WeakPolarHBondContact CA-O 3.27Å; M26-R41 HydrophobicContact CB-CB 4.45Å; M26-R41 PolarHBondContact N-O 3.28Å; R41-M86 HydrophobicContact CB-CG 4.44Å; R41-M86 HydrophobicContact CB-SD 4.43Å; R41-R87 CarbonylContact C-O 3.57Å; R41-R87 WeakPolarHBondContact CA-O 3.36Å; R41-Q88 HydrophobicContact CG-CG 4.08Å
42	F	92.7	Very high	86	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	152.2	177.2	61.4	-87.6	0	0	0	111.7	V23 V24 F25 L44 V56 V75 R87 A89 Y108	V23-F42 HydrophobicContact CG1-CB 3.96Å; V23-F42 HydrophobicContact CG1-CD2 3.62Å; V23-F42 HydrophobicContact CG1-CE2 4.45Å; V23-F42 HydrophobicContact CG1-CG 4.08Å; V24-F42 CarbonylContact O-C 3.35Å; V24-F42 WeakPolarHBondContact O-CA 3.49Å; V24-F42 WeakPolarHBondContact O-CB 3.35Å; F25-F42 HydrophobicContact CD1-CB 3.85Å; F25-F42 HydrophobicContact CE1-CB 4.1Å; F25-F42 HydrophobicContact CE1-CD1 4.25Å; F25-F42 HydrophobicContact CE1-CG 4.39Å; F25-F42 HydrophobicContact CG-CB 4.34Å; F42-L44 HydrophobicContact CD2-CD2 4Å; F42-L44 HydrophobicContact CE2-CD2 3.98Å; F42-L44 HydrophobicContact CE2-CG 4.46Å; F42-V56 HydrophobicContact CD1-CG2 4.44Å; F42-V56 HydrophobicContact CE1-CG2 3.89Å; F42-V56 HydrophobicContact CZ-CG2 4.16Å; F42-V75 HydrophobicContact CZ-CG1 4.28Å; F42-V75 HydrophobicContact CZ-CG2 4.26Å; F42-R87 HydrophobicContact CD1-CB 4.41Å; F42-R87 HydrophobicContact CD2-CB 3.95Å; F42-R87 HydrophobicContact CE1-CB 4.02Å; F42-R87 HydrophobicContact CE2-CB 3.53Å; F42-R87 HydrophobicContact CE2-CG 4.23Å; F42-R87 HydrophobicContact CG-CB 4.39Å; F42-R87 HydrophobicContact CZ-CB 3.57Å; F42-R87 PolarHBondContact N-O 3.22Å; F42-R87 WeakPolarHBondContact O-CA 3.32Å; F42-R87 PolarHBondContact O-N 2.82Å; F42-A89 HydrophobicContact CE1-CB 3.95Å; F42-Y108 HydrophobicContact CD2-CD2 4.29Å; F42-Y108 HydrophobicContact CD2-CE2 4.37Å; F42-Y108 AromaticContact CE2-CD2 3.93Å; F42-Y108 HydrophobicContact CE2-CD2 3.93Å; F42-Y108 AromaticContact CE2-CE2 3.65Å; F42-Y108 HydrophobicContact CE2-CE2 3.65Å; F42-Y108 HydrophobicContact CZ-CD2 4.33Å; F42-Y108 HydrophobicContact CZ-CE2 4.09Å
43	T	91.5	Very high	85.9	Confident	42 Å²	42	66.4 Å²	66.4	26%	0.258	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	149.7	174.4	60.4	0	0	0	0	109.9	V23 V24 M26 E85 M86	V23-T43 WeakPolarHBondContact CA-O 3.45Å; V24-T43 PolarHBondContact N-O 2.95Å; V24-T43 PolarHBondContact O-N 3.43Å; M26-T43 HydrophobicContact CG-CG2 4.16Å; T43-E85 WeakPolarHBondContact CA-O 3.35Å; T43-E85 WeakPolarHBondContact CB-O 3.37Å; T43-E85 WeakPolarHBondContact CG2-O 3.06Å; T43-M86 HydrophobicContact CG2-CB 4.39Å
44	L	87.9	Confident	86.2	Confident	30 Å²	30	64.2 Å²	64.2	16%	0.157	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	135.5	175.7	-57.9	-179.3	0	0	0	108.8	V23 F42 F48 P50 R87 Y108	V23-L44 HydrophobicContact CB-CD2 4.18Å; V23-L44 HydrophobicContact CG1-CD2 3.96Å; V23-L44 HydrophobicContact CG2-CD2 3.41Å; V23-L44 VanDerWaalsContact CG2-CD2 3.41Å; F42-L44 HydrophobicContact CD2-CD2 4Å; F42-L44 HydrophobicContact CE2-CD2 3.98Å; F42-L44 HydrophobicContact CE2-CG 4.46Å; L44-F48 HydrophobicContact CB-CD1 4.37Å; L44-F48 HydrophobicContact CD1-CD1 4.28Å; L44-F48 HydrophobicContact CD2-CD1 3.92Å; L44-F48 HydrophobicContact CD2-CE1 4.08Å; L44-F48 HydrophobicContact CG-CD1 4.43Å; L44-P50 HydrophobicContact CD1-CB 3.79Å; L44-P50 HydrophobicContact CD1-CG 3.64Å; L44-R87 VanDerWaalsContact CD1-NE 3.27Å; L44-Y108 HydrophobicContact CD2-CE2 4.11Å
45	N	83.4	Confident	86.9	Confident	88 Å²	88	64.9 Å²	64.9	47%	0.471	37%	0.366	S	S	.	.			trans	-62.7	145.1	172.5	-168.6	-13.6	0	0	0	110.5	Q22 A47 F48	Q22-N45 WeakPolarHBondContact O-CB 3.42Å; Q22-N45 PolarHBondContact O-N 2.84Å; N45-A47 PolarHBondContact O-N 3.35Å; N45-F48 WeakPolarHBondContact O-CB 3.41Å; N45-F48 PolarHBondContact O-N 2.87Å
46	S	67.8	Low	87.7	Confident	126 Å²	126	61.1 Å²	61.1	88%	0.881	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-23	-174.7	57.2	0	0	0	0	114.5
47	A	74.8	Confident	88.2	Confident	90 Å²	90	58.9 Å²	58.9	74%	0.744	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-8.3	175.7	0	0	0	0	0	114.4	N45	N45-A47 PolarHBondContact O-N 3.35Å
48	F	82	Confident	88.5	Confident	30 Å²	30	54.8 Å²	54.8	13%	0.132	30%	0.297	C	S	.	.			trans	-92.5	124.1	-176.5	-177.3	-105.1	0	0	0	111.2	Q22 V23 L44 N45 P50 Y108 D110 R116	Q22-F48 HydrophobicContact CB-CB 4.39Å; Q22-F48 HydrophobicContact CB-CD2 4.05Å; Q22-F48 HydrophobicContact CB-CG 4.25Å; V23-F48 HydrophobicContact CG2-CD1 4.38Å; V23-F48 HydrophobicContact CG2-CE1 4.15Å; L44-F48 HydrophobicContact CB-CD1 4.37Å; L44-F48 HydrophobicContact CD1-CD1 4.28Å; L44-F48 HydrophobicContact CD2-CD1 3.92Å; L44-F48 HydrophobicContact CD2-CE1 4.08Å; L44-F48 HydrophobicContact CG-CD1 4.43Å; N45-F48 WeakPolarHBondContact O-CB 3.41Å; N45-F48 PolarHBondContact O-N 2.87Å; F48-P50 HydrophobicContact CE1-CB 4.35Å; F48-P50 WeakPolarHBondContact O-CD 3.42Å; F48-Y108 AromaticContact CE1-CE1 3.81Å; F48-Y108 HydrophobicContact CE1-CE1 3.81Å; F48-Y108 AromaticContact CE1-CZ 3.96Å; F48-Y108 AromaticContact CZ-CE1 3.78Å; F48-Y108 HydrophobicContact CZ-CE1 3.78Å; F48-D110 HydrophobicContact CZ-CB 4.48Å; F48-R116 HydrophobicContact CE2-CB 4.37Å; F48-R116 HydrophobicContact CE2-CG 3.87Å; F48-R116 HydrophobicContact CZ-CB 4.38Å; F48-R116 HydrophobicContact CZ-CG 4.02Å
49	Q	81.4	Confident	88.6	Confident	178 Å²	178	54.4 Å²	54.4	83%	0.832	30%	0.296	S	S	*	.			trans	-99.1	109.9	177.6	-70	-172.2	-6.3	0	0	110.4
50	P	85.4	Confident	88.8	Confident	47 Å²	47	55.7 Å²	55.7	31%	0.305	30%	0.295	S	S	.	.			trans	-75.6	143.9	-179.3	27.8	-29.7	0	0	0	111.6	L44 F48 D54	L44-P50 HydrophobicContact CD1-CB 3.79Å; L44-P50 HydrophobicContact CD1-CG 3.64Å; F48-P50 HydrophobicContact CE1-CB 4.35Å; F48-P50 WeakPolarHBondContact O-CD 3.42Å; P50-D54 WeakPolarHBondContact CA-OD2 3.39Å
51	S	86.5	Confident	88.9	Confident	28 Å²	28	58.6 Å²	58.6	20%	0.196	31%	0.313	C	S	.	.			trans	-104	150.7	176.1	-159.1	0	0	0	0	111.5	R53 D54 N111	S51-R53 PolarHBondContact O-N 3.03Å; S51-D54 WeakPolarHBondContact CB-OD1 3.37Å; S51-D54 VanDerWaalsContact N-CG 3.3Å; S51-D54 PolarHBondContact N-OD2 3.44Å; S51-D54 VanDerWaalsContact O-CB 3.27Å; S51-D54 WeakPolarHBondContact O-CB 3.26Å; S51-D54 VanDerWaalsContact O-CG 3.3Å; S51-D54 PolarHBondContact O-N 3.43Å; S51-N111 WeakPolarHBondContact CB-ND2 3.41Å; S51-N111 PolarHBondContact OG-ND2 3.08Å
52	P	85.3	Confident	88.8	Confident	89 Å²	89	56.7 Å²	56.7	58%	0.578	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-10.3	170	-21.3	32.8	0	0	0	114.3
53	R	89.3	Confident	88.9	Confident	188 Å²	188	60.1 Å²	60.1	71%	0.709	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	11.6	173.9	-61	-174	-176.3	-158.7	1.2	112.5	S51 W74 N111	S51-R53 PolarHBondContact O-N 3.03Å; R53-W74 HydrophobicContact CB-CZ3 4.46Å; R53-W74 VanDerWaalsContact O-CZ3 3.28Å; R53-W74 WeakPolarHBondContact O-CZ3 3.3Å; R53-N111 HydrophobicContact CB-CB 3.9Å
54	D	93.8	Very high	88.8	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.011	37%	0.365	C	S	.	.			trans	-82.3	150.8	170.2	-62.8	-3.7	0	0	0	109.2	P50 S51 V75 Y108 I109 D110 N111	P50-D54 WeakPolarHBondContact CA-OD2 3.39Å; S51-D54 WeakPolarHBondContact CB-OD1 3.37Å; S51-D54 VanDerWaalsContact N-CG 3.3Å; S51-D54 PolarHBondContact N-OD2 3.44Å; S51-D54 VanDerWaalsContact O-CB 3.27Å; S51-D54 WeakPolarHBondContact O-CB 3.26Å; S51-D54 VanDerWaalsContact O-CG 3.3Å; S51-D54 PolarHBondContact O-N 3.43Å; D54-V75 HydrophobicContact CB-CB 4.3Å; D54-V75 HydrophobicContact CB-CG2 4.11Å; D54-V75 PolarHBondContact O-N 3.32Å; D54-Y108 HydrophobicContact CB-CE1 3.77Å; D54-Y108 WeakPolarHBondContact CB-OH 3.47Å; D54-Y108 PolarHBondContact OD2-OH 3.09Å; D54-I109 WeakPolarHBondContact CA-O 3.39Å; D54-D110 VanDerWaalsContact OD1-CA 3.27Å; D54-D110 WeakPolarHBondContact OD1-CA 3.29Å; D54-N111 PolarHBondContact OD1-N 3.43Å
55	W	95.6	Very high	89.1	Confident	32 Å²	32	64.3 Å²	64.3	12%	0.121	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	153	-177	55.6	-79.5	0	0	0	111.5	F59 T66 Y69 F72 V73 W74 I109	W55-F59 HydrophobicContact CH2-CE2 4.35Å; W55-F59 AromaticContact CH2-CZ 3.8Å; W55-F59 HydrophobicContact CH2-CZ 3.8Å; W55-F59 HydrophobicContact CZ3-CE2 4.08Å; W55-F59 AromaticContact CZ3-CZ 3.99Å; W55-F59 HydrophobicContact CZ3-CZ 3.99Å; W55-T66 WeakPolarHBondContact CH2-O 3.22Å; W55-Y69 AromaticContact CH2-CD1 3.61Å; W55-Y69 HydrophobicContact CH2-CD1 3.61Å; W55-Y69 HydrophobicContact CH2-CE1 4.27Å; W55-Y69 HydrophobicContact CH2-CG 4.07Å; W55-Y69 HydrophobicContact CZ3-CD1 4.02Å; W55-Y69 HydrophobicContact CZ3-CG 4.03Å; W55-F72 HydrophobicContact CB-CD2 4.1Å; W55-F72 HydrophobicContact CD2-CB 4.38Å; W55-F72 HydrophobicContact CD2-CD2 4.37Å; W55-F72 HydrophobicContact CE3-CB 3.44Å; W55-F72 VanDerWaalsContact CE3-CB 3.44Å; W55-F72 HydrophobicContact CE3-CD2 4.22Å; W55-F72 HydrophobicContact CE3-CG 4.09Å; W55-F72 HydrophobicContact CG-CD2 4.39Å; W55-F72 HydrophobicContact CZ3-CB 3.73Å; W55-F72 HydrophobicContact CZ3-CG 4.45Å; W55-V73 CarbonylContact C-O 3.52Å; W55-V73 VanDerWaalsContact CA-O 3.3Å; W55-V73 WeakPolarHBondContact CA-O 3.35Å; W55-V73 WeakPolarHBondContact CB-O 3.46Å; W55-W74 HydrophobicContact CB-CD2 4.44Å; W55-W74 HydrophobicContact CB-CE3 3.81Å; W55-W74 HydrophobicContact CB-CZ3 4.09Å; W55-W74 AromaticContact CD1-CZ3 3.71Å; W55-W74 HydrophobicContact CG-CE3 4.37Å; W55-W74 HydrophobicContact CG-CZ3 4.15Å; W55-I109 HydrophobicContact CD2-CB 3.98Å; W55-I109 HydrophobicContact CD2-CD1 4.25Å; W55-I109 HydrophobicContact CE3-CD1 3.92Å; W55-I109 HydrophobicContact CG-CB 4.42Å; W55-I109 HydrophobicContact CH2-CB 4.44Å; W55-I109 HydrophobicContact CH2-CD1 3.78Å; W55-I109 HydrophobicContact CH2-CG1 4.12Å; W55-I109 HydrophobicContact CZ2-CB 3.8Å; W55-I109 HydrophobicContact CZ2-CD1 4.04Å; W55-I109 HydrophobicContact CZ2-CG1 3.9Å; W55-I109 HydrophobicContact CZ2-CG2 3.78Å; W55-I109 HydrophobicContact CZ3-CD1 3.72Å; W55-I109 HydrophobicContact CZ3-CG1 4.48Å; W55-I109 PolarHBondContact N-O 2.95Å; W55-I109 PolarHBondContact O-N 2.97Å
56	V	96.7	Very high	89.5	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	124.7	172.1	-177.9	0	0	0	0	107.9	F25 F42 F72 V73 V75 A89 F91 F106 C107 Y108	F25-V56 HydrophobicContact CE1-CG1 3.82Å; F25-V56 HydrophobicContact CZ-CG1 3.94Å; F42-V56 HydrophobicContact CD1-CG2 4.44Å; F42-V56 HydrophobicContact CE1-CG2 3.89Å; F42-V56 HydrophobicContact CZ-CG2 4.16Å; V56-F72 CarbonylContact O-C 3.5Å; V56-F72 VanDerWaalsContact O-CA 3.26Å; V56-F72 WeakPolarHBondContact O-CA 3.2Å; V56-V73 HydrophobicContact CB-CG2 4.39Å; V56-V73 PolarHBondContact N-O 2.95Å; V56-V73 PolarHBondContact O-N 3.37Å; V56-V75 HydrophobicContact CG2-CG2 4.08Å; V56-A89 HydrophobicContact CB-CB 4.08Å; V56-A89 HydrophobicContact CG1-CB 4.47Å; V56-A89 HydrophobicContact CG2-CB 4.07Å; V56-F91 HydrophobicContact CB-CZ 4.31Å; V56-F91 HydrophobicContact CG1-CE2 4.29Å; V56-F91 HydrophobicContact CG1-CZ 4Å; V56-F91 WeakPolarHBondContact O-CZ 3.46Å; V56-F106 HydrophobicContact CG1-CB 4.24Å; V56-F106 HydrophobicContact CG1-CD1 4.29Å; V56-C107 WeakPolarHBondContact CA-O 3.44Å; V56-Y108 HydrophobicContact CG2-CD2 3.87Å
57	G	96.6	Very high	90.7	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	151.1	177.2	0	0	0	0	0	112.3	T71 F106 C107	G57-T71 CarbonylContact C-O 3.59Å; G57-T71 VanDerWaalsContact CA-O 3.32Å; G57-T71 WeakPolarHBondContact CA-O 3.37Å; G57-F106 CarbonylContact O-C 3.6Å; G57-F106 WeakPolarHBondContact O-CA 3.43Å; G57-C107 PolarHBondContact N-O 3.33Å; G57-C107 PolarHBondContact O-N 2.87Å
58	I	96.2	Very high	91.6	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	121.1	165.3	-60.7	-178.1	0	0	0	107.2	I38 H70 T71 F91 L96 P97 Y104 F106 F122 F124	I38-I58 HydrophobicContact CD1-CD1 3.84Å; I58-H70 WeakPolarHBondContact O-CB 3.41Å; I58-H70 PolarHBondContact O-N 3.19Å; I58-T71 HydrophobicContact CB-CG2 3.99Å; I58-T71 HydrophobicContact CD1-CG2 3.7Å; I58-T71 HydrophobicContact CG1-CG2 3.98Å; I58-T71 PolarHBondContact N-O 2.94Å; I58-F91 HydrophobicContact CD1-CD1 3.78Å; I58-F91 HydrophobicContact CD1-CD2 4.3Å; I58-F91 HydrophobicContact CD1-CE1 3.96Å; I58-F91 HydrophobicContact CD1-CE2 4.47Å; I58-F91 HydrophobicContact CD1-CG 3.95Å; I58-F91 HydrophobicContact CD1-CZ 4.3Å; I58-F91 HydrophobicContact CG1-CD1 4.09Å; I58-F91 HydrophobicContact CG1-CE1 3.72Å; I58-F91 HydrophobicContact CG1-CE2 4.33Å; I58-F91 HydrophobicContact CG1-CZ 3.85Å; I58-L96 HydrophobicContact CD1-CD2 3.91Å; I58-P97 HydrophobicContact CG2-CG 4.37Å; I58-Y104 HydrophobicContact CG2-CD1 3.85Å; I58-Y104 HydrophobicContact CG2-CG 4.08Å; I58-F106 HydrophobicContact CD1-CD1 4.49Å; I58-F106 HydrophobicContact CD1-CE1 3.81Å; I58-F106 HydrophobicContact CG1-CD1 3.77Å; I58-F106 HydrophobicContact CG1-CE1 3.58Å; I58-F122 HydrophobicContact CG2-CZ 4.36Å; I58-F124 HydrophobicContact CD1-CZ 4.28Å
59	F	96.3	Very high	92.3	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	141.5	-179	-70.9	-100.9	0	0	0	110.3	W55 W63 Y104 Q105 C107 I109	W55-F59 HydrophobicContact CH2-CE2 4.35Å; W55-F59 AromaticContact CH2-CZ 3.8Å; W55-F59 HydrophobicContact CH2-CZ 3.8Å; W55-F59 HydrophobicContact CZ3-CE2 4.08Å; W55-F59 AromaticContact CZ3-CZ 3.99Å; W55-F59 HydrophobicContact CZ3-CZ 3.99Å; F59-W63 HydrophobicContact CB-CB 4.37Å; F59-W63 VanDerWaalsContact CB-CD1 3.43Å; F59-W63 HydrophobicContact CB-CG 3.86Å; F59-W63 HydrophobicContact CD1-CB 4.04Å; F59-W63 AromaticContact CD1-CD2 3.89Å; F59-W63 HydrophobicContact CD1-CD2 3.89Å; F59-W63 HydrophobicContact CD1-CE3 4.31Å; F59-W63 AromaticContact CD1-CG 3.75Å; F59-W63 HydrophobicContact CD1-CG 3.75Å; F59-W63 HydrophobicContact CE1-CD2 4.46Å; F59-W63 HydrophobicContact CE1-CE3 4.47Å; F59-W63 HydrophobicContact CG-CD2 4.37Å; F59-W63 HydrophobicContact CG-CG 4.13Å; F59-Y104 CarbonylContact O-C 3.3Å; F59-Y104 WeakPolarHBondContact O-CA 3.2Å; F59-Q105 HydrophobicContact CB-CG 4.5Å; F59-Q105 PolarHBondContact N-O 3.47Å; F59-Q105 PolarHBondContact O-N 3.45Å; F59-C107 HydrophobicContact CD2-CB 3.59Å; F59-C107 HydrophobicContact CE2-CB 3.63Å; F59-I109 HydrophobicContact CE2-CD1 3.58Å; F59-I109 HydrophobicContact CZ-CD1 3.8Å
60	K	95.6	Very high	92.9	Very high	92 Å²	92	62.4 Å²	62.4	40%	0.4	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	135.3	167	178.3	175.3	171.9	161.2	0	109.4	G62 W63 E102 F103 Y104	K60-G62 PolarHBondContact O-N 2.91Å; K60-W63 WeakPolarHBondContact O-CB 3.45Å; K60-W63 VanDerWaalsContact O-CD1 3.25Å; K60-W63 PolarHBondContact O-N 2.89Å; K60-E102 VanDerWaalsContact CE-CD 3.42Å; K60-E102 WeakPolarHBondContact CE-OE2 3.38Å; K60-E102 IonicContact NZ-OE1 2.88Å; K60-E102 PolarHBondContact NZ-OE1 3.36Å; K60-E102 IonicContact NZ-OE2 3.36Å; K60-E102 PolarHBondContact NZ-OE2 3.29Å; K60-F103 WeakPolarHBondContact CA-O 3.49Å; K60-Y104 HydrophobicContact CB-CD1 4.24Å; K60-Y104 HydrophobicContact CB-CE1 4.09Å
61	V	94.2	Very high	93.3	Very high	62 Å²	62	60.8 Å²	60.8	38%	0.376	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	134.6	177.9	174.3	0	0	0	0	109.8	F103 Q105 P121	V61-F103 HydrophobicContact CB-CB 4.22Å; V61-F103 HydrophobicContact CG2-CB 3.76Å; V61-F103 WeakPolarHBondContact CG2-O 3.16Å; V61-F103 PolarHBondContact N-O 2.92Å; V61-Q105 HydrophobicContact CG2-CG 4.5Å; V61-P121 HydrophobicContact CG2-CB 3.94Å; V61-P121 HydrophobicContact CG2-CG 4.11Å
62	G	91.2	Very high	93.8	Very high	67 Å²	67	62.7 Å²	62.7	69%	0.691	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.9	10.2	-173.5	0	0	0	0	0	114.9	K60	K60-G62 PolarHBondContact O-N 2.91Å
63	W	95.1	Very high	94.3	Very high	72 Å²	72	60 Å²	60	27%	0.273	31%	0.307	S	S	.	.			trans	-55.7	148.1	170.8	64.1	-89.5	0	0	0	112.1	F59 K60 D68 V115	F59-W63 HydrophobicContact CB-CB 4.37Å; F59-W63 VanDerWaalsContact CB-CD1 3.43Å; F59-W63 HydrophobicContact CB-CG 3.86Å; F59-W63 HydrophobicContact CD1-CB 4.04Å; F59-W63 AromaticContact CD1-CD2 3.89Å; F59-W63 HydrophobicContact CD1-CD2 3.89Å; F59-W63 HydrophobicContact CD1-CE3 4.31Å; F59-W63 AromaticContact CD1-CG 3.75Å; F59-W63 HydrophobicContact CD1-CG 3.75Å; F59-W63 HydrophobicContact CE1-CD2 4.46Å; F59-W63 HydrophobicContact CE1-CE3 4.47Å; F59-W63 HydrophobicContact CG-CD2 4.37Å; F59-W63 HydrophobicContact CG-CG 4.13Å; K60-W63 WeakPolarHBondContact O-CB 3.45Å; K60-W63 VanDerWaalsContact O-CD1 3.25Å; K60-W63 PolarHBondContact O-N 2.89Å; W63-D68 HydrophobicContact CB-CB 4.04Å; W63-V115 HydrophobicContact CH2-CG2 3.56Å; W63-V115 HydrophobicContact CZ2-CG2 4.22Å; W63-V115 HydrophobicContact CZ3-CG2 4.34Å
64	S	90.3	Very high	94.5	Very high	113 Å²	113	58.1 Å²	58.1	79%	0.79	30%	0.3	S	S	*	.			trans	-115.6	-18.2	-176.2	-64.5	0	0	0	0	113.1	D68	S64-D68 PolarHBondContact N-OD2 3.35Å
65	S	93.1	Very high	94.3	Very high	46 Å²	46	58.4 Å²	58.4	32%	0.322	30%	0.302	S	S	.	.	S	Bend	trans	-136.4	150.7	179.3	-168.9	0	0	0	0	112.1	K67 D68	S65-K67 PolarHBondContact O-N 3.2Å; S65-K67 PolarHBondContact OG-N 3.11Å; S65-D68 PolarHBondContact N-OD2 3.31Å; S65-D68 WeakPolarHBondContact O-CB 3.49Å; S65-D68 PolarHBondContact O-N 3.38Å
66	T	92.6	Very high	93.7	Very high	37 Å²	37	64.5 Å²	64.5	23%	0.227	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-7.3	170	52	0	0	0	0	113.2	W55 Y69 I109 G113 V115	W55-T66 WeakPolarHBondContact CH2-O 3.22Å; T66-Y69 WeakPolarHBondContact O-CD1 3.42Å; T66-I109 HydrophobicContact CG2-CG1 4.01Å; T66-I109 HydrophobicContact CG2-CG2 4.49Å; T66-G113 WeakPolarHBondContact CG2-O 3.33Å; T66-V115 HydrophobicContact CG2-CG2 3.65Å
67	K	93.2	Very high	92.5	Very high	173 Å²	173	68 Å²	68	75%	0.752	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-12.2	170.8	-63.8	-179.6	-179.6	177.1	0	113.6	S65 Y69	S65-K67 PolarHBondContact O-N 3.2Å; S65-K67 PolarHBondContact OG-N 3.11Å; K67-Y69 PolarHBondContact O-N 3.13Å
68	D	94.4	Very high	91.2	Very high	79 Å²	79	71.2 Å²	71.2	42%	0.422	37%	0.374	S	S	.	.			trans	-85.7	22.3	-176.7	-53.1	-23.9	0	0	0	112.3	W63 S64 S65	W63-D68 HydrophobicContact CB-CB 4.04Å; S64-D68 PolarHBondContact N-OD2 3.35Å; S65-D68 PolarHBondContact N-OD2 3.31Å; S65-D68 WeakPolarHBondContact O-CB 3.49Å; S65-D68 PolarHBondContact O-N 3.38Å
69	Y	95.4	Very high	89.4	Confident	97 Å²	97	79.4 Å²	79.4	38%	0.38	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	142	177.9	66.8	-93.9	0	0	0	110	W55 T66 K67 F72	W55-Y69 AromaticContact CH2-CD1 3.61Å; W55-Y69 HydrophobicContact CH2-CD1 3.61Å; W55-Y69 HydrophobicContact CH2-CE1 4.27Å; W55-Y69 HydrophobicContact CH2-CG 4.07Å; W55-Y69 HydrophobicContact CZ3-CD1 4.02Å; W55-Y69 HydrophobicContact CZ3-CG 4.03Å; T66-Y69 WeakPolarHBondContact O-CD1 3.42Å; K67-Y69 PolarHBondContact O-N 3.13Å; Y69-F72 HydrophobicContact CD2-CB 4.3Å; Y69-F72 AromaticContact CD2-CD1 3.92Å; Y69-F72 HydrophobicContact CD2-CD1 3.92Å; Y69-F72 AromaticContact CE2-CD1 3.39Å; Y69-F72 HydrophobicContact CE2-CD1 3.39Å; Y69-F72 AromaticContact CE2-CE1 3.96Å; Y69-F72 HydrophobicContact CE2-CE1 3.96Å; Y69-F72 HydrophobicContact CE2-CG 4.34Å; Y69-F72 AromaticContact CZ-CD1 3.87Å
70	H	93.9	Very high	87.4	Confident	87 Å²	87	85 Å²	85	40%	0.403	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	-50.9	170.6	-175.2	90.6	0	0	0	110.7	I58 P97 Y104	I58-H70 WeakPolarHBondContact O-CB 3.41Å; I58-H70 PolarHBondContact O-N 3.19Å; H70-P97 HydrophobicContact CB-CG 4.43Å; H70-P97 VanDerWaalsContact CD2-CG 3.5Å; H70-P97 WeakPolarHBondContact CD2-CG 3.39Å; H70-P97 WeakPolarHBondContact NE2-CA 3.45Å; H70-Y104 HydrophobicContact CB-CE1 4.49Å
71	T	94.8	Very high	85.4	Confident	12 Å²	12	85.8 Å²	85.8	7%	0.074	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	162	175.6	-173.8	0	0	0	0	109.9	G57 I58 F91 Y95	G57-T71 CarbonylContact C-O 3.59Å; G57-T71 VanDerWaalsContact CA-O 3.32Å; G57-T71 WeakPolarHBondContact CA-O 3.37Å; I58-T71 HydrophobicContact CB-CG2 3.99Å; I58-T71 HydrophobicContact CD1-CG2 3.7Å; I58-T71 HydrophobicContact CG1-CG2 3.98Å; I58-T71 PolarHBondContact N-O 2.94Å; T71-F91 HydrophobicContact CG2-CD1 3.75Å; T71-F91 HydrophobicContact CG2-CE1 4.03Å; T71-Y95 VanDerWaalsContact CB-O 3.28Å; T71-Y95 WeakPolarHBondContact CB-O 3.43Å; T71-Y95 VanDerWaalsContact CG2-O 3.28Å; T71-Y95 WeakPolarHBondContact CG2-O 3.49Å; T71-Y95 WeakPolarHBondContact OG1-CB 3.32Å
72	F	96.3	Very high	83.3	Confident	68 Å²	68	92 Å²	92	30%	0.298	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	160	179.7	77.8	-77.8	0	0	0	112.5	W55 V56 Y69 W74	W55-F72 HydrophobicContact CB-CD2 4.1Å; W55-F72 HydrophobicContact CD2-CB 4.38Å; W55-F72 HydrophobicContact CD2-CD2 4.37Å; W55-F72 HydrophobicContact CE3-CB 3.44Å; W55-F72 VanDerWaalsContact CE3-CB 3.44Å; W55-F72 HydrophobicContact CE3-CD2 4.22Å; W55-F72 HydrophobicContact CE3-CG 4.09Å; W55-F72 HydrophobicContact CG-CD2 4.39Å; W55-F72 HydrophobicContact CZ3-CB 3.73Å; W55-F72 HydrophobicContact CZ3-CG 4.45Å; V56-F72 CarbonylContact O-C 3.5Å; V56-F72 VanDerWaalsContact O-CA 3.26Å; V56-F72 WeakPolarHBondContact O-CA 3.2Å; Y69-F72 HydrophobicContact CD2-CB 4.3Å; Y69-F72 AromaticContact CD2-CD1 3.92Å; Y69-F72 HydrophobicContact CD2-CD1 3.92Å; Y69-F72 AromaticContact CE2-CD1 3.39Å; Y69-F72 HydrophobicContact CE2-CD1 3.39Å; Y69-F72 AromaticContact CE2-CE1 3.96Å; Y69-F72 HydrophobicContact CE2-CE1 3.96Å; Y69-F72 HydrophobicContact CE2-CG 4.34Å; Y69-F72 AromaticContact CZ-CD1 3.87Å; F72-W74 HydrophobicContact CE2-CD2 4.15Å; F72-W74 AromaticContact CE2-CE2 3.58Å; F72-W74 HydrophobicContact CE2-CG 4.47Å; F72-W74 HydrophobicContact CE2-CH2 4.48Å; F72-W74 AromaticContact CE2-CZ2 3.78Å; F72-W74 HydrophobicContact CE2-CZ2 3.78Å; F72-W74 AromaticContact CE2-NE1 3.58Å; F72-W74 HydrophobicContact CZ-CZ2 4.36Å
73	V	95.8	Very high	81.4	Confident	32 Å²	32	96.3 Å²	96.3	19%	0.194	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	139.4	169.5	-64.3	0	0	0	0	109.8	W55 V56 A89 F91	W55-V73 CarbonylContact C-O 3.52Å; W55-V73 VanDerWaalsContact CA-O 3.3Å; W55-V73 WeakPolarHBondContact CA-O 3.35Å; W55-V73 WeakPolarHBondContact CB-O 3.46Å; V56-V73 HydrophobicContact CB-CG2 4.39Å; V56-V73 PolarHBondContact N-O 2.95Å; V56-V73 PolarHBondContact O-N 3.37Å; V73-A89 HydrophobicContact CG2-CB 3.59Å; V73-F91 HydrophobicContact CB-CE1 4.42Å; V73-F91 HydrophobicContact CG1-CD1 3.82Å; V73-F91 HydrophobicContact CG1-CE1 3.96Å; V73-F91 HydrophobicContact CG1-CG 4.28Å; V73-F91 HydrophobicContact CG2-CD1 4.42Å; V73-F91 HydrophobicContact CG2-CD2 4.45Å; V73-F91 HydrophobicContact CG2-CE1 3.92Å; V73-F91 HydrophobicContact CG2-CE2 3.94Å; V73-F91 HydrophobicContact CG2-CZ 3.65Å
74	W	94.4	Very high	79.4	Confident	149 Å²	149	96 Å²	96	56%	0.564	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	141.9	173.3	-64.3	107.1	0	0	0	110.2	R53 W55 F72 E76	R53-W74 HydrophobicContact CB-CZ3 4.46Å; R53-W74 VanDerWaalsContact O-CZ3 3.28Å; R53-W74 WeakPolarHBondContact O-CZ3 3.3Å; W55-W74 HydrophobicContact CB-CD2 4.44Å; W55-W74 HydrophobicContact CB-CE3 3.81Å; W55-W74 HydrophobicContact CB-CZ3 4.09Å; W55-W74 AromaticContact CD1-CZ3 3.71Å; W55-W74 HydrophobicContact CG-CE3 4.37Å; W55-W74 HydrophobicContact CG-CZ3 4.15Å; F72-W74 HydrophobicContact CE2-CD2 4.15Å; F72-W74 AromaticContact CE2-CE2 3.58Å; F72-W74 HydrophobicContact CE2-CG 4.47Å; F72-W74 HydrophobicContact CE2-CH2 4.48Å; F72-W74 AromaticContact CE2-CZ2 3.78Å; F72-W74 HydrophobicContact CE2-CZ2 3.78Å; F72-W74 AromaticContact CE2-NE1 3.58Å; F72-W74 HydrophobicContact CZ-CZ2 4.36Å; W74-E76 PolarHBondContact O-N 3.29Å
75	V	89.4	Confident	78.3	Confident	9 Å²	9	99.1 Å²	99.1	6%	0.055	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-72.6	124.9	174.2	176.9	0	0	0	0	108.4	F42 D54 V56 Y108	F42-V75 HydrophobicContact CZ-CG1 4.28Å; F42-V75 HydrophobicContact CZ-CG2 4.26Å; D54-V75 HydrophobicContact CB-CB 4.3Å; D54-V75 HydrophobicContact CB-CG2 4.11Å; D54-V75 PolarHBondContact O-N 3.32Å; V56-V75 HydrophobicContact CG2-CG2 4.08Å; V75-Y108 HydrophobicContact CG2-CD2 4.28Å; V75-Y108 HydrophobicContact CG2-CE2 3.55Å
76	E	82.3	Confident	77.7	Confident	160 Å²	160	101.4 Å²	101.4	75%	0.748	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-66.3	136.9	178.2	-67.3	-174.8	172.6	0	0	111.2	W74	W74-E76 PolarHBondContact O-N 3.29Å
77	P	72	Confident	77.5	Confident	72 Å²	72	101.5 Å²	101.5	47%	0.468	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-68.1	143.6	175.9	22.3	-25.8	0	0	0	111.2	H79	P77-H79 PolarHBondContact O-CE1 3.37Å; P77-H79 VanDerWaalsContact O-CE1 3.32Å; P77-H79 PolarHBondContact O-ND1 3.07Å
78	V	68.4	Low	77.4	Confident	69 Å²	69	98.1 Å²	98.1	42%	0.418	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-80	127.3	178.8	177	0	0	0	0	109.7	D80	V78-D80 VanDerWaalsContact CG1-O 3.28Å; V78-D80 WeakPolarHBondContact CG1-O 3.23Å
79	H	58.8	Low	77.2	Confident	171 Å²	171	94.7 Å²	94.7	79%	0.792	47%	0.473	S	S	*	.			trans	-104.8	-11.9	-179.9	-64.4	82.2	0	0	0	113.4	P77	P77-H79 PolarHBondContact O-CE1 3.37Å; P77-H79 VanDerWaalsContact O-CE1 3.32Å; P77-H79 PolarHBondContact O-ND1 3.07Å
80	D	55.2	Low	77.1	Confident	117 Å²	117	92.8 Å²	92.8	63%	0.626	48%	0.477	S	S	*	.			trans	-134	128.7	-178.8	-109.1	-30	0	0	0	112.3	V78 Q82	V78-D80 VanDerWaalsContact CG1-O 3.28Å; V78-D80 WeakPolarHBondContact CG1-O 3.23Å; D80-Q82 VanDerWaalsContact C-N 3.3Å; D80-Q82 PolarHBondContact O-N 2.87Å
81	A	53.4	Low	77.1	Confident	110 Å²	110	88.7 Å²	88.7	91%	0.909	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-3.2	-175.5	0	0	0	0	0	114.4
82	Q	48.4	Very low	77	Confident	191 Å²	191	93.7 Å²	93.7	89%	0.893	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-6.1	-174.6	-77.4	178.2	-13.3	0	0	114.4	D80	D80-Q82 VanDerWaalsContact C-N 3.3Å; D80-Q82 PolarHBondContact O-N 2.87Å
83	Q	51.6	Low	76.7	Confident	159 Å²	159	94.5 Å²	94.5	74%	0.743	48%	0.484	S	S	*	.	S	Bend	trans	-122.5	157	169.6	-76	-178.3	1.6	0	0	108.6
84	T	53.3	Low	76.3	Confident	66 Å²	66	100.6 Å²	100.6	41%	0.405	51%	0.505	S	S	.	.			trans	105.3	60.3	158.4	-29.3	0	0	0	0	116.7	M86 R87	T84-M86 WeakPolarHBondContact CG2-O 3.31Å; T84-R87 HydrophobicContact CG2-CB 4.5Å; T84-R87 HydrophobicContact CG2-CG 3.52Å
85	E	67	Low	76.1	Confident	178 Å²	178	99.9 Å²	99.9	83%	0.832	50%	0.503	S	S	*	.	S	Bend	trans	-67.7	-26.6	147.7	-72	-171.8	167.5	0	0	111.1	T43	T43-E85 WeakPolarHBondContact CA-O 3.35Å; T43-E85 WeakPolarHBondContact CB-O 3.37Å; T43-E85 WeakPolarHBondContact CG2-O 3.06Å
86	M	82.1	Confident	76.2	Confident	94 Å²	94	99.7 Å²	99.7	46%	0.463	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	119.4	-176.4	-175.5	175.3	63.9	0	0	112.7	R41 T43 T84	R41-M86 HydrophobicContact CB-CG 4.44Å; R41-M86 HydrophobicContact CB-SD 4.43Å; T43-M86 HydrophobicContact CG2-CB 4.39Å; T84-M86 WeakPolarHBondContact CG2-O 3.31Å
87	R	87.6	Confident	76.5	Confident	39 Å²	39	92.1 Å²	92.1	15%	0.147	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	164	178	-66	-172.8	-175.7	-150.6	5.3	111.9	R41 F42 L44 T84	R41-R87 CarbonylContact C-O 3.57Å; R41-R87 WeakPolarHBondContact CA-O 3.36Å; F42-R87 HydrophobicContact CD1-CB 4.41Å; F42-R87 HydrophobicContact CD2-CB 3.95Å; F42-R87 HydrophobicContact CE1-CB 4.02Å; F42-R87 HydrophobicContact CE2-CB 3.53Å; F42-R87 HydrophobicContact CE2-CG 4.23Å; F42-R87 HydrophobicContact CG-CB 4.39Å; F42-R87 HydrophobicContact CZ-CB 3.57Å; F42-R87 PolarHBondContact N-O 3.22Å; F42-R87 WeakPolarHBondContact O-CA 3.32Å; F42-R87 PolarHBondContact O-N 2.82Å; L44-R87 VanDerWaalsContact CD1-NE 3.27Å; T84-R87 HydrophobicContact CG2-CB 4.5Å; T84-R87 HydrophobicContact CG2-CG 3.52Å
88	Q	90.4	Very high	77	Confident	102 Å²	102	96.9 Å²	96.9	48%	0.477	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	146.7	-179.7	-53.2	-168.1	-5.5	0	0	111	T39 C40 R41	T39-Q88 HydrophobicContact CG2-CB 3.91Å; T39-Q88 HydrophobicContact CG2-CG 4.44Å; C40-Q88 WeakPolarHBondContact O-CA 3.44Å; R41-Q88 HydrophobicContact CG-CG 4.08Å
89	A	91.4	Very high	77.4	Confident	6 Å²	6	98 Å²	98	5%	0.05	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	121.6	171.7	0	0	0	0	0	108.4	T39 C40 F42 V56 V73 F91	T39-A89 WeakPolarHBondContact CA-O 3.33Å; C40-A89 PolarHBondContact N-O 3.39Å; C40-A89 PolarHBondContact O-N 2.85Å; F42-A89 HydrophobicContact CE1-CB 3.95Å; V56-A89 HydrophobicContact CB-CB 4.08Å; V56-A89 HydrophobicContact CG1-CB 4.47Å; V56-A89 HydrophobicContact CG2-CB 4.07Å; V73-A89 HydrophobicContact CG2-CB 3.59Å; A89-F91 HydrophobicContact CB-CE2 4.26Å
90	A	92.9	Very high	78	Confident	57 Å²	57	93.6 Å²	93.6	47%	0.471	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	114.5	-173.7	0	0	0	0	0	111.1	I38	I38-A90 CarbonylContact O-C 3.57Å; I38-A90 WeakPolarHBondContact O-CA 3.37Å
91	F	94.5	Very high	79	Confident	2 Å²	2	94.6 Å²	94.6	1%	0.009	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	129.5	177.2	-64.4	-95.8	0	0	0	110.2	P37 I38 V56 I58 T71 V73 A89 L96 F106	P37-F91 VanDerWaalsContact CA-O 3.3Å; P37-F91 WeakPolarHBondContact CA-O 3.39Å; P37-F91 WeakPolarHBondContact CB-O 3.36Å; I38-F91 HydrophobicContact CD1-CB 4.34Å; I38-F91 HydrophobicContact CG1-CB 4.15Å; I38-F91 PolarHBondContact N-O 3.29Å; I38-F91 PolarHBondContact O-N 3.12Å; V56-F91 HydrophobicContact CB-CZ 4.31Å; V56-F91 HydrophobicContact CG1-CE2 4.29Å; V56-F91 HydrophobicContact CG1-CZ 4Å; V56-F91 WeakPolarHBondContact O-CZ 3.46Å; I58-F91 HydrophobicContact CD1-CD1 3.78Å; I58-F91 HydrophobicContact CD1-CD2 4.3Å; I58-F91 HydrophobicContact CD1-CE1 3.96Å; I58-F91 HydrophobicContact CD1-CE2 4.47Å; I58-F91 HydrophobicContact CD1-CG 3.95Å; I58-F91 HydrophobicContact CD1-CZ 4.3Å; I58-F91 HydrophobicContact CG1-CD1 4.09Å; I58-F91 HydrophobicContact CG1-CE1 3.72Å; I58-F91 HydrophobicContact CG1-CE2 4.33Å; I58-F91 HydrophobicContact CG1-CZ 3.85Å; T71-F91 HydrophobicContact CG2-CD1 3.75Å; T71-F91 HydrophobicContact CG2-CE1 4.03Å; V73-F91 HydrophobicContact CB-CE1 4.42Å; V73-F91 HydrophobicContact CG1-CD1 3.82Å; V73-F91 HydrophobicContact CG1-CE1 3.96Å; V73-F91 HydrophobicContact CG1-CG 4.28Å; V73-F91 HydrophobicContact CG2-CD1 4.42Å; V73-F91 HydrophobicContact CG2-CD2 4.45Å; V73-F91 HydrophobicContact CG2-CE1 3.92Å; V73-F91 HydrophobicContact CG2-CE2 3.94Å; V73-F91 HydrophobicContact CG2-CZ 3.65Å; A89-F91 HydrophobicContact CB-CE2 4.26Å; F91-L96 HydrophobicContact CB-CD2 3.67Å; F91-L96 HydrophobicContact CG-CD2 4.47Å; F91-F106 HydrophobicContact CD2-CE1 4.01Å; F91-F106 AromaticContact CE2-CD1 3.91Å; F91-F106 HydrophobicContact CE2-CD1 3.91Å; F91-F106 AromaticContact CE2-CE1 3.61Å; F91-F106 HydrophobicContact CE2-CE1 3.61Å; F91-F106 HydrophobicContact CZ-CD1 4.21Å; F91-F106 HydrophobicContact CZ-CE1 4.21Å
92	K	91.5	Very high	80.7	Confident	117 Å²	117	92.6 Å²	92.6	51%	0.509	44%	0.438	S	S	.	.			trans	-78.5	140.8	176.5	-57.8	-63.8	-175.1	-178.2	0	110.2	Y94 Y95	K92-Y94 VanDerWaalsContact C-N 3.26Å; K92-Y94 HydrophobicContact CB-CD1 3.88Å; K92-Y94 HydrophobicContact CB-CE1 3.35Å; K92-Y94 HydrophobicContact CB-CE2 4.38Å; K92-Y94 HydrophobicContact CG-CE1 3.93Å; K92-Y94 PolarHBondContact O-N 3.03Å; K92-Y94 VanDerWaalsContact O-N 3.15Å; K92-Y95 HydrophobicContact CB-CD2 4.16Å; K92-Y95 PolarHBondContact O-N 2.83Å
93	E	89.6	Confident	82.8	Confident	84 Å²	84	88.5 Å²	88.5	39%	0.393	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-47.4	-44	-177	-179.5	-174.7	167.6	0	0	113.9	S35 Y95 L96	S35-E93 WeakPolarHBondContact CA-OE1 3.48Å; S35-E93 WeakPolarHBondContact CB-OE1 3.39Å; S35-E93 VanDerWaalsContact O-CD 3.32Å; E93-Y95 PolarHBondContact O-N 3.48Å; E93-Y95 VanDerWaalsContact O-N 3.1Å; E93-L96 WeakPolarHBondContact O-CB 3.27Å; E93-L96 WeakPolarHBondContact O-CG 3.38Å; E93-L96 PolarHBondContact O-N 3.06Å
94	Y	88.2	Confident	84.9	Confident	160 Å²	160	81.2 Å²	81.2	63%	0.627	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-69.9	-8.6	-175	54.7	-93	0	0	0	114.6	K92	K92-Y94 VanDerWaalsContact C-N 3.26Å; K92-Y94 HydrophobicContact CB-CD1 3.88Å; K92-Y94 HydrophobicContact CB-CE1 3.35Å; K92-Y94 HydrophobicContact CB-CE2 4.38Å; K92-Y94 HydrophobicContact CG-CE1 3.93Å; K92-Y94 PolarHBondContact O-N 3.03Å; K92-Y94 VanDerWaalsContact O-N 3.15Å
95	Y	90	Very high	86.9	Confident	134 Å²	134	79.4 Å²	79.4	53%	0.525	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-103.5	3.2	173.8	-65	-56.9	0	0	0	113.7	T71 K92 E93	T71-Y95 VanDerWaalsContact CB-O 3.28Å; T71-Y95 WeakPolarHBondContact CB-O 3.43Å; T71-Y95 VanDerWaalsContact CG2-O 3.28Å; T71-Y95 WeakPolarHBondContact CG2-O 3.49Å; T71-Y95 WeakPolarHBondContact OG1-CB 3.32Å; K92-Y95 HydrophobicContact CB-CD2 4.16Å; K92-Y95 PolarHBondContact O-N 2.83Å; E93-Y95 PolarHBondContact O-N 3.48Å; E93-Y95 VanDerWaalsContact O-N 3.1Å
96	L	91.1	Very high	88.3	Confident	6 Å²	6	70.9 Å²	70.9	3%	0.031	33%	0.331	C	S	.	.	S	Bend	trans	-86.3	150.7	-175.3	-57.6	-177	0	0	0	112.1	S36 I38 I58 F91 E93 K98 F124	S36-L96 WeakPolarHBondContact O-CD1 3.26Å; I38-L96 HydrophobicContact CD1-CD1 3.76Å; I38-L96 HydrophobicContact CD1-CD2 3.47Å; I38-L96 VanDerWaalsContact CD1-CD2 3.47Å; I38-L96 HydrophobicContact CD1-CG 4.21Å; I38-L96 HydrophobicContact CG1-CD1 3.3Å; I38-L96 HydrophobicContact CG1-CD2 3.71Å; I38-L96 HydrophobicContact CG1-CG 4.12Å; I58-L96 HydrophobicContact CD1-CD2 3.91Å; F91-L96 HydrophobicContact CB-CD2 3.67Å; F91-L96 HydrophobicContact CG-CD2 4.47Å; E93-L96 WeakPolarHBondContact O-CB 3.27Å; E93-L96 WeakPolarHBondContact O-CG 3.38Å; E93-L96 PolarHBondContact O-N 3.06Å; L96-K98 PolarHBondContact O-N 2.95Å; L96-F124 HydrophobicContact CB-CE1 4.15Å; L96-F124 HydrophobicContact CB-CZ 4.49Å; L96-F124 HydrophobicContact CD1-CE1 4Å; L96-F124 HydrophobicContact CD2-CE1 4.47Å; L96-F124 HydrophobicContact CD2-CZ 4.48Å; L96-F124 HydrophobicContact CG-CE1 4.43Å
97	P	88.8	Confident	89	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	31%	0.309	C	S	.	.			trans	-56.2	136.7	170.5	-20.5	29.2	0	0	0	111.8	I58 H70 Y104 F124	I58-P97 HydrophobicContact CG2-CG 4.37Å; H70-P97 HydrophobicContact CB-CG 4.43Å; H70-P97 VanDerWaalsContact CD2-CG 3.5Å; H70-P97 WeakPolarHBondContact CD2-CG 3.39Å; H70-P97 WeakPolarHBondContact NE2-CA 3.45Å; P97-Y104 HydrophobicContact CB-CD2 4.35Å; P97-Y104 HydrophobicContact CB-CE1 3.85Å; P97-Y104 HydrophobicContact CB-CE2 3.63Å; P97-Y104 WeakPolarHBondContact CB-OH 3.47Å; P97-Y104 HydrophobicContact CG-CD1 3.83Å; P97-Y104 HydrophobicContact CG-CD2 4.2Å; P97-Y104 HydrophobicContact CG-CE1 3.49Å; P97-Y104 VanDerWaalsContact CG-CE1 3.49Å; P97-Y104 HydrophobicContact CG-CE2 3.89Å; P97-Y104 HydrophobicContact CG-CG 4.18Å; P97-F124 HydrophobicContact CB-CD2 3.76Å; P97-F124 HydrophobicContact CB-CE2 4Å; P97-F124 VanDerWaalsContact CD-CE2 3.45Å; P97-F124 HydrophobicContact CG-CD2 3.8Å; P97-F124 HydrophobicContact CG-CE2 3.47Å; P97-F124 VanDerWaalsContact CG-CE2 3.47Å; P97-F124 HydrophobicContact CG-CZ 4.24Å
98	K	81.8	Confident	89.4	Confident	172 Å²	172	64.6 Å²	64.6	75%	0.748	30%	0.302	S	S	*	.			trans	-100.8	-1.9	175.1	-59.8	-176.5	-179.1	-177.8	0	112.4	L96 E100	L96-K98 PolarHBondContact O-N 2.95Å; K98-E100 PolarHBondContact O-N 3.46Å
99	D	77.6	Confident	89.6	Confident	92 Å²	92	59.7 Å²	59.7	49%	0.492	28%	0.279	S	S	.	.			trans	-83	111.5	-177.7	-55.1	-52.4	0	0	0	109.1	I101 E102	D99-I101 VanDerWaalsContact C-N 3.27Å; D99-I101 PolarHBondContact O-N 2.93Å; D99-E102 HydrophobicContact CB-CG 4.31Å
100	E	71.6	Confident	89.7	Confident	80 Å²	80	60 Å²	60	37%	0.374	28%	0.28	S	S	.	.	S	Bend	trans	-79.3	-7.4	-175.6	-65.3	177.2	171.1	0	0	113.2	K98 F124 R125	K98-E100 PolarHBondContact O-N 3.46Å; E100-F124 WeakPolarHBondContact CA-O 3.38Å; E100-R125 HydrophobicContact CB-CG 4.29Å; E100-R125 PolarHBondContact O-NE 2.94Å; E100-R125 PolarHBondContact O-NH2 2.9Å
101	I	75.9	Confident	89.6	Confident	137 Å²	137	62 Å²	62	70%	0.703	28%	0.283	S	S	*	.	S	Bend	trans	-95.7	-26.4	-174.4	-58.6	173.6	0	0	0	111.5	D99 R125	D99-I101 VanDerWaalsContact C-N 3.27Å; D99-I101 PolarHBondContact O-N 2.93Å; I101-R125 PolarHBondContact O-NH2 3.39Å
102	E	88.5	Confident	89.4	Confident	68 Å²	68	65.1 Å²	65.1	32%	0.318	31%	0.305	S	S	.	.			trans	-89.6	146.2	-167.8	-64.4	-68.6	-173.8	0	0	112.7	K60 D99 Y104	K60-E102 VanDerWaalsContact CE-CD 3.42Å; K60-E102 WeakPolarHBondContact CE-OE2 3.38Å; K60-E102 IonicContact NZ-OE1 2.88Å; K60-E102 PolarHBondContact NZ-OE1 3.36Å; K60-E102 IonicContact NZ-OE2 3.36Å; K60-E102 PolarHBondContact NZ-OE2 3.29Å; D99-E102 HydrophobicContact CB-CG 4.31Å; E102-Y104 HydrophobicContact CB-CE2 3.7Å; E102-Y104 WeakPolarHBondContact O-CD2 3.3Å; E102-Y104 WeakPolarHBondContact O-CE2 3.4Å
103	F	93	Very high	89.3	Confident	105 Å²	105	61.2 Å²	61.2	46%	0.461	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	137.8	173.5	-67.1	-85.9	0	0	0	110.3	K60 V61 P121 F122 C123	K60-F103 WeakPolarHBondContact CA-O 3.49Å; V61-F103 HydrophobicContact CB-CB 4.22Å; V61-F103 HydrophobicContact CG2-CB 3.76Å; V61-F103 WeakPolarHBondContact CG2-O 3.16Å; V61-F103 PolarHBondContact N-O 2.92Å; F103-P121 HydrophobicContact CB-CB 4.49Å; F103-F122 CarbonylContact C-O 3.47Å; F103-F122 WeakPolarHBondContact CA-O 3.33Å; F103-C123 HydrophobicContact CD1-CB 4.27Å; F103-C123 HydrophobicContact CE1-CB 4.38Å
104	Y	95.4	Very high	89.4	Confident	6 Å²	6	61.6 Å²	61.6	2%	0.024	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	161.8	179	-60.7	-90.6	0	0	0	110.6	I58 F59 K60 H70 P97 E102 P121 F122 F124	I58-Y104 HydrophobicContact CG2-CD1 3.85Å; I58-Y104 HydrophobicContact CG2-CG 4.08Å; F59-Y104 CarbonylContact O-C 3.3Å; F59-Y104 WeakPolarHBondContact O-CA 3.2Å; K60-Y104 HydrophobicContact CB-CD1 4.24Å; K60-Y104 HydrophobicContact CB-CE1 4.09Å; H70-Y104 HydrophobicContact CB-CE1 4.49Å; P97-Y104 HydrophobicContact CB-CD2 4.35Å; P97-Y104 HydrophobicContact CB-CE1 3.85Å; P97-Y104 HydrophobicContact CB-CE2 3.63Å; P97-Y104 WeakPolarHBondContact CB-OH 3.47Å; P97-Y104 HydrophobicContact CG-CD1 3.83Å; P97-Y104 HydrophobicContact CG-CD2 4.2Å; P97-Y104 HydrophobicContact CG-CE1 3.49Å; P97-Y104 VanDerWaalsContact CG-CE1 3.49Å; P97-Y104 HydrophobicContact CG-CE2 3.89Å; P97-Y104 HydrophobicContact CG-CG 4.18Å; E102-Y104 HydrophobicContact CB-CE2 3.7Å; E102-Y104 WeakPolarHBondContact O-CD2 3.3Å; E102-Y104 WeakPolarHBondContact O-CE2 3.4Å; Y104-P121 CarbonylContact O-C 3.57Å; Y104-P121 VanDerWaalsContact O-CA 3.28Å; Y104-P121 WeakPolarHBondContact O-CA 3.36Å; Y104-F122 PolarHBondContact N-O 3.13Å; Y104-F122 WeakPolarHBondContact O-CD1 3.5Å; Y104-F122 PolarHBondContact O-N 3.32Å; Y104-F124 AromaticContact CD2-CD2 3.72Å; Y104-F124 HydrophobicContact CD2-CD2 3.72Å; Y104-F124 AromaticContact CD2-CE2 3.83Å; Y104-F124 HydrophobicContact CD2-CE2 3.83Å; Y104-F124 HydrophobicContact CE2-CD2 4.01Å; Y104-F124 HydrophobicContact CE2-CE2 4.4Å; Y104-F124 HydrophobicContact CG-CD2 4.43Å; Y104-F124 HydrophobicContact CG-CE2 4.08Å
105	Q	96.1	Very high	89.6	Confident	28 Å²	28	54.7 Å²	54.7	13%	0.131	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	152.2	172.9	58.2	179.3	71.5	0	0	109.7	F59 V61 C107	F59-Q105 HydrophobicContact CB-CG 4.5Å; F59-Q105 PolarHBondContact N-O 3.47Å; F59-Q105 PolarHBondContact O-N 3.45Å; V61-Q105 HydrophobicContact CG2-CG 4.5Å; Q105-C107 PolarHBondContact NE2-SG 3.02Å; Q105-C107 VanDerWaalsContact NE2-SG 3.41Å
106	F	97.3	Very high	89.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	136.7	169.4	-60.8	-68.3	0	0	0	109.3	F25 I28 Y32 I38 C40 V56 G57 I58 F91 A118 S119 F122	F25-F106 HydrophobicContact CD1-CB 3.85Å; F25-F106 HydrophobicContact CD1-CG 4.42Å; F25-F106 HydrophobicContact CD2-CB 4.45Å; F25-F106 HydrophobicContact CE1-CB 3.51Å; F25-F106 HydrophobicContact CE1-CG 4.28Å; F25-F106 HydrophobicContact CE2-CB 4.15Å; F25-F106 HydrophobicContact CG-CB 4.31Å; F25-F106 HydrophobicContact CZ-CB 3.68Å; I28-F106 HydrophobicContact CD1-CD2 3.85Å; I28-F106 HydrophobicContact CD1-CE2 3.94Å; I28-F106 HydrophobicContact CG2-CE2 4.49Å; Y32-F106 AromaticContact CE2-CE2 3.84Å; Y32-F106 HydrophobicContact CE2-CE2 3.84Å; Y32-F106 AromaticContact CE2-CZ 3.97Å; Y32-F106 HydrophobicContact CE2-CZ 3.97Å; I38-F106 HydrophobicContact CD1-CZ 4.36Å; C40-F106 HydrophobicContact CB-CD1 4.22Å; C40-F106 HydrophobicContact CB-CD2 3.76Å; C40-F106 HydrophobicContact CB-CE1 4.03Å; C40-F106 HydrophobicContact CB-CE2 3.56Å; C40-F106 HydrophobicContact CB-CG 4.11Å; C40-F106 HydrophobicContact CB-CZ 3.71Å; V56-F106 HydrophobicContact CG1-CB 4.24Å; V56-F106 HydrophobicContact CG1-CD1 4.29Å; G57-F106 CarbonylContact O-C 3.6Å; G57-F106 WeakPolarHBondContact O-CA 3.43Å; I58-F106 HydrophobicContact CD1-CD1 4.49Å; I58-F106 HydrophobicContact CD1-CE1 3.81Å; I58-F106 HydrophobicContact CG1-CD1 3.77Å; I58-F106 HydrophobicContact CG1-CE1 3.58Å; F91-F106 HydrophobicContact CD2-CE1 4.01Å; F91-F106 AromaticContact CE2-CD1 3.91Å; F91-F106 HydrophobicContact CE2-CD1 3.91Å; F91-F106 AromaticContact CE2-CE1 3.61Å; F91-F106 HydrophobicContact CE2-CE1 3.61Å; F91-F106 HydrophobicContact CZ-CD1 4.21Å; F91-F106 HydrophobicContact CZ-CE1 4.21Å; F106-A118 CarbonylContact O-C 3.52Å; F106-A118 VanDerWaalsContact O-CA 3.26Å; F106-A118 WeakPolarHBondContact O-CA 3.39Å; F106-S119 PolarHBondContact N-OG 2.88Å; F106-S119 PolarHBondContact O-N 3.28Å; F106-F122 HydrophobicContact CD1-CE1 4.33Å; F106-F122 HydrophobicContact CD1-CZ 4.11Å; F106-F122 HydrophobicContact CD2-CD1 4.25Å; F106-F122 AromaticContact CD2-CE1 3.31Å; F106-F122 HydrophobicContact CD2-CE1 3.31Å; F106-F122 AromaticContact CD2-CZ 3.84Å; F106-F122 HydrophobicContact CD2-CZ 3.84Å; F106-F122 HydrophobicContact CE1-CE1 4.29Å; F106-F122 AromaticContact CE1-CZ 3.79Å; F106-F122 HydrophobicContact CE1-CZ 3.79Å; F106-F122 HydrophobicContact CE2-CD1 4.04Å; F106-F122 AromaticContact CE2-CE1 3.23Å; F106-F122 HydrophobicContact CE2-CE1 3.23Å; F106-F122 HydrophobicContact CE2-CE2 4.44Å; F106-F122 AromaticContact CE2-CZ 3.47Å; F106-F122 HydrophobicContact CE2-CZ 3.47Å; F106-F122 VanDerWaalsContact CE2-CZ 3.47Å; F106-F122 AromaticContact CG-CE1 3.87Å; F106-F122 HydrophobicContact CG-CE1 3.87Å; F106-F122 HydrophobicContact CG-CZ 4.12Å; F106-F122 AromaticContact CZ-CE1 3.75Å; F106-F122 HydrophobicContact CZ-CE1 3.75Å; F106-F122 HydrophobicContact CZ-CE2 4.24Å; F106-F122 AromaticContact CZ-CZ 3.44Å; F106-F122 HydrophobicContact CZ-CZ 3.44Å; F106-F122 VanDerWaalsContact CZ-CZ 3.44Å
107	C	96.4	Very high	89.9	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	136.8	170.5	-63.3	0	0	0	0	109	V56 G57 F59 Q105 I109 V115 G117	V56-C107 WeakPolarHBondContact CA-O 3.44Å; G57-C107 PolarHBondContact N-O 3.33Å; G57-C107 PolarHBondContact O-N 2.87Å; F59-C107 HydrophobicContact CD2-CB 3.59Å; F59-C107 HydrophobicContact CE2-CB 3.63Å; Q105-C107 PolarHBondContact NE2-SG 3.02Å; Q105-C107 VanDerWaalsContact NE2-SG 3.41Å; C107-I109 HydrophobicContact CB-CD1 3.84Å; C107-I109 WeakPolarHBondContact O-CD1 3.16Å; C107-V115 HydrophobicContact CB-CG1 4.35Å; C107-G117 WeakPolarHBondContact CA-O 3.46Å
108	Y	95.8	Very high	90.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	125.9	170.5	-171.8	-74	0	0	0	109.3	V23 F42 L44 F48 D54 V56 V75 V115 R116 G117	V23-Y108 HydrophobicContact CB-CD2 4.31Å; V23-Y108 HydrophobicContact CB-CG 4.06Å; V23-Y108 HydrophobicContact CG1-CD2 3.76Å; V23-Y108 HydrophobicContact CG1-CE2 4.49Å; V23-Y108 HydrophobicContact CG1-CG 3.95Å; V23-Y108 HydrophobicContact CG2-CD1 3.76Å; V23-Y108 HydrophobicContact CG2-CD2 3.93Å; V23-Y108 HydrophobicContact CG2-CE1 4.13Å; V23-Y108 HydrophobicContact CG2-CE2 4.26Å; V23-Y108 HydrophobicContact CG2-CG 3.65Å; F42-Y108 HydrophobicContact CD2-CD2 4.29Å; F42-Y108 HydrophobicContact CD2-CE2 4.37Å; F42-Y108 AromaticContact CE2-CD2 3.93Å; F42-Y108 HydrophobicContact CE2-CD2 3.93Å; F42-Y108 AromaticContact CE2-CE2 3.65Å; F42-Y108 HydrophobicContact CE2-CE2 3.65Å; F42-Y108 HydrophobicContact CZ-CD2 4.33Å; F42-Y108 HydrophobicContact CZ-CE2 4.09Å; L44-Y108 HydrophobicContact CD2-CE2 4.11Å; F48-Y108 AromaticContact CE1-CE1 3.81Å; F48-Y108 HydrophobicContact CE1-CE1 3.81Å; F48-Y108 AromaticContact CE1-CZ 3.96Å; F48-Y108 AromaticContact CZ-CE1 3.78Å; F48-Y108 HydrophobicContact CZ-CE1 3.78Å; D54-Y108 HydrophobicContact CB-CE1 3.77Å; D54-Y108 WeakPolarHBondContact CB-OH 3.47Å; D54-Y108 PolarHBondContact OD2-OH 3.09Å; V56-Y108 HydrophobicContact CG2-CD2 3.87Å; V75-Y108 HydrophobicContact CG2-CD2 4.28Å; V75-Y108 HydrophobicContact CG2-CE2 3.55Å; Y108-V115 CarbonylContact O-C 3.59Å; Y108-V115 WeakPolarHBondContact O-CA 3.34Å; Y108-R116 HydrophobicContact CD1-CB 3.97Å; Y108-R116 HydrophobicContact CD1-CG 4.4Å; Y108-R116 PolarHBondContact O-N 3.09Å; Y108-G117 PolarHBondContact N-O 3.26Å
109	I	95.1	Very high	90.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	128.3	-178.9	-62.9	88.8	0	0	0	108.9	D54 W55 F59 T66 C107 Q114 V115	D54-I109 WeakPolarHBondContact CA-O 3.39Å; W55-I109 HydrophobicContact CD2-CB 3.98Å; W55-I109 HydrophobicContact CD2-CD1 4.25Å; W55-I109 HydrophobicContact CE3-CD1 3.92Å; W55-I109 HydrophobicContact CG-CB 4.42Å; W55-I109 HydrophobicContact CH2-CB 4.44Å; W55-I109 HydrophobicContact CH2-CD1 3.78Å; W55-I109 HydrophobicContact CH2-CG1 4.12Å; W55-I109 HydrophobicContact CZ2-CB 3.8Å; W55-I109 HydrophobicContact CZ2-CD1 4.04Å; W55-I109 HydrophobicContact CZ2-CG1 3.9Å; W55-I109 HydrophobicContact CZ2-CG2 3.78Å; W55-I109 HydrophobicContact CZ3-CD1 3.72Å; W55-I109 HydrophobicContact CZ3-CG1 4.48Å; W55-I109 PolarHBondContact N-O 2.95Å; W55-I109 PolarHBondContact O-N 2.97Å; F59-I109 HydrophobicContact CE2-CD1 3.58Å; F59-I109 HydrophobicContact CZ-CD1 3.8Å; T66-I109 HydrophobicContact CG2-CG1 4.01Å; T66-I109 HydrophobicContact CG2-CG2 4.49Å; C107-I109 HydrophobicContact CB-CD1 3.84Å; C107-I109 WeakPolarHBondContact O-CD1 3.16Å; I109-Q114 WeakPolarHBondContact CA-O 3.44Å; I109-V115 HydrophobicContact CG1-CG2 4.22Å
110	D	92.8	Very high	91.6	Very high	11 Å²	11	43.9 Å²	43.9	6%	0.059	24%	0.243	C	C	.	.			trans	-82.4	173	178.1	74.6	8.1	0	0	0	113.1	F48 D54 S112 G113 Q114 R116	F48-D110 HydrophobicContact CZ-CB 4.48Å; D54-D110 VanDerWaalsContact OD1-CA 3.27Å; D54-D110 WeakPolarHBondContact OD1-CA 3.29Å; D110-S112 VanDerWaalsContact CG-OG 3.25Å; D110-S112 PolarHBondContact O-N 3.21Å; D110-S112 VanDerWaalsContact OD1-CA 3.31Å; D110-S112 WeakPolarHBondContact OD1-CA 3.4Å; D110-S112 WeakPolarHBondContact OD1-CB 3.33Å; D110-S112 PolarHBondContact OD1-N 2.87Å; D110-S112 PolarHBondContact OD1-OG 3.38Å; D110-S112 PolarHBondContact OD2-OG 2.97Å; D110-G113 PolarHBondContact O-N 3.28Å; D110-G113 PolarHBondContact OD1-N 3Å; D110-G113 VanDerWaalsContact OD1-N 3.09Å; D110-Q114 PolarHBondContact N-O 2.89Å; D110-Q114 PolarHBondContact OD1-N 3.48Å; D110-R116 HydrophobicContact CB-CG 4Å; D110-R116 IonicContact OD2-CZ 2.83Å; D110-R116 IonicContact OD2-NE 3.79Å; D110-R116 PolarHBondContact OD2-NE 3.35Å; D110-R116 IonicContact OD2-NH2 3.57Å; D110-R116 PolarHBondContact OD2-NH2 2.9Å
111	N	90.9	Very high	92.7	Very high	101 Å²	101	43 Å²	43	54%	0.54	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-16.6	176.6	70	6.4	0	0	0	115.4	S51 R53 D54	S51-N111 WeakPolarHBondContact CB-ND2 3.41Å; S51-N111 PolarHBondContact OG-ND2 3.08Å; R53-N111 HydrophobicContact CB-CB 3.9Å; D54-N111 PolarHBondContact OD1-N 3.43Å
112	S	90.3	Very high	93.6	Very high	67 Å²	67	36.5 Å²	36.5	47%	0.469	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-3.5	177.1	80.2	0	0	0	0	112.7	D110 Q114	D110-S112 VanDerWaalsContact CG-OG 3.25Å; D110-S112 PolarHBondContact O-N 3.21Å; D110-S112 VanDerWaalsContact OD1-CA 3.31Å; D110-S112 WeakPolarHBondContact OD1-CA 3.4Å; D110-S112 WeakPolarHBondContact OD1-CB 3.33Å; D110-S112 PolarHBondContact OD1-N 2.87Å; D110-S112 PolarHBondContact OD1-OG 3.38Å; D110-S112 PolarHBondContact OD2-OG 2.97Å; S112-Q114 PolarHBondContact OG-NE2 3Å; S112-Q114 VanDerWaalsContact OG-NE2 3.12Å
113	G	89	Confident	93.7	Very high	34 Å²	34	33.6 Å²	33.6	35%	0.351	20%	0.198	S	C	.	.	S	Bend	trans	82.2	15	-178.4	0	0	0	0	0	113.9	T66 D110	T66-G113 WeakPolarHBondContact CG2-O 3.33Å; D110-G113 PolarHBondContact O-N 3.28Å; D110-G113 PolarHBondContact OD1-N 3Å; D110-G113 VanDerWaalsContact OD1-N 3.09Å
114	Q	91.3	Very high	93.5	Very high	92 Å²	92	28.6 Å²	28.6	43%	0.43	18%	0.176	S	C	.	.			trans	-94.2	143.5	179	-71.4	-179.1	59.8	0	0	111.7	I109 D110 S112 R116	I109-Q114 WeakPolarHBondContact CA-O 3.44Å; D110-Q114 PolarHBondContact N-O 2.89Å; D110-Q114 PolarHBondContact OD1-N 3.48Å; S112-Q114 PolarHBondContact OG-NE2 3Å; S112-Q114 VanDerWaalsContact OG-NE2 3.12Å; Q114-R116 VanDerWaalsContact OE1-NH2 3.11Å
115	V	93.8	Very high	93	Very high	15 Å²	15	30.4 Å²	30.4	9%	0.091	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	124.7	175.1	-177.1	0	0	0	0	110.2	F20 W63 T66 C107 Y108 I109	F20-V115 HydrophobicContact CD1-CB 4.45Å; F20-V115 WeakPolarHBondContact CD1-O 3.44Å; W63-V115 HydrophobicContact CH2-CG2 3.56Å; W63-V115 HydrophobicContact CZ2-CG2 4.22Å; W63-V115 HydrophobicContact CZ3-CG2 4.34Å; T66-V115 HydrophobicContact CG2-CG2 3.65Å; C107-V115 HydrophobicContact CB-CG1 4.35Å; Y108-V115 CarbonylContact O-C 3.59Å; Y108-V115 WeakPolarHBondContact O-CA 3.34Å; I109-V115 HydrophobicContact CG1-CG2 4.22Å
116	R	92.8	Very high	91.9	Very high	25 Å²	25	32 Å²	32	9%	0.094	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	-9	-176.6	-57.9	-54.8	-170.3	-164.3	-5.1	114.3	F20 Q22 V23 F48 Y108 D110 Q114	F20-R116 CarbonylContact C-O 3.57Å; F20-R116 VanDerWaalsContact C-O 3.3Å; F20-R116 CarbonylContact O-C 3.56Å; Q22-R116 HydrophobicContact CB-CB 4.4Å; Q22-R116 PolarHBondContact N-O 3.19Å; V23-R116 HydrophobicContact CG2-CB 3.99Å; V23-R116 PolarHBondContact N-O 2.87Å; F48-R116 HydrophobicContact CE2-CB 4.37Å; F48-R116 HydrophobicContact CE2-CG 3.87Å; F48-R116 HydrophobicContact CZ-CB 4.38Å; F48-R116 HydrophobicContact CZ-CG 4.02Å; Y108-R116 HydrophobicContact CD1-CB 3.97Å; Y108-R116 HydrophobicContact CD1-CG 4.4Å; Y108-R116 PolarHBondContact O-N 3.09Å; D110-R116 HydrophobicContact CB-CG 4Å; D110-R116 IonicContact OD2-CZ 2.83Å; D110-R116 IonicContact OD2-NE 3.79Å; D110-R116 PolarHBondContact OD2-NE 3.35Å; D110-R116 IonicContact OD2-NH2 3.57Å; D110-R116 PolarHBondContact OD2-NH2 2.9Å; Q114-R116 VanDerWaalsContact OE1-NH2 3.11Å
117	G	93.5	Very high	90.1	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170	149.7	177.4	0	0	0	0	0	111.2	F20 V23 C107 Y108	F20-G117 WeakPolarHBondContact O-CA 3.4Å; V23-G117 VanDerWaalsContact O-CA 3.29Å; V23-G117 WeakPolarHBondContact O-CA 3.45Å; C107-G117 WeakPolarHBondContact CA-O 3.46Å; Y108-G117 PolarHBondContact N-O 3.26Å
118	A	95.3	Very high	88.2	Confident	53 Å²	53	40.5 Å²	40.5	44%	0.438	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	140.7	173	0	0	0	0	0	110.4	F106	F106-A118 CarbonylContact O-C 3.52Å; F106-A118 VanDerWaalsContact O-CA 3.26Å; F106-A118 WeakPolarHBondContact O-CA 3.39Å
119	S	95.8	Very high	86.2	Confident	13 Å²	13	44.1 Å²	44.1	9%	0.091	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-80.8	169.5	176.9	74	0	0	0	0	112.7	F106	F106-S119 PolarHBondContact N-OG 2.88Å; F106-S119 PolarHBondContact O-N 3.28Å
120	T	93.9	Very high	84.1	Confident	87 Å²	87	48.8 Å²	48.8	53%	0.534	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-61	147.7	159.2	48.4	0	0	0	0	110.4
121	P	94.6	Very high	81.6	Confident	61 Å²	61	50.9 Å²	50.9	40%	0.396	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-62.9	146.7	176.3	-25.5	35.8	0	0	0	113.7	V61 F103 Y104	V61-P121 HydrophobicContact CG2-CB 3.94Å; V61-P121 HydrophobicContact CG2-CG 4.11Å; F103-P121 HydrophobicContact CB-CB 4.49Å; Y104-P121 CarbonylContact O-C 3.57Å; Y104-P121 VanDerWaalsContact O-CA 3.28Å; Y104-P121 WeakPolarHBondContact O-CA 3.36Å
122	F	93.1	Very high	79.6	Confident	1 Å²	1	48.6 Å²	48.6	0%	0.004	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	166.2	175	58.4	-96.1	0	0	0	110.7	I28 P29 Y30 Y32 I58 F103 Y104 F106 F124	I28-F122 HydrophobicContact CG2-CD1 3.7Å; I28-F122 HydrophobicContact CG2-CE1 4.38Å; I28-F122 HydrophobicContact CG2-CG 4.47Å; P29-F122 VanDerWaalsContact O-CB 3.28Å; P29-F122 WeakPolarHBondContact O-CB 3.49Å; Y30-F122 WeakPolarHBondContact O-CA 3.44Å; Y32-F122 HydrophobicContact CD2-CB 4.38Å; Y32-F122 AromaticContact CD2-CD2 3.53Å; Y32-F122 HydrophobicContact CD2-CD2 3.53Å; Y32-F122 AromaticContact CD2-CE2 3.89Å; Y32-F122 HydrophobicContact CD2-CE2 3.89Å; Y32-F122 AromaticContact CD2-CG 3.95Å; Y32-F122 HydrophobicContact CD2-CG 3.95Å; Y32-F122 HydrophobicContact CE2-CB 4.38Å; Y32-F122 HydrophobicContact CE2-CD1 4.13Å; Y32-F122 AromaticContact CE2-CD2 3.81Å; Y32-F122 HydrophobicContact CE2-CD2 3.81Å; Y32-F122 HydrophobicContact CE2-CE1 4.35Å; Y32-F122 HydrophobicContact CE2-CE2 4.05Å; Y32-F122 AromaticContact CE2-CG 3.85Å; Y32-F122 HydrophobicContact CE2-CG 3.85Å; Y32-F122 HydrophobicContact CE2-CZ 4.31Å; I58-F122 HydrophobicContact CG2-CZ 4.36Å; F103-F122 CarbonylContact C-O 3.47Å; F103-F122 WeakPolarHBondContact CA-O 3.33Å; Y104-F122 PolarHBondContact N-O 3.13Å; Y104-F122 WeakPolarHBondContact O-CD1 3.5Å; Y104-F122 PolarHBondContact O-N 3.32Å; F106-F122 HydrophobicContact CD1-CE1 4.33Å; F106-F122 HydrophobicContact CD1-CZ 4.11Å; F106-F122 HydrophobicContact CD2-CD1 4.25Å; F106-F122 AromaticContact CD2-CE1 3.31Å; F106-F122 HydrophobicContact CD2-CE1 3.31Å; F106-F122 AromaticContact CD2-CZ 3.84Å; F106-F122 HydrophobicContact CD2-CZ 3.84Å; F106-F122 HydrophobicContact CE1-CE1 4.29Å; F106-F122 AromaticContact CE1-CZ 3.79Å; F106-F122 HydrophobicContact CE1-CZ 3.79Å; F106-F122 HydrophobicContact CE2-CD1 4.04Å; F106-F122 AromaticContact CE2-CE1 3.23Å; F106-F122 HydrophobicContact CE2-CE1 3.23Å; F106-F122 HydrophobicContact CE2-CE2 4.44Å; F106-F122 AromaticContact CE2-CZ 3.47Å; F106-F122 HydrophobicContact CE2-CZ 3.47Å; F106-F122 VanDerWaalsContact CE2-CZ 3.47Å; F106-F122 AromaticContact CG-CE1 3.87Å; F106-F122 HydrophobicContact CG-CE1 3.87Å; F106-F122 HydrophobicContact CG-CZ 4.12Å; F106-F122 AromaticContact CZ-CE1 3.75Å; F106-F122 HydrophobicContact CZ-CE1 3.75Å; F106-F122 HydrophobicContact CZ-CE2 4.24Å; F106-F122 AromaticContact CZ-CZ 3.44Å; F106-F122 HydrophobicContact CZ-CZ 3.44Å; F106-F122 VanDerWaalsContact CZ-CZ 3.44Å; F122-F124 HydrophobicContact CD2-CE2 4.28Å; F122-F124 HydrophobicContact CD2-CZ 4.42Å; F122-F124 AromaticContact CE2-CE2 3.75Å; F122-F124 HydrophobicContact CE2-CE2 3.75Å; F122-F124 AromaticContact CE2-CZ 3.74Å; F122-F124 HydrophobicContact CE2-CZ 3.74Å
123	C	92.1	Very high	77.2	Confident	6 Å²	6	53 Å²	53	4%	0.041	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	165.3	176	60.4	0	0	0	0	111.2	Y30 S31 Y32 F103 R125	Y30-C123 PolarHBondContact O-N 2.93Å; Y30-C123 VanDerWaalsContact O-N 3.1Å; Y30-C123 PolarHBondContact O-SG 3.47Å; Y30-C123 VanDerWaalsContact O-SG 3.41Å; S31-C123 CarbonylContact C-O 3.59Å; S31-C123 VanDerWaalsContact CA-O 3.24Å; S31-C123 WeakPolarHBondContact CA-O 3.32Å; Y32-C123 PolarHBondContact N-O 3.02Å; F103-C123 HydrophobicContact CD1-CB 4.27Å; F103-C123 HydrophobicContact CE1-CB 4.38Å; C123-R125 HydrophobicContact CB-CG 4.45Å; C123-R125 PolarHBondContact SG-NH1 3.43Å
124	F	89.1	Confident	74.8	Confident	0 Å²	0	56 Å²	56	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	100.3	171.4	-68.9	-84.2	0	0	0	108.7	Y32 P34 I38 I58 L96 P97 E100 Y104 F122	Y32-F124 CarbonylContact O-C 3.46Å; Y32-F124 VanDerWaalsContact O-CA 3.25Å; Y32-F124 WeakPolarHBondContact O-CA 3.45Å; P34-F124 HydrophobicContact CG-CB 4.31Å; I38-F124 HydrophobicContact CD1-CE1 3.46Å; I38-F124 VanDerWaalsContact CD1-CE1 3.46Å; I38-F124 HydrophobicContact CD1-CZ 3.57Å; I38-F124 HydrophobicContact CG1-CE1 4.28Å; I58-F124 HydrophobicContact CD1-CZ 4.28Å; L96-F124 HydrophobicContact CB-CE1 4.15Å; L96-F124 HydrophobicContact CB-CZ 4.49Å; L96-F124 HydrophobicContact CD1-CE1 4Å; L96-F124 HydrophobicContact CD2-CE1 4.47Å; L96-F124 HydrophobicContact CD2-CZ 4.48Å; L96-F124 HydrophobicContact CG-CE1 4.43Å; P97-F124 HydrophobicContact CB-CD2 3.76Å; P97-F124 HydrophobicContact CB-CE2 4Å; P97-F124 VanDerWaalsContact CD-CE2 3.45Å; P97-F124 HydrophobicContact CG-CD2 3.8Å; P97-F124 HydrophobicContact CG-CE2 3.47Å; P97-F124 VanDerWaalsContact CG-CE2 3.47Å; P97-F124 HydrophobicContact CG-CZ 4.24Å; E100-F124 WeakPolarHBondContact CA-O 3.38Å; Y104-F124 AromaticContact CD2-CD2 3.72Å; Y104-F124 HydrophobicContact CD2-CD2 3.72Å; Y104-F124 AromaticContact CD2-CE2 3.83Å; Y104-F124 HydrophobicContact CD2-CE2 3.83Å; Y104-F124 HydrophobicContact CE2-CD2 4.01Å; Y104-F124 HydrophobicContact CE2-CE2 4.4Å; Y104-F124 HydrophobicContact CG-CD2 4.43Å; Y104-F124 HydrophobicContact CG-CE2 4.08Å; F122-F124 HydrophobicContact CD2-CE2 4.28Å; F122-F124 HydrophobicContact CD2-CZ 4.42Å; F122-F124 AromaticContact CE2-CE2 3.75Å; F122-F124 HydrophobicContact CE2-CE2 3.75Å; F122-F124 AromaticContact CE2-CZ 3.74Å; F122-F124 HydrophobicContact CE2-CZ 3.74Å
125	R	84.2	Confident	72.4	Confident	45 Å²	45	55.8 Å²	55.8	17%	0.17	33%	0.329	C	S	.	.			trans	-145.6	146.7	-178.4	-69.6	-173.9	-174.7	110.6	10.4	110.7	Y32 E100 I101 C123	Y32-R125 PolarHBondContact O-N 2.97Å; E100-R125 HydrophobicContact CB-CG 4.29Å; E100-R125 PolarHBondContact O-NE 2.94Å; E100-R125 PolarHBondContact O-NH2 2.9Å; I101-R125 PolarHBondContact O-NH2 3.39Å; C123-R125 HydrophobicContact CB-CG 4.45Å; C123-R125 PolarHBondContact SG-NH1 3.43Å
126	N	73.3	Confident	69.9	Low	60 Å²	60	59.6 Å²	59.6	32%	0.321	36%	0.362	S	S	.	.			trans	-72.3	140.4	173.8	-76.6	-49.5	0	0	0	110.6	S128 E129	N126-S128 PolarHBondContact O-N 3.04Å; N126-S128 VanDerWaalsContact O-N 3.11Å; N126-E129 PolarHBondContact O-N 2.98Å
127	P	59.9	Low	67.5	Low	85 Å²	85	63.3 Å²	63.3	55%	0.552	38%	0.384	S	S	*	.	H	α-helix	trans	-56	-28.3	174.5	-24.4	32.8	0	0	0	113.4	E129 Q130	P127-E129 VanDerWaalsContact C-N 3.25Å; P127-E129 PolarHBondContact O-N 3.47Å; P127-Q130 PolarHBondContact O-N 3.09Å
128	S	55.1	Low	65.1	Low	95 Å²	95	69.8 Å²	69.8	66%	0.664	42%	0.418	S	S	*	.	H	α-helix	trans	-67.9	-20.5	177.8	-43.3	0	0	0	0	114	N126 S131	N126-S128 PolarHBondContact O-N 3.04Å; N126-S128 VanDerWaalsContact O-N 3.11Å; S128-S131 PolarHBondContact O-OG 3Å
129	E	53.8	Low	62.7	Low	75 Å²	75	75.3 Å²	75.3	35%	0.35	44%	0.441	S	S	.	.	H	α-helix	trans	-97.5	-12.5	-179.8	-71.5	165.6	170.7	0	0	112.7	N126 P127 S131 A132 E133	N126-E129 PolarHBondContact O-N 2.98Å; P127-E129 VanDerWaalsContact C-N 3.25Å; P127-E129 PolarHBondContact O-N 3.47Å; E129-S131 PolarHBondContact O-N 3.42Å; E129-A132 PolarHBondContact O-N 2.93Å; E129-E133 PolarHBondContact O-N 3.19Å; E129-E133 VanDerWaalsContact O-N 3.14Å
130	Q	50.8	Low	60.4	Low	98 Å²	98	79.2 Å²	79.2	46%	0.458	46%	0.46	S	S	.	.	H	α-helix	trans	-65.6	-29.4	167.7	-72.3	172.9	21.8	0	0	111.7	S31 P127 S134	S31-Q130 VanDerWaalsContact CB-NE2 3.26Å; S31-Q130 PolarHBondContact OG-NE2 3.35Å; P127-Q130 PolarHBondContact O-N 3.09Å; Q130-S134 PolarHBondContact O-OG 3.44Å
131	S	41.9	Very low	58.3	Low	55 Å²	55	82.3 Å²	82.3	39%	0.385	47%	0.472	S	S	.	.	H	α-helix	trans	-67.6	-44.6	163.4	23.8	0	0	0	0	111.2	S128 E129 E133 S134 I135	S128-S131 PolarHBondContact O-OG 3Å; E129-S131 PolarHBondContact O-N 3.42Å; S131-E133 PolarHBondContact O-N 2.94Å; S131-S134 CarbonylContact O-C 3.5Å; S131-S134 PolarHBondContact O-N 3.21Å; S131-S134 PolarHBondContact O-OG 2.89Å; S131-I135 VanDerWaalsContact C-CD1 3.47Å; S131-I135 WeakPolarHBondContact O-CB 3.34Å; S131-I135 WeakPolarHBondContact O-CD1 3.38Å; S131-I135 WeakPolarHBondContact O-CG1 3.4Å; S131-I135 PolarHBondContact O-N 3.12Å
132	A	47.5	Very low	56.3	Low	54 Å²	54	83.9 Å²	83.9	45%	0.446	48%	0.481	S	S	.	.	H	α-helix	trans	-68.5	-34.8	-170.6	0	0	0	0	0	115.4	E129 S134 I135 A136	E129-A132 PolarHBondContact O-N 2.93Å; A132-S134 VanDerWaalsContact C-N 3.35Å; A132-I135 CarbonylContact O-C 3.42Å; A132-I135 PolarHBondContact O-N 3.36Å; A132-I135 VanDerWaalsContact O-N 3.14Å; A132-A136 PolarHBondContact O-N 3.01Å
133	E	40.1	Very low	54.5	Low	159 Å²	159	90.3 Å²	90.3	74%	0.743	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-6.9	177.5	-70.3	-170.1	163	0	0	114.1	E129 S131	E129-E133 PolarHBondContact O-N 3.19Å; E129-E133 VanDerWaalsContact O-N 3.14Å; S131-E133 PolarHBondContact O-N 2.94Å
134	S	38	Very low	52.6	Low	98 Å²	98	93.4 Å²	93.4	69%	0.685	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	1.7	160.6	54	0	0	0	0	112.8	Q130 S131 A132	Q130-S134 PolarHBondContact O-OG 3.44Å; S131-S134 CarbonylContact O-C 3.5Å; S131-S134 PolarHBondContact O-N 3.21Å; S131-S134 PolarHBondContact O-OG 2.89Å; A132-S134 VanDerWaalsContact C-N 3.35Å
135	I	42.8	Very low	51.7	Low	86 Å²	86	96.5 Å²	96.5	44%	0.441	55%	0.551	S	S	.	*			trans	-123.1	22.3	-176.8	-62.3	165.8	0	0	0	110.9	S131 A132 D137 D138	S131-I135 VanDerWaalsContact C-CD1 3.47Å; S131-I135 WeakPolarHBondContact O-CB 3.34Å; S131-I135 WeakPolarHBondContact O-CD1 3.38Å; S131-I135 WeakPolarHBondContact O-CG1 3.4Å; S131-I135 PolarHBondContact O-N 3.12Å; A132-I135 CarbonylContact O-C 3.42Å; A132-I135 PolarHBondContact O-N 3.36Å; A132-I135 VanDerWaalsContact O-N 3.14Å; I135-D137 PolarHBondContact O-N 3.3Å; I135-D137 VanDerWaalsContact O-N 3.1Å; I135-D138 HydrophobicContact CG2-CB 3.86Å
136	A	40.3	Very low	51.2	Low	95 Å²	95	100.6 Å²	100.6	79%	0.785	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	28.4	166.7	0	0	0	0	0	113	A132	A132-A136 PolarHBondContact O-N 3.01Å
137	D	42.8	Very low	51.3	Low	104 Å²	104	104.3 Å²	104.3	56%	0.556	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.8	30.8	173.5	-150	21.6	0	0	0	111.6	I135 D139 L140	I135-D137 PolarHBondContact O-N 3.3Å; I135-D137 VanDerWaalsContact O-N 3.1Å; D137-D139 PolarHBondContact O-N 2.88Å; D137-L140 PolarHBondContact O-N 3.38Å
138	D	42.9	Very low	52	Low	135 Å²	135	105.6 Å²	105.6	72%	0.722	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	35.8	176.3	-141.3	24.1	0	0	0	112.6	I135	I135-D138 HydrophobicContact CG2-CB 3.86Å
139	D	43.7	Very low	53.2	Low	170 Å²	170	103.7 Å²	103.7	91%	0.909	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.4	13.7	149.9	-131.1	11.6	0	0	0	111.1	D137	D137-D139 PolarHBondContact O-N 2.88Å
140	L	49.2	Very low	54.6	Low	95 Å²	95	103.8 Å²	103.8	50%	0.497	57%	0.571	S	S	.	*	S	Bend	trans	-98.6	98.4	156.1	-171.4	67.2	0	0	0	107	D137 V142	D137-L140 PolarHBondContact O-N 3.38Å; L140-V142 HydrophobicContact CD2-CG2 4.1Å; L140-V142 HydrophobicContact CG-CG2 4.2Å; L140-V142 PolarHBondContact O-N 3.45Å
141	L	49.1	Very low	56.1	Low	152 Å²	152	102.9 Å²	102.9	80%	0.796	57%	0.567	S	S	*	*			trans	-59.7	89.8	162.9	-150.7	103.7	0	0	0	106.6	I143	L141-I143 HydrophobicContact CD2-CG1 4.08Å; L141-I143 PolarHBondContact O-N 2.89Å
142	V	53.6	Low	57.7	Low	94 Å²	94	103.8 Å²	103.8	57%	0.57	57%	0.573	S	S	*	*			trans	-67.2	97.5	170.7	-173.8	0	0	0	0	104.2	L140 T144	L140-V142 HydrophobicContact CD2-CG2 4.1Å; L140-V142 HydrophobicContact CG-CG2 4.2Å; L140-V142 PolarHBondContact O-N 3.45Å; V142-T144 HydrophobicContact CB-CG2 4.33Å; V142-T144 HydrophobicContact CG1-CG2 3.5Å; V142-T144 PolarHBondContact O-N 2.93Å
143	I	53.7	Low	59.5	Low	135 Å²	135	107.1 Å²	107.1	69%	0.692	58%	0.579	S	S	*	*			trans	-65	73.8	163.6	-55.5	172	0	0	0	105	L141 T145	L141-I143 HydrophobicContact CD2-CG1 4.08Å; L141-I143 PolarHBondContact O-N 2.89Å; I143-T145 PolarHBondContact O-N 3.44Å
144	T	53	Low	61.8	Low	72 Å²	72	105.8 Å²	105.8	44%	0.442	57%	0.568	S	S	.	*			trans	-64.9	120.6	161.3	53.1	0	0	0	0	104.3	V142 Q146	V142-T144 HydrophobicContact CB-CG2 4.33Å; V142-T144 HydrophobicContact CG1-CG2 3.5Å; V142-T144 PolarHBondContact O-N 2.93Å; T144-Q146 PolarHBondContact O-N 2.93Å
145	T	69.3	Low	64.2	Low	64 Å²	64	106 Å²	106	39%	0.393	56%	0.558	S	S	.	*			trans	-61.7	144.6	177	58.3	0	0	0	0	107.3	I143 E147 Q148 V149	I143-T145 PolarHBondContact O-N 3.44Å; T145-E147 PolarHBondContact O-N 3.02Å; T145-Q148 WeakPolarHBondContact O-CB 3.2Å; T145-Q148 PolarHBondContact O-N 3.36Å; T145-Q148 WeakPolarHBondContact OG1-CG 3.38Å; T145-Q148 PolarHBondContact OG1-N 3.32Å; T145-V149 PolarHBondContact O-N 3.14Å
146	Q	74.9	Confident	66.3	Low	132 Å²	132	109.1 Å²	109.1	62%	0.617	57%	0.568	S	S	*	*	H	α-helix	trans	-46.4	-34.3	172.4	176.2	62.9	20.5	0	0	111.1	T144 V149 E150	T144-Q146 PolarHBondContact O-N 2.93Å; Q146-V149 PolarHBondContact O-N 3.36Å; Q146-E150 WeakPolarHBondContact CG-OE1 3.43Å; Q146-E150 PolarHBondContact NE2-OE1 2.89Å; Q146-E150 WeakPolarHBondContact O-CB 3.24Å; Q146-E150 VanDerWaalsContact O-CG 3.31Å; Q146-E150 WeakPolarHBondContact O-CG 3.45Å; Q146-E150 PolarHBondContact O-N 3.45Å
147	E	75	Confident	68.8	Low	138 Å²	138	107.6 Å²	107.6	65%	0.645	56%	0.555	S	S	*	*	H	α-helix	trans	-61.2	-42	173.6	-173.6	174.4	-157.9	0	0	114.3	T145 E150 Q151	T145-E147 PolarHBondContact O-N 3.02Å; E147-E150 PolarHBondContact O-N 2.86Å; E147-Q151 WeakPolarHBondContact O-CB 3.42Å; E147-Q151 PolarHBondContact O-N 3.02Å
148	Q	73.7	Confident	71.2	Confident	112 Å²	112	107 Å²	107	52%	0.523	55%	0.549	S	S	.	.	H	α-helix	trans	-67.5	-37.6	177.2	-77.7	171	-22.1	0	0	112.5	T145 Q151 S152	T145-Q148 WeakPolarHBondContact O-CB 3.2Å; T145-Q148 PolarHBondContact O-N 3.36Å; T145-Q148 WeakPolarHBondContact OG1-CG 3.38Å; T145-Q148 PolarHBondContact OG1-N 3.32Å; Q148-Q151 PolarHBondContact O-N 3.14Å; Q148-S152 WeakPolarHBondContact O-CB 3.4Å; Q148-S152 PolarHBondContact O-N 3.45Å
149	V	80.7	Confident	73.6	Confident	54 Å²	54	105.9 Å²	105.9	33%	0.327	54%	0.543	S	S	.	.	H	α-helix	trans	-67.5	-45.2	175.5	177.1	0	0	0	0	110.4	T145 Q146 Q151 S152 Q153	T145-V149 PolarHBondContact O-N 3.14Å; Q146-V149 PolarHBondContact O-N 3.36Å; V149-Q151 VanDerWaalsContact C-N 3.3Å; V149-Q151 PolarHBondContact O-N 3.47Å; V149-S152 PolarHBondContact O-N 3.16Å; V149-Q153 WeakPolarHBondContact O-CB 3.43Å; V149-Q153 VanDerWaalsContact O-CG 3.3Å; V149-Q153 WeakPolarHBondContact O-CG 3.44Å; V149-Q153 PolarHBondContact O-N 2.93Å
150	E	83	Confident	75.9	Confident	78 Å²	78	102.2 Å²	102.2	36%	0.364	52%	0.52	S	S	.	.	H	α-helix	trans	-63.3	-37	175.2	-73.9	175.6	-171.6	0	0	112.3	Q146 E147 R154	Q146-E150 WeakPolarHBondContact CG-OE1 3.43Å; Q146-E150 PolarHBondContact NE2-OE1 2.89Å; Q146-E150 WeakPolarHBondContact O-CB 3.24Å; Q146-E150 VanDerWaalsContact O-CG 3.31Å; Q146-E150 WeakPolarHBondContact O-CG 3.45Å; Q146-E150 PolarHBondContact O-N 3.45Å; E147-E150 PolarHBondContact O-N 2.86Å; E150-R154 WeakPolarHBondContact O-CB 3.39Å; E150-R154 VanDerWaalsContact O-CG 3.25Å; E150-R154 WeakPolarHBondContact O-CG 3.38Å; E150-R154 PolarHBondContact O-N 3.46Å; E150-R154 PolarHBondContact O-NE 3.17Å; E150-R154 IonicContact OE2-NH2 2.65Å
151	Q	82.1	Confident	78.1	Confident	78 Å²	78	104.1 Å²	104.1	36%	0.364	52%	0.524	S	S	.	.	H	α-helix	trans	-65.6	-46.7	175.6	-176.6	63	21.5	0	0	111.3	E147 Q148 V149 Q153 R154 E155	E147-Q151 WeakPolarHBondContact O-CB 3.42Å; E147-Q151 PolarHBondContact O-N 3.02Å; Q148-Q151 PolarHBondContact O-N 3.14Å; V149-Q151 VanDerWaalsContact C-N 3.3Å; V149-Q151 PolarHBondContact O-N 3.47Å; Q151-Q153 VanDerWaalsContact C-N 3.35Å; Q151-Q153 PolarHBondContact O-N 3.31Å; Q151-R154 WeakPolarHBondContact O-CB 3.4Å; Q151-R154 PolarHBondContact O-N 2.97Å; Q151-E155 WeakPolarHBondContact CG-OE1 3.31Å; Q151-E155 PolarHBondContact NE2-OE1 2.94Å; Q151-E155 WeakPolarHBondContact O-CG 3.28Å; Q151-E155 PolarHBondContact O-N 3.01Å
152	S	76.8	Confident	80.3	Confident	74 Å²	74	101.6 Å²	101.6	52%	0.517	51%	0.509	S	S	.	.	H	α-helix	trans	-63.5	-38.7	176.4	-178.2	0	0	0	0	112.4	Q148 V149 E155 K156	Q148-S152 WeakPolarHBondContact O-CB 3.4Å; Q148-S152 PolarHBondContact O-N 3.45Å; V149-S152 PolarHBondContact O-N 3.16Å; S152-E155 PolarHBondContact O-N 2.98Å; S152-K156 WeakPolarHBondContact O-CB 3.49Å; S152-K156 PolarHBondContact O-N 3.49Å
153	Q	84.3	Confident	82.1	Confident	124 Å²	124	102 Å²	102	58%	0.579	51%	0.507	S	S	*	.	H	α-helix	trans	-67	-38.8	174.7	-73.6	178.5	5.9	0	0	112.2	V149 Q151 K156 A157	V149-Q153 WeakPolarHBondContact O-CB 3.43Å; V149-Q153 VanDerWaalsContact O-CG 3.3Å; V149-Q153 WeakPolarHBondContact O-CG 3.44Å; V149-Q153 PolarHBondContact O-N 2.93Å; Q151-Q153 VanDerWaalsContact C-N 3.35Å; Q151-Q153 PolarHBondContact O-N 3.31Å; Q153-K156 PolarHBondContact O-N 2.93Å; Q153-A157 WeakPolarHBondContact O-CB 3.26Å; Q153-A157 PolarHBondContact O-N 2.84Å
154	R	88.3	Confident	84	Confident	131 Å²	131	99.9 Å²	99.9	49%	0.494	50%	0.497	S	S	.	.	H	α-helix	trans	-62.8	-45.4	173	-80	-178.6	-103	143	-10.4	111.4	E150 Q151 A157 E158	E150-R154 WeakPolarHBondContact O-CB 3.39Å; E150-R154 VanDerWaalsContact O-CG 3.25Å; E150-R154 WeakPolarHBondContact O-CG 3.38Å; E150-R154 PolarHBondContact O-N 3.46Å; E150-R154 PolarHBondContact O-NE 3.17Å; E150-R154 IonicContact OE2-NH2 2.65Å; Q151-R154 WeakPolarHBondContact O-CB 3.4Å; Q151-R154 PolarHBondContact O-N 2.97Å; R154-A157 PolarHBondContact O-N 2.76Å; R154-E158 WeakPolarHBondContact O-CB 3.27Å; R154-E158 PolarHBondContact O-N 3.42Å
155	E	89.4	Confident	86.1	Confident	102 Å²	102	102.1 Å²	102.1	48%	0.477	51%	0.506	S	S	.	.	H	α-helix	trans	-63.1	-43.1	176.5	-73.9	170.7	-166.4	0	0	111.9	Q151 S152 A157 E158 L159	Q151-E155 WeakPolarHBondContact CG-OE1 3.31Å; Q151-E155 PolarHBondContact NE2-OE1 2.94Å; Q151-E155 WeakPolarHBondContact O-CG 3.28Å; Q151-E155 PolarHBondContact O-N 3.01Å; S152-E155 PolarHBondContact O-N 2.98Å; E155-A157 PolarHBondContact O-N 2.97Å; E155-E158 PolarHBondContact O-N 3.02Å; E155-L159 WeakPolarHBondContact O-CB 3.36Å; E155-L159 VanDerWaalsContact O-CG 3.31Å; E155-L159 WeakPolarHBondContact O-CG 3.37Å; E155-L159 PolarHBondContact O-N 2.92Å
156	K	86.1	Confident	87.1	Confident	153 Å²	153	104 Å²	104	67%	0.665	51%	0.511	S	S	*	.	H	α-helix	trans	-62.4	-41.8	175	-175	178.1	178.9	178.7	0	112.3	S152 Q153 Q160	S152-K156 WeakPolarHBondContact O-CB 3.49Å; S152-K156 PolarHBondContact O-N 3.49Å; Q153-K156 PolarHBondContact O-N 2.93Å; K156-Q160 WeakPolarHBondContact O-CB 3.44Å; K156-Q160 PolarHBondContact O-N 3.32Å
157	A	92.4	Very high	88	Confident	62 Å²	62	101.8 Å²	101.8	51%	0.512	51%	0.507	S	S	.	.	H	α-helix	trans	-65.5	-39.5	176.8	0	0	0	0	0	111.8	Q153 R154 E155 Q160 K161	Q153-A157 WeakPolarHBondContact O-CB 3.26Å; Q153-A157 PolarHBondContact O-N 2.84Å; R154-A157 PolarHBondContact O-N 2.76Å; E155-A157 PolarHBondContact O-N 2.97Å; A157-Q160 PolarHBondContact O-N 3.25Å; A157-K161 WeakPolarHBondContact O-CB 3.34Å; A157-K161 PolarHBondContact O-N 3.47Å
158	E	93.6	Very high	89	Confident	92 Å²	92	97.8 Å²	97.8	43%	0.43	50%	0.497	S	S	.	.	H	α-helix	trans	-68.4	-43.4	176.8	-173	56.4	-147.7	0	0	111.7	R154 E155 Q160 K161 Q162	R154-E158 WeakPolarHBondContact O-CB 3.27Å; R154-E158 PolarHBondContact O-N 3.42Å; E155-E158 PolarHBondContact O-N 3.02Å; E158-Q160 VanDerWaalsContact C-N 3.32Å; E158-Q160 PolarHBondContact O-N 3.29Å; E158-K161 WeakPolarHBondContact O-CB 3.34Å; E158-K161 PolarHBondContact O-N 3.36Å; E158-Q162 WeakPolarHBondContact O-CG 3.47Å; E158-Q162 PolarHBondContact O-N 3.42Å
159	L	93.2	Very high	90	Very high	112 Å²	112	97.3 Å²	97.3	59%	0.586	50%	0.495	S	S	*	.	H	α-helix	trans	-61.5	-40.5	173.8	-73	172.4	0	0	0	111.9	E155 K161 Q162 L163	E155-L159 WeakPolarHBondContact O-CB 3.36Å; E155-L159 VanDerWaalsContact O-CG 3.31Å; E155-L159 WeakPolarHBondContact O-CG 3.37Å; E155-L159 PolarHBondContact O-N 2.92Å; L159-K161 VanDerWaalsContact C-N 3.34Å; L159-Q162 PolarHBondContact O-N 3.3Å; L159-L163 PolarHBondContact O-N 3.49Å
160	Q	92.5	Very high	90.4	Very high	93 Å²	93	98.4 Å²	98.4	44%	0.435	50%	0.499	S	S	.	.	H	α-helix	trans	-62.9	-42.9	175.4	-173.6	62	56.3	0	0	111.3	K156 A157 E158 Q162 L163 D164	K156-Q160 WeakPolarHBondContact O-CB 3.44Å; K156-Q160 PolarHBondContact O-N 3.32Å; A157-Q160 PolarHBondContact O-N 3.25Å; E158-Q160 VanDerWaalsContact C-N 3.32Å; E158-Q160 PolarHBondContact O-N 3.29Å; Q160-Q162 VanDerWaalsContact C-N 3.33Å; Q160-Q162 PolarHBondContact O-N 2.94Å; Q160-L163 WeakPolarHBondContact O-CB 3.32Å; Q160-L163 PolarHBondContact O-N 2.7Å; Q160-D164 PolarHBondContact NE2-OD1 3.04Å; Q160-D164 VanDerWaalsContact O-CG 3.25Å; Q160-D164 PolarHBondContact O-N 3Å
161	K	95.9	Very high	91	Very high	134 Å²	134	102.4 Å²	102.4	58%	0.583	52%	0.516	S	S	*	.	H	α-helix	trans	-62.6	-39.4	176.7	-173.7	-176.2	175.4	-168.3	0	112.1	A157 E158 L159 D164 L165	A157-K161 WeakPolarHBondContact O-CB 3.34Å; A157-K161 PolarHBondContact O-N 3.47Å; E158-K161 WeakPolarHBondContact O-CB 3.34Å; E158-K161 PolarHBondContact O-N 3.36Å; L159-K161 VanDerWaalsContact C-N 3.34Å; K161-D164 PolarHBondContact O-N 2.84Å; K161-L165 WeakPolarHBondContact O-CB 3.47Å; K161-L165 PolarHBondContact O-N 2.91Å
162	Q	95.7	Very high	91.7	Very high	99 Å²	99	103.4 Å²	103.4	46%	0.463	53%	0.527	S	S	.	.	H	α-helix	trans	-65.3	-40.7	174.3	-71	178.7	22.4	0	0	111.8	E158 L159 Q160 L165 M166	E158-Q162 WeakPolarHBondContact O-CG 3.47Å; E158-Q162 PolarHBondContact O-N 3.42Å; L159-Q162 PolarHBondContact O-N 3.3Å; Q160-Q162 VanDerWaalsContact C-N 3.33Å; Q160-Q162 PolarHBondContact O-N 2.94Å; Q162-L165 PolarHBondContact O-N 3.25Å; Q162-M166 WeakPolarHBondContact O-CB 3.25Å; Q162-M166 WeakPolarHBondContact O-CG 3.39Å; Q162-M166 PolarHBondContact O-N 2.87Å
163	L	89.9	Confident	92.5	Very high	102 Å²	102	104.8 Å²	104.8	53%	0.534	53%	0.528	S	S	.	.	H	α-helix	trans	-63.6	-42.2	176.3	-170.6	69.2	0	0	0	111.9	L159 Q160 M166 T167	L159-L163 PolarHBondContact O-N 3.49Å; Q160-L163 WeakPolarHBondContact O-CB 3.32Å; Q160-L163 PolarHBondContact O-N 2.7Å; L163-M166 PolarHBondContact O-N 3.46Å; L163-T167 WeakPolarHBondContact O-CB 3.31Å; L163-T167 PolarHBondContact O-N 2.83Å; L163-T167 PolarHBondContact O-OG1 2.92Å
164	D	94.4	Very high	93	Very high	91 Å²	91	105.6 Å²	105.6	49%	0.487	53%	0.53	S	S	.	.	H	α-helix	trans	-65	-41.4	177.6	-66.8	-14.1	0	0	0	111.1	Q160 K161 T167 A168	Q160-D164 PolarHBondContact NE2-OD1 3.04Å; Q160-D164 VanDerWaalsContact O-CG 3.25Å; Q160-D164 PolarHBondContact O-N 3Å; K161-D164 PolarHBondContact O-N 2.84Å; D164-T167 PolarHBondContact O-N 3.44Å; D164-A168 WeakPolarHBondContact O-CB 3.48Å; D164-A168 PolarHBondContact O-N 3.4Å
165	L	96.1	Very high	93.4	Very high	120 Å²	120	103.2 Å²	103.2	63%	0.628	53%	0.533	S	S	*	.	H	α-helix	trans	-62.8	-49.6	175.8	-175	67.6	0	0	0	111.4	K161 Q162 T167 A168 E169	K161-L165 WeakPolarHBondContact O-CB 3.47Å; K161-L165 PolarHBondContact O-N 2.91Å; Q162-L165 PolarHBondContact O-N 3.25Å; L165-T167 PolarHBondContact O-N 3.43Å; L165-A168 PolarHBondContact O-N 2.97Å; L165-E169 WeakPolarHBondContact O-CB 3.35Å; L165-E169 PolarHBondContact O-N 3.36Å
166	M	92.1	Very high	93.7	Very high	102 Å²	102	100.4 Å²	100.4	50%	0.502	53%	0.527	S	S	.	.	H	α-helix	trans	-59.8	-36.7	176.5	-75.6	-62.9	-61.8	0	0	111.9	Q162 L163 N170	Q162-M166 WeakPolarHBondContact O-CB 3.25Å; Q162-M166 WeakPolarHBondContact O-CG 3.39Å; Q162-M166 PolarHBondContact O-N 2.87Å; L163-M166 PolarHBondContact O-N 3.46Å; M166-N170 WeakPolarHBondContact O-CB 3.49Å; M166-N170 PolarHBondContact O-N 3.39Å; M166-N170 PolarHBondContact O-ND2 3.29Å
167	T	93.4	Very high	94	Very high	87 Å²	87	98.7 Å²	98.7	53%	0.534	53%	0.525	S	S	.	.	H	α-helix	trans	-68.7	-42.4	177.7	-59.1	0	0	0	0	111.4	L163 D164 L165 N170 K171	L163-T167 WeakPolarHBondContact O-CB 3.31Å; L163-T167 PolarHBondContact O-N 2.83Å; L163-T167 PolarHBondContact O-OG1 2.92Å; D164-T167 PolarHBondContact O-N 3.44Å; L165-T167 PolarHBondContact O-N 3.43Å; T167-N170 PolarHBondContact O-N 3.06Å; T167-K171 PolarHBondContact O-N 3.12Å
168	A	95.5	Very high	94.2	Very high	53 Å²	53	101.4 Å²	101.4	44%	0.438	53%	0.53	S	S	.	.	H	α-helix	trans	-65.5	-40.9	176.1	0	0	0	0	0	112.3	D164 L165 K171 T172	D164-A168 WeakPolarHBondContact O-CB 3.48Å; D164-A168 PolarHBondContact O-N 3.4Å; L165-A168 PolarHBondContact O-N 2.97Å; A168-K171 PolarHBondContact O-N 2.97Å; A168-T172 PolarHBondContact O-N 2.93Å; A168-T172 PolarHBondContact O-OG1 3.13Å
169	E	95.1	Very high	94.4	Very high	103 Å²	103	103.5 Å²	103.5	48%	0.481	54%	0.538	S	S	.	.	H	α-helix	trans	-64.2	-47	175.2	-172	174.6	-169.3	0	0	111.1	L165 K171 T172 L173	L165-E169 WeakPolarHBondContact O-CB 3.35Å; L165-E169 PolarHBondContact O-N 3.36Å; E169-K171 VanDerWaalsContact C-N 3.26Å; E169-K171 PolarHBondContact O-N 3.4Å; E169-T172 WeakPolarHBondContact O-CB 3.5Å; E169-T172 PolarHBondContact O-N 3.39Å; E169-L173 HydrophobicContact CG-CD1 4.13Å; E169-L173 HydrophobicContact CG-CG 4.42Å; E169-L173 WeakPolarHBondContact O-CG 3.5Å; E169-L173 PolarHBondContact O-N 3.13Å
170	N	88.1	Confident	94.3	Very high	77 Å²	77	102.3 Å²	102.3	41%	0.412	53%	0.532	S	S	.	.	H	α-helix	trans	-58.1	-37.8	175.1	-91.3	-79.4	0	0	0	112.8	M166 T167 K174	M166-N170 WeakPolarHBondContact O-CB 3.49Å; M166-N170 PolarHBondContact O-N 3.39Å; M166-N170 PolarHBondContact O-ND2 3.29Å; T167-N170 PolarHBondContact O-N 3.06Å; N170-K174 WeakPolarHBondContact O-CB 3.46Å; N170-K174 WeakPolarHBondContact O-CG 3.34Å; N170-K174 PolarHBondContact O-N 3.37Å
171	K	96.4	Very high	94.3	Very high	162 Å²	162	103.9 Å²	103.9	70%	0.704	54%	0.54	S	S	*	.	H	α-helix	trans	-65.6	-42.4	175.7	-172.4	178.6	179.5	-179.3	0	111.5	T167 A168 E169 K174 S175	T167-K171 PolarHBondContact O-N 3.12Å; A168-K171 PolarHBondContact O-N 2.97Å; E169-K171 VanDerWaalsContact C-N 3.26Å; E169-K171 PolarHBondContact O-N 3.4Å; K171-K174 PolarHBondContact O-N 2.97Å; K171-S175 PolarHBondContact O-N 2.84Å; K171-S175 VanDerWaalsContact O-N 3.08Å
172	T	95.8	Very high	94.2	Very high	99 Å²	99	104.7 Å²	104.7	61%	0.607	54%	0.543	S	S	*	.	H	α-helix	trans	-63.5	-48	176.4	-56.2	0	0	0	0	111	A168 E169 K174 S175 A176	A168-T172 PolarHBondContact O-N 2.93Å; A168-T172 PolarHBondContact O-OG1 3.13Å; E169-T172 WeakPolarHBondContact O-CB 3.5Å; E169-T172 PolarHBondContact O-N 3.39Å; T172-K174 PolarHBondContact O-N 2.93Å; T172-S175 WeakPolarHBondContact O-CB 3.46Å; T172-S175 PolarHBondContact O-N 2.79Å; T172-S175 VanDerWaalsContact O-N 3.14Å; T172-A176 PolarHBondContact O-N 3.1Å
173	L	94.6	Very high	94.1	Very high	102 Å²	102	103.9 Å²	103.9	53%	0.534	54%	0.542	S	S	.	.	H	α-helix	trans	-60.7	-42.2	177.8	-71.3	173.7	0	0	0	112	E169 S175 A176 L177	E169-L173 HydrophobicContact CG-CD1 4.13Å; E169-L173 HydrophobicContact CG-CG 4.42Å; E169-L173 WeakPolarHBondContact O-CG 3.5Å; E169-L173 PolarHBondContact O-N 3.13Å; L173-S175 VanDerWaalsContact C-N 3.33Å; L173-S175 PolarHBondContact O-N 3.35Å; L173-A176 PolarHBondContact O-N 2.84Å; L173-L177 WeakPolarHBondContact O-CB 3.49Å; L173-L177 PolarHBondContact O-N 3.06Å
174	K	95.4	Very high	94.2	Very high	142 Å²	142	104.7 Å²	104.7	62%	0.617	55%	0.545	S	S	*	.	H	α-helix	trans	-61.8	-40	174.6	-79.2	179	179.7	179.3	0	112.6	N170 K171 T172 L178	N170-K174 WeakPolarHBondContact O-CB 3.46Å; N170-K174 WeakPolarHBondContact O-CG 3.34Å; N170-K174 PolarHBondContact O-N 3.37Å; K171-K174 PolarHBondContact O-N 2.97Å; T172-K174 PolarHBondContact O-N 2.93Å; K174-L178 PolarHBondContact O-N 3.44Å; K174-L178 VanDerWaalsContact O-N 3.07Å
175	S	95.8	Very high	94	Very high	80 Å²	80	103.6 Å²	103.6	56%	0.559	55%	0.545	S	S	*	.	H	α-helix	trans	-67.5	-38.4	176.7	-172.2	0	0	0	0	112.2	K171 T172 L173 K179	K171-S175 PolarHBondContact O-N 2.84Å; K171-S175 VanDerWaalsContact O-N 3.08Å; T172-S175 WeakPolarHBondContact O-CB 3.46Å; T172-S175 PolarHBondContact O-N 2.79Å; T172-S175 VanDerWaalsContact O-N 3.14Å; L173-S175 VanDerWaalsContact C-N 3.33Å; L173-S175 PolarHBondContact O-N 3.35Å; S175-K179 PolarHBondContact O-N 3.09Å; S175-K179 VanDerWaalsContact O-N 3.16Å
176	A	95.3	Very high	94	Very high	44 Å²	44	100.3 Å²	100.3	36%	0.364	53%	0.532	S	S	.	.	H	α-helix	trans	-64.5	-47.4	174.8	0	0	0	0	0	110.7	T172 L173 L178 K179 D180	T172-A176 PolarHBondContact O-N 3.1Å; L173-A176 PolarHBondContact O-N 2.84Å; A176-L178 VanDerWaalsContact C-N 3.32Å; A176-L178 PolarHBondContact O-N 3.39Å; A176-K179 WeakPolarHBondContact O-CA 3.44Å; A176-K179 WeakPolarHBondContact O-CB 3.35Å; A176-K179 PolarHBondContact O-N 3.25Å; A176-D180 PolarHBondContact O-N 3.5Å
177	L	93.8	Very high	93.7	Very high	116 Å²	116	99 Å²	99	61%	0.607	53%	0.533	S	S	*	.	H	α-helix	trans	-56.9	-43.4	177.3	-166.9	87.6	0	0	0	112.5	L173 K179 D180 Q181	L173-L177 WeakPolarHBondContact O-CB 3.49Å; L173-L177 PolarHBondContact O-N 3.06Å; L177-K179 VanDerWaalsContact C-N 3.31Å; L177-K179 PolarHBondContact O-N 3.14Å; L177-D180 PolarHBondContact O-N 3.02Å; L177-Q181 VanDerWaalsContact O-CB 3.3Å; L177-Q181 WeakPolarHBondContact O-CB 3.48Å; L177-Q181 PolarHBondContact O-N 3.05Å
178	L	96.2	Very high	93.7	Very high	120 Å²	120	101.2 Å²	101.2	63%	0.628	54%	0.535	S	S	*	.	H	α-helix	trans	-63	-38.1	176.1	-94.4	159.1	0	0	0	112.5	K174 A176 K182	K174-L178 PolarHBondContact O-N 3.44Å; K174-L178 VanDerWaalsContact O-N 3.07Å; A176-L178 VanDerWaalsContact C-N 3.32Å; A176-L178 PolarHBondContact O-N 3.39Å; L178-K182 PolarHBondContact O-N 3.31Å; L178-K182 VanDerWaalsContact O-N 3.16Å
179	K	96.4	Very high	93.6	Very high	135 Å²	135	105.3 Å²	105.3	59%	0.587	55%	0.545	S	S	*	.	H	α-helix	trans	-67.9	-49	176.8	-172.3	-176.1	175.1	-170.7	0	110.6	S175 A176 L177 Q181 K182 D183	S175-K179 PolarHBondContact O-N 3.09Å; S175-K179 VanDerWaalsContact O-N 3.16Å; A176-K179 WeakPolarHBondContact O-CA 3.44Å; A176-K179 WeakPolarHBondContact O-CB 3.35Å; A176-K179 PolarHBondContact O-N 3.25Å; L177-K179 VanDerWaalsContact C-N 3.31Å; L177-K179 PolarHBondContact O-N 3.14Å; K179-Q181 VanDerWaalsContact C-N 3.28Å; K179-Q181 PolarHBondContact O-N 3.43Å; K179-K182 WeakPolarHBondContact O-CA 3.37Å; K179-K182 WeakPolarHBondContact O-CB 3.46Å; K179-K182 PolarHBondContact O-N 3.34Å; K179-D183 PolarHBondContact O-N 3.4Å
180	D	91.9	Very high	93.5	Very high	88 Å²	88	104.9 Å²	104.9	47%	0.471	54%	0.543	S	S	.	.	H	α-helix	trans	-60.4	-40.1	178.6	-64.2	-8.3	0	0	0	110.9	A176 L177 K182 D183 I184	A176-D180 PolarHBondContact O-N 3.5Å; L177-D180 PolarHBondContact O-N 3.02Å; D180-K182 VanDerWaalsContact C-N 3.31Å; D180-K182 PolarHBondContact O-N 3.21Å; D180-D183 PolarHBondContact O-N 2.89Å; D180-I184 WeakPolarHBondContact O-CB 3.46Å; D180-I184 WeakPolarHBondContact O-CD1 3.23Å; D180-I184 WeakPolarHBondContact O-CG1 3.35Å; D180-I184 PolarHBondContact O-N 3Å
181	Q	91.9	Very high	93.3	Very high	126 Å²	126	103.9 Å²	103.9	59%	0.589	54%	0.542	S	S	*	.	H	α-helix	trans	-62.7	-37.2	175.6	-172.1	168.4	2.6	0	0	112.4	L177 K179 S185	L177-Q181 VanDerWaalsContact O-CB 3.3Å; L177-Q181 WeakPolarHBondContact O-CB 3.48Å; L177-Q181 PolarHBondContact O-N 3.05Å; K179-Q181 VanDerWaalsContact C-N 3.28Å; K179-Q181 PolarHBondContact O-N 3.43Å; Q181-S185 PolarHBondContact O-N 3.47Å; Q181-S185 VanDerWaalsContact O-N 3.12Å
182	K	94.8	Very high	93.1	Very high	150 Å²	150	100.2 Å²	100.2	65%	0.652	53%	0.53	S	S	*	.	H	α-helix	trans	-68.3	-44.2	174.1	-172.9	179.7	179.1	-178.6	0	111.3	L178 K179 D180 I184 S185 S186	L178-K182 PolarHBondContact O-N 3.31Å; L178-K182 VanDerWaalsContact O-N 3.16Å; K179-K182 WeakPolarHBondContact O-CA 3.37Å; K179-K182 WeakPolarHBondContact O-CB 3.46Å; K179-K182 PolarHBondContact O-N 3.34Å; D180-K182 VanDerWaalsContact C-N 3.31Å; D180-K182 PolarHBondContact O-N 3.21Å; K182-I184 PolarHBondContact O-N 3.49Å; K182-S185 PolarHBondContact O-N 2.92Å; K182-S185 VanDerWaalsContact O-N 3.17Å; K182-S185 PolarHBondContact O-OG 3.48Å; K182-S186 PolarHBondContact O-N 2.92Å
183	D	93.8	Very high	93	Very high	83 Å²	83	101.1 Å²	101.1	44%	0.444	53%	0.528	S	S	.	.	H	α-helix	trans	-65.3	-40.1	-179.6	-67	-13	0	0	0	111	K179 D180 S185 S186 S187	K179-D183 PolarHBondContact O-N 3.4Å; D180-D183 PolarHBondContact O-N 2.89Å; D183-S185 PolarHBondContact O-N 2.92Å; D183-S186 PolarHBondContact O-N 3.38Å; D183-S187 WeakPolarHBondContact O-CB 3.34Å; D183-S187 PolarHBondContact O-N 3.48Å
184	I	91.7	Very high	92.9	Very high	118 Å²	118	104 Å²	104	61%	0.605	53%	0.531	S	S	*	.	H	α-helix	trans	-58.9	-45.8	171.6	-70	164.6	0	0	0	110.8	D180 K182 S186 S187 K188	D180-I184 WeakPolarHBondContact O-CB 3.46Å; D180-I184 WeakPolarHBondContact O-CD1 3.23Å; D180-I184 WeakPolarHBondContact O-CG1 3.35Å; D180-I184 PolarHBondContact O-N 3Å; K182-I184 PolarHBondContact O-N 3.49Å; I184-S186 PolarHBondContact O-N 2.9Å; I184-S187 PolarHBondContact O-N 2.92Å; I184-K188 VanDerWaalsContact O-CB 3.32Å; I184-K188 WeakPolarHBondContact O-CB 3.45Å; I184-K188 PolarHBondContact O-N 2.91Å
185	S	90.7	Very high	92.6	Very high	68 Å²	68	102.8 Å²	102.8	48%	0.476	53%	0.528	S	S	.	.	H	α-helix	trans	-63.4	-40.9	179.9	69.2	0	0	0	0	112.5	Q181 K182 D183 K188 E189	Q181-S185 PolarHBondContact O-N 3.47Å; Q181-S185 VanDerWaalsContact O-N 3.12Å; K182-S185 PolarHBondContact O-N 2.92Å; K182-S185 VanDerWaalsContact O-N 3.17Å; K182-S185 PolarHBondContact O-OG 3.48Å; D183-S185 PolarHBondContact O-N 2.92Å; S185-K188 PolarHBondContact O-N 3.42Å; S185-E189 PolarHBondContact O-N 3.43Å; S185-E189 VanDerWaalsContact O-N 3.12Å
186	S	94.6	Very high	92.6	Very high	52 Å²	52	101.9 Å²	101.9	36%	0.364	53%	0.526	S	S	.	.	H	α-helix	trans	-69.6	-41.7	177.6	-176.7	0	0	0	0	112.1	K182 D183 I184 K188 E189 Q190	K182-S186 PolarHBondContact O-N 2.92Å; D183-S186 PolarHBondContact O-N 3.38Å; I184-S186 PolarHBondContact O-N 2.9Å; S186-K188 VanDerWaalsContact C-N 3.3Å; S186-K188 PolarHBondContact O-N 3.45Å; S186-E189 PolarHBondContact O-N 3.46Å; S186-Q190 WeakPolarHBondContact O-CG 3.16Å; S186-Q190 PolarHBondContact O-N 3.37Å; S186-Q190 VanDerWaalsContact O-N 3.08Å
187	S	87.7	Confident	92.5	Very high	74 Å²	74	104.9 Å²	104.9	52%	0.517	53%	0.532	S	S	.	.	H	α-helix	trans	-64.6	-36.4	176.3	-173.8	0	0	0	0	111.9	D183 I184 Q190 S191	D183-S187 WeakPolarHBondContact O-CB 3.34Å; D183-S187 PolarHBondContact O-N 3.48Å; I184-S187 PolarHBondContact O-N 2.92Å; S187-Q190 PolarHBondContact O-N 3.05Å; S187-S191 PolarHBondContact O-N 3.13Å
188	K	93.1	Very high	92.4	Very high	133 Å²	133	104.7 Å²	104.7	58%	0.578	53%	0.529	S	S	*	.	H	α-helix	trans	-64.5	-45.7	176.1	-172.5	177.3	179.4	-178.5	0	111.3	I184 S185 S186 Q190 S191 D192	I184-K188 VanDerWaalsContact O-CB 3.32Å; I184-K188 WeakPolarHBondContact O-CB 3.45Å; I184-K188 PolarHBondContact O-N 2.91Å; S185-K188 PolarHBondContact O-N 3.42Å; S186-K188 VanDerWaalsContact C-N 3.3Å; S186-K188 PolarHBondContact O-N 3.45Å; K188-Q190 VanDerWaalsContact C-N 3.32Å; K188-Q190 PolarHBondContact O-N 3.45Å; K188-S191 WeakPolarHBondContact O-CB 3.18Å; K188-S191 PolarHBondContact O-N 3.32Å; K188-S191 VanDerWaalsContact O-N 3.11Å; K188-D192 VanDerWaalsContact O-CG 3.32Å; K188-D192 PolarHBondContact O-N 3.44Å
189	E	93.8	Very high	92.3	Very high	139 Å²	139	101.6 Å²	101.6	65%	0.65	52%	0.521	S	S	*	.	H	α-helix	trans	-59.8	-41.9	176.6	-173.7	173.1	-158.3	0	0	112.1	S185 S186 S191 D192 Q193	S185-E189 PolarHBondContact O-N 3.43Å; S185-E189 VanDerWaalsContact O-N 3.12Å; S186-E189 PolarHBondContact O-N 3.46Å; E189-S191 VanDerWaalsContact C-N 3.35Å; E189-S191 PolarHBondContact O-N 3.34Å; E189-D192 PolarHBondContact O-N 3.07Å; E189-Q193 WeakPolarHBondContact O-CB 3.41Å; E189-Q193 PolarHBondContact O-N 3.44Å
190	Q	92.2	Very high	92.3	Very high	94 Å²	94	101.5 Å²	101.5	44%	0.439	52%	0.521	S	S	.	.	H	α-helix	trans	-64.6	-37.7	174.3	-69.9	-179.8	25.6	0	0	112.8	S186 S187 K188 Q193 R194	S186-Q190 WeakPolarHBondContact O-CG 3.16Å; S186-Q190 PolarHBondContact O-N 3.37Å; S186-Q190 VanDerWaalsContact O-N 3.08Å; S187-Q190 PolarHBondContact O-N 3.05Å; K188-Q190 VanDerWaalsContact C-N 3.32Å; K188-Q190 PolarHBondContact O-N 3.45Å; Q190-Q193 PolarHBondContact O-N 3.38Å; Q190-R194 WeakPolarHBondContact O-CG 3Å; Q190-R194 PolarHBondContact O-N 3.01Å
191	S	83.8	Confident	92.4	Very high	56 Å²	56	102.1 Å²	102.1	39%	0.392	52%	0.523	S	S	.	.	H	α-helix	trans	-63.8	-47.7	176.3	-168.4	0	0	0	0	111.2	S187 K188 E189 Q193 R194 E195	S187-S191 PolarHBondContact O-N 3.13Å; K188-S191 WeakPolarHBondContact O-CB 3.18Å; K188-S191 PolarHBondContact O-N 3.32Å; K188-S191 VanDerWaalsContact O-N 3.11Å; E189-S191 VanDerWaalsContact C-N 3.35Å; E189-S191 PolarHBondContact O-N 3.34Å; S191-Q193 VanDerWaalsContact C-N 3.26Å; S191-Q193 PolarHBondContact O-N 2.98Å; S191-R194 PolarHBondContact O-N 2.96Å; S191-E195 PolarHBondContact O-N 3Å
192	D	92.8	Very high	92.5	Very high	86 Å²	86	100.3 Å²	100.3	46%	0.46	52%	0.517	S	S	.	.	H	α-helix	trans	-60.7	-38.3	178.3	-65.5	-13.2	0	0	0	110.7	K188 E189 A196	K188-D192 VanDerWaalsContact O-CG 3.32Å; K188-D192 PolarHBondContact O-N 3.44Å; E189-D192 PolarHBondContact O-N 3.07Å; D192-A196 PolarHBondContact O-N 2.9Å; D192-A196 VanDerWaalsContact O-N 3.1Å
193	Q	93.5	Very high	92.6	Very high	117 Å²	117	100.2 Å²	100.2	55%	0.547	52%	0.517	S	S	.	.	H	α-helix	trans	-66.2	-44.3	175.4	-174.8	165.9	0.4	0	0	112.7	E189 Q190 S191 E195 A196 E197	E189-Q193 WeakPolarHBondContact O-CB 3.41Å; E189-Q193 PolarHBondContact O-N 3.44Å; Q190-Q193 PolarHBondContact O-N 3.38Å; S191-Q193 VanDerWaalsContact C-N 3.26Å; S191-Q193 PolarHBondContact O-N 2.98Å; Q193-E195 VanDerWaalsContact C-N 3.34Å; Q193-E195 PolarHBondContact O-N 3.21Å; Q193-A196 PolarHBondContact O-N 3.38Å; Q193-E197 PolarHBondContact O-N 3.2Å
194	R	91.9	Very high	92.6	Very high	163 Å²	163	100.6 Å²	100.6	62%	0.615	52%	0.516	S	S	*	.	H	α-helix	trans	-63.9	-38.4	176.4	-73.7	178.9	-172.2	157.7	3.4	112.1	Q190 S191 A196 E197 M198	Q190-R194 WeakPolarHBondContact O-CG 3Å; Q190-R194 PolarHBondContact O-N 3.01Å; S191-R194 PolarHBondContact O-N 2.96Å; R194-A196 VanDerWaalsContact C-N 3.35Å; R194-E197 PolarHBondContact O-N 3.39Å; R194-M198 WeakPolarHBondContact O-CB 3.37Å; R194-M198 PolarHBondContact O-N 3.43Å
195	E	89.8	Confident	92.7	Very high	116 Å²	116	99.2 Å²	99.2	54%	0.542	51%	0.508	S	S	.	.	H	α-helix	trans	-62.7	-41.5	174.5	-80.5	-172.9	169.7	0	0	111.9	S191 Q193 M198 A199	S191-E195 PolarHBondContact O-N 3Å; Q193-E195 VanDerWaalsContact C-N 3.34Å; Q193-E195 PolarHBondContact O-N 3.21Å; E195-M198 PolarHBondContact O-N 3.23Å; E195-A199 WeakPolarHBondContact O-CB 3.39Å; E195-A199 PolarHBondContact O-N 3.21Å
196	A	94.8	Very high	92.8	Very high	62 Å²	62	100 Å²	100	51%	0.512	51%	0.507	S	S	.	.	H	α-helix	trans	-64	-41.3	176.1	0	0	0	0	0	112.4	D192 Q193 R194 A199 K200	D192-A196 PolarHBondContact O-N 2.9Å; D192-A196 VanDerWaalsContact O-N 3.1Å; Q193-A196 PolarHBondContact O-N 3.38Å; R194-A196 VanDerWaalsContact C-N 3.35Å; A196-A199 PolarHBondContact O-N 2.65Å; A196-K200 PolarHBondContact O-N 2.89Å; A196-K200 VanDerWaalsContact O-N 3.11Å
197	E	94.3	Very high	92.9	Very high	107 Å²	107	103.6 Å²	103.6	50%	0.5	52%	0.518	S	S	.	.	H	α-helix	trans	-65.3	-44	175.3	-74.2	178.8	-172.1	0	0	111.9	Q193 R194 A199 K200 L201	Q193-E197 PolarHBondContact O-N 3.2Å; R194-E197 PolarHBondContact O-N 3.39Å; E197-A199 VanDerWaalsContact C-N 3.34Å; E197-A199 PolarHBondContact O-N 2.86Å; E197-K200 WeakPolarHBondContact O-CB 3.37Å; E197-K200 PolarHBondContact O-N 3.44Å; E197-K200 VanDerWaalsContact O-N 3.12Å; E197-L201 PolarHBondContact O-N 3.04Å
198	M	90.2	Very high	93.1	Very high	111 Å²	111	102.5 Å²	102.5	55%	0.547	51%	0.513	S	S	.	.	H	α-helix	trans	-60.5	-43.1	175.8	-174.9	173.2	66.5	0	0	111.4	R194 E195 K200 L201 I202	R194-M198 WeakPolarHBondContact O-CB 3.37Å; R194-M198 PolarHBondContact O-N 3.43Å; E195-M198 PolarHBondContact O-N 3.23Å; M198-K200 VanDerWaalsContact C-N 3.26Å; M198-K200 PolarHBondContact O-N 3.46Å; M198-L201 PolarHBondContact O-N 3.23Å; M198-I202 HydrophobicContact CG-CD1 4.06Å; M198-I202 VanDerWaalsContact O-CG1 3.28Å; M198-I202 WeakPolarHBondContact O-CG1 3.47Å; M198-I202 PolarHBondContact O-N 3.02Å
199	A	95.4	Very high	93.2	Very high	55 Å²	55	102.1 Å²	102.1	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-62.6	-33.5	176.2	0	0	0	0	0	112.6	E195 A196 E197 K203	E195-A199 WeakPolarHBondContact O-CB 3.39Å; E195-A199 PolarHBondContact O-N 3.21Å; A196-A199 PolarHBondContact O-N 2.65Å; E197-A199 VanDerWaalsContact C-N 3.34Å; E197-A199 PolarHBondContact O-N 2.86Å; A199-K203 PolarHBondContact O-N 3.01Å
200	K	95.8	Very high	93.2	Very high	134 Å²	134	100.8 Å²	100.8	58%	0.583	51%	0.506	S	S	*	.	H	α-helix	trans	-69.4	-47.5	174.7	-171	-171.4	174.6	-156.1	0	111.4	A196 E197 M198 I202 K203 E204	A196-K200 PolarHBondContact O-N 2.89Å; A196-K200 VanDerWaalsContact O-N 3.11Å; E197-K200 WeakPolarHBondContact O-CB 3.37Å; E197-K200 PolarHBondContact O-N 3.44Å; E197-K200 VanDerWaalsContact O-N 3.12Å; M198-K200 VanDerWaalsContact C-N 3.26Å; M198-K200 PolarHBondContact O-N 3.46Å; K200-I202 VanDerWaalsContact C-N 3.31Å; K200-I202 PolarHBondContact O-N 3.4Å; K200-K203 WeakPolarHBondContact O-CB 3.46Å; K200-K203 PolarHBondContact O-N 3.27Å; K200-K203 VanDerWaalsContact O-N 3.14Å; K200-E204 VanDerWaalsContact CE-OE1 3.23Å; K200-E204 WeakPolarHBondContact CE-OE1 3.43Å; K200-E204 IonicContact NZ-OE1 3.72Å; K200-E204 PolarHBondContact O-N 3.37Å
201	L	93.9	Very high	93.2	Very high	100 Å²	100	101.9 Å²	101.9	52%	0.524	51%	0.51	S	S	.	.	H	α-helix	trans	-59.1	-41.1	176.7	-85	151.2	0	0	0	112.1	E197 M198 K203 E204 I205	E197-L201 PolarHBondContact O-N 3.04Å; M198-L201 PolarHBondContact O-N 3.23Å; L201-K203 VanDerWaalsContact C-N 3.32Å; L201-K203 PolarHBondContact O-N 3.49Å; L201-E204 PolarHBondContact O-N 3.11Å; L201-E204 VanDerWaalsContact O-N 3.17Å; L201-I205 WeakPolarHBondContact O-CG1 3.38Å; L201-I205 PolarHBondContact O-N 2.6Å
202	I	94.7	Very high	93.5	Very high	88 Å²	88	104.1 Å²	104.1	45%	0.451	52%	0.518	S	S	.	.	H	α-helix	trans	-58.9	-44.5	175.5	-70.6	166.3	0	0	0	110.8	M198 K200 E204 I205 D206	M198-I202 HydrophobicContact CG-CD1 4.06Å; M198-I202 VanDerWaalsContact O-CG1 3.28Å; M198-I202 WeakPolarHBondContact O-CG1 3.47Å; M198-I202 PolarHBondContact O-N 3.02Å; K200-I202 VanDerWaalsContact C-N 3.31Å; K200-I202 PolarHBondContact O-N 3.4Å; I202-E204 VanDerWaalsContact C-N 3.34Å; I202-E204 PolarHBondContact O-N 3.43Å; I202-I205 PolarHBondContact O-N 2.9Å; I202-D206 PolarHBondContact O-N 3.01Å
203	K	95.3	Very high	93.7	Very high	149 Å²	149	104.3 Å²	104.3	65%	0.648	52%	0.516	S	S	*	.	H	α-helix	trans	-61.6	-40.6	175.6	-79.9	-179.9	176.6	175.3	0	112.6	A199 K200 L201 D206 Q207	A199-K203 PolarHBondContact O-N 3.01Å; K200-K203 WeakPolarHBondContact O-CB 3.46Å; K200-K203 PolarHBondContact O-N 3.27Å; K200-K203 VanDerWaalsContact O-N 3.14Å; L201-K203 VanDerWaalsContact C-N 3.32Å; L201-K203 PolarHBondContact O-N 3.49Å; K203-D206 PolarHBondContact O-N 3.14Å; K203-Q207 VanDerWaalsContact O-CG 3.29Å; K203-Q207 WeakPolarHBondContact O-CG 3.32Å; K203-Q207 PolarHBondContact O-N 2.93Å
204	E	95.3	Very high	93.8	Very high	91 Å²	91	104.2 Å²	104.2	43%	0.425	51%	0.514	S	S	.	.	H	α-helix	trans	-65.3	-41.6	177.8	-70.4	175.1	-170.1	0	0	111.4	K200 L201 I202 D206 Q207 A208	K200-E204 VanDerWaalsContact CE-OE1 3.23Å; K200-E204 WeakPolarHBondContact CE-OE1 3.43Å; K200-E204 IonicContact NZ-OE1 3.72Å; K200-E204 PolarHBondContact O-N 3.37Å; L201-E204 PolarHBondContact O-N 3.11Å; L201-E204 VanDerWaalsContact O-N 3.17Å; I202-E204 VanDerWaalsContact C-N 3.34Å; I202-E204 PolarHBondContact O-N 3.43Å; E204-D206 PolarHBondContact O-N 3.49Å; E204-Q207 PolarHBondContact O-N 3.35Å; E204-A208 WeakPolarHBondContact O-CB 3.44Å; E204-A208 PolarHBondContact O-N 3.32Å
205	I	93.2	Very high	93.8	Very high	88 Å²	88	101.2 Å²	101.2	45%	0.451	51%	0.51	S	S	.	.	H	α-helix	trans	-61.4	-44.8	174.6	-70.7	169.7	0	0	0	111.1	L201 I202 A208 K209	L201-I205 WeakPolarHBondContact O-CG1 3.38Å; L201-I205 PolarHBondContact O-N 2.6Å; I202-I205 PolarHBondContact O-N 2.9Å; I205-A208 PolarHBondContact O-N 3.44Å; I205-K209 HydrophobicContact CG2-CD 4.21Å; I205-K209 HydrophobicContact CG2-CG 4.49Å; I205-K209 WeakPolarHBondContact O-CG 3.4Å; I205-K209 PolarHBondContact O-N 2.95Å
206	D	93.9	Very high	94.1	Very high	84 Å²	84	101.5 Å²	101.5	45%	0.449	51%	0.509	S	S	.	.	H	α-helix	trans	-65.7	-39.5	-180	-73.4	-21.2	0	0	0	111.9	I202 K203 E204 K209 E210	I202-D206 PolarHBondContact O-N 3.01Å; K203-D206 PolarHBondContact O-N 3.14Å; E204-D206 PolarHBondContact O-N 3.49Å; D206-K209 PolarHBondContact O-N 2.95Å; D206-K209 IonicContact OD1-NZ 3.15Å; D206-E210 PolarHBondContact O-N 3.45Å
207	Q	95.8	Very high	94.2	Very high	129 Å²	129	102.7 Å²	102.7	60%	0.603	51%	0.507	S	S	*	.	H	α-helix	trans	-62.5	-42.6	172.6	-72.7	173.5	4	0	0	111.9	K203 E204 E210 H211	K203-Q207 VanDerWaalsContact O-CG 3.29Å; K203-Q207 WeakPolarHBondContact O-CG 3.32Å; K203-Q207 PolarHBondContact O-N 2.93Å; E204-Q207 PolarHBondContact O-N 3.35Å; Q207-E210 PolarHBondContact O-N 3.41Å; Q207-H211 WeakPolarHBondContact O-CB 3.49Å; Q207-H211 PolarHBondContact O-N 3.13Å
208	A	92.3	Very high	94.2	Very high	50 Å²	50	101.3 Å²	101.3	41%	0.413	51%	0.506	S	S	.	.	H	α-helix	trans	-65	-39.1	177.1	0	0	0	0	0	112	E204 I205 H211 N212	E204-A208 WeakPolarHBondContact O-CB 3.44Å; E204-A208 PolarHBondContact O-N 3.32Å; I205-A208 PolarHBondContact O-N 3.44Å; A208-H211 PolarHBondContact O-N 2.87Å; A208-N212 WeakPolarHBondContact O-CB 3.29Å; A208-N212 PolarHBondContact O-N 3.27Å; A208-N212 PolarHBondContact O-ND2 2.9Å
209	K	93.8	Very high	94.3	Very high	126 Å²	126	100.8 Å²	100.8	55%	0.548	51%	0.505	S	S	.	.	H	α-helix	trans	-61.7	-46.4	173.4	-75.7	173.8	-177.1	166.9	0	111.6	I205 D206 H211 N212 E213	I205-K209 HydrophobicContact CG2-CD 4.21Å; I205-K209 HydrophobicContact CG2-CG 4.49Å; I205-K209 WeakPolarHBondContact O-CG 3.4Å; I205-K209 PolarHBondContact O-N 2.95Å; D206-K209 PolarHBondContact O-N 2.95Å; D206-K209 IonicContact OD1-NZ 3.15Å; K209-H211 VanDerWaalsContact C-N 3.32Å; K209-H211 PolarHBondContact O-N 2.92Å; K209-N212 PolarHBondContact O-N 3.49Å; K209-E213 PolarHBondContact O-N 3.36Å
210	E	95.3	Very high	94.3	Very high	111 Å²	111	103 Å²	103	52%	0.519	51%	0.506	S	S	.	.	H	α-helix	trans	-61.9	-41.8	178	-164.8	-168.8	155.7	0	0	111.3	D206 Q207 E213 K214	D206-E210 PolarHBondContact O-N 3.45Å; Q207-E210 PolarHBondContact O-N 3.41Å; E210-E213 PolarHBondContact O-N 3.17Å; E210-K214 WeakPolarHBondContact O-CG 3.43Å; E210-K214 PolarHBondContact O-N 3.45Å; E210-K214 WeakPolarHBondContact OE1-CE 3.48Å; E210-K214 IonicContact OE1-NZ 3.62Å; E210-K214 PolarHBondContact OE1-NZ 2.98Å
211	H	92.3	Very high	94.3	Very high	116 Å²	116	102.2 Å²	102.2	54%	0.537	51%	0.507	S	S	.	.	H	α-helix	trans	-63.9	-44.1	175.7	-171.9	-80	0	0	0	112.1	Q207 A208 K209 E213 K214 L215	Q207-H211 WeakPolarHBondContact O-CB 3.49Å; Q207-H211 PolarHBondContact O-N 3.13Å; A208-H211 PolarHBondContact O-N 2.87Å; K209-H211 VanDerWaalsContact C-N 3.32Å; K209-H211 PolarHBondContact O-N 2.92Å; H211-E213 PolarHBondContact O-N 2.96Å; H211-K214 PolarHBondContact O-N 3.31Å; H211-L215 WeakPolarHBondContact O-CB 3.44Å; H211-L215 PolarHBondContact O-N 3.5Å
212	N	89.9	Confident	94.2	Very high	103 Å²	103	102.8 Å²	102.8	55%	0.551	51%	0.507	S	S	*	.	H	α-helix	trans	-61.9	-42	176.6	-87.8	-36.9	0	0	0	112.3	A208 K209 L215 K216	A208-N212 WeakPolarHBondContact O-CB 3.29Å; A208-N212 PolarHBondContact O-N 3.27Å; A208-N212 PolarHBondContact O-ND2 2.9Å; K209-N212 PolarHBondContact O-N 3.49Å; N212-L215 PolarHBondContact O-N 3.01Å; N212-K216 WeakPolarHBondContact O-CB 3.47Å; N212-K216 PolarHBondContact O-N 3Å
213	E	95.5	Very high	93.9	Very high	91 Å²	91	104 Å²	104	43%	0.425	51%	0.512	S	S	.	.	H	α-helix	trans	-65.3	-39.9	175.7	-84.4	-62	139.9	0	0	112.1	K209 E210 H211 L215 K216 N217	K209-E213 PolarHBondContact O-N 3.36Å; E210-E213 PolarHBondContact O-N 3.17Å; H211-E213 PolarHBondContact O-N 2.96Å; E213-L215 PolarHBondContact O-N 3.25Å; E213-K216 PolarHBondContact O-N 2.93Å; E213-K216 IonicContact OE1-NZ 3.43Å; E213-K216 PolarHBondContact OE1-NZ 3.34Å; E213-K216 VanDerWaalsContact OE1-NZ 3.15Å; E213-N217 VanDerWaalsContact O-CG 3.32Å; E213-N217 PolarHBondContact O-N 3.45Å; E213-N217 PolarHBondContact O-ND2 3.29Å
214	K	95.8	Very high	93.8	Very high	115 Å²	115	103.3 Å²	103.3	50%	0.5	51%	0.509	S	S	.	.	H	α-helix	trans	-59	-47.8	171.7	-74.3	172.3	-174.5	165.9	0	111.5	E210 H211 K216 N217 T218	E210-K214 WeakPolarHBondContact O-CG 3.43Å; E210-K214 PolarHBondContact O-N 3.45Å; E210-K214 WeakPolarHBondContact OE1-CE 3.48Å; E210-K214 IonicContact OE1-NZ 3.62Å; E210-K214 PolarHBondContact OE1-NZ 2.98Å; H211-K214 PolarHBondContact O-N 3.31Å; K214-K216 VanDerWaalsContact C-N 3.34Å; K214-K216 PolarHBondContact O-N 2.94Å; K214-N217 PolarHBondContact O-N 3.48Å; K214-T218 PolarHBondContact O-N 3.38Å; K214-T218 PolarHBondContact O-OG1 3.41Å; K214-T218 VanDerWaalsContact O-OG1 3.13Å
215	L	93.8	Very high	93.8	Very high	100 Å²	100	103.2 Å²	103.2	52%	0.524	51%	0.509	S	S	.	.	H	α-helix	trans	-62.5	-41.5	-179.2	-151.1	78.6	0	0	0	111.9	H211 N212 E213 T218 L219	H211-L215 WeakPolarHBondContact O-CB 3.44Å; H211-L215 PolarHBondContact O-N 3.5Å; N212-L215 PolarHBondContact O-N 3.01Å; E213-L215 PolarHBondContact O-N 3.25Å; L215-T218 PolarHBondContact O-N 2.78Å; L215-L219 WeakPolarHBondContact O-CB 3.44Å; L215-L219 PolarHBondContact O-N 3.19Å
216	K	95.3	Very high	93.4	Very high	121 Å²	121	103.4 Å²	103.4	53%	0.526	51%	0.511	S	S	.	.	H	α-helix	trans	-61.7	-44.6	175.6	-178.2	-177	173.2	-169.9	0	112	N212 E213 K214 L219 Q220	N212-K216 WeakPolarHBondContact O-CB 3.47Å; N212-K216 PolarHBondContact O-N 3Å; E213-K216 PolarHBondContact O-N 2.93Å; E213-K216 IonicContact OE1-NZ 3.43Å; E213-K216 PolarHBondContact OE1-NZ 3.34Å; E213-K216 VanDerWaalsContact OE1-NZ 3.15Å; K214-K216 VanDerWaalsContact C-N 3.34Å; K214-K216 PolarHBondContact O-N 2.94Å; K216-L219 PolarHBondContact O-N 3.03Å; K216-Q220 WeakPolarHBondContact O-CB 3.48Å; K216-Q220 PolarHBondContact O-N 3.08Å
217	N	95.7	Very high	93.3	Very high	87 Å²	87	103.6 Å²	103.6	47%	0.465	51%	0.512	S	S	.	.	H	α-helix	trans	-62.5	-41.9	175.3	-72.7	-40.7	0	0	0	111.8	E213 K214 Q220 L221	E213-N217 VanDerWaalsContact O-CG 3.32Å; E213-N217 PolarHBondContact O-N 3.45Å; E213-N217 PolarHBondContact O-ND2 3.29Å; K214-N217 PolarHBondContact O-N 3.48Å; N217-Q220 PolarHBondContact O-N 3.37Å; N217-L221 PolarHBondContact O-N 2.93Å
218	T	95.3	Very high	93.1	Very high	78 Å²	78	103.3 Å²	103.3	48%	0.479	51%	0.505	S	S	.	.	H	α-helix	trans	-62.5	-45.1	174.8	-58.4	0	0	0	0	111.8	K214 L215 Q220 L221 Q222	K214-T218 PolarHBondContact O-N 3.38Å; K214-T218 PolarHBondContact O-OG1 3.41Å; K214-T218 VanDerWaalsContact O-OG1 3.13Å; L215-T218 PolarHBondContact O-N 2.78Å; T218-Q220 VanDerWaalsContact C-N 3.34Å; T218-Q220 PolarHBondContact O-N 3.35Å; T218-L221 WeakPolarHBondContact O-CB 3.39Å; T218-L221 PolarHBondContact O-N 2.91Å; T218-Q222 PolarHBondContact O-N 2.9Å
219	L	93.1	Very high	93.1	Very high	101 Å²	101	104.8 Å²	104.8	53%	0.529	51%	0.506	S	S	.	.	H	α-helix	trans	-61.6	-43.4	177.8	-173.4	68.1	0	0	0	111.2	L215 K216 L221 Q222 M223	L215-L219 WeakPolarHBondContact O-CB 3.44Å; L215-L219 PolarHBondContact O-N 3.19Å; K216-L219 PolarHBondContact O-N 3.03Å; L219-L221 VanDerWaalsContact C-N 3.29Å; L219-L221 PolarHBondContact O-N 3.27Å; L219-Q222 PolarHBondContact O-N 3.48Å; L219-M223 WeakPolarHBondContact O-CG 3.22Å; L219-M223 PolarHBondContact O-N 3.06Å
220	Q	94.9	Very high	92.9	Very high	102 Å²	102	105 Å²	105	48%	0.477	51%	0.506	S	S	.	.	H	α-helix	trans	-62.4	-37	176.7	-169.2	178.3	10.8	0	0	112.2	K216 N217 T218 M223 K224	K216-Q220 WeakPolarHBondContact O-CB 3.48Å; K216-Q220 PolarHBondContact O-N 3.08Å; N217-Q220 PolarHBondContact O-N 3.37Å; T218-Q220 VanDerWaalsContact C-N 3.34Å; T218-Q220 PolarHBondContact O-N 3.35Å; Q220-M223 PolarHBondContact O-N 3.18Å; Q220-K224 WeakPolarHBondContact O-CG 3.49Å; Q220-K224 PolarHBondContact O-N 2.85Å
221	L	95.3	Very high	92.7	Very high	116 Å²	116	105.9 Å²	105.9	61%	0.607	51%	0.511	S	S	*	.	H	α-helix	trans	-66.4	-44.1	175.2	-164.6	71.5	0	0	0	111.4	N217 T218 L219 M223 K224 E225	N217-L221 PolarHBondContact O-N 2.93Å; T218-L221 WeakPolarHBondContact O-CB 3.39Å; T218-L221 PolarHBondContact O-N 2.91Å; L219-L221 VanDerWaalsContact C-N 3.29Å; L219-L221 PolarHBondContact O-N 3.27Å; L221-M223 VanDerWaalsContact C-N 3.32Å; L221-M223 PolarHBondContact O-N 3.27Å; L221-K224 PolarHBondContact O-N 3.32Å; L221-E225 PolarHBondContact O-N 3.35Å
222	Q	91.9	Very high	92.6	Very high	113 Å²	113	105 Å²	105	53%	0.528	51%	0.507	S	S	.	.	H	α-helix	trans	-63.5	-35.3	176	-74.5	-170.4	-28.8	0	0	112.9	T218 L219 E225 N226	T218-Q222 PolarHBondContact O-N 2.9Å; L219-Q222 PolarHBondContact O-N 3.48Å; Q222-E225 PolarHBondContact O-N 3Å; Q222-N226 WeakPolarHBondContact O-CB 3.49Å; Q222-N226 PolarHBondContact O-N 2.95Å
223	M	89.6	Confident	92.4	Very high	113 Å²	113	106.6 Å²	106.6	56%	0.557	51%	0.513	S	S	*	.	H	α-helix	trans	-63.1	-48	174.1	-72.5	179.5	71.6	0	0	111.4	L219 Q220 L221 E225 N226 D227	L219-M223 WeakPolarHBondContact O-CG 3.22Å; L219-M223 PolarHBondContact O-N 3.06Å; Q220-M223 PolarHBondContact O-N 3.18Å; L221-M223 VanDerWaalsContact C-N 3.32Å; L221-M223 PolarHBondContact O-N 3.27Å; M223-E225 VanDerWaalsContact C-N 3.29Å; M223-E225 PolarHBondContact O-N 3.41Å; M223-N226 WeakPolarHBondContact O-CB 3.27Å; M223-N226 PolarHBondContact O-N 2.94Å; M223-D227 PolarHBondContact O-N 3.04Å
224	K	93.2	Very high	92.1	Very high	135 Å²	135	104.8 Å²	104.8	59%	0.587	51%	0.513	S	S	*	.	H	α-helix	trans	-60.3	-38.9	176.9	-72.1	179.8	178.7	-179.6	0	112.4	Q220 L221 D227 R228	Q220-K224 WeakPolarHBondContact O-CG 3.49Å; Q220-K224 PolarHBondContact O-N 2.85Å; L221-K224 PolarHBondContact O-N 3.32Å; K224-D227 PolarHBondContact O-N 3.33Å; K224-R228 PolarHBondContact O-N 3.32Å
225	E	93.3	Very high	91.8	Very high	89 Å²	89	104.4 Å²	104.4	42%	0.416	52%	0.516	S	S	.	.	H	α-helix	trans	-69.3	-40	176.9	-175.6	146.8	-138.6	0	0	112.3	L221 Q222 M223 D227 R228 L229	L221-E225 PolarHBondContact O-N 3.35Å; Q222-E225 PolarHBondContact O-N 3Å; M223-E225 VanDerWaalsContact C-N 3.29Å; M223-E225 PolarHBondContact O-N 3.41Å; E225-D227 VanDerWaalsContact C-N 3.32Å; E225-D227 PolarHBondContact O-N 3.49Å; E225-R228 PolarHBondContact O-N 3.12Å; E225-R228 IonicContact OE1-CZ 2.66Å; E225-R228 IonicContact OE1-NH2 3.02Å; E225-R228 PolarHBondContact OE1-NH2 2.64Å; E225-L229 HydrophobicContact CG-CD1 4.35Å; E225-L229 WeakPolarHBondContact O-CG 3.43Å; E225-L229 PolarHBondContact O-N 2.71Å
226	N	86.4	Confident	91.5	Very high	92 Å²	92	104 Å²	104	49%	0.492	51%	0.511	S	S	.	.	H	α-helix	trans	-59.8	-41.9	172.1	-105.6	-54.9	0	0	0	112.2	Q222 M223 L229 K230	Q222-N226 WeakPolarHBondContact O-CB 3.49Å; Q222-N226 PolarHBondContact O-N 2.95Å; M223-N226 WeakPolarHBondContact O-CB 3.27Å; M223-N226 PolarHBondContact O-N 2.94Å; N226-L229 PolarHBondContact O-N 3.43Å; N226-K230 WeakPolarHBondContact O-CG 3.15Å; N226-K230 PolarHBondContact O-N 3.47Å
227	D	90.6	Very high	91.1	Very high	87 Å²	87	105 Å²	105	47%	0.465	52%	0.515	S	S	.	.	H	α-helix	trans	-66.5	-40.4	177.7	-67.5	-24.4	0	0	0	111.3	M223 K224 E225 L229 K230 E231	M223-D227 PolarHBondContact O-N 3.04Å; K224-D227 PolarHBondContact O-N 3.33Å; E225-D227 VanDerWaalsContact C-N 3.32Å; E225-D227 PolarHBondContact O-N 3.49Å; D227-L229 PolarHBondContact O-N 2.98Å; D227-K230 PolarHBondContact O-N 3.42Å; D227-K230 IonicContact OD1-NZ 3.77Å; D227-E231 PolarHBondContact O-N 3.37Å
228	R	92.8	Very high	90.6	Very high	124 Å²	124	104.3 Å²	104.3	47%	0.468	52%	0.515	S	S	.	.	H	α-helix	trans	-60	-45.2	172.4	-166.1	-174.4	78.4	-142.1	-14.3	111.8	K224 E225 K230 E231 E232	K224-R228 PolarHBondContact O-N 3.32Å; E225-R228 PolarHBondContact O-N 3.12Å; E225-R228 IonicContact OE1-CZ 2.66Å; E225-R228 IonicContact OE1-NH2 3.02Å; E225-R228 PolarHBondContact OE1-NH2 2.64Å; R228-K230 PolarHBondContact O-N 2.85Å; R228-E231 PolarHBondContact O-N 3.5Å; R228-E232 IonicContact NE-OE1 3.89Å; R228-E232 PolarHBondContact NE-OE1 3.24Å; R228-E232 WeakPolarHBondContact O-CG 3.36Å; R228-E232 PolarHBondContact O-N 3.47Å
229	L	90.8	Very high	90.1	Very high	80 Å²	80	106.4 Å²	106.4	42%	0.419	52%	0.517	S	S	.	.	H	α-helix	trans	-65.2	-37.5	178.3	-73.8	171	0	0	0	112.3	E225 N226 D227 E231 E232 M233	E225-L229 HydrophobicContact CG-CD1 4.35Å; E225-L229 WeakPolarHBondContact O-CG 3.43Å; E225-L229 PolarHBondContact O-N 2.71Å; N226-L229 PolarHBondContact O-N 3.43Å; D227-L229 PolarHBondContact O-N 2.98Å; L229-E231 VanDerWaalsContact C-N 3.34Å; L229-E232 PolarHBondContact O-N 2.95Å; L229-M233 VanDerWaalsContact O-CB 3.28Å; L229-M233 WeakPolarHBondContact O-CB 3.18Å; L229-M233 PolarHBondContact O-N 3.42Å
230	K	90.3	Very high	89.6	Confident	130 Å²	130	109.8 Å²	109.8	57%	0.565	52%	0.523	S	S	*	.	H	α-helix	trans	-62.7	-41.9	173.2	-76	173.4	-174.1	167.6	0	111.5	N226 D227 R228 M233 A234	N226-K230 WeakPolarHBondContact O-CG 3.15Å; N226-K230 PolarHBondContact O-N 3.47Å; D227-K230 PolarHBondContact O-N 3.42Å; D227-K230 IonicContact OD1-NZ 3.77Å; R228-K230 PolarHBondContact O-N 2.85Å; K230-M233 PolarHBondContact O-N 3.03Å; K230-A234 WeakPolarHBondContact O-CB 3.31Å; K230-A234 PolarHBondContact O-N 3.24Å
231	E	90.4	Very high	88.8	Confident	131 Å²	131	110 Å²	110	61%	0.612	53%	0.525	S	S	*	.	H	α-helix	trans	-65.2	-46.9	176.9	-170.6	171.6	-166	0	0	111.4	D227 R228 L229 M233 A234 I235	D227-E231 PolarHBondContact O-N 3.37Å; R228-E231 PolarHBondContact O-N 3.5Å; L229-E231 VanDerWaalsContact C-N 3.34Å; E231-M233 VanDerWaalsContact C-N 3.31Å; E231-M233 PolarHBondContact O-N 2.89Å; E231-A234 PolarHBondContact O-N 3.14Å; E231-A234 VanDerWaalsContact O-N 3.17Å; E231-I235 HydrophobicContact CG-CD1 4.32Å; E231-I235 WeakPolarHBondContact O-CG1 3.42Å; E231-I235 PolarHBondContact O-N 3.39Å
232	E	90.4	Very high	88.1	Confident	97 Å²	97	110.1 Å²	110.1	45%	0.453	52%	0.522	S	S	.	.	H	α-helix	trans	-57.2	-43.5	173.6	-75.4	174.8	-161.7	0	0	111.7	R228 L229 A234 I235 E236	R228-E232 IonicContact NE-OE1 3.89Å; R228-E232 PolarHBondContact NE-OE1 3.24Å; R228-E232 WeakPolarHBondContact O-CG 3.36Å; R228-E232 PolarHBondContact O-N 3.47Å; L229-E232 PolarHBondContact O-N 2.95Å; E232-A234 PolarHBondContact O-N 2.84Å; E232-I235 PolarHBondContact O-N 3.41Å; E232-E236 WeakPolarHBondContact O-CB 3.42Å; E232-E236 PolarHBondContact O-N 3.41Å
233	M	85.9	Confident	87.5	Confident	137 Å²	137	108.5 Å²	108.5	68%	0.675	52%	0.516	S	S	*	.	H	α-helix	trans	-65.5	-36.8	177.8	-166.8	-173.6	-58.3	0	0	112.4	L229 K230 E231 K237	L229-M233 VanDerWaalsContact O-CB 3.28Å; L229-M233 WeakPolarHBondContact O-CB 3.18Å; L229-M233 PolarHBondContact O-N 3.42Å; K230-M233 PolarHBondContact O-N 3.03Å; E231-M233 VanDerWaalsContact C-N 3.31Å; E231-M233 PolarHBondContact O-N 2.89Å; M233-K237 VanDerWaalsContact O-CB 3.26Å; M233-K237 WeakPolarHBondContact O-CB 3.48Å; M233-K237 PolarHBondContact O-N 3.48Å
234	A	89.3	Confident	86.6	Confident	53 Å²	53	109.7 Å²	109.7	44%	0.438	52%	0.521	S	S	.	.	H	α-helix	trans	-67.3	-41.1	175.7	0	0	0	0	0	111.9	K230 E231 E232 K237 T238	K230-A234 WeakPolarHBondContact O-CB 3.31Å; K230-A234 PolarHBondContact O-N 3.24Å; E231-A234 PolarHBondContact O-N 3.14Å; E231-A234 VanDerWaalsContact O-N 3.17Å; E232-A234 PolarHBondContact O-N 2.84Å; A234-K237 PolarHBondContact O-N 3.23Å; A234-T238 PolarHBondContact O-N 3.29Å; A234-T238 PolarHBondContact O-OG1 3.36Å
235	I	90.4	Very high	85.4	Confident	107 Å²	107	110.6 Å²	110.6	55%	0.549	53%	0.525	S	S	.	.	H	α-helix	trans	-62	-48.9	174.5	-66.9	166.3	0	0	0	110	E231 E232 K237 T238 K239	E231-I235 HydrophobicContact CG-CD1 4.32Å; E231-I235 WeakPolarHBondContact O-CG1 3.42Å; E231-I235 PolarHBondContact O-N 3.39Å; E232-I235 PolarHBondContact O-N 3.41Å; I235-K237 VanDerWaalsContact C-N 3.34Å; I235-K237 PolarHBondContact O-N 3.39Å; I235-T238 PolarHBondContact O-N 3.18Å; I235-K239 PolarHBondContact O-N 3.47Å
236	E	87.2	Confident	84	Confident	92 Å²	92	112 Å²	112	43%	0.43	53%	0.531	S	S	.	.	H	α-helix	trans	-62.8	-40.4	179.6	-174.5	57.9	-150.4	0	0	111.8	E232 T238 K239 R240	E232-E236 WeakPolarHBondContact O-CB 3.42Å; E232-E236 PolarHBondContact O-N 3.41Å; E236-T238 VanDerWaalsContact C-N 3.34Å; E236-T238 PolarHBondContact O-N 2.92Å; E236-K239 PolarHBondContact O-N 2.92Å; E236-R240 PolarHBondContact O-N 3.44Å
237	K	86.6	Confident	82.6	Confident	141 Å²	141	111.8 Å²	111.8	61%	0.613	53%	0.53	S	S	*	.	H	α-helix	trans	-61.7	-40.8	174.8	-173.2	178.1	-179.6	-179.4	0	112	M233 A234 I235 R240 M241	M233-K237 VanDerWaalsContact O-CB 3.26Å; M233-K237 WeakPolarHBondContact O-CB 3.48Å; M233-K237 PolarHBondContact O-N 3.48Å; A234-K237 PolarHBondContact O-N 3.23Å; I235-K237 VanDerWaalsContact C-N 3.34Å; I235-K237 PolarHBondContact O-N 3.39Å; K237-R240 PolarHBondContact O-N 3.12Å; K237-M241 PolarHBondContact O-N 2.91Å
238	T	84.2	Confident	80.8	Confident	73 Å²	73	110.7 Å²	110.7	45%	0.448	53%	0.529	S	S	.	.	H	α-helix	trans	-65.5	-46.6	177.5	-53.8	0	0	0	0	110.7	A234 I235 E236 R240 M241 E242	A234-T238 PolarHBondContact O-N 3.29Å; A234-T238 PolarHBondContact O-OG1 3.36Å; I235-T238 PolarHBondContact O-N 3.18Å; E236-T238 VanDerWaalsContact C-N 3.34Å; E236-T238 PolarHBondContact O-N 2.92Å; T238-R240 VanDerWaalsContact C-N 3.33Å; T238-R240 PolarHBondContact O-N 3.43Å; T238-M241 PolarHBondContact O-N 3.17Å; T238-M241 VanDerWaalsContact O-N 3.13Å; T238-E242 PolarHBondContact O-N 3.41Å
239	K	86.4	Confident	78.9	Confident	122 Å²	122	109.2 Å²	109.2	53%	0.53	53%	0.534	S	S	.	.	H	α-helix	trans	-59.4	-41.3	176.2	-167.6	177.7	-177.7	-177.4	0	112.3	I235 E236 E242 I243	I235-K239 PolarHBondContact O-N 3.47Å; E236-K239 PolarHBondContact O-N 2.92Å; K239-E242 PolarHBondContact O-N 3.21Å; K239-I243 HydrophobicContact CG-CD1 4.3Å; K239-I243 WeakPolarHBondContact O-CG1 3.45Å; K239-I243 PolarHBondContact O-N 3.48Å
240	R	81	Confident	76.8	Confident	172 Å²	172	112.6 Å²	112.6	65%	0.649	55%	0.548	S	S	*	.	H	α-helix	trans	-62.6	-42.7	173.3	-81.4	-169.4	178.3	-159.1	0.7	113	E236 K237 T238 E242 I243 Q244	E236-R240 PolarHBondContact O-N 3.44Å; K237-R240 PolarHBondContact O-N 3.12Å; T238-R240 VanDerWaalsContact C-N 3.33Å; T238-R240 PolarHBondContact O-N 3.43Å; R240-E242 VanDerWaalsContact C-N 3.27Å; R240-E242 PolarHBondContact O-N 2.96Å; R240-I243 PolarHBondContact O-N 3.41Å; R240-Q244 WeakPolarHBondContact O-CB 3.47Å; R240-Q244 PolarHBondContact O-N 3.38Å
241	M	79.1	Confident	74.6	Confident	106 Å²	106	112.9 Å²	112.9	52%	0.522	55%	0.551	S	S	.	*	H	α-helix	trans	-62.5	-36.9	175.9	-79.3	-167.8	-70.2	0	0	111.8	K237 T238 Q244 K245	K237-M241 PolarHBondContact O-N 2.91Å; T238-M241 PolarHBondContact O-N 3.17Å; T238-M241 VanDerWaalsContact O-N 3.13Å; M241-Q244 PolarHBondContact O-N 3.3Å; M241-K245 WeakPolarHBondContact O-CB 3.45Å; M241-K245 PolarHBondContact O-N 3.14Å
242	E	80.5	Confident	72.4	Confident	119 Å²	119	114.6 Å²	114.6	56%	0.556	56%	0.559	S	S	*	*	H	α-helix	trans	-68.9	-42.6	178.6	-137.2	146.1	-151.1	0	0	112	T238 K239 R240 K245 Q246	T238-E242 PolarHBondContact O-N 3.41Å; K239-E242 PolarHBondContact O-N 3.21Å; R240-E242 VanDerWaalsContact C-N 3.27Å; R240-E242 PolarHBondContact O-N 2.96Å; E242-K245 PolarHBondContact O-N 3.41Å; E242-Q246 WeakPolarHBondContact O-CG 3.47Å; E242-Q246 PolarHBondContact O-N 3.06Å
243	I	79.8	Confident	70.3	Confident	78 Å²	78	119.1 Å²	119.1	40%	0.4	58%	0.577	S	S	.	*	H	α-helix	trans	-63.5	-41	171.7	-67.1	165.8	0	0	0	110.9	K239 R240 K245 Q246 N247	K239-I243 HydrophobicContact CG-CD1 4.3Å; K239-I243 WeakPolarHBondContact O-CG1 3.45Å; K239-I243 PolarHBondContact O-N 3.48Å; R240-I243 PolarHBondContact O-N 3.41Å; I243-K245 VanDerWaalsContact C-N 3.33Å; I243-K245 PolarHBondContact O-N 3.31Å; I243-Q246 PolarHBondContact O-N 3.5Å; I243-N247 WeakPolarHBondContact O-CB 3.42Å; I243-N247 VanDerWaalsContact O-CG 3.28Å; I243-N247 PolarHBondContact O-N 2.94Å
244	Q	70.3	Confident	68	Low	139 Å²	139	118.1 Å²	118.1	65%	0.65	57%	0.574	S	S	*	*	H	α-helix	trans	-65.1	-36.9	177.7	-172.9	173.5	9.7	0	0	112.1	R240 M241 S248	R240-Q244 WeakPolarHBondContact O-CB 3.47Å; R240-Q244 PolarHBondContact O-N 3.38Å; M241-Q244 PolarHBondContact O-N 3.3Å; Q244-S248 WeakPolarHBondContact O-CB 3.22Å; Q244-S248 PolarHBondContact O-N 3.44Å
245	K	67.8	Low	65.3	Low	153 Å²	153	122.3 Å²	122.3	67%	0.665	59%	0.589	S	S	*	*	H	α-helix	trans	-70.8	-34.4	175.1	-169.4	179.4	179.1	-177.2	0	112.3	M241 E242 I243 S248 T249	M241-K245 WeakPolarHBondContact O-CB 3.45Å; M241-K245 PolarHBondContact O-N 3.14Å; E242-K245 PolarHBondContact O-N 3.41Å; I243-K245 VanDerWaalsContact C-N 3.33Å; I243-K245 PolarHBondContact O-N 3.31Å; K245-S248 PolarHBondContact O-N 3.02Å; K245-S248 PolarHBondContact O-OG 3.35Å; K245-T249 PolarHBondContact O-N 2.95Å; K245-T249 PolarHBondContact O-OG1 3.35Å
246	Q	63.9	Low	62.7	Low	118 Å²	118	121.7 Å²	121.7	55%	0.551	59%	0.594	S	S	*	*	H	α-helix	trans	-69.8	-41.5	172.4	-74	173.8	-4.3	0	0	111.9	E242 I243 S248 T249 E250	E242-Q246 WeakPolarHBondContact O-CG 3.47Å; E242-Q246 PolarHBondContact O-N 3.06Å; I243-Q246 PolarHBondContact O-N 3.5Å; Q246-S248 VanDerWaalsContact C-N 3.3Å; Q246-S248 PolarHBondContact O-N 3.26Å; Q246-T249 PolarHBondContact O-N 3.49Å; Q246-T249 PolarHBondContact O-OG1 2.89Å; Q246-T249 VanDerWaalsContact O-OG1 3.06Å; Q246-E250 PolarHBondContact O-N 2.9Å; Q246-E250 VanDerWaalsContact O-N 3.12Å
247	N	57	Low	60.2	Low	89 Å²	89	125 Å²	125	48%	0.476	61%	0.614	S	S	.	*	H	α-helix	trans	-65.9	-32.3	173.4	-72.2	-10.4	0	0	0	111.6	I243 E250 Q251	I243-N247 WeakPolarHBondContact O-CB 3.42Å; I243-N247 VanDerWaalsContact O-CG 3.28Å; I243-N247 PolarHBondContact O-N 2.94Å; N247-E250 PolarHBondContact O-N 3.4Å; N247-Q251 WeakPolarHBondContact O-CB 3.39Å; N247-Q251 PolarHBondContact O-N 3.45Å
248	S	52.3	Low	58.3	Low	63 Å²	63	123.3 Å²	123.3	44%	0.441	62%	0.62	S	S	.	*	H	α-helix	trans	-71.2	-33.4	176.3	80.3	0	0	0	0	113.1	Q244 K245 Q246 E252	Q244-S248 WeakPolarHBondContact O-CB 3.22Å; Q244-S248 PolarHBondContact O-N 3.44Å; K245-S248 PolarHBondContact O-N 3.02Å; K245-S248 PolarHBondContact O-OG 3.35Å; Q246-S248 VanDerWaalsContact C-N 3.3Å; Q246-S248 PolarHBondContact O-N 3.26Å; S248-E252 PolarHBondContact O-N 2.93Å
249	T	53.1	Low	56.2	Low	93 Å²	93	125 Å²	125	57%	0.571	64%	0.635	S	S	*	*	H	α-helix	trans	-74.8	-25.2	173.1	25.9	0	0	0	0	113.4	K245 Q246	K245-T249 PolarHBondContact O-N 2.95Å; K245-T249 PolarHBondContact O-OG1 3.35Å; Q246-T249 PolarHBondContact O-N 3.49Å; Q246-T249 PolarHBondContact O-OG1 2.89Å; Q246-T249 VanDerWaalsContact O-OG1 3.06Å
250	E	46.4	Very low	54.1	Low	151 Å²	151	128 Å²	128	71%	0.706	64%	0.643	S	S	*	*	H	α-helix	trans	-80.9	-31.1	170	-74.9	-173.5	159	0	0	112.9	Q246 N247 K253	Q246-E250 PolarHBondContact O-N 2.9Å; Q246-E250 VanDerWaalsContact O-N 3.12Å; N247-E250 PolarHBondContact O-N 3.4Å; E250-K253 PolarHBondContact O-N 3.3Å
251	Q	43.6	Very low	52.8	Low	136 Å²	136	123 Å²	123	64%	0.636	63%	0.634	S	S	*	*	H	α-helix	trans	-75.9	-19.5	-179.5	-160.6	68.4	37.5	0	0	113.7	N247 K253 L254	N247-Q251 WeakPolarHBondContact O-CB 3.39Å; N247-Q251 PolarHBondContact O-N 3.45Å; Q251-K253 PolarHBondContact O-N 2.95Å; Q251-K253 VanDerWaalsContact O-N 3.14Å; Q251-L254 PolarHBondContact O-N 3.27Å
252	E	45.8	Very low	51.3	Low	167 Å²	167	124.1 Å²	124.1	78%	0.78	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-2.5	173.5	-81.6	-178.8	170.1	0	0	114.1	S248	S248-E252 PolarHBondContact O-N 2.93Å
253	K	46	Very low	50	Low	193 Å²	193	124.9 Å²	124.9	84%	0.839	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	5.3	173.5	-81.4	-173	180	177.2	0	115.8	E250 Q251	E250-K253 PolarHBondContact O-N 3.3Å; Q251-K253 PolarHBondContact O-N 2.95Å; Q251-K253 VanDerWaalsContact O-N 3.14Å
254	L	37.7	Very low	49	Very low	115 Å²	115	126.3 Å²	126.3	60%	0.602	65%	0.651	S	S	*	*	S	Bend	trans	-146	108.9	176.8	-158.2	64.9	0	0	0	115	Q251	Q251-L254 PolarHBondContact O-N 3.27Å
255	N	32.9	Very low	48.5	Very low	141 Å²	141	125.8 Å²	125.8	75%	0.754	65%	0.646	S	S	*	*			trans	96.5	125	140.9	-80.7	-4	0	0	0	121.9
256	S	35.8	Very low	48.5	Very low	94 Å²	94	126.8 Å²	126.8	66%	0.657	65%	0.647	S	S	*	*			trans	-74.4	166.8	154.8	50.6	0	0	0	0	112.6
257	L	33.9	Very low	48.8	Very low	161 Å²	161	126.1 Å²	126.1	84%	0.843	65%	0.647	S	S	*	*			trans	93.1	93.7	159	-67.9	154.3	0	0	0	118.9
258	S	46.1	Very low	49.7	Very low	107 Å²	107	130.2 Å²	130.2	75%	0.748	66%	0.656	S	S	*	*				58.9	139.7	114.5	-156.9	0	0	0	0	121.7
259	S	41	Very low	50.7	Low	108 Å²	108	129.6 Å²	129.6	76%	0.755	66%	0.655	S	S	*	*			trans	79	78.7	156.9	51.3	0	0	0	0	119.3
260	R	42.4	Very low	51.8	Low	186 Å²	186	128 Å²	128	70%	0.702	65%	0.645	S	S	*	*			trans	-165.6	32.2	148.1	-111.3	171.8	179	-170.6	-1.4	115.7	N262	R260-N262 PolarHBondContact O-N 3.01Å; R260-N262 VanDerWaalsContact O-N 3.13Å
261	S	53.2	Low	53.5	Low	67 Å²	67	127.5 Å²	127.5	47%	0.469	64%	0.644	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.2	-14.8	-161.3	-164.1	0	0	0	0	117.6	K265	S261-K265 WeakPolarHBondContact O-CD 3.48Å; S261-K265 WeakPolarHBondContact O-CE 3.39Å; S261-K265 WeakPolarHBondContact O-CG 3.37Å; S261-K265 WeakPolarHBondContact OG-CE 3.48Å; S261-K265 PolarHBondContact OG-NZ 3.44Å
262	N	48.7	Very low	55.5	Low	129 Å²	129	127.1 Å²	127.1	69%	0.69	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	-34.8	-170.9	-71.5	-18.6	0	0	0	114.7	R260 Y266	R260-N262 PolarHBondContact O-N 3.01Å; R260-N262 VanDerWaalsContact O-N 3.13Å; N262-Y266 PolarHBondContact O-N 2.9Å
263	E	51.8	Low	57	Low	135 Å²	135	123.6 Å²	123.6	63%	0.631	63%	0.626	S	S	*	*	H	α-helix	trans	-70.8	-42	174.7	-84.8	166.1	151.3	0	0	111.7	K265 Y266 D267	E263-K265 VanDerWaalsContact C-N 3.31Å; E263-K265 PolarHBondContact O-N 3.44Å; E263-Y266 WeakPolarHBondContact O-CB 3.4Å; E263-Y266 PolarHBondContact O-N 3.41Å; E263-Y266 VanDerWaalsContact O-N 3.11Å; E263-D267 PolarHBondContact O-N 3.49Å
264	E	58.4	Low	58.7	Low	107 Å²	107	118.3 Å²	118.3	50%	0.5	61%	0.607	S	S	.	*	H	α-helix	trans	-66.5	-28.6	178.6	-70	179.1	175.1	0	0	113.8	R268	E264-R268 WeakPolarHBondContact O-CB 3.38Å; E264-R268 PolarHBondContact O-N 3.13Å; E264-R268 VanDerWaalsContact O-N 3.09Å
265	K	60	Low	61.2	Low	128 Å²	128	117.5 Å²	117.5	56%	0.557	60%	0.6	S	S	*	*	H	α-helix	trans	-72.5	-36.6	173.6	-75.4	176.7	-171.9	166.5	0	111.2	S261 E263 A269	S261-K265 WeakPolarHBondContact O-CD 3.48Å; S261-K265 WeakPolarHBondContact O-CE 3.39Å; S261-K265 WeakPolarHBondContact O-CG 3.37Å; S261-K265 WeakPolarHBondContact OG-CE 3.48Å; S261-K265 PolarHBondContact OG-NZ 3.44Å; E263-K265 VanDerWaalsContact C-N 3.31Å; E263-K265 PolarHBondContact O-N 3.44Å; K265-A269 WeakPolarHBondContact O-CB 3.37Å; K265-A269 PolarHBondContact O-N 3.26Å
266	Y	67.8	Low	63.6	Low	175 Å²	175	115.5 Å²	115.5	69%	0.686	59%	0.587	S	S	*	*	H	α-helix	trans	-68.3	-47.5	177.1	-141.7	-87.7	0	0	0	110.8	N262 E263 R268 A269 V270	N262-Y266 PolarHBondContact O-N 2.9Å; E263-Y266 WeakPolarHBondContact O-CB 3.4Å; E263-Y266 PolarHBondContact O-N 3.41Å; E263-Y266 VanDerWaalsContact O-N 3.11Å; Y266-R268 VanDerWaalsContact C-N 3.32Å; Y266-R268 PolarHBondContact O-N 2.87Å; Y266-A269 PolarHBondContact O-N 3.3Å; Y266-V270 HydrophobicContact CD1-CG2 4.15Å; Y266-V270 HydrophobicContact CE1-CG2 4.42Å; Y266-V270 WeakPolarHBondContact O-CG2 3.41Å; Y266-V270 PolarHBondContact O-N 3.31Å
267	D	71.5	Confident	66	Low	103 Å²	103	119 Å²	119	55%	0.551	59%	0.586	S	S	*	*	H	α-helix	trans	-62	-39.6	176.7	-72.7	-22.6	0	0	0	111.9	E263 V270 M271	E263-D267 PolarHBondContact O-N 3.49Å; D267-V270 PolarHBondContact O-N 2.98Å; D267-M271 WeakPolarHBondContact O-CG 3.28Å; D267-M271 PolarHBondContact O-N 3Å
268	R	75.7	Confident	68.7	Low	175 Å²	175	118.1 Å²	118.1	66%	0.66	58%	0.578	S	S	*	*	H	α-helix	trans	-67.6	-36.3	177	-157.5	-178.5	-56.3	-149.6	2.2	112.4	E264 Y266 K272	E264-R268 WeakPolarHBondContact O-CB 3.38Å; E264-R268 PolarHBondContact O-N 3.13Å; E264-R268 VanDerWaalsContact O-N 3.09Å; Y266-R268 VanDerWaalsContact C-N 3.32Å; Y266-R268 PolarHBondContact O-N 2.87Å; R268-K272 WeakPolarHBondContact O-CB 3.39Å; R268-K272 PolarHBondContact O-N 2.97Å; R268-K272 VanDerWaalsContact O-N 3.09Å
269	A	73.3	Confident	70.7	Confident	50 Å²	50	117.6 Å²	117.6	41%	0.413	56%	0.564	S	S	.	*	H	α-helix	trans	-68.3	-41.9	173.2	0	0	0	0	0	111.7	K265 Y266 K272 I273	K265-A269 WeakPolarHBondContact O-CB 3.37Å; K265-A269 PolarHBondContact O-N 3.26Å; Y266-A269 PolarHBondContact O-N 3.3Å; A269-K272 PolarHBondContact O-N 3.33Å; A269-I273 VanDerWaalsContact O-CG1 3.29Å; A269-I273 WeakPolarHBondContact O-CG1 3.28Å; A269-I273 PolarHBondContact O-N 3.02Å
270	V	75.5	Confident	72.9	Confident	60 Å²	60	121.7 Å²	121.7	36%	0.364	56%	0.562	S	S	.	*	H	α-helix	trans	-63.8	-43.3	176.2	171.4	0	0	0	0	111.2	Y266 D267 K272 I273 N274	Y266-V270 HydrophobicContact CD1-CG2 4.15Å; Y266-V270 HydrophobicContact CE1-CG2 4.42Å; Y266-V270 WeakPolarHBondContact O-CG2 3.41Å; Y266-V270 PolarHBondContact O-N 3.31Å; D267-V270 PolarHBondContact O-N 2.98Å; V270-K272 VanDerWaalsContact C-N 3.34Å; V270-K272 PolarHBondContact O-N 3.21Å; V270-I273 PolarHBondContact O-N 3.02Å; V270-N274 PolarHBondContact O-N 3.22Å; V270-N274 PolarHBondContact O-ND2 3.03Å
271	M	82.4	Confident	75.2	Confident	140 Å²	140	118.1 Å²	118.1	69%	0.69	55%	0.554	S	S	*	*	H	α-helix	trans	-60.5	-42.4	173.9	-72.7	-175.5	101.5	0	0	111.9	D267 N274 Q275	D267-M271 WeakPolarHBondContact O-CG 3.28Å; D267-M271 PolarHBondContact O-N 3Å; M271-N274 PolarHBondContact O-N 3.47Å; M271-Q275 WeakPolarHBondContact O-CB 3.39Å; M271-Q275 PolarHBondContact O-N 3.35Å
272	K	85.1	Confident	77.1	Confident	129 Å²	129	120.4 Å²	120.4	56%	0.561	56%	0.557	S	S	*	*	H	α-helix	trans	-63.5	-41.7	176.6	-166.2	84.4	177.7	-178.4	0	111.9	R268 A269 V270 Q275 M276	R268-K272 WeakPolarHBondContact O-CB 3.39Å; R268-K272 PolarHBondContact O-N 2.97Å; R268-K272 VanDerWaalsContact O-N 3.09Å; A269-K272 PolarHBondContact O-N 3.33Å; V270-K272 VanDerWaalsContact C-N 3.34Å; V270-K272 PolarHBondContact O-N 3.21Å; K272-Q275 PolarHBondContact O-N 2.99Å; K272-M276 WeakPolarHBondContact O-CG 3.38Å; K272-M276 PolarHBondContact O-N 3.49Å
273	I	77.6	Confident	79	Confident	93 Å²	93	119.7 Å²	119.7	48%	0.477	55%	0.553	S	S	.	*	H	α-helix	trans	-64.7	-43	177	-71.6	166.7	0	0	0	110.8	A269 V270 M276 R277	A269-I273 VanDerWaalsContact O-CG1 3.29Å; A269-I273 WeakPolarHBondContact O-CG1 3.28Å; A269-I273 PolarHBondContact O-N 3.02Å; V270-I273 PolarHBondContact O-N 3.02Å; I273-M276 PolarHBondContact O-N 2.67Å; I273-R277 WeakPolarHBondContact O-CB 3.34Å; I273-R277 PolarHBondContact O-N 2.98Å
274	N	81.8	Confident	80.9	Confident	81 Å²	81	118.3 Å²	118.3	43%	0.433	54%	0.544	S	S	.	.	H	α-helix	trans	-65.7	-41.2	177	-72.5	-21	0	0	0	111.6	V270 M271 R277 E278	V270-N274 PolarHBondContact O-N 3.22Å; V270-N274 PolarHBondContact O-ND2 3.03Å; M271-N274 PolarHBondContact O-N 3.47Å; N274-R277 WeakPolarHBondContact O-CB 3.45Å; N274-R277 PolarHBondContact O-N 2.94Å; N274-R277 VanDerWaalsContact O-N 3.13Å; N274-E278 PolarHBondContact O-N 2.88Å
275	Q	89.3	Confident	82.6	Confident	98 Å²	98	115.1 Å²	115.1	46%	0.458	54%	0.54	S	S	.	.	H	α-helix	trans	-60.7	-47.5	175.2	-172.1	176.3	16	0	0	111.7	M271 K272 R277 E278 E279	M271-Q275 WeakPolarHBondContact O-CB 3.39Å; M271-Q275 PolarHBondContact O-N 3.35Å; K272-Q275 PolarHBondContact O-N 2.99Å; Q275-R277 PolarHBondContact O-N 3.4Å; Q275-E278 PolarHBondContact O-N 3.15Å; Q275-E279 WeakPolarHBondContact O-CG 3.38Å; Q275-E279 PolarHBondContact O-N 3.25Å
276	M	84.7	Confident	84.1	Confident	99 Å²	99	114.1 Å²	114.1	49%	0.488	54%	0.536	S	S	.	.	H	α-helix	trans	-64.9	-28.8	175.7	-69.5	-165.6	-53.1	0	0	112.7	K272 I273 R280	K272-M276 WeakPolarHBondContact O-CG 3.38Å; K272-M276 PolarHBondContact O-N 3.49Å; I273-M276 PolarHBondContact O-N 2.67Å; M276-R280 WeakPolarHBondContact O-CB 3.48Å; M276-R280 WeakPolarHBondContact O-CG 3.47Å; M276-R280 PolarHBondContact O-N 3.23Å
277	R	85.4	Confident	85.2	Confident	168 Å²	168	111.1 Å²	111.1	63%	0.634	53%	0.531	S	S	*	.	H	α-helix	trans	-71.2	-42.7	175.1	-174.8	-172.9	-72.1	-131.3	0.9	111.3	I273 N274 Q275 R280 E281	I273-R277 WeakPolarHBondContact O-CB 3.34Å; I273-R277 PolarHBondContact O-N 2.98Å; N274-R277 WeakPolarHBondContact O-CB 3.45Å; N274-R277 PolarHBondContact O-N 2.94Å; N274-R277 VanDerWaalsContact O-N 3.13Å; Q275-R277 PolarHBondContact O-N 3.4Å; R277-R280 PolarHBondContact O-N 2.93Å; R277-E281 PolarHBondContact O-N 3.14Å
278	E	90.6	Very high	86.2	Confident	143 Å²	143	110.2 Å²	110.2	67%	0.668	53%	0.526	S	S	*	.	H	α-helix	trans	-62.5	-46.3	173.9	-78.7	176.3	167.7	0	0	111.3	N274 Q275 R280 E281 E282	N274-E278 PolarHBondContact O-N 2.88Å; Q275-E278 PolarHBondContact O-N 3.15Å; E278-R280 VanDerWaalsContact C-N 3.29Å; E278-R280 PolarHBondContact O-N 2.88Å; E278-E281 PolarHBondContact O-N 3.27Å; E278-E282 WeakPolarHBondContact O-CB 3.41Å; E278-E282 PolarHBondContact O-N 3.46Å
279	E	88.9	Confident	87.1	Confident	96 Å²	96	104.6 Å²	104.6	45%	0.449	52%	0.518	S	S	.	.	H	α-helix	trans	-60	-39.4	175.5	-72.5	171.9	-173	0	0	111.9	Q275 E282 L283	Q275-E279 WeakPolarHBondContact O-CG 3.38Å; Q275-E279 PolarHBondContact O-N 3.25Å; E279-E282 PolarHBondContact O-N 2.74Å; E279-L283 WeakPolarHBondContact O-CB 3.36Å; E279-L283 VanDerWaalsContact O-CG 3.3Å; E279-L283 WeakPolarHBondContact O-CG 3.47Å; E279-L283 PolarHBondContact O-N 3.26Å
280	R	86.1	Confident	88	Confident	193 Å²	193	108.2 Å²	108.2	73%	0.728	53%	0.526	S	S	*	.	H	α-helix	trans	-64.4	-43.4	174.8	-85.5	-177.1	167.7	-142.9	-2	112.7	M276 R277 E278 L283 K284	M276-R280 WeakPolarHBondContact O-CB 3.48Å; M276-R280 WeakPolarHBondContact O-CG 3.47Å; M276-R280 PolarHBondContact O-N 3.23Å; R277-R280 PolarHBondContact O-N 2.93Å; E278-R280 VanDerWaalsContact C-N 3.29Å; E278-R280 PolarHBondContact O-N 2.88Å; R280-L283 PolarHBondContact O-N 2.97Å; R280-K284 VanDerWaalsContact O-CB 3.31Å; R280-K284 WeakPolarHBondContact O-CB 3.35Å; R280-K284 PolarHBondContact O-N 3.33Å
281	E	91.1	Very high	88.8	Confident	111 Å²	111	108.6 Å²	108.6	52%	0.519	53%	0.531	S	S	.	.	H	α-helix	trans	-71.7	-31.1	177.1	-76.6	-52.1	-120	0	0	113	R277 E278 K284 G285	R277-E281 PolarHBondContact O-N 3.14Å; E278-E281 PolarHBondContact O-N 3.27Å; E281-K284 PolarHBondContact O-N 3.27Å; E281-K284 IonicContact OE1-NZ 3.79Å; E281-K284 WeakPolarHBondContact OE2-CD 3.46Å; E281-K284 IonicContact OE2-NZ 3.99Å; E281-G285 PolarHBondContact O-N 2.89Å
282	E	92.6	Very high	89.4	Confident	115 Å²	115	106.8 Å²	106.8	54%	0.537	52%	0.524	S	S	.	.	H	α-helix	trans	-66.3	-43.8	172.2	-161.8	-169.7	151.5	0	0	111.3	E278 E279 G285 K286	E278-E282 WeakPolarHBondContact O-CB 3.41Å; E278-E282 PolarHBondContact O-N 3.46Å; E279-E282 PolarHBondContact O-N 2.74Å; E282-G285 PolarHBondContact O-N 2.9Å; E282-K286 WeakPolarHBondContact O-CG 3.37Å; E282-K286 PolarHBondContact O-N 3.03Å; E282-K286 WeakPolarHBondContact OE1-CE 3.3Å; E282-K286 IonicContact OE1-NZ 2.7Å; E282-K286 PolarHBondContact OE1-NZ 3.33Å
283	L	89.6	Confident	89.9	Confident	115 Å²	115	105 Å²	105	60%	0.602	52%	0.518	S	S	*	.	H	α-helix	trans	-64.2	-40.3	175.1	-75.3	171.5	0	0	0	112	E279 R280 K286 L287	E279-L283 WeakPolarHBondContact O-CB 3.36Å; E279-L283 VanDerWaalsContact O-CG 3.3Å; E279-L283 WeakPolarHBondContact O-CG 3.47Å; E279-L283 PolarHBondContact O-N 3.26Å; R280-L283 PolarHBondContact O-N 2.97Å; L283-K286 PolarHBondContact O-N 3.34Å; L283-L287 PolarHBondContact O-N 2.93Å
284	K	91.3	Very high	90.6	Very high	105 Å²	105	105 Å²	105	46%	0.457	52%	0.518	S	S	.	.	H	α-helix	trans	-63.2	-44.8	175.2	-171.8	-173	175.5	-170.3	0	111.5	R280 E281 K286 L287 D288	R280-K284 VanDerWaalsContact O-CB 3.31Å; R280-K284 WeakPolarHBondContact O-CB 3.35Å; R280-K284 PolarHBondContact O-N 3.33Å; E281-K284 PolarHBondContact O-N 3.27Å; E281-K284 IonicContact OE1-NZ 3.79Å; E281-K284 WeakPolarHBondContact OE2-CD 3.46Å; E281-K284 IonicContact OE2-NZ 3.99Å; K284-K286 VanDerWaalsContact C-N 3.29Å; K284-K286 PolarHBondContact O-N 3.49Å; K284-L287 WeakPolarHBondContact O-CB 3.49Å; K284-L287 PolarHBondContact O-N 2.97Å; K284-L287 VanDerWaalsContact O-N 3.12Å; K284-D288 PolarHBondContact O-N 2.88Å
285	G	93.6	Very high	91.2	Very high	40 Å²	40	103.7 Å²	103.7	41%	0.412	52%	0.519	S	S	.	.	H	α-helix	trans	-60	-38.1	174.8	0	0	0	0	0	112.8	E281 E282 A289	E281-G285 PolarHBondContact O-N 2.89Å; E282-G285 PolarHBondContact O-N 2.9Å; G285-A289 WeakPolarHBondContact O-CB 3.44Å; G285-A289 PolarHBondContact O-N 3.24Å
286	K	93.3	Very high	91.5	Very high	108 Å²	108	105 Å²	105	47%	0.47	52%	0.523	S	S	.	.	H	α-helix	trans	-66.4	-40.5	173.5	-72.2	170.3	-173.6	164.8	0	112.2	E282 L283 K284 A289 Q290	E282-K286 WeakPolarHBondContact O-CG 3.37Å; E282-K286 PolarHBondContact O-N 3.03Å; E282-K286 WeakPolarHBondContact OE1-CE 3.3Å; E282-K286 IonicContact OE1-NZ 2.7Å; E282-K286 PolarHBondContact OE1-NZ 3.33Å; L283-K286 PolarHBondContact O-N 3.34Å; K284-K286 VanDerWaalsContact C-N 3.29Å; K284-K286 PolarHBondContact O-N 3.49Å; K286-A289 PolarHBondContact O-N 3.46Å; K286-Q290 WeakPolarHBondContact O-CB 3.42Å; K286-Q290 WeakPolarHBondContact O-CG 3.5Å; K286-Q290 PolarHBondContact O-N 2.66Å
287	L	90.9	Very high	91.9	Very high	111 Å²	111	104.8 Å²	104.8	58%	0.581	52%	0.523	S	S	*	.	H	α-helix	trans	-64.5	-44.4	176.9	-171.5	74	0	0	0	111.5	L283 K284 Q290 S291	L283-L287 PolarHBondContact O-N 2.93Å; K284-L287 WeakPolarHBondContact O-CB 3.49Å; K284-L287 PolarHBondContact O-N 2.97Å; K284-L287 VanDerWaalsContact O-N 3.12Å; L287-Q290 PolarHBondContact O-N 3.47Å; L287-S291 WeakPolarHBondContact O-CB 3.32Å; L287-S291 PolarHBondContact O-N 3.43Å
288	D	92.4	Very high	92.3	Very high	84 Å²	84	103.1 Å²	103.1	45%	0.449	52%	0.52	S	S	.	.	H	α-helix	trans	-63.4	-44.1	177.8	-69.3	-20.3	0	0	0	110.7	K284 Q290 S291 D292	K284-D288 PolarHBondContact O-N 2.88Å; D288-Q290 PolarHBondContact O-N 3.49Å; D288-S291 WeakPolarHBondContact O-CB 3.2Å; D288-S291 PolarHBondContact O-N 3.17Å; D288-D292 PolarHBondContact O-N 2.99Å
289	A	93.6	Very high	92.5	Very high	58 Å²	58	99 Å²	99	48%	0.479	51%	0.511	S	S	.	.	H	α-helix	trans	-62.2	-40.5	175	0	0	0	0	0	112.9	G285 K286 D292 E293	G285-A289 WeakPolarHBondContact O-CB 3.44Å; G285-A289 PolarHBondContact O-N 3.24Å; K286-A289 PolarHBondContact O-N 3.46Å; A289-D292 PolarHBondContact O-N 3.08Å; A289-E293 PolarHBondContact O-N 3.36Å
290	Q	92.9	Very high	92.8	Very high	125 Å²	125	101 Å²	101	58%	0.584	52%	0.518	S	S	*	.	H	α-helix	trans	-66	-39.4	174	-77.6	-177	-20.8	0	0	111.9	K286 L287 D288 E293 I294	K286-Q290 WeakPolarHBondContact O-CB 3.42Å; K286-Q290 WeakPolarHBondContact O-CG 3.5Å; K286-Q290 PolarHBondContact O-N 2.66Å; L287-Q290 PolarHBondContact O-N 3.47Å; D288-Q290 PolarHBondContact O-N 3.49Å; Q290-E293 PolarHBondContact O-N 3.48Å; Q290-I294 VanDerWaalsContact O-CG1 3.27Å; Q290-I294 WeakPolarHBondContact O-CG1 3.45Å; Q290-I294 PolarHBondContact O-N 3Å
291	S	92.6	Very high	93.1	Very high	68 Å²	68	97 Å²	97	48%	0.476	51%	0.511	S	S	.	.	H	α-helix	trans	-61.6	-43.6	175.7	-179.9	0	0	0	0	111.5	L287 D288 I294 A295	L287-S291 WeakPolarHBondContact O-CB 3.32Å; L287-S291 PolarHBondContact O-N 3.43Å; D288-S291 WeakPolarHBondContact O-CB 3.2Å; D288-S291 PolarHBondContact O-N 3.17Å; S291-I294 PolarHBondContact O-N 3.45Å; S291-A295 PolarHBondContact O-N 3.11Å
292	D	94.4	Very high	93.3	Very high	102 Å²	102	100.7 Å²	100.7	55%	0.545	52%	0.52	S	S	.	.	H	α-helix	trans	-64.1	-39.9	175.8	-76.2	-12.9	0	0	0	112.2	D288 A289 A295 K296	D288-D292 PolarHBondContact O-N 2.99Å; A289-D292 PolarHBondContact O-N 3.08Å; D292-A295 PolarHBondContact O-N 3.43Å; D292-K296 WeakPolarHBondContact O-CG 3.38Å; D292-K296 PolarHBondContact O-N 3.15Å
293	E	95.9	Very high	93.5	Very high	91 Å²	91	101.1 Å²	101.1	43%	0.425	52%	0.522	S	S	.	.	H	α-helix	trans	-67.1	-41.1	176.6	-164.6	60	-154.2	0	0	111.6	A289 Q290 A295 K296 L297	A289-E293 PolarHBondContact O-N 3.36Å; Q290-E293 PolarHBondContact O-N 3.48Å; E293-A295 VanDerWaalsContact C-N 3.3Å; E293-A295 PolarHBondContact O-N 2.99Å; E293-K296 PolarHBondContact O-N 3.12Å; E293-K296 IonicContact OE2-NZ 3.76Å; E293-L297 WeakPolarHBondContact O-CG 3.46Å; E293-L297 PolarHBondContact O-N 2.93Å
294	I	91.2	Very high	93.6	Very high	93 Å²	93	98 Å²	98	48%	0.477	51%	0.513	S	S	.	.	H	α-helix	trans	-60.5	-41.1	172.5	-70.4	166.7	0	0	0	110.7	Q290 S291 L297 K298	Q290-I294 VanDerWaalsContact O-CG1 3.27Å; Q290-I294 WeakPolarHBondContact O-CG1 3.45Å; Q290-I294 PolarHBondContact O-N 3Å; S291-I294 PolarHBondContact O-N 3.45Å; I294-L297 PolarHBondContact O-N 3.35Å; I294-K298 HydrophobicContact CG2-CD 4.26Å; I294-K298 WeakPolarHBondContact O-CB 3.36Å; I294-K298 WeakPolarHBondContact O-CG 3.29Å; I294-K298 PolarHBondContact O-N 3.43Å
295	A	94.6	Very high	93.6	Very high	55 Å²	55	97.4 Å²	97.4	46%	0.455	52%	0.515	S	S	.	.	H	α-helix	trans	-63.3	-42.6	177	0	0	0	0	0	111.8	S291 D292 E293 K298 A299	S291-A295 PolarHBondContact O-N 3.11Å; D292-A295 PolarHBondContact O-N 3.43Å; E293-A295 VanDerWaalsContact C-N 3.3Å; E293-A295 PolarHBondContact O-N 2.99Å; A295-K298 PolarHBondContact O-N 3.37Å; A295-A299 PolarHBondContact O-N 2.89Å
296	K	95.8	Very high	93.7	Very high	124 Å²	124	103.9 Å²	103.9	54%	0.539	53%	0.527	S	S	.	.	H	α-helix	trans	-63.1	-45	174.2	-72.5	174.1	-169.7	163.9	0	112.3	D292 E293 K298 A299 K300	D292-K296 WeakPolarHBondContact O-CG 3.38Å; D292-K296 PolarHBondContact O-N 3.15Å; E293-K296 PolarHBondContact O-N 3.12Å; E293-K296 IonicContact OE2-NZ 3.76Å; K296-K298 VanDerWaalsContact C-N 3.34Å; K296-K298 PolarHBondContact O-N 3.41Å; K296-A299 PolarHBondContact O-N 3.19Å; K296-K300 PolarHBondContact O-N 3.1Å
297	L	93.9	Very high	93.8	Very high	96 Å²	96	104.3 Å²	104.3	50%	0.503	53%	0.53	S	S	.	.	H	α-helix	trans	-63.2	-40.3	178	-71.6	172.9	0	0	0	111.6	E293 I294 A299 K300 L301	E293-L297 WeakPolarHBondContact O-CG 3.46Å; E293-L297 PolarHBondContact O-N 2.93Å; I294-L297 PolarHBondContact O-N 3.35Å; L297-A299 VanDerWaalsContact C-N 3.34Å; L297-A299 PolarHBondContact O-N 3.02Å; L297-K300 PolarHBondContact O-N 3.48Å; L297-L301 WeakPolarHBondContact O-CB 3.48Å; L297-L301 PolarHBondContact O-N 3.02Å
298	K	92.6	Very high	93.9	Very high	132 Å²	132	104.5 Å²	104.5	57%	0.574	53%	0.531	S	S	*	.	H	α-helix	trans	-62.8	-38.4	173.5	-79.3	179.9	178.5	177.2	0	112.7	I294 A295 K296 L301 R302	I294-K298 HydrophobicContact CG2-CD 4.26Å; I294-K298 WeakPolarHBondContact O-CB 3.36Å; I294-K298 WeakPolarHBondContact O-CG 3.29Å; I294-K298 PolarHBondContact O-N 3.43Å; A295-K298 PolarHBondContact O-N 3.37Å; K296-K298 VanDerWaalsContact C-N 3.34Å; K296-K298 PolarHBondContact O-N 3.41Å; K298-L301 PolarHBondContact O-N 2.94Å; K298-R302 WeakPolarHBondContact O-CG 3.48Å; K298-R302 PolarHBondContact O-N 3.35Å; K298-R302 VanDerWaalsContact O-N 3.14Å
299	A	94.9	Very high	94	Very high	57 Å²	57	103.1 Å²	103.1	47%	0.471	53%	0.528	S	S	.	.	H	α-helix	trans	-64.6	-46	175.6	0	0	0	0	0	111.3	A295 K296 L297 L301 R302 E303	A295-A299 PolarHBondContact O-N 2.89Å; K296-A299 PolarHBondContact O-N 3.19Å; L297-A299 VanDerWaalsContact C-N 3.34Å; L297-A299 PolarHBondContact O-N 3.02Å; A299-L301 VanDerWaalsContact C-N 3.33Å; A299-L301 PolarHBondContact O-N 3.26Å; A299-R302 PolarHBondContact O-N 3.11Å; A299-E303 PolarHBondContact O-N 2.93Å
300	K	96	Very high	94.1	Very high	137 Å²	137	104.3 Å²	104.3	60%	0.596	53%	0.526	S	S	*	.	H	α-helix	trans	-60.7	-40	175.6	-72.7	-178.5	176.2	179.4	0	112.8	K296 L297 E303 A304	K296-K300 PolarHBondContact O-N 3.1Å; L297-K300 PolarHBondContact O-N 3.48Å; K300-E303 PolarHBondContact O-N 2.95Å; K300-A304 PolarHBondContact O-N 3.31Å
301	L	92.5	Very high	94	Very high	109 Å²	109	102.3 Å²	102.3	57%	0.571	52%	0.523	S	S	*	.	H	α-helix	trans	-61.8	-45.1	176.8	-171	72.8	0	0	0	111.3	L297 K298 A299 E303 A304 D305	L297-L301 WeakPolarHBondContact O-CB 3.48Å; L297-L301 PolarHBondContact O-N 3.02Å; K298-L301 PolarHBondContact O-N 2.94Å; A299-L301 VanDerWaalsContact C-N 3.33Å; A299-L301 PolarHBondContact O-N 3.26Å; L301-E303 VanDerWaalsContact C-N 3.29Å; L301-E303 PolarHBondContact O-N 3.4Å; L301-A304 PolarHBondContact O-N 2.98Å; L301-D305 PolarHBondContact O-N 2.98Å
302	R	95.6	Very high	94.2	Very high	190 Å²	190	104.1 Å²	104.1	72%	0.717	53%	0.525	S	S	*	.	H	α-helix	trans	-63.2	-35.7	176.9	-72.7	179.3	179.4	-177.5	-0.1	113	K298 A299 R306	K298-R302 WeakPolarHBondContact O-CG 3.48Å; K298-R302 PolarHBondContact O-N 3.35Å; K298-R302 VanDerWaalsContact O-N 3.14Å; A299-R302 PolarHBondContact O-N 3.11Å; R302-R306 WeakPolarHBondContact O-CB 3.08Å; R302-R306 PolarHBondContact O-N 3.46Å; R302-R306 VanDerWaalsContact O-N 3.09Å
303	E	95.6	Very high	94.2	Very high	123 Å²	123	103.1 Å²	103.1	58%	0.575	52%	0.52	S	S	*	.	H	α-helix	trans	-67.1	-46.4	175.8	-169.5	165.2	-152.8	0	0	110.8	A299 K300 L301 D305 R306 E307	A299-E303 PolarHBondContact O-N 2.93Å; K300-E303 PolarHBondContact O-N 2.95Å; L301-E303 VanDerWaalsContact C-N 3.29Å; L301-E303 PolarHBondContact O-N 3.4Å; E303-D305 PolarHBondContact O-N 3Å; E303-R306 WeakPolarHBondContact O-CB 3.41Å; E303-R306 PolarHBondContact O-N 3.4Å; E303-R306 VanDerWaalsContact O-N 3.13Å; E303-E307 WeakPolarHBondContact O-CG 3.49Å; E303-E307 PolarHBondContact O-N 3.08Å
304	A	92.4	Very high	94.1	Very high	50 Å²	50	102 Å²	102	41%	0.413	52%	0.522	S	S	.	.	H	α-helix	trans	-60.6	-41.5	174.4	0	0	0	0	0	112.7	K300 L301 R306 E307 L308	K300-A304 PolarHBondContact O-N 3.31Å; L301-A304 PolarHBondContact O-N 2.98Å; A304-R306 VanDerWaalsContact C-N 3.28Å; A304-R306 PolarHBondContact O-N 3.43Å; A304-E307 PolarHBondContact O-N 3.21Å; A304-L308 WeakPolarHBondContact O-CB 3.33Å; A304-L308 PolarHBondContact O-N 3.38Å
305	D	90.2	Very high	94.2	Very high	93 Å²	93	104.1 Å²	104.1	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-61.7	-38.6	175.2	-73.7	-25.4	0	0	0	111.6	L301 E303 L308 S309	L301-D305 PolarHBondContact O-N 2.98Å; E303-D305 PolarHBondContact O-N 3Å; D305-L308 PolarHBondContact O-N 2.68Å; D305-S309 PolarHBondContact O-N 2.95Å
306	R	95.4	Very high	94.2	Very high	176 Å²	176	106.4 Å²	106.4	66%	0.664	53%	0.529	S	S	*	.	H	α-helix	trans	-70.4	-40.1	178.3	-167.2	-179.1	158.3	75.5	9.3	111.5	R302 E303 A304 S309 N310	R302-R306 WeakPolarHBondContact O-CB 3.08Å; R302-R306 PolarHBondContact O-N 3.46Å; R302-R306 VanDerWaalsContact O-N 3.09Å; E303-R306 WeakPolarHBondContact O-CB 3.41Å; E303-R306 PolarHBondContact O-N 3.4Å; E303-R306 VanDerWaalsContact O-N 3.13Å; A304-R306 VanDerWaalsContact C-N 3.28Å; A304-R306 PolarHBondContact O-N 3.43Å; R306-S309 PolarHBondContact O-N 2.94Å; R306-N310 PolarHBondContact O-N 3.47Å; R306-N310 PolarHBondContact O-ND2 2.95Å; R306-N310 PolarHBondContact O-OD1 3.38Å
307	E	95.3	Very high	94.2	Very high	117 Å²	117	106 Å²	106	55%	0.547	53%	0.532	S	S	.	.	H	α-helix	trans	-62.9	-42.6	171.6	-72.1	178.6	178.5	0	0	111.8	E303 A304 S309 N310 T311	E303-E307 WeakPolarHBondContact O-CG 3.49Å; E303-E307 PolarHBondContact O-N 3.08Å; A304-E307 PolarHBondContact O-N 3.21Å; E307-S309 VanDerWaalsContact C-N 3.35Å; E307-S309 PolarHBondContact O-N 3.45Å; E307-N310 PolarHBondContact O-N 3.13Å; E307-T311 WeakPolarHBondContact O-CG2 3.42Å; E307-T311 PolarHBondContact O-N 3.4Å; E307-T311 PolarHBondContact O-OG1 3Å; E307-T311 VanDerWaalsContact O-OG1 3.14Å
308	L	94.4	Very high	94.2	Very high	114 Å²	114	106.5 Å²	106.5	60%	0.597	54%	0.535	S	S	*	.	H	α-helix	trans	-61.1	-43.5	175.6	-176	64.1	0	0	0	111.5	A304 D305 N310 T311 M312	A304-L308 WeakPolarHBondContact O-CB 3.33Å; A304-L308 PolarHBondContact O-N 3.38Å; D305-L308 PolarHBondContact O-N 2.68Å; L308-N310 PolarHBondContact O-N 2.89Å; L308-T311 WeakPolarHBondContact CA-OG1 3.37Å; L308-T311 PolarHBondContact O-N 3.01Å; L308-T311 PolarHBondContact O-OG1 3.42Å; L308-M312 WeakPolarHBondContact O-CB 3.49Å; L308-M312 PolarHBondContact O-N 3.28Å
309	S	94.3	Very high	94.3	Very high	55 Å²	55	104.7 Å²	104.7	39%	0.385	53%	0.528	S	S	.	.	H	α-helix	trans	-60	-46.5	173.9	-168.3	0	0	0	0	111.8	D305 R306 E307 T311 M312 D313	D305-S309 PolarHBondContact O-N 2.95Å; R306-S309 PolarHBondContact O-N 2.94Å; E307-S309 VanDerWaalsContact C-N 3.35Å; E307-S309 PolarHBondContact O-N 3.45Å; S309-T311 VanDerWaalsContact C-N 3.33Å; S309-T311 PolarHBondContact O-N 3.47Å; S309-M312 PolarHBondContact O-N 3.05Å; S309-D313 PolarHBondContact O-N 2.98Å
310	N	95.3	Very high	94.4	Very high	83 Å²	83	106.3 Å²	106.3	44%	0.444	53%	0.532	S	S	.	.	H	α-helix	trans	-63.3	-39.3	179.4	-67.4	-20	0	0	0	112.2	R306 E307 L308 D313 S314	R306-N310 PolarHBondContact O-N 3.47Å; R306-N310 PolarHBondContact O-ND2 2.95Å; R306-N310 PolarHBondContact O-OD1 3.38Å; E307-N310 PolarHBondContact O-N 3.13Å; L308-N310 PolarHBondContact O-N 2.89Å; N310-D313 PolarHBondContact O-N 3.14Å; N310-S314 WeakPolarHBondContact O-CB 3.32Å; N310-S314 PolarHBondContact O-N 3.47Å
311	T	91.8	Very high	94.3	Very high	84 Å²	84	104 Å²	104	52%	0.515	53%	0.527	S	S	.	.	H	α-helix	trans	-69	-35.9	177	53.8	0	0	0	0	111.8	E307 L308 S309 S314 F315	E307-T311 WeakPolarHBondContact O-CG2 3.42Å; E307-T311 PolarHBondContact O-N 3.4Å; E307-T311 PolarHBondContact O-OG1 3Å; E307-T311 VanDerWaalsContact O-OG1 3.14Å; L308-T311 WeakPolarHBondContact CA-OG1 3.37Å; L308-T311 PolarHBondContact O-N 3.01Å; L308-T311 PolarHBondContact O-OG1 3.42Å; S309-T311 VanDerWaalsContact C-N 3.33Å; S309-T311 PolarHBondContact O-N 3.47Å; T311-S314 PolarHBondContact O-N 3.24Å; T311-F315 WeakPolarHBondContact O-CB 3.42Å; T311-F315 PolarHBondContact O-N 3.03Å
312	M	95.1	Very high	94.3	Very high	105 Å²	105	104.3 Å²	104.3	52%	0.517	53%	0.528	S	S	.	.	H	α-helix	trans	-64.4	-43.2	174	-168.2	169	69.5	0	0	111.9	L308 S309 S314 F315 Q316	L308-M312 WeakPolarHBondContact O-CB 3.49Å; L308-M312 PolarHBondContact O-N 3.28Å; S309-M312 PolarHBondContact O-N 3.05Å; M312-S314 VanDerWaalsContact C-N 3.34Å; M312-S314 PolarHBondContact O-N 3.41Å; M312-F315 PolarHBondContact O-N 3.11Å; M312-Q316 WeakPolarHBondContact O-CG 3.4Å; M312-Q316 PolarHBondContact O-N 3.03Å
313	D	94.4	Very high	94.3	Very high	82 Å²	82	100.3 Å²	100.3	44%	0.439	52%	0.518	S	S	.	.	H	α-helix	trans	-62.6	-42.3	175.4	-67.4	-18.5	0	0	0	111.4	S309 N310 F315 Q316 L317	S309-D313 PolarHBondContact O-N 2.98Å; N310-D313 PolarHBondContact O-N 3.14Å; D313-F315 PolarHBondContact O-N 2.97Å; D313-Q316 PolarHBondContact O-N 2.91Å; D313-L317 PolarHBondContact O-N 3.28Å
314	S	94.5	Very high	94.2	Very high	66 Å²	66	97.8 Å²	97.8	46%	0.462	51%	0.514	S	S	.	.	H	α-helix	trans	-63	-41.2	175.5	-165.5	0	0	0	0	111.9	N310 T311 M312 L317 L318	N310-S314 WeakPolarHBondContact O-CB 3.32Å; N310-S314 PolarHBondContact O-N 3.47Å; T311-S314 PolarHBondContact O-N 3.24Å; M312-S314 VanDerWaalsContact C-N 3.34Å; M312-S314 PolarHBondContact O-N 3.41Å; S314-L317 WeakPolarHBondContact O-CB 3.42Å; S314-L317 PolarHBondContact O-N 3.3Å; S314-L318 WeakPolarHBondContact O-CD1 3.28Å; S314-L318 PolarHBondContact O-N 2.89Å
315	F	93.1	Very high	94.2	Very high	139 Å²	139	99.2 Å²	99.2	61%	0.61	52%	0.517	S	S	*	.	H	α-helix	trans	-62.9	-42.3	175.7	180	-95.2	0	0	0	112.3	T311 M312 D313 L317 L318 Q319	T311-F315 WeakPolarHBondContact O-CB 3.42Å; T311-F315 PolarHBondContact O-N 3.03Å; M312-F315 PolarHBondContact O-N 3.11Å; D313-F315 PolarHBondContact O-N 2.97Å; F315-L317 VanDerWaalsContact C-N 3.31Å; F315-L317 PolarHBondContact O-N 2.86Å; F315-L318 PolarHBondContact O-N 3.47Å; F315-Q319 WeakPolarHBondContact O-CB 3.34Å; F315-Q319 PolarHBondContact O-N 3.4Å
316	Q	95.3	Very high	94.2	Very high	103 Å²	103	97.8 Å²	97.8	48%	0.481	51%	0.512	S	S	.	.	H	α-helix	trans	-61.6	-40.8	174.8	-72.5	179	12.2	0	0	111.6	M312 D313 Q319 V320	M312-Q316 WeakPolarHBondContact O-CG 3.4Å; M312-Q316 PolarHBondContact O-N 3.03Å; D313-Q316 PolarHBondContact O-N 2.91Å; Q316-Q319 WeakPolarHBondContact O-CB 3.33Å; Q316-Q319 PolarHBondContact O-N 3.13Å; Q316-V320 WeakPolarHBondContact O-CG2 3.39Å; Q316-V320 PolarHBondContact O-N 3.49Å; Q316-V320 VanDerWaalsContact O-N 3.14Å
317	L	95.4	Very high	94.2	Very high	114 Å²	114	96.1 Å²	96.1	60%	0.597	51%	0.509	S	S	*	.	H	α-helix	trans	-61.8	-48.6	175.8	-135.5	86.7	0	0	0	111.4	D313 S314 F315 Q319 V320 D321	D313-L317 PolarHBondContact O-N 3.28Å; S314-L317 WeakPolarHBondContact O-CB 3.42Å; S314-L317 PolarHBondContact O-N 3.3Å; F315-L317 VanDerWaalsContact C-N 3.31Å; F315-L317 PolarHBondContact O-N 2.86Å; L317-Q319 PolarHBondContact O-N 2.87Å; L317-V320 PolarHBondContact O-N 3.03Å; L317-V320 VanDerWaalsContact O-N 3.13Å; L317-D321 PolarHBondContact O-N 2.94Å
318	L	94.4	Very high	94.1	Very high	108 Å²	108	95.3 Å²	95.3	57%	0.565	51%	0.506	S	S	*	.	H	α-helix	trans	-59.7	-35.5	176.2	-95.7	85.7	0	0	0	112.3	S314 F315 V320 D321 L322	S314-L318 WeakPolarHBondContact O-CD1 3.28Å; S314-L318 PolarHBondContact O-N 2.89Å; F315-L318 PolarHBondContact O-N 3.47Å; L318-V320 VanDerWaalsContact C-N 3.35Å; L318-D321 PolarHBondContact O-N 3.28Å; L318-L322 VanDerWaalsContact O-CB 3.32Å; L318-L322 WeakPolarHBondContact O-CB 3.25Å; L318-L322 PolarHBondContact O-N 3.49Å
319	Q	95.1	Very high	94	Very high	93 Å²	93	97.4 Å²	97.4	44%	0.435	51%	0.51	S	S	.	.	H	α-helix	trans	-65	-40.1	177.2	-172.3	177	10.5	0	0	111.7	F315 Q316 L317 L322 Q323	F315-Q319 WeakPolarHBondContact O-CB 3.34Å; F315-Q319 PolarHBondContact O-N 3.4Å; Q316-Q319 WeakPolarHBondContact O-CB 3.33Å; Q316-Q319 PolarHBondContact O-N 3.13Å; L317-Q319 PolarHBondContact O-N 2.87Å; Q319-L322 PolarHBondContact O-N 2.99Å; Q319-Q323 WeakPolarHBondContact O-CG 3.43Å; Q319-Q323 PolarHBondContact O-N 3.44Å
320	V	95.9	Very high	94	Very high	91 Å²	91	100.8 Å²	100.8	55%	0.552	52%	0.52	S	S	*	.	H	α-helix	trans	-65.5	-44.3	175.2	174.6	0	0	0	0	110.7	Q316 L317 L318 L322 Q323 S324	Q316-V320 WeakPolarHBondContact O-CG2 3.39Å; Q316-V320 PolarHBondContact O-N 3.49Å; Q316-V320 VanDerWaalsContact O-N 3.14Å; L317-V320 PolarHBondContact O-N 3.03Å; L317-V320 VanDerWaalsContact O-N 3.13Å; L318-V320 VanDerWaalsContact C-N 3.35Å; V320-L322 VanDerWaalsContact C-N 3.35Å; V320-L322 PolarHBondContact O-N 3.07Å; V320-Q323 PolarHBondContact O-N 3.34Å; V320-S324 PolarHBondContact O-N 3.47Å
321	D	95	Very high	94.1	Very high	90 Å²	90	105 Å²	105	48%	0.481	53%	0.529	S	S	.	.	H	α-helix	trans	-62.9	-41.2	177.2	-72.5	-16.8	0	0	0	111.8	L317 L318 Q323 S324 T325	L317-D321 PolarHBondContact O-N 2.94Å; L318-D321 PolarHBondContact O-N 3.28Å; D321-Q323 VanDerWaalsContact C-N 3.35Å; D321-Q323 PolarHBondContact O-N 3.07Å; D321-S324 PolarHBondContact O-N 3.02Å; D321-T325 WeakPolarHBondContact O-CB 3.34Å; D321-T325 WeakPolarHBondContact O-CG2 3.13Å; D321-T325 PolarHBondContact O-N 3.43Å; D321-T325 PolarHBondContact O-OG1 3.14Å
322	L	92.8	Very high	94.2	Very high	114 Å²	114	106 Å²	106	60%	0.597	53%	0.531	S	S	*	.	H	α-helix	trans	-62.6	-41.5	175.5	-174.9	66.5	0	0	0	111.6	L318 Q319 V320 T325 T326	L318-L322 VanDerWaalsContact O-CB 3.32Å; L318-L322 WeakPolarHBondContact O-CB 3.25Å; L318-L322 PolarHBondContact O-N 3.49Å; Q319-L322 PolarHBondContact O-N 2.99Å; V320-L322 VanDerWaalsContact C-N 3.35Å; V320-L322 PolarHBondContact O-N 3.07Å; L322-T325 WeakPolarHBondContact CA-OG1 3.37Å; L322-T325 PolarHBondContact O-OG1 3.08Å; L322-T326 WeakPolarHBondContact O-CB 3.48Å; L322-T326 PolarHBondContact O-N 3.16Å; L322-T326 PolarHBondContact O-OG1 2.89Å
323	Q	94.8	Very high	94.1	Very high	107 Å²	107	104.5 Å²	104.5	50%	0.5	53%	0.53	S	S	.	.	H	α-helix	trans	-65.8	-40.7	175.6	-74.9	-178.1	2.6	0	0	112.1	Q319 V320 D321 T326 K327	Q319-Q323 WeakPolarHBondContact O-CG 3.43Å; Q319-Q323 PolarHBondContact O-N 3.44Å; V320-Q323 PolarHBondContact O-N 3.34Å; D321-Q323 VanDerWaalsContact C-N 3.35Å; D321-Q323 PolarHBondContact O-N 3.07Å; Q323-T326 PolarHBondContact O-N 3.31Å; Q323-K327 WeakPolarHBondContact O-CG 3.44Å; Q323-K327 PolarHBondContact O-N 2.87Å; Q323-K327 VanDerWaalsContact O-N 3.09Å
324	S	94.1	Very high	94.2	Very high	70 Å²	70	105 Å²	105	49%	0.49	53%	0.533	S	S	.	.	H	α-helix	trans	-62.1	-50.5	177.2	-172.7	0	0	0	0	111.3	V320 D321 T326 K327 E328	V320-S324 PolarHBondContact O-N 3.47Å; D321-S324 PolarHBondContact O-N 3.02Å; S324-T326 VanDerWaalsContact C-N 3.31Å; S324-T326 PolarHBondContact O-N 2.9Å; S324-K327 PolarHBondContact O-N 3.39Å; S324-E328 PolarHBondContact O-N 2.92Å
325	T	91.1	Very high	94.2	Very high	79 Å²	79	106.4 Å²	106.4	49%	0.485	53%	0.532	S	S	.	.	H	α-helix	trans	-64.2	-34.7	178.6	51	0	0	0	0	112.5	D321 L322 E328 K329	D321-T325 WeakPolarHBondContact O-CB 3.34Å; D321-T325 WeakPolarHBondContact O-CG2 3.13Å; D321-T325 PolarHBondContact O-N 3.43Å; D321-T325 PolarHBondContact O-OG1 3.14Å; L322-T325 WeakPolarHBondContact CA-OG1 3.37Å; L322-T325 PolarHBondContact O-OG1 3.08Å; T325-E328 PolarHBondContact O-N 3.45Å; T325-K329 WeakPolarHBondContact O-CB 3.41Å; T325-K329 PolarHBondContact O-N 3.16Å
326	T	90.8	Very high	94.3	Very high	63 Å²	63	104.6 Å²	104.6	39%	0.387	53%	0.528	S	S	.	.	H	α-helix	trans	-64.1	-45.4	174.4	-57.6	0	0	0	0	111.3	L322 Q323 S324 E328 K329 E330	L322-T326 WeakPolarHBondContact O-CB 3.48Å; L322-T326 PolarHBondContact O-N 3.16Å; L322-T326 PolarHBondContact O-OG1 2.89Å; Q323-T326 PolarHBondContact O-N 3.31Å; S324-T326 VanDerWaalsContact C-N 3.31Å; S324-T326 PolarHBondContact O-N 2.9Å; T326-E328 VanDerWaalsContact C-N 3.32Å; T326-E328 PolarHBondContact O-N 3.12Å; T326-K329 WeakPolarHBondContact O-CB 3.3Å; T326-K329 PolarHBondContact O-N 3.44Å; T326-E330 WeakPolarHBondContact O-CG 3.35Å; T326-E330 PolarHBondContact O-N 3.24Å
327	K	95.1	Very high	94.3	Very high	141 Å²	141	106 Å²	106	61%	0.613	53%	0.534	S	S	*	.	H	α-helix	trans	-63.5	-37.4	176.3	-72.9	176.8	-179.6	175.5	0	112.4	Q323 S324 E330 R331	Q323-K327 WeakPolarHBondContact O-CG 3.44Å; Q323-K327 PolarHBondContact O-N 2.87Å; Q323-K327 VanDerWaalsContact O-N 3.09Å; S324-K327 PolarHBondContact O-N 3.39Å; K327-E330 PolarHBondContact O-N 2.85Å; K327-R331 PolarHBondContact O-N 3.48Å
328	E	93.9	Very high	94.3	Very high	100 Å²	100	105.4 Å²	105.4	47%	0.467	53%	0.527	S	S	.	.	H	α-helix	trans	-68.1	-42.5	176.3	-176.1	145.7	-136.6	0	0	111.9	S324 T325 T326 E330 R331 I332	S324-E328 PolarHBondContact O-N 2.92Å; T325-E328 PolarHBondContact O-N 3.45Å; T326-E328 VanDerWaalsContact C-N 3.32Å; T326-E328 PolarHBondContact O-N 3.12Å; E328-E330 VanDerWaalsContact C-N 3.32Å; E328-E330 PolarHBondContact O-N 3.31Å; E328-R331 WeakPolarHBondContact O-CB 3.42Å; E328-R331 PolarHBondContact O-N 2.86Å; E328-R331 VanDerWaalsContact O-N 3.17Å; E328-I332 HydrophobicContact CG-CD1 4.01Å; E328-I332 WeakPolarHBondContact O-CG1 3.46Å; E328-I332 PolarHBondContact O-N 2.84Å
329	K	92.6	Very high	94.2	Very high	159 Å²	159	105.3 Å²	105.3	69%	0.691	53%	0.527	S	S	*	.	H	α-helix	trans	-57.5	-44.4	172.7	-178.9	-175.1	175.4	-175.4	0	111.8	T325 T326 I332 S333	T325-K329 WeakPolarHBondContact O-CB 3.41Å; T325-K329 PolarHBondContact O-N 3.16Å; T326-K329 WeakPolarHBondContact O-CB 3.3Å; T326-K329 PolarHBondContact O-N 3.44Å; K329-I332 PolarHBondContact O-N 3.41Å; K329-S333 WeakPolarHBondContact O-CB 3.43Å; K329-S333 PolarHBondContact O-N 3.46Å
330	E	94.5	Very high	94.2	Very high	126 Å²	126	105.9 Å²	105.9	59%	0.589	53%	0.532	S	S	*	.	H	α-helix	trans	-61.5	-43.3	175.8	-73.4	173	176.4	0	0	111.8	T326 K327 E328 S333 L334	T326-E330 WeakPolarHBondContact O-CG 3.35Å; T326-E330 PolarHBondContact O-N 3.24Å; K327-E330 PolarHBondContact O-N 2.85Å; E328-E330 VanDerWaalsContact C-N 3.32Å; E328-E330 PolarHBondContact O-N 3.31Å; E330-S333 PolarHBondContact O-N 3.41Å; E330-L334 PolarHBondContact O-N 3.43Å
331	R	96.6	Very high	94.1	Very high	171 Å²	171	104.7 Å²	104.7	65%	0.645	53%	0.528	S	S	*	.	H	α-helix	trans	-60.2	-48	175.9	-173	-166.6	-63.2	172.8	0.9	111.6	K327 E328 S333 L334 E335	K327-R331 PolarHBondContact O-N 3.48Å; E328-R331 WeakPolarHBondContact O-CB 3.42Å; E328-R331 PolarHBondContact O-N 2.86Å; E328-R331 VanDerWaalsContact O-N 3.17Å; R331-S333 VanDerWaalsContact C-N 3.32Å; R331-S333 PolarHBondContact O-N 2.94Å; R331-L334 PolarHBondContact O-N 3.24Å; R331-E335 PolarHBondContact O-N 3.04Å
332	I	94.4	Very high	94	Very high	106 Å²	106	104.8 Å²	104.8	54%	0.544	53%	0.531	S	S	.	.	H	α-helix	trans	-63.9	-40.6	178.9	-67.1	168.1	0	0	0	110.4	E328 K329 L334 E335 L336	E328-I332 HydrophobicContact CG-CD1 4.01Å; E328-I332 WeakPolarHBondContact O-CG1 3.46Å; E328-I332 PolarHBondContact O-N 2.84Å; K329-I332 PolarHBondContact O-N 3.41Å; I332-L334 VanDerWaalsContact C-N 3.32Å; I332-L334 PolarHBondContact O-N 2.97Å; I332-E335 PolarHBondContact O-N 3.39Å; I332-L336 WeakPolarHBondContact O-CB 3.35Å; I332-L336 PolarHBondContact O-N 3.03Å
333	S	92.9	Very high	94.1	Very high	72 Å²	72	105 Å²	105	50%	0.503	53%	0.527	S	S	.	.	H	α-helix	trans	-60.5	-41.9	176.5	-172.5	0	0	0	0	111.9	K329 E330 R331 L336 Q337	K329-S333 WeakPolarHBondContact O-CB 3.43Å; K329-S333 PolarHBondContact O-N 3.46Å; E330-S333 PolarHBondContact O-N 3.41Å; R331-S333 VanDerWaalsContact C-N 3.32Å; R331-S333 PolarHBondContact O-N 2.94Å; S333-L336 PolarHBondContact O-N 2.97Å; S333-Q337 PolarHBondContact O-N 3.31Å
334	L	95.6	Very high	94	Very high	94 Å²	94	103.2 Å²	103.2	49%	0.492	53%	0.527	S	S	.	.	H	α-helix	trans	-65	-42	176.2	-174.6	68.9	0	0	0	111.5	E330 R331 I332 Q337 K338	E330-L334 PolarHBondContact O-N 3.43Å; R331-L334 PolarHBondContact O-N 3.24Å; I332-L334 VanDerWaalsContact C-N 3.32Å; I332-L334 PolarHBondContact O-N 2.97Å; L334-Q337 WeakPolarHBondContact O-CB 3.37Å; L334-Q337 PolarHBondContact O-N 2.95Å; L334-K338 WeakPolarHBondContact O-CG 3.48Å; L334-K338 PolarHBondContact O-N 3.43Å
335	E	95.2	Very high	94	Very high	94 Å²	94	104 Å²	104	44%	0.439	53%	0.526	S	S	.	.	H	α-helix	trans	-67	-38.9	179.1	-154.7	61.5	-156.1	0	0	111.7	R331 I332 Q337 K338 L339	R331-E335 PolarHBondContact O-N 3.04Å; I332-E335 PolarHBondContact O-N 3.39Å; E335-Q337 VanDerWaalsContact C-N 3.33Å; E335-Q337 PolarHBondContact O-N 3.47Å; E335-K338 PolarHBondContact O-N 3.09Å; E335-K338 IonicContact OE2-NZ 2.68Å; E335-K338 PolarHBondContact OE2-NZ 3.46Å; E335-L339 WeakPolarHBondContact O-CG 3.43Å; E335-L339 PolarHBondContact O-N 2.99Å
336	L	94.3	Very high	93.9	Very high	102 Å²	102	105 Å²	105	53%	0.534	53%	0.526	S	S	.	.	H	α-helix	trans	-61.2	-41.8	172.9	-175.4	64	0	0	0	111.5	I332 S333 K338 L339 L340	I332-L336 WeakPolarHBondContact O-CB 3.35Å; I332-L336 PolarHBondContact O-N 3.03Å; S333-L336 PolarHBondContact O-N 2.97Å; L336-K338 VanDerWaalsContact C-N 3.35Å; L336-K338 PolarHBondContact O-N 2.68Å; L336-L339 PolarHBondContact O-N 2.95Å; L336-L340 HydrophobicContact CG-CD1 4.44Å; L336-L340 WeakPolarHBondContact O-CG 3.34Å; L336-L340 PolarHBondContact O-N 3.47Å
337	Q	95.4	Very high	94	Very high	131 Å²	131	104.8 Å²	104.8	61%	0.612	52%	0.522	S	S	*	.	H	α-helix	trans	-62.2	-41.4	176.2	-173.5	177.8	3.9	0	0	111.9	S333 L334 E335 L340 S341	S333-Q337 PolarHBondContact O-N 3.31Å; L334-Q337 WeakPolarHBondContact O-CB 3.37Å; L334-Q337 PolarHBondContact O-N 2.95Å; E335-Q337 VanDerWaalsContact C-N 3.33Å; E335-Q337 PolarHBondContact O-N 3.47Å; Q337-L340 PolarHBondContact O-N 3.21Å; Q337-S341 PolarHBondContact O-N 3.01Å
338	K	95.6	Very high	93.9	Very high	103 Å²	103	102.5 Å²	102.5	45%	0.448	51%	0.514	S	S	.	.	H	α-helix	trans	-62.6	-45.2	174.8	-67.9	176.7	-164	158.7	0	111.7	L334 E335 L336 L340 S341 V342	L334-K338 WeakPolarHBondContact O-CG 3.48Å; L334-K338 PolarHBondContact O-N 3.43Å; E335-K338 PolarHBondContact O-N 3.09Å; E335-K338 IonicContact OE2-NZ 2.68Å; E335-K338 PolarHBondContact OE2-NZ 3.46Å; L336-K338 VanDerWaalsContact C-N 3.35Å; L336-K338 PolarHBondContact O-N 2.68Å; K338-L340 VanDerWaalsContact C-N 3.31Å; K338-L340 PolarHBondContact O-N 3.38Å; K338-S341 WeakPolarHBondContact O-CB 3.35Å; K338-S341 PolarHBondContact O-N 2.9Å; K338-S341 VanDerWaalsContact O-N 3.15Å; K338-V342 WeakPolarHBondContact O-CG2 3.37Å; K338-V342 PolarHBondContact O-N 2.94Å
339	L	93.1	Very high	93.8	Very high	106 Å²	106	101.9 Å²	101.9	56%	0.555	52%	0.517	S	S	*	.	H	α-helix	trans	-61.8	-39.5	178.1	-74	174.4	0	0	0	112.2	E335 L336 S341 V342 K343	E335-L339 WeakPolarHBondContact O-CG 3.43Å; E335-L339 PolarHBondContact O-N 2.99Å; L336-L339 PolarHBondContact O-N 2.95Å; L339-S341 VanDerWaalsContact C-N 3.35Å; L339-V342 PolarHBondContact O-N 3.02Å; L339-K343 WeakPolarHBondContact O-CB 3.33Å; L339-K343 PolarHBondContact O-N 2.97Å
340	L	94.6	Very high	93.8	Very high	105 Å²	105	99.8 Å²	99.8	55%	0.55	51%	0.505	S	S	.	.	H	α-helix	trans	-63.2	-40.7	174.1	-72.4	172.3	0	0	0	111.9	L336 Q337 K338 K343 S344	L336-L340 HydrophobicContact CG-CD1 4.44Å; L336-L340 WeakPolarHBondContact O-CG 3.34Å; L336-L340 PolarHBondContact O-N 3.47Å; Q337-L340 PolarHBondContact O-N 3.21Å; K338-L340 VanDerWaalsContact C-N 3.31Å; K338-L340 PolarHBondContact O-N 3.38Å; L340-K343 PolarHBondContact O-N 3.48Å; L340-S344 PolarHBondContact O-N 3.33Å
341	S	94.3	Very high	93.8	Very high	66 Å²	66	101.2 Å²	101.2	46%	0.462	51%	0.505	S	S	.	.	H	α-helix	trans	-63.5	-46.3	174.7	177.2	0	0	0	0	111.9	Q337 K338 L339 K343 S344 N345	Q337-S341 PolarHBondContact O-N 3.01Å; K338-S341 WeakPolarHBondContact O-CB 3.35Å; K338-S341 PolarHBondContact O-N 2.9Å; K338-S341 VanDerWaalsContact O-N 3.15Å; L339-S341 VanDerWaalsContact C-N 3.35Å; S341-K343 VanDerWaalsContact C-N 3.31Å; S341-K343 PolarHBondContact O-N 3.03Å; S341-S344 WeakPolarHBondContact O-CB 3.34Å; S341-S344 PolarHBondContact O-N 2.93Å; S341-N345 VanDerWaalsContact O-CG 3.31Å; S341-N345 PolarHBondContact O-N 3.2Å; S341-N345 PolarHBondContact O-OD1 2.83Å
342	V	93.1	Very high	93.6	Very high	91 Å²	91	98.7 Å²	98.7	55%	0.552	50%	0.5	S	S	*	.	H	α-helix	trans	-61	-41.7	176.6	172.7	0	0	0	0	111.1	K338 L339 N345 M346	K338-V342 WeakPolarHBondContact O-CG2 3.37Å; K338-V342 PolarHBondContact O-N 2.94Å; L339-V342 PolarHBondContact O-N 3.02Å; V342-N345 PolarHBondContact O-N 2.92Å; V342-M346 WeakPolarHBondContact O-CB 3.36Å; V342-M346 PolarHBondContact O-N 2.85Å
343	K	93.3	Very high	93.4	Very high	119 Å²	119	97.9 Å²	97.9	52%	0.517	50%	0.497	S	S	.	.	H	α-helix	trans	-60.2	-46.3	175.6	-176.5	-176	175.4	-174	0	111.7	L339 L340 S341 N345 M346 D347	L339-K343 WeakPolarHBondContact O-CB 3.33Å; L339-K343 PolarHBondContact O-N 2.97Å; L340-K343 PolarHBondContact O-N 3.48Å; S341-K343 VanDerWaalsContact C-N 3.31Å; S341-K343 PolarHBondContact O-N 3.03Å; K343-N345 VanDerWaalsContact C-N 3.33Å; K343-N345 PolarHBondContact O-N 2.9Å; K343-M346 PolarHBondContact O-N 2.96Å; K343-D347 VanDerWaalsContact O-CG 3.29Å; K343-D347 PolarHBondContact O-N 3.32Å
344	S	93.8	Very high	93.3	Very high	70 Å²	70	100.2 Å²	100.2	49%	0.49	50%	0.5	S	S	.	.	H	α-helix	trans	-58	-45.7	176.7	-173	0	0	0	0	111.7	L340 S341 M346 D347 E348	L340-S344 PolarHBondContact O-N 3.33Å; S341-S344 WeakPolarHBondContact O-CB 3.34Å; S341-S344 PolarHBondContact O-N 2.93Å; S344-M346 PolarHBondContact O-N 3.41Å; S344-D347 PolarHBondContact O-N 2.9Å; S344-E348 PolarHBondContact O-N 3.06Å
345	N	93.4	Very high	93.1	Very high	87 Å²	87	98.6 Å²	98.6	47%	0.465	49%	0.49	S	S	.	.	H	α-helix	trans	-63.4	-41.5	178	-64.2	-6.8	0	0	0	111.4	S341 V342 K343 D347 E348 V349	S341-N345 VanDerWaalsContact O-CG 3.31Å; S341-N345 PolarHBondContact O-N 3.2Å; S341-N345 PolarHBondContact O-OD1 2.83Å; V342-N345 PolarHBondContact O-N 2.92Å; K343-N345 VanDerWaalsContact C-N 3.33Å; K343-N345 PolarHBondContact O-N 2.9Å; N345-D347 VanDerWaalsContact C-N 3.35Å; N345-D347 PolarHBondContact O-N 3.37Å; N345-E348 PolarHBondContact O-N 2.95Å; N345-V349 WeakPolarHBondContact O-CG2 3.16Å; N345-V349 PolarHBondContact O-N 3.27Å
346	M	90.3	Very high	92.9	Very high	99 Å²	99	98.8 Å²	98.8	49%	0.488	49%	0.493	S	S	.	.	H	α-helix	trans	-64.5	-39.1	176.8	-174.5	179.2	59.4	0	0	112	V342 K343 S344 E348 V349 R350	V342-M346 WeakPolarHBondContact O-CB 3.36Å; V342-M346 PolarHBondContact O-N 2.85Å; K343-M346 PolarHBondContact O-N 2.96Å; S344-M346 PolarHBondContact O-N 3.41Å; M346-E348 VanDerWaalsContact C-N 3.32Å; M346-V349 PolarHBondContact O-N 2.97Å; M346-R350 WeakPolarHBondContact O-CB 3.34Å; M346-R350 PolarHBondContact O-N 3.43Å
347	D	92	Very high	92.3	Very high	58 Å²	58	97.8 Å²	97.8	31%	0.31	49%	0.488	S	S	.	.	H	α-helix	trans	-67.9	-33.5	176.6	-69.4	-19.1	0	0	0	111.7	K343 S344 N345 R350 R351	K343-D347 VanDerWaalsContact O-CG 3.29Å; K343-D347 PolarHBondContact O-N 3.32Å; S344-D347 PolarHBondContact O-N 2.9Å; N345-D347 VanDerWaalsContact C-N 3.35Å; N345-D347 PolarHBondContact O-N 3.37Å; D347-R350 IonicContact OD1-CZ 3.45Å; D347-R350 IonicContact OD1-NH1 3.1Å; D347-R350 PolarHBondContact OD1-NH1 2.78Å; D347-R351 WeakPolarHBondContact O-CG 3.49Å; D347-R351 PolarHBondContact O-N 2.77Å; D347-R351 VanDerWaalsContact O-N 3.07Å
348	E	93.5	Very high	91.9	Very high	93 Å²	93	96.8 Å²	96.8	44%	0.435	48%	0.479	S	S	.	.	H	α-helix	trans	-67	-50.6	172.3	-171.2	161	-139.9	0	0	112	S344 N345 M346 R350 R351 E352	S344-E348 PolarHBondContact O-N 3.06Å; N345-E348 PolarHBondContact O-N 2.95Å; M346-E348 VanDerWaalsContact C-N 3.32Å; E348-R350 VanDerWaalsContact C-N 3.25Å; E348-R350 PolarHBondContact O-N 3.49Å; E348-R351 WeakPolarHBondContact O-CB 3.46Å; E348-R351 PolarHBondContact O-N 2.93Å; E348-E352 PolarHBondContact O-N 3.2Å
349	V	91.5	Very high	91.4	Very high	88 Å²	88	98.8 Å²	98.8	53%	0.533	48%	0.484	S	S	.	.	H	α-helix	trans	-58.2	-39.3	174.8	173.1	0	0	0	0	111.2	N345 M346 R351 E352 N353	N345-V349 WeakPolarHBondContact O-CG2 3.16Å; N345-V349 PolarHBondContact O-N 3.27Å; M346-V349 PolarHBondContact O-N 2.97Å; V349-R351 PolarHBondContact O-N 3.32Å; V349-E352 PolarHBondContact O-N 3.1Å; V349-N353 WeakPolarHBondContact O-CB 3.31Å; V349-N353 PolarHBondContact O-N 3.05Å
350	R	92.9	Very high	90.8	Very high	115 Å²	115	98.1 Å²	98.1	43%	0.434	48%	0.48	S	S	.	.	H	α-helix	trans	-62.6	-42.8	175.9	-170.5	-176.6	-63	109.9	2.2	111.7	M346 D347 E348 N353 Q354	M346-R350 WeakPolarHBondContact O-CB 3.34Å; M346-R350 PolarHBondContact O-N 3.43Å; D347-R350 IonicContact OD1-CZ 3.45Å; D347-R350 IonicContact OD1-NH1 3.1Å; D347-R350 PolarHBondContact OD1-NH1 2.78Å; E348-R350 VanDerWaalsContact C-N 3.25Å; E348-R350 PolarHBondContact O-N 3.49Å; R350-N353 PolarHBondContact O-N 3.17Å; R350-Q354 WeakPolarHBondContact O-CG 3.46Å; R350-Q354 PolarHBondContact O-N 3.41Å
351	R	93.5	Very high	90.1	Very high	156 Å²	156	96.5 Å²	96.5	59%	0.589	48%	0.478	S	S	*	.	H	α-helix	trans	-63.4	-44.9	175.9	-79.7	-174.1	-66.7	150.9	2.6	111.6	D347 E348 V349 N353 Q354 E355	D347-R351 WeakPolarHBondContact O-CG 3.49Å; D347-R351 PolarHBondContact O-N 2.77Å; D347-R351 VanDerWaalsContact O-N 3.07Å; E348-R351 WeakPolarHBondContact O-CB 3.46Å; E348-R351 PolarHBondContact O-N 2.93Å; V349-R351 PolarHBondContact O-N 3.32Å; R351-N353 VanDerWaalsContact C-N 3.32Å; R351-N353 PolarHBondContact O-N 3.32Å; R351-Q354 PolarHBondContact O-N 2.83Å; R351-E355 PolarHBondContact O-N 3.04Å
352	E	93.3	Very high	89.2	Confident	118 Å²	118	98 Å²	98	55%	0.551	48%	0.477	S	S	*	.	H	α-helix	trans	-60.4	-42.7	176.4	-70.9	-174.3	166.4	0	0	111.7	E348 V349 Q354 E355 L356	E348-E352 PolarHBondContact O-N 3.2Å; V349-E352 PolarHBondContact O-N 3.1Å; E352-Q354 PolarHBondContact O-N 3.29Å; E352-E355 PolarHBondContact O-N 3.49Å; E352-L356 WeakPolarHBondContact O-CB 3.48Å; E352-L356 WeakPolarHBondContact O-CG 3.47Å; E352-L356 PolarHBondContact O-N 3.47Å
353	N	89.1	Confident	88.1	Confident	89 Å²	89	99.5 Å²	99.5	48%	0.476	48%	0.478	S	S	.	.	H	α-helix	trans	-65.2	-40.2	178.7	-156.3	-74.7	0	0	0	112	V349 R350 R351 L356 N357	V349-N353 WeakPolarHBondContact O-CB 3.31Å; V349-N353 PolarHBondContact O-N 3.05Å; R350-N353 PolarHBondContact O-N 3.17Å; R351-N353 VanDerWaalsContact C-N 3.32Å; R351-N353 PolarHBondContact O-N 3.32Å; N353-L356 PolarHBondContact O-N 3.21Å; N353-N357 WeakPolarHBondContact O-CB 3.48Å; N353-N357 PolarHBondContact O-N 3.3Å; N353-N357 PolarHBondContact O-ND2 3.44Å; N353-N357 PolarHBondContact OD1-ND2 2.98Å
354	Q	91.4	Very high	86.8	Confident	120 Å²	120	99.1 Å²	99.1	56%	0.561	48%	0.482	S	S	*	.	H	α-helix	trans	-62.4	-42.7	173.4	-74.5	174.2	-10.2	0	0	112.1	R350 R351 E352 N357 R358	R350-Q354 WeakPolarHBondContact O-CG 3.46Å; R350-Q354 PolarHBondContact O-N 3.41Å; R351-Q354 PolarHBondContact O-N 2.83Å; E352-Q354 PolarHBondContact O-N 3.29Å; Q354-N357 PolarHBondContact O-N 2.93Å; Q354-R358 WeakPolarHBondContact O-CB 3.34Å; Q354-R358 PolarHBondContact O-N 3.32Å
355	E	91.9	Very high	85.3	Confident	61 Å²	61	102 Å²	102	29%	0.285	49%	0.491	S	S	.	.	H	α-helix	trans	-67.2	-39.3	177.6	176.3	56.2	-161.2	0	0	111.9	R351 E352 R358 R359	R351-E355 PolarHBondContact O-N 3.04Å; E352-E355 PolarHBondContact O-N 3.49Å; E355-R358 WeakPolarHBondContact O-CB 3.35Å; E355-R358 PolarHBondContact O-N 2.99Å; E355-R358 IonicContact OE1-CZ 3.65Å; E355-R358 IonicContact OE1-NE 3.72Å; E355-R358 IonicContact OE1-NH2 2.76Å; E355-R358 PolarHBondContact OE1-NH2 2.92Å; E355-R358 IonicContact OE2-CZ 3.52Å; E355-R358 IonicContact OE2-NE 2.83Å; E355-R358 PolarHBondContact OE2-NE 3.32Å; E355-R358 IonicContact OE2-NH2 3.37Å; E355-R358 PolarHBondContact OE2-NH2 3.48Å; E355-R359 WeakPolarHBondContact O-CG 3.38Å; E355-R359 PolarHBondContact O-N 3.31Å; E355-R359 IonicContact OE1-CZ 2.72Å; E355-R359 IonicContact OE1-NE 3.78Å; E355-R359 PolarHBondContact OE1-NE 2.92Å; E355-R359 IonicContact OE1-NH2 2.69Å; E355-R359 PolarHBondContact OE1-NH2 3.2Å
356	L	90.6	Very high	83.7	Confident	97 Å²	97	103.5 Å²	103.5	51%	0.508	50%	0.498	S	S	.	.	H	α-helix	trans	-62.7	-45.1	173.9	-75.7	171.7	0	0	0	111.9	E352 N353 R358 R359 L360	E352-L356 WeakPolarHBondContact O-CB 3.48Å; E352-L356 WeakPolarHBondContact O-CG 3.47Å; E352-L356 PolarHBondContact O-N 3.47Å; N353-L356 PolarHBondContact O-N 3.21Å; L356-R358 VanDerWaalsContact C-N 3.32Å; L356-R358 PolarHBondContact O-N 2.97Å; L356-R359 WeakPolarHBondContact O-CB 3.45Å; L356-R359 PolarHBondContact O-N 3.44Å; L356-R359 VanDerWaalsContact O-N 3.15Å; L356-L360 PolarHBondContact O-N 2.94Å
357	N	82	Confident	82.1	Confident	82 Å²	82	105.4 Å²	105.4	44%	0.439	51%	0.51	S	S	.	.	H	α-helix	trans	-60.7	-42.2	175.2	-76.6	-44.4	0	0	0	111.7	N353 Q354 R359 L360 S361	N353-N357 WeakPolarHBondContact O-CB 3.48Å; N353-N357 PolarHBondContact O-N 3.3Å; N353-N357 PolarHBondContact O-ND2 3.44Å; N353-N357 PolarHBondContact OD1-ND2 2.98Å; Q354-N357 PolarHBondContact O-N 2.93Å; N357-R359 VanDerWaalsContact C-N 3.3Å; N357-R359 PolarHBondContact O-N 3.4Å; N357-L360 PolarHBondContact O-N 2.96Å; N357-S361 PolarHBondContact O-N 3.32Å; N357-S361 PolarHBondContact O-OG 3.44Å; N357-S361 VanDerWaalsContact O-OG 3.12Å
358	R	86.8	Confident	80.4	Confident	110 Å²	110	108.3 Å²	108.3	42%	0.415	53%	0.53	S	S	.	.	H	α-helix	trans	-59.9	-40.6	175	-166.7	-168.8	68.5	71.9	7.2	111.7	Q354 E355 L356 Q362	Q354-R358 WeakPolarHBondContact O-CB 3.34Å; Q354-R358 PolarHBondContact O-N 3.32Å; E355-R358 WeakPolarHBondContact O-CB 3.35Å; E355-R358 PolarHBondContact O-N 2.99Å; E355-R358 IonicContact OE1-CZ 3.65Å; E355-R358 IonicContact OE1-NE 3.72Å; E355-R358 IonicContact OE1-NH2 2.76Å; E355-R358 PolarHBondContact OE1-NH2 2.92Å; E355-R358 IonicContact OE2-CZ 3.52Å; E355-R358 IonicContact OE2-NE 2.83Å; E355-R358 PolarHBondContact OE2-NE 3.32Å; E355-R358 IonicContact OE2-NH2 3.37Å; E355-R358 PolarHBondContact OE2-NH2 3.48Å; L356-R358 VanDerWaalsContact C-N 3.32Å; L356-R358 PolarHBondContact O-N 2.97Å; R358-Q362 WeakPolarHBondContact O-CG 3.35Å; R358-Q362 PolarHBondContact O-N 3.41Å; R358-Q362 VanDerWaalsContact O-N 3.08Å
359	R	85.8	Confident	78.7	Confident	144 Å²	144	106.3 Å²	106.3	54%	0.543	53%	0.53	S	S	.	.	H	α-helix	trans	-67.5	-42.4	177	-72.1	175.9	-172	-169.1	4	112.3	E355 L356 N357 Q362 Q363	E355-R359 WeakPolarHBondContact O-CG 3.38Å; E355-R359 PolarHBondContact O-N 3.31Å; E355-R359 IonicContact OE1-CZ 2.72Å; E355-R359 IonicContact OE1-NE 3.78Å; E355-R359 PolarHBondContact OE1-NE 2.92Å; E355-R359 IonicContact OE1-NH2 2.69Å; E355-R359 PolarHBondContact OE1-NH2 3.2Å; L356-R359 WeakPolarHBondContact O-CB 3.45Å; L356-R359 PolarHBondContact O-N 3.44Å; L356-R359 VanDerWaalsContact O-N 3.15Å; N357-R359 VanDerWaalsContact C-N 3.3Å; N357-R359 PolarHBondContact O-N 3.4Å; R359-Q362 PolarHBondContact O-N 2.9Å; R359-Q363 PolarHBondContact O-N 2.88Å
360	L	80.3	Confident	77	Confident	93 Å²	93	107.4 Å²	107.4	49%	0.487	54%	0.538	S	S	.	.	H	α-helix	trans	-59.6	-48.4	174.9	-81.8	159.1	0	0	0	111.1	L356 N357 Q362 Q363 D364	L356-L360 PolarHBondContact O-N 2.94Å; N357-L360 PolarHBondContact O-N 2.96Å; L360-Q362 VanDerWaalsContact C-N 3.29Å; L360-Q362 PolarHBondContact O-N 3.46Å; L360-Q363 WeakPolarHBondContact O-CB 3.31Å; L360-Q363 PolarHBondContact O-N 2.92Å; L360-D364 PolarHBondContact O-N 2.74Å
361	S	78.4	Confident	75.2	Confident	70 Å²	70	111.1 Å²	111.1	49%	0.49	56%	0.558	S	S	.	*	H	α-helix	trans	-61.9	-34.6	176.4	-56.1	0	0	0	0	113.2	N357 L365	N357-S361 PolarHBondContact O-N 3.32Å; N357-S361 PolarHBondContact O-OG 3.44Å; N357-S361 VanDerWaalsContact O-OG 3.12Å; S361-L365 PolarHBondContact O-N 3.18Å
362	Q	77.1	Confident	73.4	Confident	97 Å²	97	111.8 Å²	111.8	45%	0.453	57%	0.573	S	S	.	*	H	α-helix	trans	-69.4	-33.3	173.8	-77.1	-174.8	-17.8	0	0	112.8	R358 R359 L360 L366	R358-Q362 WeakPolarHBondContact O-CG 3.35Å; R358-Q362 PolarHBondContact O-N 3.41Å; R358-Q362 VanDerWaalsContact O-N 3.08Å; R359-Q362 PolarHBondContact O-N 2.9Å; L360-Q362 VanDerWaalsContact C-N 3.29Å; L360-Q362 PolarHBondContact O-N 3.46Å; Q362-L366 WeakPolarHBondContact O-CD1 3.43Å; Q362-L366 WeakPolarHBondContact O-CG 3.45Å; Q362-L366 PolarHBondContact O-N 3.03Å
363	Q	68.9	Low	71.7	Confident	123 Å²	123	109.7 Å²	109.7	58%	0.575	57%	0.566	S	S	*	*	H	α-helix	trans	-72	-38.5	177.6	-160.7	171.2	26.3	0	0	111.8	R359 L360 L365 L366 L367	R359-Q363 PolarHBondContact O-N 2.88Å; L360-Q363 WeakPolarHBondContact O-CB 3.31Å; L360-Q363 PolarHBondContact O-N 2.92Å; Q363-L365 VanDerWaalsContact C-N 3.33Å; Q363-L365 PolarHBondContact O-N 3.43Å; Q363-L366 PolarHBondContact O-N 3.26Å; Q363-L367 PolarHBondContact O-N 3.47Å
364	D	65.6	Low	70.2	Confident	111 Å²	111	110.6 Å²	110.6	59%	0.594	57%	0.57	S	S	*	*	H	α-helix	trans	-62.2	-38.3	173.8	-78.1	-23.2	0	0	0	112.4	L360 L366 L367	L360-D364 PolarHBondContact O-N 2.74Å; D364-L366 VanDerWaalsContact C-N 3.3Å; D364-L366 PolarHBondContact O-N 2.89Å; D364-L367 PolarHBondContact O-N 3.48Å
365	L	64.1	Low	68.9	Low	132 Å²	132	109.7 Å²	109.7	69%	0.691	57%	0.573	S	S	*	*	H	α-helix	trans	-67	-27.4	175.3	-90	153.4	0	0	0	113.6	S361 Q363 T368	S361-L365 PolarHBondContact O-N 3.18Å; Q363-L365 VanDerWaalsContact C-N 3.33Å; Q363-L365 PolarHBondContact O-N 3.43Å; L365-T368 PolarHBondContact O-OG1 3.42Å
366	L	58.6	Low	67.6	Low	117 Å²	117	109.3 Å²	109.3	61%	0.613	58%	0.58	S	S	*	*	H	α-helix	trans	-83.1	-19.7	-178.8	-74.6	166.4	0	0	0	113.4	Q362 Q363 D364 T368	Q362-L366 WeakPolarHBondContact O-CD1 3.43Å; Q362-L366 WeakPolarHBondContact O-CG 3.45Å; Q362-L366 PolarHBondContact O-N 3.03Å; Q363-L366 PolarHBondContact O-N 3.26Å; D364-L366 VanDerWaalsContact C-N 3.3Å; D364-L366 PolarHBondContact O-N 2.89Å; L366-T368 PolarHBondContact O-N 2.98Å
367	L	56.2	Low	66.5	Low	140 Å²	140	107 Å²	107	73%	0.733	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-7.5	178.7	-81.3	156.3	0	0	0	114	Q363 D364	Q363-L367 PolarHBondContact O-N 3.47Å; D364-L367 PolarHBondContact O-N 3.48Å
368	T	57	Low	65.8	Low	119 Å²	119	106.7 Å²	106.7	73%	0.73	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	4.1	-179.3	27.9	0	0	0	0	115.8	L365 L366	L365-T368 PolarHBondContact O-OG1 3.42Å; L366-T368 PolarHBondContact O-N 2.98Å
369	A	56.8	Low	65.3	Low	51 Å²	51	108 Å²	108	42%	0.421	58%	0.581	S	S	.	*	S	Bend	trans	-93.4	144.4	-174.7	0	0	0	0	0	114.2
370	P	57	Low	64.9	Low	111 Å²	111	103.3 Å²	103.3	72%	0.721	57%	0.573	S	S	*	*			trans	-70.9	151.1	-176.4	-13.5	28.6	0	0	0	114.5	D372	P370-D372 VanDerWaalsContact C-N 3.31Å; P370-D372 PolarHBondContact O-N 2.9Å
371	K	54	Low	64.8	Low	192 Å²	192	103.8 Å²	103.8	84%	0.835	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-66	-1.2	-165.3	-93.3	178.9	175	174.9	0	118.9	D373	K371-D373 VanDerWaalsContact C-N 3.32Å
372	D	56.3	Low	64.6	Low	171 Å²	171	104.2 Å²	104.2	91%	0.914	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-87.1	-2.8	178.7	-71.5	-24.6	0	0	0	113.6	P370	P370-D372 VanDerWaalsContact C-N 3.31Å; P370-D372 PolarHBondContact O-N 2.9Å
373	D	57.8	Low	65	Low	74 Å²	74	106.1 Å²	106.1	40%	0.396	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-96	0.8	-175.9	-164.5	32	0	0	0	113.7	K371 T375 A376 Q377	K371-D373 VanDerWaalsContact C-N 3.32Å; D373-T375 VanDerWaalsContact C-N 3.33Å; D373-T375 PolarHBondContact O-N 3.45Å; D373-A376 PolarHBondContact O-N 3Å; D373-A376 WeakPolarHBondContact OD1-CB 3.49Å; D373-Q377 HydrophobicContact CB-CG 4.34Å; D373-Q377 VanDerWaalsContact O-CB 3.27Å; D373-Q377 WeakPolarHBondContact O-CB 3.42Å; D373-Q377 WeakPolarHBondContact O-CG 3.21Å; D373-Q377 PolarHBondContact O-N 3.34Å; D373-Q377 WeakPolarHBondContact OD2-CG 3.31Å; D373-Q377 PolarHBondContact OD2-NE2 3.44Å
374	L	57.9	Low	65.6	Low	108 Å²	108	106.1 Å²	106.1	57%	0.565	59%	0.585	S	S	*	*	H	α-helix	trans	-62.1	-35.8	-170.3	-132.1	79.4	0	0	0	113.6	C378	L374-C378 WeakPolarHBondContact O-CB 3.47Å; L374-C378 PolarHBondContact O-N 2.85Å; L374-C378 PolarHBondContact O-SG 3.27Å
375	T	63	Low	66.4	Low	101 Å²	101	105.9 Å²	105.9	62%	0.62	58%	0.583	S	S	*	*	H	α-helix	trans	-75.2	-38.5	-179.6	-35.5	0	0	0	0	111.9	D373 C378 Q379	D373-T375 VanDerWaalsContact C-N 3.33Å; D373-T375 PolarHBondContact O-N 3.45Å; T375-C378 PolarHBondContact O-N 2.91Å; T375-Q379 WeakPolarHBondContact O-CG 3.07Å; T375-Q379 PolarHBondContact O-N 3.06Å
376	A	66.3	Low	67.4	Low	52 Å²	52	106 Å²	106	43%	0.43	58%	0.58	S	S	.	*	H	α-helix	trans	-71.5	-36	174.4	0	0	0	0	0	111	D373 Q379 A380	D373-A376 PolarHBondContact O-N 3Å; D373-A376 WeakPolarHBondContact OD1-CB 3.49Å; A376-Q379 PolarHBondContact O-N 3.43Å; A376-A380 WeakPolarHBondContact O-CB 3.38Å; A376-A380 PolarHBondContact O-N 3.48Å
377	Q	66.4	Low	68.8	Low	50 Å²	50	104.4 Å²	104.4	23%	0.234	57%	0.572	C	S	.	*	H	α-helix	trans	-64	-43.6	170.3	-75.3	173.3	11.9	0	0	112.1	D373 Q379 A380 L381	D373-Q377 HydrophobicContact CB-CG 4.34Å; D373-Q377 VanDerWaalsContact O-CB 3.27Å; D373-Q377 WeakPolarHBondContact O-CB 3.42Å; D373-Q377 WeakPolarHBondContact O-CG 3.21Å; D373-Q377 PolarHBondContact O-N 3.34Å; D373-Q377 WeakPolarHBondContact OD2-CG 3.31Å; D373-Q377 PolarHBondContact OD2-NE2 3.44Å; Q377-Q379 PolarHBondContact O-N 3.04Å; Q377-A380 PolarHBondContact O-N 2.84Å; Q377-L381 WeakPolarHBondContact O-CB 3.33Å; Q377-L381 WeakPolarHBondContact O-CD1 3.5Å; Q377-L381 VanDerWaalsContact O-CG 3.26Å; Q377-L381 WeakPolarHBondContact O-CG 3.34Å; Q377-L381 PolarHBondContact O-N 3.43Å
378	C	68.6	Low	69.9	Low	75 Å²	75	100.4 Å²	100.4	51%	0.507	56%	0.559	S	S	.	*	H	α-helix	trans	-62.2	-42.2	174.7	-75.7	0	0	0	0	111.9	L374 T375 S382	L374-C378 WeakPolarHBondContact O-CB 3.47Å; L374-C378 PolarHBondContact O-N 2.85Å; L374-C378 PolarHBondContact O-SG 3.27Å; T375-C378 PolarHBondContact O-N 2.91Å; C378-S382 WeakPolarHBondContact O-CB 3.19Å; C378-S382 PolarHBondContact O-N 3.23Å; C378-S382 PolarHBondContact O-OG 2.93Å
379	Q	75.7	Confident	71.3	Confident	138 Å²	138	100.1 Å²	100.1	65%	0.645	55%	0.549	S	S	*	.	H	α-helix	trans	-68.4	-39.4	176.2	-72.6	177.7	-1.9	0	0	112.3	T375 A376 Q377 S382 K383	T375-Q379 WeakPolarHBondContact O-CG 3.07Å; T375-Q379 PolarHBondContact O-N 3.06Å; A376-Q379 PolarHBondContact O-N 3.43Å; Q377-Q379 PolarHBondContact O-N 3.04Å; Q379-S382 PolarHBondContact O-N 3.36Å; Q379-K383 WeakPolarHBondContact O-CB 3.12Å; Q379-K383 PolarHBondContact O-N 2.87Å
380	A	76.5	Confident	72.9	Confident	45 Å²	45	100.4 Å²	100.4	37%	0.372	55%	0.552	S	S	.	*	H	α-helix	trans	-65.4	-42.6	175	0	0	0	0	0	111.6	A376 Q377 K383 Q384	A376-A380 WeakPolarHBondContact O-CB 3.38Å; A376-A380 PolarHBondContact O-N 3.48Å; Q377-A380 PolarHBondContact O-N 2.84Å; A380-K383 PolarHBondContact O-N 3.41Å; A380-Q384 WeakPolarHBondContact O-CB 3.47Å; A380-Q384 VanDerWaalsContact O-CG 3.28Å; A380-Q384 WeakPolarHBondContact O-CG 3.4Å; A380-Q384 PolarHBondContact O-N 2.88Å
381	L	78.6	Confident	74.4	Confident	103 Å²	103	102.3 Å²	102.3	54%	0.539	55%	0.549	S	S	.	.	H	α-helix	trans	-65.3	-41.2	174.8	-78.5	163.3	0	0	0	111.7	Q377 K383 Q384 L385	Q377-L381 WeakPolarHBondContact O-CB 3.33Å; Q377-L381 WeakPolarHBondContact O-CD1 3.5Å; Q377-L381 VanDerWaalsContact O-CG 3.26Å; Q377-L381 WeakPolarHBondContact O-CG 3.34Å; Q377-L381 PolarHBondContact O-N 3.43Å; L381-K383 VanDerWaalsContact C-N 3.35Å; L381-K383 PolarHBondContact O-N 2.91Å; L381-Q384 PolarHBondContact O-N 3.45Å; L381-L385 VanDerWaalsContact O-CB 3.29Å; L381-L385 WeakPolarHBondContact O-CB 3.45Å; L381-L385 PolarHBondContact O-N 3.23Å
382	S	75.3	Confident	75.9	Confident	78 Å²	78	97 Å²	97	55%	0.545	53%	0.529	S	S	.	.	H	α-helix	trans	-62.2	-41.6	173.3	-73.3	0	0	0	0	112	C378 Q379 L385 Q386	C378-S382 WeakPolarHBondContact O-CB 3.19Å; C378-S382 PolarHBondContact O-N 3.23Å; C378-S382 PolarHBondContact O-OG 2.93Å; Q379-S382 PolarHBondContact O-N 3.36Å; S382-L385 PolarHBondContact O-N 2.87Å; S382-Q386 WeakPolarHBondContact O-CB 3.39Å; S382-Q386 PolarHBondContact O-N 2.87Å
383	K	83.8	Confident	77.3	Confident	137 Å²	137	94.4 Å²	94.4	60%	0.596	51%	0.511	S	S	*	.	H	α-helix	trans	-66.8	-43.2	175.9	-170.2	177.2	179.9	-178.1	0	111.9	Q379 A380 L381 L385 Q386 D387	Q379-K383 WeakPolarHBondContact O-CB 3.12Å; Q379-K383 PolarHBondContact O-N 2.87Å; A380-K383 PolarHBondContact O-N 3.41Å; L381-K383 VanDerWaalsContact C-N 3.35Å; L381-K383 PolarHBondContact O-N 2.91Å; K383-L385 VanDerWaalsContact C-N 3.32Å; K383-L385 PolarHBondContact O-N 2.98Å; K383-Q386 PolarHBondContact O-N 3.11Å; K383-D387 WeakPolarHBondContact O-CB 3.15Å; K383-D387 PolarHBondContact O-N 2.86Å
384	Q	82.8	Confident	78.8	Confident	124 Å²	124	93.5 Å²	93.5	58%	0.579	51%	0.514	S	S	*	.	H	α-helix	trans	-62	-39	174.6	-75.9	178.3	11.1	0	0	112	A380 L381 A388	A380-Q384 WeakPolarHBondContact O-CB 3.47Å; A380-Q384 VanDerWaalsContact O-CG 3.28Å; A380-Q384 WeakPolarHBondContact O-CG 3.4Å; A380-Q384 PolarHBondContact O-N 2.88Å; L381-Q384 PolarHBondContact O-N 3.45Å; Q384-A388 WeakPolarHBondContact O-CB 3.41Å; Q384-A388 PolarHBondContact O-N 2.96Å
385	L	81.1	Confident	80	Confident	106 Å²	106	94.4 Å²	94.4	56%	0.555	52%	0.515	S	S	*	.	H	α-helix	trans	-62.9	-43.9	174.4	-171.7	80	0	0	0	110.8	L381 S382 K383 A388 Q389	L381-L385 VanDerWaalsContact O-CB 3.29Å; L381-L385 WeakPolarHBondContact O-CB 3.45Å; L381-L385 PolarHBondContact O-N 3.23Å; S382-L385 PolarHBondContact O-N 2.87Å; K383-L385 VanDerWaalsContact C-N 3.32Å; K383-L385 PolarHBondContact O-N 2.98Å; L385-A388 PolarHBondContact O-N 2.95Å; L385-Q389 WeakPolarHBondContact O-CB 3.42Å; L385-Q389 VanDerWaalsContact O-CG 3.22Å; L385-Q389 WeakPolarHBondContact O-CG 3.48Å; L385-Q389 PolarHBondContact O-N 2.76Å
386	Q	86.4	Confident	81.2	Confident	133 Å²	133	97 Å²	97	62%	0.621	51%	0.514	S	S	*	.	H	α-helix	trans	-67.2	-41.6	179.7	-150.8	171.7	17.4	0	0	111.8	S382 K383 Q389 A390	S382-Q386 WeakPolarHBondContact O-CB 3.39Å; S382-Q386 PolarHBondContact O-N 2.87Å; K383-Q386 PolarHBondContact O-N 3.11Å; Q386-Q389 PolarHBondContact O-N 2.91Å; Q386-A390 WeakPolarHBondContact O-CB 3.3Å; Q386-A390 PolarHBondContact O-N 3.3Å
387	D	87	Confident	82.2	Confident	85 Å²	85	99.8 Å²	99.8	46%	0.455	52%	0.518	S	S	.	.	H	α-helix	trans	-66.5	-39.2	174.7	-73.2	-17	0	0	0	111.8	K383 A390 K391	K383-D387 WeakPolarHBondContact O-CB 3.15Å; K383-D387 PolarHBondContact O-N 2.86Å; D387-A390 PolarHBondContact O-N 2.93Å; D387-K391 WeakPolarHBondContact O-CB 3.46Å; D387-K391 WeakPolarHBondContact O-CG 3.39Å; D387-K391 PolarHBondContact O-N 3Å
388	A	80.2	Confident	83.2	Confident	55 Å²	55	100.1 Å²	100.1	46%	0.455	53%	0.529	S	S	.	.	H	α-helix	trans	-66.9	-40	175.1	0	0	0	0	0	111.7	Q384 L385 K391 L392	Q384-A388 WeakPolarHBondContact O-CB 3.41Å; Q384-A388 PolarHBondContact O-N 2.96Å; L385-A388 PolarHBondContact O-N 2.95Å; A388-K391 PolarHBondContact O-N 2.86Å; A388-L392 VanDerWaalsContact O-CB 3.28Å; A388-L392 WeakPolarHBondContact O-CB 3.42Å; A388-L392 PolarHBondContact O-N 2.77Å
389	Q	86.6	Confident	83.9	Confident	114 Å²	114	100.1 Å²	100.1	53%	0.533	53%	0.527	S	S	.	.	H	α-helix	trans	-63.3	-43.1	173.8	-77.3	173.5	-14.4	0	0	111.5	L385 Q386 L392 Q393	L385-Q389 WeakPolarHBondContact O-CB 3.42Å; L385-Q389 VanDerWaalsContact O-CG 3.22Å; L385-Q389 WeakPolarHBondContact O-CG 3.48Å; L385-Q389 PolarHBondContact O-N 2.76Å; Q386-Q389 PolarHBondContact O-N 2.91Å; Q389-L392 PolarHBondContact O-N 3Å; Q389-Q393 WeakPolarHBondContact O-CB 3.44Å; Q389-Q393 PolarHBondContact O-N 3.07Å
390	A	88.8	Confident	84.5	Confident	57 Å²	57	102.6 Å²	102.6	47%	0.471	53%	0.53	S	S	.	.	H	α-helix	trans	-64	-43.5	176.1	0	0	0	0	0	112.1	Q386 D387 Q393 A394	Q386-A390 WeakPolarHBondContact O-CB 3.3Å; Q386-A390 PolarHBondContact O-N 3.3Å; D387-A390 PolarHBondContact O-N 2.93Å; A390-Q393 PolarHBondContact O-N 3.43Å; A390-A394 WeakPolarHBondContact O-CB 3.38Å; A390-A394 PolarHBondContact O-N 3.46Å
391	K	88.7	Confident	85.1	Confident	151 Å²	151	102.9 Å²	102.9	66%	0.657	53%	0.533	S	S	*	.	H	α-helix	trans	-63.1	-45.1	175.1	-76.2	175.9	-177.7	176.8	0	112.2	D387 A388 Q393 A394 E395	D387-K391 WeakPolarHBondContact O-CB 3.46Å; D387-K391 WeakPolarHBondContact O-CG 3.39Å; D387-K391 PolarHBondContact O-N 3Å; A388-K391 PolarHBondContact O-N 2.86Å; K391-Q393 VanDerWaalsContact C-N 3.29Å; K391-Q393 PolarHBondContact O-N 3.45Å; K391-A394 PolarHBondContact O-N 3.47Å; K391-E395 WeakPolarHBondContact O-CB 3.21Å; K391-E395 PolarHBondContact O-N 3.47Å
392	L	86.8	Confident	85.5	Confident	80 Å²	80	101.6 Å²	101.6	42%	0.419	53%	0.529	S	S	.	.	H	α-helix	trans	-62.1	-39.1	177.4	-174.6	71.5	0	0	0	111.3	A388 Q389 R396	A388-L392 VanDerWaalsContact O-CB 3.28Å; A388-L392 WeakPolarHBondContact O-CB 3.42Å; A388-L392 PolarHBondContact O-N 2.77Å; Q389-L392 PolarHBondContact O-N 3Å; L392-R396 WeakPolarHBondContact O-CB 3.49Å; L392-R396 WeakPolarHBondContact O-CG 3.43Å; L392-R396 PolarHBondContact O-N 2.9Å
393	Q	85.8	Confident	85.9	Confident	116 Å²	116	101.6 Å²	101.6	54%	0.542	53%	0.526	S	S	.	.	H	α-helix	trans	-66.8	-44.3	176	-174.5	169.1	-18.5	0	0	111.6	Q389 A390 K391 E395 R396 E397	Q389-Q393 WeakPolarHBondContact O-CB 3.44Å; Q389-Q393 PolarHBondContact O-N 3.07Å; A390-Q393 PolarHBondContact O-N 3.43Å; K391-Q393 VanDerWaalsContact C-N 3.29Å; K391-Q393 PolarHBondContact O-N 3.45Å; Q393-E395 PolarHBondContact O-N 2.97Å; Q393-R396 PolarHBondContact O-N 3.02Å; Q393-E397 PolarHBondContact NE2-OE1 2.99Å; Q393-E397 WeakPolarHBondContact O-CG 3.45Å; Q393-E397 PolarHBondContact O-N 2.88Å
394	A	88.8	Confident	86.2	Confident	56 Å²	56	102 Å²	102	46%	0.463	53%	0.528	S	S	.	.	H	α-helix	trans	-61.8	-41.5	175.4	0	0	0	0	0	112.2	A390 K391 E397 A398	A390-A394 WeakPolarHBondContact O-CB 3.38Å; A390-A394 PolarHBondContact O-N 3.46Å; K391-A394 PolarHBondContact O-N 3.47Å; A394-E397 PolarHBondContact O-N 3.22Å; A394-A398 WeakPolarHBondContact O-CB 3.42Å; A394-A398 PolarHBondContact O-N 3.34Å
395	E	84.1	Confident	86.5	Confident	126 Å²	126	99.6 Å²	99.6	59%	0.589	52%	0.519	S	S	*	.	H	α-helix	trans	-67.6	-37.7	176.8	-170.2	171.7	-168.2	0	0	112	K391 Q393 A398 T399	K391-E395 WeakPolarHBondContact O-CB 3.21Å; K391-E395 PolarHBondContact O-N 3.47Å; Q393-E395 PolarHBondContact O-N 2.97Å; E395-A398 PolarHBondContact O-N 3.42Å; E395-T399 WeakPolarHBondContact O-CB 3.35Å; E395-T399 WeakPolarHBondContact O-CG2 2.99Å; E395-T399 PolarHBondContact O-N 3.32Å; E395-T399 PolarHBondContact O-OG1 2.97Å
396	R	87.1	Confident	86.9	Confident	156 Å²	156	99.8 Å²	99.8	59%	0.589	52%	0.517	S	S	*	.	H	α-helix	trans	-63.9	-38.8	171.7	-78.6	173.5	174.2	-178.5	-0.5	112.7	L392 Q393 T399 R400	L392-R396 WeakPolarHBondContact O-CB 3.49Å; L392-R396 WeakPolarHBondContact O-CG 3.43Å; L392-R396 PolarHBondContact O-N 2.9Å; Q393-R396 PolarHBondContact O-N 3.02Å; R396-T399 VanDerWaalsContact CA-OG1 3.29Å; R396-T399 WeakPolarHBondContact CA-OG1 2.87Å; R396-T399 PolarHBondContact O-OG1 3.46Å; R396-T399 VanDerWaalsContact O-OG1 3.07Å; R396-R400 VanDerWaalsContact O-CB 3.28Å; R396-R400 WeakPolarHBondContact O-CB 3.25Å; R396-R400 WeakPolarHBondContact O-CG 3.28Å; R396-R400 PolarHBondContact O-N 3.12Å
397	E	87.3	Confident	87.1	Confident	111 Å²	111	99.5 Å²	99.5	52%	0.519	52%	0.519	S	S	.	.	H	α-helix	trans	-71	-39.9	176.2	-74	173.3	-167.8	0	0	111.3	Q393 A394 R400 A401	Q393-E397 PolarHBondContact NE2-OE1 2.99Å; Q393-E397 WeakPolarHBondContact O-CG 3.45Å; Q393-E397 PolarHBondContact O-N 2.88Å; A394-E397 PolarHBondContact O-N 3.22Å; E397-R400 PolarHBondContact O-N 3.48Å; E397-A401 WeakPolarHBondContact O-CB 3.29Å; E397-A401 PolarHBondContact O-N 2.91Å
398	A	87.7	Confident	87.4	Confident	56 Å²	56	102.1 Å²	102.1	46%	0.463	52%	0.523	S	S	.	.	H	α-helix	trans	-64.2	-48.1	174.9	0	0	0	0	0	112	A394 E395 R400 A401 V402	A394-A398 WeakPolarHBondContact O-CB 3.42Å; A394-A398 PolarHBondContact O-N 3.34Å; E395-A398 PolarHBondContact O-N 3.42Å; A398-R400 VanDerWaalsContact C-N 3.35Å; A398-R400 PolarHBondContact O-N 2.88Å; A398-A401 WeakPolarHBondContact O-CB 3.48Å; A398-A401 PolarHBondContact O-N 3.15Å; A398-A401 VanDerWaalsContact O-N 3.11Å; A398-V402 WeakPolarHBondContact O-CG2 3.37Å; A398-V402 PolarHBondContact O-N 2.91Å
399	T	83.1	Confident	88	Confident	76 Å²	76	103.6 Å²	103.6	47%	0.466	52%	0.523	S	S	.	.	H	α-helix	trans	-62.8	-39	175.3	45.8	0	0	0	0	111.9	E395 R396 A401 V402 T403	E395-T399 WeakPolarHBondContact O-CB 3.35Å; E395-T399 WeakPolarHBondContact O-CG2 2.99Å; E395-T399 PolarHBondContact O-N 3.32Å; E395-T399 PolarHBondContact O-OG1 2.97Å; R396-T399 VanDerWaalsContact CA-OG1 3.29Å; R396-T399 WeakPolarHBondContact CA-OG1 2.87Å; R396-T399 PolarHBondContact O-OG1 3.46Å; R396-T399 VanDerWaalsContact O-OG1 3.07Å; T399-A401 VanDerWaalsContact C-N 3.34Å; T399-A401 PolarHBondContact O-N 3.04Å; T399-V402 PolarHBondContact O-N 2.8Å; T399-T403 WeakPolarHBondContact O-CB 3.41Å; T399-T403 VanDerWaalsContact O-CG2 3.28Å; T399-T403 WeakPolarHBondContact O-CG2 3.42Å; T399-T403 PolarHBondContact O-N 3.48Å; T399-T403 PolarHBondContact O-OG1 3.4Å
400	R	88.3	Confident	88.3	Confident	189 Å²	189	102.4 Å²	102.4	71%	0.713	52%	0.523	S	S	*	.	H	α-helix	trans	-61.9	-38.6	170.6	-86.3	179.3	172.6	171.8	-1.2	113.1	R396 E397 A398 T403 K404	R396-R400 VanDerWaalsContact O-CB 3.28Å; R396-R400 WeakPolarHBondContact O-CB 3.25Å; R396-R400 WeakPolarHBondContact O-CG 3.28Å; R396-R400 PolarHBondContact O-N 3.12Å; E397-R400 PolarHBondContact O-N 3.48Å; A398-R400 VanDerWaalsContact C-N 3.35Å; A398-R400 PolarHBondContact O-N 2.88Å; R400-T403 WeakPolarHBondContact CA-OG1 3.37Å; R400-T403 PolarHBondContact O-OG1 3.4Å; R400-T403 VanDerWaalsContact O-OG1 3.07Å; R400-K404 WeakPolarHBondContact O-CB 3.24Å; R400-K404 PolarHBondContact O-N 3.45Å
401	A	88.6	Confident	88.5	Confident	51 Å²	51	106.8 Å²	106.8	42%	0.421	53%	0.531	S	S	.	.	H	α-helix	trans	-68.4	-44.2	178	0	0	0	0	0	111.6	E397 A398 T399 K404 N405	E397-A401 WeakPolarHBondContact O-CB 3.29Å; E397-A401 PolarHBondContact O-N 2.91Å; A398-A401 WeakPolarHBondContact O-CB 3.48Å; A398-A401 PolarHBondContact O-N 3.15Å; A398-A401 VanDerWaalsContact O-N 3.11Å; T399-A401 VanDerWaalsContact C-N 3.34Å; T399-A401 PolarHBondContact O-N 3.04Å; A401-K404 PolarHBondContact O-N 3.31Å; A401-N405 PolarHBondContact O-N 2.9Å; A401-N405 PolarHBondContact O-ND2 3.42Å
402	V	87.8	Confident	88.7	Confident	77 Å²	77	106 Å²	106	47%	0.467	53%	0.53	S	S	.	.	H	α-helix	trans	-61.7	-53.4	176.6	173	0	0	0	0	110.5	A398 T399 K404 N405 E406	A398-V402 WeakPolarHBondContact O-CG2 3.37Å; A398-V402 PolarHBondContact O-N 2.91Å; T399-V402 PolarHBondContact O-N 2.8Å; V402-K404 VanDerWaalsContact C-N 3.27Å; V402-K404 PolarHBondContact O-N 3.27Å; V402-N405 WeakPolarHBondContact O-CA 3.48Å; V402-N405 WeakPolarHBondContact O-CB 3.47Å; V402-N405 PolarHBondContact O-N 3.31Å; V402-E406 HydrophobicContact CG1-CG 4.28Å; V402-E406 WeakPolarHBondContact CG1-OE1 3.35Å; V402-E406 WeakPolarHBondContact O-CG 3.45Å; V402-E406 PolarHBondContact O-N 3.25Å
403	T	83.8	Confident	89.1	Confident	77 Å²	77	108.5 Å²	108.5	47%	0.472	54%	0.54	S	S	.	.	H	α-helix	trans	-59	-36.3	178.6	50.5	0	0	0	0	112.7	T399 R400 L407	T399-T403 WeakPolarHBondContact O-CB 3.41Å; T399-T403 VanDerWaalsContact O-CG2 3.28Å; T399-T403 WeakPolarHBondContact O-CG2 3.42Å; T399-T403 PolarHBondContact O-N 3.48Å; T399-T403 PolarHBondContact O-OG1 3.4Å; R400-T403 WeakPolarHBondContact CA-OG1 3.37Å; R400-T403 PolarHBondContact O-OG1 3.4Å; R400-T403 VanDerWaalsContact O-OG1 3.07Å; T403-L407 VanDerWaalsContact O-CB 3.24Å; T403-L407 WeakPolarHBondContact O-CB 3.3Å; T403-L407 PolarHBondContact O-N 2.97Å
404	K	89.9	Confident	89.5	Confident	145 Å²	145	108.6 Å²	108.6	63%	0.63	54%	0.543	S	S	*	.	H	α-helix	trans	-67.9	-34.5	175.1	-174.7	177.5	179.5	-179	0	112.7	R400 A401 V402 R408	R400-K404 WeakPolarHBondContact O-CB 3.24Å; R400-K404 PolarHBondContact O-N 3.45Å; A401-K404 PolarHBondContact O-N 3.31Å; V402-K404 VanDerWaalsContact C-N 3.27Å; V402-K404 PolarHBondContact O-N 3.27Å; K404-R408 PolarHBondContact O-N 2.96Å
405	N	87.9	Confident	89.7	Confident	74 Å²	74	108.6 Å²	108.6	40%	0.396	54%	0.538	S	S	.	.	H	α-helix	trans	-73.3	-46.5	175.4	-70.9	-17.9	0	0	0	110.8	A401 V402 L407 R408 D409	A401-N405 PolarHBondContact O-N 2.9Å; A401-N405 PolarHBondContact O-ND2 3.42Å; V402-N405 WeakPolarHBondContact O-CA 3.48Å; V402-N405 WeakPolarHBondContact O-CB 3.47Å; V402-N405 PolarHBondContact O-N 3.31Å; N405-L407 VanDerWaalsContact C-N 3.31Å; N405-L407 PolarHBondContact O-N 2.72Å; N405-R408 WeakPolarHBondContact O-CA 3.26Å; N405-R408 VanDerWaalsContact O-CB 3.27Å; N405-R408 WeakPolarHBondContact O-CB 3.33Å; N405-R408 PolarHBondContact O-N 3.28Å; N405-R408 PolarHBondContact OD1-NH2 3.42Å; N405-D409 PolarHBondContact O-N 3.4Å
406	E	90.1	Very high	90.2	Very high	110 Å²	110	105.4 Å²	105.4	51%	0.514	53%	0.529	S	S	.	.	H	α-helix	trans	-57.7	-43.2	174.8	-69.3	172.9	167.9	0	0	111.8	V402 R408 D409 V410	V402-E406 HydrophobicContact CG1-CG 4.28Å; V402-E406 WeakPolarHBondContact CG1-OE1 3.35Å; V402-E406 WeakPolarHBondContact O-CG 3.45Å; V402-E406 PolarHBondContact O-N 3.25Å; E406-R408 VanDerWaalsContact C-N 3.26Å; E406-R408 PolarHBondContact O-N 3.42Å; E406-D409 PolarHBondContact O-N 3.36Å; E406-V410 WeakPolarHBondContact O-CB 3.17Å; E406-V410 VanDerWaalsContact O-CG2 3.29Å; E406-V410 WeakPolarHBondContact O-CG2 3.35Å; E406-V410 PolarHBondContact O-N 3.02Å
407	L	90.8	Very high	90.5	Very high	128 Å²	128	103.3 Å²	103.3	67%	0.67	53%	0.529	S	S	*	.	H	α-helix	trans	-61.3	-36.5	175.5	-167.8	83.5	0	0	0	112	T403 N405 K411	T403-L407 VanDerWaalsContact O-CB 3.24Å; T403-L407 WeakPolarHBondContact O-CB 3.3Å; T403-L407 PolarHBondContact O-N 2.97Å; N405-L407 VanDerWaalsContact C-N 3.31Å; N405-L407 PolarHBondContact O-N 2.72Å; L407-K411 VanDerWaalsContact O-CB 3.26Å; L407-K411 WeakPolarHBondContact O-CB 3.27Å; L407-K411 PolarHBondContact O-N 2.93Å
408	R	93.1	Very high	90.8	Very high	140 Å²	140	100.4 Å²	100.4	53%	0.528	52%	0.524	S	S	.	.	H	α-helix	trans	-67.8	-46.4	177.1	-169.5	-165.2	-44.1	-170.6	9.7	110.7	K404 N405 E406 K411 E412	K404-R408 PolarHBondContact O-N 2.96Å; N405-R408 WeakPolarHBondContact O-CA 3.26Å; N405-R408 VanDerWaalsContact O-CB 3.27Å; N405-R408 WeakPolarHBondContact O-CB 3.33Å; N405-R408 PolarHBondContact O-N 3.28Å; N405-R408 PolarHBondContact OD1-NH2 3.42Å; E406-R408 VanDerWaalsContact C-N 3.26Å; E406-R408 PolarHBondContact O-N 3.42Å; R408-K411 WeakPolarHBondContact O-CB 3.14Å; R408-K411 PolarHBondContact O-N 2.86Å; R408-E412 PolarHBondContact O-N 2.99Å
409	D	92.9	Very high	91.2	Very high	85 Å²	85	105.3 Å²	105.3	46%	0.455	53%	0.531	S	S	.	.	H	α-helix	trans	-63.9	-44.7	-179.8	-66.2	-5.4	0	0	0	110.7	N405 E406 K411 E412 Q413	N405-D409 PolarHBondContact O-N 3.4Å; E406-D409 PolarHBondContact O-N 3.36Å; D409-K411 VanDerWaalsContact C-N 3.32Å; D409-K411 PolarHBondContact O-N 3.21Å; D409-E412 PolarHBondContact O-N 3.1Å; D409-Q413 WeakPolarHBondContact O-CG 3.28Å; D409-Q413 PolarHBondContact O-N 3.07Å
410	V	92.1	Very high	91.6	Very high	89 Å²	89	105.6 Å²	105.6	54%	0.539	53%	0.529	S	S	.	.	H	α-helix	trans	-60.9	-41.4	174.3	171.2	0	0	0	0	111.1	E406 E412 Q413 L414	E406-V410 WeakPolarHBondContact O-CB 3.17Å; E406-V410 VanDerWaalsContact O-CG2 3.29Å; E406-V410 WeakPolarHBondContact O-CG2 3.35Å; E406-V410 PolarHBondContact O-N 3.02Å; V410-E412 VanDerWaalsContact C-N 3.34Å; V410-E412 PolarHBondContact O-N 2.73Å; V410-Q413 PolarHBondContact O-N 3.21Å; V410-L414 WeakPolarHBondContact O-CB 3.49Å; V410-L414 PolarHBondContact O-N 2.89Å
411	K	93.4	Very high	91.8	Very high	149 Å²	149	100.3 Å²	100.3	65%	0.648	52%	0.52	S	S	*	.	H	α-helix	trans	-64.4	-39.4	177.3	-173.8	177.2	-178.4	179.3	0	112	L407 R408 D409 L414 T415	L407-K411 VanDerWaalsContact O-CB 3.26Å; L407-K411 WeakPolarHBondContact O-CB 3.27Å; L407-K411 PolarHBondContact O-N 2.93Å; R408-K411 WeakPolarHBondContact O-CB 3.14Å; R408-K411 PolarHBondContact O-N 2.86Å; D409-K411 VanDerWaalsContact C-N 3.32Å; D409-K411 PolarHBondContact O-N 3.21Å; K411-L414 PolarHBondContact O-N 2.91Å; K411-T415 WeakPolarHBondContact O-CB 3.43Å; K411-T415 PolarHBondContact O-N 2.64Å; K411-T415 PolarHBondContact O-OG1 2.94Å
412	E	94.2	Very high	92	Very high	136 Å²	136	102.4 Å²	102.4	64%	0.636	52%	0.521	S	S	*	.	H	α-helix	trans	-68.2	-43	177.2	-168.5	159.5	-156.5	0	0	111.4	R408 D409 V410 L414 T415 S416	R408-E412 PolarHBondContact O-N 2.99Å; D409-E412 PolarHBondContact O-N 3.1Å; V410-E412 VanDerWaalsContact C-N 3.34Å; V410-E412 PolarHBondContact O-N 2.73Å; E412-L414 PolarHBondContact O-N 2.9Å; E412-T415 PolarHBondContact O-N 2.85Å; E412-S416 WeakPolarHBondContact O-CB 3.47Å; E412-S416 PolarHBondContact O-N 3.06Å
413	Q	93.8	Very high	92.3	Very high	132 Å²	132	103.9 Å²	103.9	62%	0.617	53%	0.525	S	S	*	.	H	α-helix	trans	-60.1	-44.7	172.5	-71.3	177.4	22.3	0	0	112.1	D409 V410 T415 S416 L417	D409-Q413 WeakPolarHBondContact O-CG 3.28Å; D409-Q413 PolarHBondContact O-N 3.07Å; V410-Q413 PolarHBondContact O-N 3.21Å; Q413-T415 VanDerWaalsContact C-N 3.31Å; Q413-T415 PolarHBondContact O-N 2.83Å; Q413-S416 WeakPolarHBondContact O-CB 3.27Å; Q413-S416 PolarHBondContact O-N 3.04Å; Q413-L417 WeakPolarHBondContact O-CB 3.35Å; Q413-L417 PolarHBondContact O-N 3.15Å
414	L	93.7	Very high	92.6	Very high	118 Å²	118	106.9 Å²	106.9	62%	0.618	53%	0.533	S	S	*	.	H	α-helix	trans	-61.4	-41.2	176.8	-166.3	82	0	0	0	111.4	V410 K411 E412 L417 A418	V410-L414 WeakPolarHBondContact O-CB 3.49Å; V410-L414 PolarHBondContact O-N 2.89Å; K411-L414 PolarHBondContact O-N 2.91Å; E412-L414 PolarHBondContact O-N 2.9Å; L414-L417 PolarHBondContact O-N 2.96Å; L414-A418 WeakPolarHBondContact O-CB 3.45Å; L414-A418 PolarHBondContact O-N 3.2Å
415	T	94.3	Very high	92.7	Very high	56 Å²	56	106.1 Å²	106.1	34%	0.344	53%	0.532	S	S	.	.	H	α-helix	trans	-67.4	-38.1	177.9	-49	0	0	0	0	111.3	K411 E412 Q413 R419	K411-T415 WeakPolarHBondContact O-CB 3.43Å; K411-T415 PolarHBondContact O-N 2.64Å; K411-T415 PolarHBondContact O-OG1 2.94Å; E412-T415 PolarHBondContact O-N 2.85Å; Q413-T415 VanDerWaalsContact C-N 3.31Å; Q413-T415 PolarHBondContact O-N 2.83Å; T415-R419 WeakPolarHBondContact O-CG 3.47Å; T415-R419 PolarHBondContact O-N 3.42Å
416	S	94.8	Very high	93	Very high	58 Å²	58	110.8 Å²	110.8	41%	0.406	54%	0.544	S	S	.	.	H	α-helix	trans	-63.9	-47.5	173.6	-173.6	0	0	0	0	111.5	E412 Q413 A418 R419 N420	E412-S416 WeakPolarHBondContact O-CB 3.47Å; E412-S416 PolarHBondContact O-N 3.06Å; Q413-S416 WeakPolarHBondContact O-CB 3.27Å; Q413-S416 PolarHBondContact O-N 3.04Å; S416-A418 VanDerWaalsContact C-N 3.35Å; S416-A418 PolarHBondContact O-N 3.2Å; S416-R419 WeakPolarHBondContact O-CB 3.5Å; S416-R419 PolarHBondContact O-N 3.25Å; S416-N420 PolarHBondContact O-N 3.41Å
417	L	93.4	Very high	93.1	Very high	112 Å²	112	110.2 Å²	110.2	59%	0.586	54%	0.541	S	S	*	.	H	α-helix	trans	-62.5	-40.9	178.8	-173.4	65.3	0	0	0	112	Q413 L414 R419 N420 C421	Q413-L417 WeakPolarHBondContact O-CB 3.35Å; Q413-L417 PolarHBondContact O-N 3.15Å; L414-L417 PolarHBondContact O-N 2.96Å; L417-R419 VanDerWaalsContact C-N 3.34Å; L417-R419 PolarHBondContact O-N 2.99Å; L417-N420 PolarHBondContact O-N 3.49Å; L417-C421 WeakPolarHBondContact O-CB 3.46Å; L417-C421 PolarHBondContact O-N 3.49Å
418	A	93.3	Very high	93.1	Very high	50 Å²	50	107.6 Å²	107.6	41%	0.413	53%	0.534	S	S	.	.	H	α-helix	trans	-59.4	-44.1	174.8	0	0	0	0	0	111.7	L414 S416 N420 C421 E422	L414-A418 WeakPolarHBondContact O-CB 3.45Å; L414-A418 PolarHBondContact O-N 3.2Å; S416-A418 VanDerWaalsContact C-N 3.35Å; S416-A418 PolarHBondContact O-N 3.2Å; A418-N420 VanDerWaalsContact C-N 3.35Å; A418-N420 PolarHBondContact O-N 3.18Å; A418-C421 PolarHBondContact O-N 3.46Å; A418-E422 WeakPolarHBondContact O-CG 3.38Å; A418-E422 PolarHBondContact O-N 3.23Å
419	R	95.3	Very high	93.1	Very high	160 Å²	160	103.8 Å²	103.8	60%	0.604	53%	0.529	S	S	*	.	H	α-helix	trans	-62.8	-39.9	175.2	-72.6	-179.9	-178.6	117.7	-0.1	112.6	T415 S416 L417 E422 M423	T415-R419 WeakPolarHBondContact O-CG 3.47Å; T415-R419 PolarHBondContact O-N 3.42Å; S416-R419 WeakPolarHBondContact O-CB 3.5Å; S416-R419 PolarHBondContact O-N 3.25Å; L417-R419 VanDerWaalsContact C-N 3.34Å; L417-R419 PolarHBondContact O-N 2.99Å; R419-E422 PolarHBondContact O-N 2.89Å; R419-M423 PolarHBondContact O-N 3.02Å
420	N	92.6	Very high	93.3	Very high	81 Å²	81	106.2 Å²	106.2	43%	0.433	54%	0.535	S	S	.	.	H	α-helix	trans	-65.9	-43.6	177.1	-69	-10.4	0	0	0	111.2	S416 L417 A418 E422 M423 E424	S416-N420 PolarHBondContact O-N 3.41Å; L417-N420 PolarHBondContact O-N 3.49Å; A418-N420 VanDerWaalsContact C-N 3.35Å; A418-N420 PolarHBondContact O-N 3.18Å; N420-E422 PolarHBondContact O-N 3.37Å; N420-M423 WeakPolarHBondContact O-CB 3.11Å; N420-M423 PolarHBondContact O-N 3.21Å; N420-M423 VanDerWaalsContact O-N 3.12Å; N420-E424 PolarHBondContact O-N 3.41Å
421	C	91.4	Very high	93.3	Very high	78 Å²	78	108.8 Å²	108.8	53%	0.527	54%	0.536	S	S	.	.	H	α-helix	trans	-61.5	-42.4	176.5	-169.4	0	0	0	0	111.7	L417 A418 M423 E424 Q425	L417-C421 WeakPolarHBondContact O-CB 3.46Å; L417-C421 PolarHBondContact O-N 3.49Å; A418-C421 PolarHBondContact O-N 3.46Å; C421-M423 VanDerWaalsContact C-N 3.32Å; C421-M423 PolarHBondContact O-N 2.86Å; C421-E424 PolarHBondContact O-N 2.85Å; C421-Q425 WeakPolarHBondContact O-CB 3.39Å; C421-Q425 PolarHBondContact O-N 2.8Å
422	E	94.4	Very high	93.3	Very high	95 Å²	95	106.5 Å²	106.5	44%	0.444	53%	0.528	S	S	.	.	H	α-helix	trans	-61.1	-39.6	172.8	-75.5	-179	-160.1	0	0	112.6	A418 R419 N420 Q425 R426	A418-E422 WeakPolarHBondContact O-CG 3.38Å; A418-E422 PolarHBondContact O-N 3.23Å; R419-E422 PolarHBondContact O-N 2.89Å; N420-E422 PolarHBondContact O-N 3.37Å; E422-Q425 PolarHBondContact O-N 2.95Å; E422-R426 WeakPolarHBondContact O-CG 3.49Å; E422-R426 PolarHBondContact O-N 3.23Å; E422-R426 IonicContact OE2-NH2 3.85Å; E422-R426 PolarHBondContact OE2-NH2 3.44Å
423	M	93.8	Very high	93.3	Very high	109 Å²	109	106.6 Å²	106.6	54%	0.537	53%	0.53	S	S	.	.	H	α-helix	trans	-66.7	-46	178.4	-169.9	-177.7	-60.4	0	0	111.5	R419 N420 C421 Q425 R426 Q427	R419-M423 PolarHBondContact O-N 3.02Å; N420-M423 WeakPolarHBondContact O-CB 3.11Å; N420-M423 PolarHBondContact O-N 3.21Å; N420-M423 VanDerWaalsContact O-N 3.12Å; C421-M423 VanDerWaalsContact C-N 3.32Å; C421-M423 PolarHBondContact O-N 2.86Å; M423-Q425 VanDerWaalsContact C-N 3.32Å; M423-Q425 PolarHBondContact O-N 3.29Å; M423-R426 PolarHBondContact O-N 2.92Å; M423-Q427 WeakPolarHBondContact O-CG 3.35Å; M423-Q427 PolarHBondContact O-N 3.32Å
424	E	88.9	Confident	93.4	Very high	139 Å²	139	104.8 Å²	104.8	65%	0.65	52%	0.521	S	S	*	.	H	α-helix	trans	-62.3	-39.9	175	-74	-163	167.9	0	0	111.6	N420 C421 R426 Q427 S428	N420-E424 PolarHBondContact O-N 3.41Å; C421-E424 PolarHBondContact O-N 2.85Å; E424-R426 VanDerWaalsContact C-N 3.32Å; E424-R426 PolarHBondContact O-N 3.47Å; E424-Q427 PolarHBondContact O-N 2.69Å; E424-S428 WeakPolarHBondContact O-CB 3.11Å; E424-S428 PolarHBondContact O-N 2.99Å
425	Q	92.3	Very high	93.3	Very high	129 Å²	129	102.6 Å²	102.6	60%	0.603	51%	0.513	S	S	*	.	H	α-helix	trans	-62.8	-39.5	176.6	-169.1	173.7	22.1	0	0	112	C421 E422 M423 S429	C421-Q425 WeakPolarHBondContact O-CB 3.39Å; C421-Q425 PolarHBondContact O-N 2.8Å; E422-Q425 PolarHBondContact O-N 2.95Å; M423-Q425 VanDerWaalsContact C-N 3.32Å; M423-Q425 PolarHBondContact O-N 3.29Å; Q425-S429 WeakPolarHBondContact O-CB 3.26Å; Q425-S429 PolarHBondContact O-N 3.49Å; Q425-S429 PolarHBondContact O-OG 3.35Å
426	R	93.9	Very high	93.3	Very high	172 Å²	172	105.9 Å²	105.9	65%	0.649	52%	0.522	S	S	*	.	H	α-helix	trans	-65.2	-41.2	173.3	-72.6	177.6	-170.2	139	13.9	112	E422 M423 E424 S429 K430	E422-R426 WeakPolarHBondContact O-CG 3.49Å; E422-R426 PolarHBondContact O-N 3.23Å; E422-R426 IonicContact OE2-NH2 3.85Å; E422-R426 PolarHBondContact OE2-NH2 3.44Å; M423-R426 PolarHBondContact O-N 2.92Å; E424-R426 VanDerWaalsContact C-N 3.32Å; E424-R426 PolarHBondContact O-N 3.47Å; R426-S429 PolarHBondContact O-N 2.91Å; R426-K430 PolarHBondContact O-N 3.2Å
427	Q	92.9	Very high	93.3	Very high	98 Å²	98	108.6 Å²	108.6	46%	0.458	53%	0.529	S	S	.	.	H	α-helix	trans	-65.4	-46.2	176.3	-73.9	-178.3	-5.9	0	0	111.7	M423 E424 S429 K430 Y431	M423-Q427 WeakPolarHBondContact O-CG 3.35Å; M423-Q427 PolarHBondContact O-N 3.32Å; E424-Q427 PolarHBondContact O-N 2.69Å; Q427-S429 VanDerWaalsContact C-N 3.33Å; Q427-S429 PolarHBondContact O-N 3.41Å; Q427-K430 WeakPolarHBondContact O-CB 3.44Å; Q427-K430 PolarHBondContact O-N 3.1Å; Q427-K430 VanDerWaalsContact O-N 3.1Å; Q427-Y431 HydrophobicContact CB-CE2 4.35Å; Q427-Y431 WeakPolarHBondContact O-CD2 3.28Å; Q427-Y431 PolarHBondContact O-N 3.14Å
428	S	89.9	Confident	93.3	Very high	74 Å²	74	107.9 Å²	107.9	52%	0.517	52%	0.523	S	S	.	.	H	α-helix	trans	-57.4	-46.1	175.2	-179.9	0	0	0	0	111.3	E424 K430 Y431 E432	E424-S428 WeakPolarHBondContact O-CB 3.11Å; E424-S428 PolarHBondContact O-N 2.99Å; S428-K430 VanDerWaalsContact C-N 3.28Å; S428-K430 PolarHBondContact O-N 3.28Å; S428-Y431 PolarHBondContact O-N 3.06Å; S428-E432 WeakPolarHBondContact O-CB 3.35Å; S428-E432 PolarHBondContact O-N 2.98Å
429	S	94.6	Very high	93.3	Very high	60 Å²	60	109.9 Å²	109.9	42%	0.42	53%	0.527	S	S	.	.	H	α-helix	trans	-60.2	-37.3	175.9	-57.8	0	0	0	0	112.5	Q425 R426 Q427 M433	Q425-S429 WeakPolarHBondContact O-CB 3.26Å; Q425-S429 PolarHBondContact O-N 3.49Å; Q425-S429 PolarHBondContact O-OG 3.35Å; R426-S429 PolarHBondContact O-N 2.91Å; Q427-S429 VanDerWaalsContact C-N 3.33Å; Q427-S429 PolarHBondContact O-N 3.41Å; S429-M433 PolarHBondContact O-N 2.71Å
430	K	96	Very high	93.3	Very high	135 Å²	135	105.1 Å²	105.1	59%	0.587	52%	0.522	S	S	*	.	H	α-helix	trans	-66.1	-46.5	176	-174.9	-176.9	178.1	-176.4	0	111.5	R426 Q427 S428 E432 M433 Q434	R426-K430 PolarHBondContact O-N 3.2Å; Q427-K430 WeakPolarHBondContact O-CB 3.44Å; Q427-K430 PolarHBondContact O-N 3.1Å; Q427-K430 VanDerWaalsContact O-N 3.1Å; S428-K430 VanDerWaalsContact C-N 3.28Å; S428-K430 PolarHBondContact O-N 3.28Å; K430-E432 VanDerWaalsContact C-N 3.35Å; K430-M433 PolarHBondContact O-N 3.14Å; K430-Q434 WeakPolarHBondContact O-CG 3.37Å; K430-Q434 PolarHBondContact O-N 3.1Å
431	Y	91.8	Very high	93.4	Very high	144 Å²	144	106.7 Å²	106.7	57%	0.565	53%	0.528	S	S	*	.	H	α-helix	trans	-64.9	-39.1	177.1	-68.7	-56.5	0	0	0	112	Q427 S428 M433 Q434 V435	Q427-Y431 HydrophobicContact CB-CE2 4.35Å; Q427-Y431 WeakPolarHBondContact O-CD2 3.28Å; Q427-Y431 PolarHBondContact O-N 3.14Å; S428-Y431 PolarHBondContact O-N 3.06Å; Y431-M433 VanDerWaalsContact C-N 3.3Å; Y431-M433 PolarHBondContact O-N 2.68Å; Y431-Q434 PolarHBondContact O-N 2.74Å; Y431-V435 WeakPolarHBondContact O-CG2 3.33Å; Y431-V435 PolarHBondContact O-N 2.79Å
432	E	94.4	Very high	93.4	Very high	101 Å²	101	108 Å²	108	47%	0.472	53%	0.525	S	S	.	.	H	α-helix	trans	-60.6	-40.9	175.2	-166.5	-170	156.4	0	0	111.5	S428 K430 V435 K436	S428-E432 WeakPolarHBondContact O-CB 3.35Å; S428-E432 PolarHBondContact O-N 2.98Å; K430-E432 VanDerWaalsContact C-N 3.35Å; E432-V435 PolarHBondContact O-N 3.17Å; E432-K436 WeakPolarHBondContact O-CG 3.43Å; E432-K436 PolarHBondContact O-N 3.44Å; E432-K436 VanDerWaalsContact OE1-CE 3.28Å; E432-K436 WeakPolarHBondContact OE1-CE 3.5Å; E432-K436 IonicContact OE1-NZ 2.67Å; E432-K436 PolarHBondContact OE1-NZ 3.41Å
433	M	94.5	Very high	93.4	Very high	137 Å²	137	105.9 Å²	105.9	68%	0.675	52%	0.524	S	S	*	.	H	α-helix	trans	-64.9	-43.2	175.7	-169.8	174.6	-69.2	0	0	112	S429 K430 Y431 V435 K436 E437	S429-M433 PolarHBondContact O-N 2.71Å; K430-M433 PolarHBondContact O-N 3.14Å; Y431-M433 VanDerWaalsContact C-N 3.3Å; Y431-M433 PolarHBondContact O-N 2.68Å; M433-V435 VanDerWaalsContact C-N 3.34Å; M433-V435 PolarHBondContact O-N 3.12Å; M433-K436 PolarHBondContact O-N 3.41Å; M433-E437 PolarHBondContact O-N 2.85Å
434	Q	95.1	Very high	93.4	Very high	94 Å²	94	105.7 Å²	105.7	44%	0.439	53%	0.525	S	S	.	.	H	α-helix	trans	-61.8	-41	176.1	-73	-179.8	-23.6	0	0	112.3	K430 Y431 E437 M438	K430-Q434 WeakPolarHBondContact O-CG 3.37Å; K430-Q434 PolarHBondContact O-N 3.1Å; Y431-Q434 PolarHBondContact O-N 2.74Å; Q434-E437 PolarHBondContact O-N 2.89Å; Q434-M438 WeakPolarHBondContact O-CB 3.28Å; Q434-M438 PolarHBondContact O-N 2.98Å
435	V	92.1	Very high	93.6	Very high	73 Å²	73	105.3 Å²	105.3	44%	0.442	52%	0.521	S	S	.	.	H	α-helix	trans	-64.6	-42.1	176	171.2	0	0	0	0	110.8	Y431 E432 M433 M438 N439	Y431-V435 WeakPolarHBondContact O-CG2 3.33Å; Y431-V435 PolarHBondContact O-N 2.79Å; E432-V435 PolarHBondContact O-N 3.17Å; M433-V435 VanDerWaalsContact C-N 3.34Å; M433-V435 PolarHBondContact O-N 3.12Å; V435-M438 PolarHBondContact O-N 2.87Å; V435-N439 WeakPolarHBondContact O-CB 3.44Å; V435-N439 PolarHBondContact O-N 3.45Å; V435-N439 PolarHBondContact O-ND2 2.85Å
436	K	94.7	Very high	93.7	Very high	124 Å²	124	103.4 Å²	103.4	54%	0.539	52%	0.515	S	S	.	.	H	α-helix	trans	-62	-43.1	176	-75.6	175.2	-175	166.5	0	112.1	E432 M433 N439 A440	E432-K436 WeakPolarHBondContact O-CG 3.43Å; E432-K436 PolarHBondContact O-N 3.44Å; E432-K436 VanDerWaalsContact OE1-CE 3.28Å; E432-K436 WeakPolarHBondContact OE1-CE 3.5Å; E432-K436 IonicContact OE1-NZ 2.67Å; E432-K436 PolarHBondContact OE1-NZ 3.41Å; M433-K436 PolarHBondContact O-N 3.41Å; K436-N439 PolarHBondContact O-N 2.83Å; K436-A440 PolarHBondContact O-N 2.89Å
437	E	95	Very high	93.8	Very high	116 Å²	116	99.5 Å²	99.5	54%	0.542	51%	0.506	S	S	.	.	H	α-helix	trans	-64.2	-45	177.6	-174.5	172.5	-163.3	0	0	111.6	M433 Q434 N439 A440 M441	M433-E437 PolarHBondContact O-N 2.85Å; Q434-E437 PolarHBondContact O-N 2.89Å; E437-N439 PolarHBondContact O-N 2.92Å; E437-A440 WeakPolarHBondContact O-CB 3.35Å; E437-A440 PolarHBondContact O-N 2.89Å; E437-M441 HydrophobicContact CG-CE 4.15Å; E437-M441 PolarHBondContact O-N 3.01Å
438	M	92.6	Very high	93.8	Very high	96 Å²	96	97.6 Å²	97.6	47%	0.473	50%	0.502	S	S	.	.	H	α-helix	trans	-63.8	-40.7	176.6	-170.7	174.2	63.9	0	0	112.1	Q434 V435 A440 M441 F442	Q434-M438 WeakPolarHBondContact O-CB 3.28Å; Q434-M438 PolarHBondContact O-N 2.98Å; V435-M438 PolarHBondContact O-N 2.87Å; M438-A440 VanDerWaalsContact C-N 3.33Å; M438-A440 PolarHBondContact O-N 2.87Å; M438-M441 PolarHBondContact O-N 2.72Å; M438-F442 HydrophobicContact CE-CE2 4.26Å; M438-F442 HydrophobicContact CG-CD2 3.9Å; M438-F442 HydrophobicContact CG-CE2 3.46Å; M438-F442 VanDerWaalsContact CG-CE2 3.46Å; M438-F442 HydrophobicContact CG-CZ 4.31Å; M438-F442 WeakPolarHBondContact O-CD2 3.38Å; M438-F442 PolarHBondContact O-N 3.16Å; M438-F442 HydrophobicContact SD-CE2 3.95Å
439	N	92.8	Very high	94	Very high	92 Å²	92	98.4 Å²	98.4	49%	0.492	50%	0.499	S	S	.	.	H	α-helix	trans	-63.6	-37.3	174.7	-74.3	-16.7	0	0	0	112.3	V435 K436 E437 F442 A443	V435-N439 WeakPolarHBondContact O-CB 3.44Å; V435-N439 PolarHBondContact O-N 3.45Å; V435-N439 PolarHBondContact O-ND2 2.85Å; K436-N439 PolarHBondContact O-N 2.83Å; E437-N439 PolarHBondContact O-N 2.92Å; N439-F442 PolarHBondContact O-N 2.78Å; N439-A443 PolarHBondContact O-N 2.94Å
440	A	95.1	Very high	94	Very high	61 Å²	61	101 Å²	101	50%	0.504	51%	0.505	S	S	.	.	H	α-helix	trans	-65.3	-41.1	174.2	0	0	0	0	0	111.6	K436 E437 M438 F442 A443 D444	K436-A440 PolarHBondContact O-N 2.89Å; E437-A440 WeakPolarHBondContact O-CB 3.35Å; E437-A440 PolarHBondContact O-N 2.89Å; M438-A440 VanDerWaalsContact C-N 3.33Å; M438-A440 PolarHBondContact O-N 2.87Å; A440-F442 VanDerWaalsContact C-N 3.34Å; A440-F442 PolarHBondContact O-N 2.85Å; A440-A443 PolarHBondContact O-N 3.09Å; A440-D444 PolarHBondContact O-N 2.61Å; A440-D444 VanDerWaalsContact O-N 3.08Å
441	M	94.6	Very high	93.9	Very high	113 Å²	113	99.9 Å²	99.9	56%	0.557	50%	0.501	S	S	*	.	H	α-helix	trans	-63.2	-38.1	173.4	-70.2	-174.9	-171.2	0	0	112.5	E437 M438 D444 K445	E437-M441 HydrophobicContact CG-CE 4.15Å; E437-M441 PolarHBondContact O-N 3.01Å; M438-M441 PolarHBondContact O-N 2.72Å; M441-D444 PolarHBondContact O-N 2.9Å; M441-K445 WeakPolarHBondContact O-CG 3.32Å; M441-K445 PolarHBondContact O-N 2.7Å
442	F	92.5	Very high	94	Very high	106 Å²	106	100.4 Å²	100.4	47%	0.465	50%	0.502	S	S	.	.	H	α-helix	trans	-65.1	-43.7	175.2	-77.4	-58	0	0	0	111.8	M438 N439 A440 D444 K445 D446	M438-F442 HydrophobicContact CE-CE2 4.26Å; M438-F442 HydrophobicContact CG-CD2 3.9Å; M438-F442 HydrophobicContact CG-CE2 3.46Å; M438-F442 VanDerWaalsContact CG-CE2 3.46Å; M438-F442 HydrophobicContact CG-CZ 4.31Å; M438-F442 WeakPolarHBondContact O-CD2 3.38Å; M438-F442 PolarHBondContact O-N 3.16Å; M438-F442 HydrophobicContact SD-CE2 3.95Å; N439-F442 PolarHBondContact O-N 2.78Å; A440-F442 VanDerWaalsContact C-N 3.34Å; A440-F442 PolarHBondContact O-N 2.85Å; F442-D444 VanDerWaalsContact C-N 3.31Å; F442-D444 PolarHBondContact O-N 3.02Å; F442-K445 PolarHBondContact O-N 3.01Å; F442-D446 VanDerWaalsContact O-CG 3.32Å; F442-D446 PolarHBondContact O-N 2.69Å
443	A	94.4	Very high	94	Very high	50 Å²	50	100.2 Å²	100.2	41%	0.413	50%	0.501	S	S	.	.	H	α-helix	trans	-60.1	-40.2	176.4	0	0	0	0	0	112.6	N439 A440 D446 I447	N439-A443 PolarHBondContact O-N 2.94Å; A440-A443 PolarHBondContact O-N 3.09Å; A443-D446 PolarHBondContact O-N 2.9Å; A443-I447 WeakPolarHBondContact O-CG1 3.37Å; A443-I447 PolarHBondContact O-N 3.2Å; A443-I447 VanDerWaalsContact O-N 3.07Å
444	D	94	Very high	94	Very high	105 Å²	105	98.6 Å²	98.6	56%	0.561	49%	0.492	S	S	*	.	H	α-helix	trans	-65.3	-40.4	175.8	-170.7	61.7	0	0	0	112.3	A440 M441 F442 I447 T448	A440-D444 PolarHBondContact O-N 2.61Å; A440-D444 VanDerWaalsContact O-N 3.08Å; M441-D444 PolarHBondContact O-N 2.9Å; F442-D444 VanDerWaalsContact C-N 3.31Å; F442-D444 PolarHBondContact O-N 3.02Å; D444-I447 PolarHBondContact O-N 3.42Å; D444-T448 PolarHBondContact O-N 3.41Å; D444-T448 PolarHBondContact O-OG1 3.23Å
445	K	92.6	Very high	94	Very high	131 Å²	131	99.3 Å²	99.3	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-64.9	-39.7	173.3	-75.5	-174.1	175.6	-172.1	0	112.4	M441 F442 T448 I449	M441-K445 WeakPolarHBondContact O-CG 3.32Å; M441-K445 PolarHBondContact O-N 2.7Å; F442-K445 PolarHBondContact O-N 3.01Å; K445-T448 WeakPolarHBondContact O-CB 3.28Å; K445-T448 PolarHBondContact O-N 3.48Å; K445-I449 VanDerWaalsContact O-CG1 3.25Å; K445-I449 WeakPolarHBondContact O-CG1 3.39Å; K445-I449 PolarHBondContact O-N 2.92Å
446	D	94.1	Very high	94.1	Very high	90 Å²	90	100.2 Å²	100.2	48%	0.481	50%	0.497	S	S	.	.	H	α-helix	trans	-63.6	-42.8	177.8	-71.7	-22.6	0	0	0	111	F442 A443 T448 I449 E450	F442-D446 VanDerWaalsContact O-CG 3.32Å; F442-D446 PolarHBondContact O-N 2.69Å; A443-D446 PolarHBondContact O-N 2.9Å; D446-T448 VanDerWaalsContact C-N 3.33Å; D446-T448 PolarHBondContact O-N 2.9Å; D446-I449 PolarHBondContact O-N 2.89Å; D446-E450 WeakPolarHBondContact O-CG 3.31Å; D446-E450 PolarHBondContact O-N 2.91Å
447	I	95.5	Very high	94.2	Very high	90 Å²	90	100.8 Å²	100.8	46%	0.462	50%	0.496	S	S	.	.	H	α-helix	trans	-58	-47.3	172.7	-66.8	164.7	0	0	0	110.4	A443 D444 I449 E450 E451	A443-I447 WeakPolarHBondContact O-CG1 3.37Å; A443-I447 PolarHBondContact O-N 3.2Å; A443-I447 VanDerWaalsContact O-N 3.07Å; D444-I447 PolarHBondContact O-N 3.42Å; I447-I449 VanDerWaalsContact C-N 3.31Å; I447-I449 PolarHBondContact O-N 3.28Å; I447-E450 PolarHBondContact O-N 3.37Å; I447-E451 WeakPolarHBondContact O-CG 3.35Å; I447-E451 PolarHBondContact O-N 3.5Å
448	T	94.1	Very high	94.2	Very high	58 Å²	58	100.7 Å²	100.7	36%	0.356	50%	0.498	S	S	.	.	H	α-helix	trans	-61	-40.5	178.4	-55.1	0	0	0	0	111.6	D444 K445 D446 E451 R452	D444-T448 PolarHBondContact O-N 3.41Å; D444-T448 PolarHBondContact O-OG1 3.23Å; K445-T448 WeakPolarHBondContact O-CB 3.28Å; K445-T448 PolarHBondContact O-N 3.48Å; D446-T448 VanDerWaalsContact C-N 3.33Å; D446-T448 PolarHBondContact O-N 2.9Å; T448-E451 PolarHBondContact O-N 2.92Å; T448-R452 VanDerWaalsContact O-CG 3.32Å; T448-R452 WeakPolarHBondContact O-CG 3.48Å; T448-R452 PolarHBondContact O-N 3.07Å
449	I	93.1	Very high	94.3	Very high	90 Å²	90	100.6 Å²	100.6	46%	0.462	50%	0.503	S	S	.	.	H	α-helix	trans	-63.7	-46.1	176.7	-70.7	163.9	0	0	0	110.2	K445 D446 I447 E451 R452 E453	K445-I449 VanDerWaalsContact O-CG1 3.25Å; K445-I449 WeakPolarHBondContact O-CG1 3.39Å; K445-I449 PolarHBondContact O-N 2.92Å; D446-I449 PolarHBondContact O-N 2.89Å; I447-I449 VanDerWaalsContact C-N 3.31Å; I447-I449 PolarHBondContact O-N 3.28Å; I449-E451 VanDerWaalsContact C-N 3.31Å; I449-E451 PolarHBondContact O-N 3.05Å; I449-R452 PolarHBondContact O-N 3.28Å; I449-E453 HydrophobicContact CG2-CG 4.37Å; I449-E453 WeakPolarHBondContact O-CG 3.26Å; I449-E453 PolarHBondContact O-N 3.03Å
450	E	94.9	Very high	94.4	Very high	116 Å²	116	101.4 Å²	101.4	54%	0.542	50%	0.502	S	S	.	.	H	α-helix	trans	-59.4	-41	177.4	-74.5	-176.1	178.9	0	0	112.3	D446 I447 E453 Q454	D446-E450 WeakPolarHBondContact O-CG 3.31Å; D446-E450 PolarHBondContact O-N 2.91Å; I447-E450 PolarHBondContact O-N 3.37Å; E450-E453 PolarHBondContact O-N 3.5Å; E450-Q454 WeakPolarHBondContact O-CG 3.29Å; E450-Q454 PolarHBondContact O-N 2.9Å
451	E	94.7	Very high	94.4	Very high	110 Å²	110	104.2 Å²	104.2	51%	0.514	51%	0.505	S	S	.	.	H	α-helix	trans	-62.4	-47.7	174.6	-72.1	178.6	167.4	0	0	111.6	I447 T448 I449 E453 Q454 E455	I447-E451 WeakPolarHBondContact O-CG 3.35Å; I447-E451 PolarHBondContact O-N 3.5Å; T448-E451 PolarHBondContact O-N 2.92Å; I449-E451 VanDerWaalsContact C-N 3.31Å; I449-E451 PolarHBondContact O-N 3.05Å; E451-E453 VanDerWaalsContact C-N 3.3Å; E451-E453 PolarHBondContact O-N 2.99Å; E451-Q454 WeakPolarHBondContact O-CB 3.46Å; E451-Q454 PolarHBondContact O-N 2.66Å; E451-Q454 VanDerWaalsContact O-N 3.13Å; E451-E455 PolarHBondContact O-N 3.26Å
452	R	93.4	Very high	94.5	Very high	156 Å²	156	104.8 Å²	104.8	59%	0.589	51%	0.506	S	S	*	.	H	α-helix	trans	-63.3	-36.8	176.8	-67	-57.4	-178.2	106.9	1.4	112.3	T448 I449 Q454 E455 I456	T448-R452 VanDerWaalsContact O-CG 3.32Å; T448-R452 WeakPolarHBondContact O-CG 3.48Å; T448-R452 PolarHBondContact O-N 3.07Å; I449-R452 PolarHBondContact O-N 3.28Å; R452-Q454 VanDerWaalsContact C-N 3.35Å; R452-E455 WeakPolarHBondContact CD-OE2 3.45Å; R452-E455 PolarHBondContact O-N 3.4Å; R452-I456 VanDerWaalsContact O-CG1 3.24Å; R452-I456 WeakPolarHBondContact O-CG1 3.33Å; R452-I456 PolarHBondContact O-N 2.83Å
453	E	93.9	Very high	94.5	Very high	96 Å²	96	106.5 Å²	106.5	45%	0.449	51%	0.509	S	S	.	.	H	α-helix	trans	-65.2	-38.7	173.9	-75.4	-170.8	171.2	0	0	112.3	I449 E450 E451 I456 R457	I449-E453 HydrophobicContact CG2-CG 4.37Å; I449-E453 WeakPolarHBondContact O-CG 3.26Å; I449-E453 PolarHBondContact O-N 3.03Å; E450-E453 PolarHBondContact O-N 3.5Å; E451-E453 VanDerWaalsContact C-N 3.3Å; E451-E453 PolarHBondContact O-N 2.99Å; E453-I456 PolarHBondContact O-N 3.18Å; E453-R457 WeakPolarHBondContact O-CG 3.45Å; E453-R457 PolarHBondContact O-N 3.11Å; E453-R457 IonicContact OE2-NH1 3.62Å
454	Q	95.9	Very high	94.6	Very high	103 Å²	103	107.3 Å²	107.3	48%	0.481	51%	0.507	S	S	.	.	H	α-helix	trans	-62	-46.4	173.4	-73.8	177.9	27.3	0	0	111.4	E450 E451 R452 I456 R457 L458	E450-Q454 WeakPolarHBondContact O-CG 3.29Å; E450-Q454 PolarHBondContact O-N 2.9Å; E451-Q454 WeakPolarHBondContact O-CB 3.46Å; E451-Q454 PolarHBondContact O-N 2.66Å; E451-Q454 VanDerWaalsContact O-N 3.13Å; R452-Q454 VanDerWaalsContact C-N 3.35Å; Q454-I456 PolarHBondContact O-N 3.42Å; Q454-R457 WeakPolarHBondContact O-CB 3.34Å; Q454-R457 PolarHBondContact O-N 2.74Å; Q454-R457 VanDerWaalsContact O-N 3.16Å; Q454-L458 WeakPolarHBondContact O-CG 3.37Å; Q454-L458 PolarHBondContact O-N 3.2Å
455	E	95	Very high	94.6	Very high	110 Å²	110	107.4 Å²	107.4	51%	0.514	50%	0.504	S	S	.	.	H	α-helix	trans	-58.3	-47.4	175.2	-73.3	179.7	165.8	0	0	111.8	E451 R452 R457 L458 V459	E451-E455 PolarHBondContact O-N 3.26Å; R452-E455 WeakPolarHBondContact CD-OE2 3.45Å; R452-E455 PolarHBondContact O-N 3.4Å; E455-R457 VanDerWaalsContact C-N 3.26Å; E455-R457 PolarHBondContact O-N 3.24Å; E455-L458 PolarHBondContact O-N 3.12Å; E455-L458 VanDerWaalsContact O-N 3.14Å; E455-V459 WeakPolarHBondContact O-CG2 3.44Å; E455-V459 PolarHBondContact O-N 3.35Å
456	I	93.5	Very high	94.7	Very high	92 Å²	92	105.5 Å²	105.5	47%	0.472	50%	0.5	S	S	.	.	H	α-helix	trans	-59.9	-38.5	177.3	-70.1	165.5	0	0	0	111.1	R452 E453 Q454 K460	R452-I456 VanDerWaalsContact O-CG1 3.24Å; R452-I456 WeakPolarHBondContact O-CG1 3.33Å; R452-I456 PolarHBondContact O-N 2.83Å; E453-I456 PolarHBondContact O-N 3.18Å; Q454-I456 PolarHBondContact O-N 3.42Å; I456-K460 HydrophobicContact CG2-CD 4.11Å; I456-K460 HydrophobicContact CG2-CG 4.49Å; I456-K460 WeakPolarHBondContact O-CB 3.45Å; I456-K460 VanDerWaalsContact O-CG 3.27Å; I456-K460 WeakPolarHBondContact O-CG 3.49Å; I456-K460 PolarHBondContact O-N 3.24Å
457	R	96.1	Very high	94.8	Very high	135 Å²	135	104 Å²	104	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-63.2	-44.7	175.8	-77.6	-171.6	-68.7	-99.5	8.4	111.6	E453 Q454 E455 K460 Q461	E453-R457 WeakPolarHBondContact O-CG 3.45Å; E453-R457 PolarHBondContact O-N 3.11Å; E453-R457 IonicContact OE2-NH1 3.62Å; Q454-R457 WeakPolarHBondContact O-CB 3.34Å; Q454-R457 PolarHBondContact O-N 2.74Å; Q454-R457 VanDerWaalsContact O-N 3.16Å; E455-R457 VanDerWaalsContact C-N 3.26Å; E455-R457 PolarHBondContact O-N 3.24Å; R457-K460 PolarHBondContact O-N 3.27Å; R457-Q461 PolarHBondContact O-N 2.72Å
458	L	95.9	Very high	94.8	Very high	115 Å²	115	106.2 Å²	106.2	60%	0.602	50%	0.499	S	S	*	.	H	α-helix	trans	-63.8	-47.7	178.4	-68.5	172.1	0	0	0	111.6	Q454 E455 K460 Q461 E462	Q454-L458 WeakPolarHBondContact O-CG 3.37Å; Q454-L458 PolarHBondContact O-N 3.2Å; E455-L458 PolarHBondContact O-N 3.12Å; E455-L458 VanDerWaalsContact O-N 3.14Å; L458-K460 VanDerWaalsContact C-N 3.29Å; L458-K460 PolarHBondContact O-N 2.91Å; L458-Q461 WeakPolarHBondContact O-CB 3.39Å; L458-Q461 PolarHBondContact O-N 3.41Å; L458-Q461 VanDerWaalsContact O-N 3.09Å; L458-E462 PolarHBondContact O-N 3.05Å
459	V	95	Very high	94.8	Very high	94 Å²	94	108.9 Å²	108.9	57%	0.57	51%	0.507	S	S	*	.	H	α-helix	trans	-60.9	-39.1	177.7	173.1	0	0	0	0	111.4	E455 E462 R463	E455-V459 WeakPolarHBondContact O-CG2 3.44Å; E455-V459 PolarHBondContact O-N 3.35Å; V459-E462 PolarHBondContact O-N 2.93Å; V459-R463 WeakPolarHBondContact O-CB 3.47Å; V459-R463 PolarHBondContact O-N 3Å
460	K	94.4	Very high	94.8	Very high	109 Å²	109	108 Å²	108	47%	0.474	51%	0.506	S	S	.	.	H	α-helix	trans	-62.5	-43.4	174.3	-80.1	175.1	-179.6	174.6	0	111.9	I456 R457 L458 R463 D464	I456-K460 HydrophobicContact CG2-CD 4.11Å; I456-K460 HydrophobicContact CG2-CG 4.49Å; I456-K460 WeakPolarHBondContact O-CB 3.45Å; I456-K460 VanDerWaalsContact O-CG 3.27Å; I456-K460 WeakPolarHBondContact O-CG 3.49Å; I456-K460 PolarHBondContact O-N 3.24Å; R457-K460 PolarHBondContact O-N 3.27Å; L458-K460 VanDerWaalsContact C-N 3.29Å; L458-K460 PolarHBondContact O-N 2.91Å; K460-R463 PolarHBondContact O-N 3.34Å; K460-D464 WeakPolarHBondContact O-CB 3.49Å; K460-D464 PolarHBondContact O-N 2.77Å
461	Q	95.8	Very high	94.8	Very high	119 Å²	119	109.3 Å²	109.3	56%	0.556	51%	0.512	S	S	*	.	H	α-helix	trans	-62.7	-44.9	178.7	-175.4	176.5	-11.5	0	0	111.5	R457 L458 D464 E465	R457-Q461 PolarHBondContact O-N 2.72Å; L458-Q461 WeakPolarHBondContact O-CB 3.39Å; L458-Q461 PolarHBondContact O-N 3.41Å; L458-Q461 VanDerWaalsContact O-N 3.09Å; Q461-D464 PolarHBondContact O-N 3.24Å; Q461-E465 WeakPolarHBondContact O-CB 3.43Å; Q461-E465 PolarHBondContact O-N 3.04Å
462	E	95.6	Very high	94.9	Very high	125 Å²	125	107.1 Å²	107.1	58%	0.584	51%	0.509	S	S	*	.	H	α-helix	trans	-63.6	-43.6	177.1	-171.9	174.9	-171.4	0	0	111.7	L458 V459 D464 E465 L466	L458-E462 PolarHBondContact O-N 3.05Å; V459-E462 PolarHBondContact O-N 2.93Å; E462-D464 VanDerWaalsContact C-N 3.31Å; E462-D464 PolarHBondContact O-N 3.27Å; E462-E465 PolarHBondContact O-N 2.92Å; E462-L466 HydrophobicContact CG-CD1 4.25Å; E462-L466 WeakPolarHBondContact O-CB 3.46Å; E462-L466 WeakPolarHBondContact O-CG 3.24Å; E462-L466 PolarHBondContact O-N 3.41Å
463	R	93.4	Very high	94.9	Very high	142 Å²	142	103.8 Å²	103.8	54%	0.536	50%	0.502	S	S	.	.	H	α-helix	trans	-58.7	-41.9	174.3	-177.7	-156.5	67.2	-179.7	-1.1	112.2	V459 K460 E465 S467	V459-R463 WeakPolarHBondContact O-CB 3.47Å; V459-R463 PolarHBondContact O-N 3Å; K460-R463 PolarHBondContact O-N 3.34Å; R463-E465 VanDerWaalsContact C-N 3.34Å; R463-S467 VanDerWaalsContact O-CB 3.3Å; R463-S467 WeakPolarHBondContact O-CB 3.27Å; R463-S467 PolarHBondContact O-N 3.41Å; R463-S467 PolarHBondContact O-OG 3.26Å
464	D	95	Very high	94.8	Very high	68 Å²	68	105.7 Å²	105.7	36%	0.364	51%	0.509	S	S	.	.	H	α-helix	trans	-70	-34.8	-180	-68.7	-6.5	0	0	0	111.1	K460 Q461 E462 S467 R468	K460-D464 WeakPolarHBondContact O-CB 3.49Å; K460-D464 PolarHBondContact O-N 2.77Å; Q461-D464 PolarHBondContact O-N 3.24Å; E462-D464 VanDerWaalsContact C-N 3.31Å; E462-D464 PolarHBondContact O-N 3.27Å; D464-S467 PolarHBondContact O-N 2.98Å; D464-R468 WeakPolarHBondContact O-CG 3.35Å; D464-R468 PolarHBondContact O-N 3.49Å
465	E	95.8	Very high	94.7	Very high	107 Å²	107	102.2 Å²	102.2	50%	0.5	50%	0.501	S	S	.	.	H	α-helix	trans	-67.2	-50.1	173.9	-169.1	134.5	-116.9	0	0	112.3	Q461 E462 R463 S467 R468 E469	Q461-E465 WeakPolarHBondContact O-CB 3.43Å; Q461-E465 PolarHBondContact O-N 3.04Å; E462-E465 PolarHBondContact O-N 2.92Å; R463-E465 VanDerWaalsContact C-N 3.34Å; E465-S467 VanDerWaalsContact C-N 3.25Å; E465-S467 PolarHBondContact O-N 2.86Å; E465-R468 WeakPolarHBondContact O-CB 3.34Å; E465-R468 PolarHBondContact O-N 2.87Å; E465-R468 IonicContact OE1-NH2 3.37Å; E465-R468 PolarHBondContact OE1-NH2 2.99Å; E465-E469 PolarHBondContact O-N 3.44Å
466	L	94.6	Very high	94.7	Very high	91 Å²	91	100.9 Å²	100.9	48%	0.476	50%	0.495	S	S	.	.	H	α-helix	trans	-58.9	-38.1	172.9	-71.4	171.7	0	0	0	111.6	E462 R468 E469 V470	E462-L466 HydrophobicContact CG-CD1 4.25Å; E462-L466 WeakPolarHBondContact O-CB 3.46Å; E462-L466 WeakPolarHBondContact O-CG 3.24Å; E462-L466 PolarHBondContact O-N 3.41Å; L466-R468 VanDerWaalsContact C-N 3.35Å; L466-R468 PolarHBondContact O-N 2.98Å; L466-E469 PolarHBondContact O-N 2.96Å; L466-V470 WeakPolarHBondContact O-CB 3.28Å; L466-V470 VanDerWaalsContact O-CG2 3.23Å; L466-V470 WeakPolarHBondContact O-CG2 3.47Å; L466-V470 PolarHBondContact O-N 2.8Å
467	S	94.3	Very high	94.5	Very high	59 Å²	59	100.3 Å²	100.3	41%	0.413	49%	0.492	S	S	.	.	H	α-helix	trans	-63.5	-39.3	175.2	-70.5	0	0	0	0	112.5	R463 D464 E465 Q471	R463-S467 VanDerWaalsContact O-CB 3.3Å; R463-S467 WeakPolarHBondContact O-CB 3.27Å; R463-S467 PolarHBondContact O-N 3.41Å; R463-S467 PolarHBondContact O-OG 3.26Å; D464-S467 PolarHBondContact O-N 2.98Å; E465-S467 VanDerWaalsContact C-N 3.25Å; E465-S467 PolarHBondContact O-N 2.86Å; S467-Q471 WeakPolarHBondContact O-CG 3.46Å; S467-Q471 PolarHBondContact O-N 3.45Å
468	R	96	Very high	94.2	Very high	135 Å²	135	100 Å²	100	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-64.7	-43.5	173.8	-73.4	-173.5	-64	-96	5	111.2	D464 E465 L466 Q471 S472	D464-R468 WeakPolarHBondContact O-CG 3.35Å; D464-R468 PolarHBondContact O-N 3.49Å; E465-R468 WeakPolarHBondContact O-CB 3.34Å; E465-R468 PolarHBondContact O-N 2.87Å; E465-R468 IonicContact OE1-NH2 3.37Å; E465-R468 PolarHBondContact OE1-NH2 2.99Å; L466-R468 VanDerWaalsContact C-N 3.35Å; L466-R468 PolarHBondContact O-N 2.98Å; R468-Q471 PolarHBondContact O-N 3.32Å; R468-S472 PolarHBondContact O-N 2.98Å
469	E	95.2	Very high	94	Very high	114 Å²	114	101.6 Å²	101.6	53%	0.533	49%	0.494	S	S	.	.	H	α-helix	trans	-64.9	-44.6	178.8	-167.3	170.3	-162.8	0	0	111.7	E465 L466 Q471 S472 L473	E465-E469 PolarHBondContact O-N 3.44Å; L466-E469 PolarHBondContact O-N 2.96Å; E469-Q471 VanDerWaalsContact C-N 3.31Å; E469-Q471 PolarHBondContact O-N 3Å; E469-S472 WeakPolarHBondContact O-CB 3.46Å; E469-S472 PolarHBondContact O-N 3.02Å; E469-S472 VanDerWaalsContact O-N 3.12Å; E469-L473 HydrophobicContact CG-CD1 4.29Å; E469-L473 WeakPolarHBondContact O-CG 3.5Å; E469-L473 PolarHBondContact O-N 2.65Å
470	V	92.6	Very high	93.7	Very high	71 Å²	71	102.9 Å²	102.9	43%	0.43	50%	0.497	S	S	.	.	H	α-helix	trans	-59.2	-40.9	173.6	168.3	0	0	0	0	111.5	L466 K474	L466-V470 WeakPolarHBondContact O-CB 3.28Å; L466-V470 VanDerWaalsContact O-CG2 3.23Å; L466-V470 WeakPolarHBondContact O-CG2 3.47Å; L466-V470 PolarHBondContact O-N 2.8Å; V470-K474 HydrophobicContact CG1-CD 4.19Å; V470-K474 WeakPolarHBondContact O-CB 3.5Å; V470-K474 VanDerWaalsContact O-CG 3.26Å; V470-K474 WeakPolarHBondContact O-CG 3.41Å; V470-K474 PolarHBondContact O-N 2.96Å
471	Q	94.7	Very high	93.4	Very high	144 Å²	144	106 Å²	106	67%	0.673	51%	0.506	S	S	*	.	H	α-helix	trans	-65	-41.4	174.8	-78.6	179.8	3.5	0	0	112.2	S467 R468 E469 K474 G475	S467-Q471 WeakPolarHBondContact O-CG 3.46Å; S467-Q471 PolarHBondContact O-N 3.45Å; R468-Q471 PolarHBondContact O-N 3.32Å; E469-Q471 VanDerWaalsContact C-N 3.31Å; E469-Q471 PolarHBondContact O-N 3Å; Q471-K474 PolarHBondContact O-N 3.05Å; Q471-G475 PolarHBondContact O-N 3.07Å
472	S	95.9	Very high	92.8	Very high	65 Å²	65	103.9 Å²	103.9	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-61.7	-50.1	176.5	-171.5	0	0	0	0	111.7	R468 E469 K474 G475 E476	R468-S472 PolarHBondContact O-N 2.98Å; E469-S472 WeakPolarHBondContact O-CB 3.46Å; E469-S472 PolarHBondContact O-N 3.02Å; E469-S472 VanDerWaalsContact O-N 3.12Å; S472-K474 VanDerWaalsContact C-N 3.34Å; S472-K474 PolarHBondContact O-N 3.43Å; S472-G475 WeakPolarHBondContact O-CA 3.37Å; S472-G475 PolarHBondContact O-N 2.8Å; S472-G475 VanDerWaalsContact O-N 3.08Å; S472-E476 PolarHBondContact O-N 2.99Å
473	L	93.8	Very high	92.3	Very high	85 Å²	85	104 Å²	104	45%	0.445	51%	0.505	S	S	.	.	H	α-helix	trans	-61.4	-41	177.8	-71.8	171.7	0	0	0	111.8	E469 G475 E476 I477	E469-L473 HydrophobicContact CG-CD1 4.29Å; E469-L473 WeakPolarHBondContact O-CG 3.5Å; E469-L473 PolarHBondContact O-N 2.65Å; L473-G475 VanDerWaalsContact C-N 3.32Å; L473-G475 PolarHBondContact O-N 3.07Å; L473-E476 PolarHBondContact O-N 3.48Å; L473-I477 VanDerWaalsContact O-CG1 3.27Å; L473-I477 WeakPolarHBondContact O-CG1 3.33Å; L473-I477 PolarHBondContact O-N 2.88Å
474	K	92.8	Very high	91.4	Very high	137 Å²	137	105.1 Å²	105.1	60%	0.596	51%	0.51	S	S	*	.	H	α-helix	trans	-58	-44.6	172.5	-80.3	177.3	179.2	-180	0	111.6	V470 Q471 S472 E476 I477 E478	V470-K474 HydrophobicContact CG1-CD 4.19Å; V470-K474 WeakPolarHBondContact O-CB 3.5Å; V470-K474 VanDerWaalsContact O-CG 3.26Å; V470-K474 WeakPolarHBondContact O-CG 3.41Å; V470-K474 PolarHBondContact O-N 2.96Å; Q471-K474 PolarHBondContact O-N 3.05Å; S472-K474 VanDerWaalsContact C-N 3.34Å; S472-K474 PolarHBondContact O-N 3.43Å; K474-E476 VanDerWaalsContact C-N 3.34Å; K474-E476 PolarHBondContact O-N 3.11Å; K474-I477 PolarHBondContact O-N 3.46Å; K474-E478 WeakPolarHBondContact O-CB 3.44Å; K474-E478 PolarHBondContact O-N 3.46Å
475	G	93.6	Very high	90.3	Very high	30 Å²	30	105.2 Å²	105.2	31%	0.309	52%	0.52	S	S	.	.	H	α-helix	trans	-64.3	-34.8	176.3	0	0	0	0	0	113.6	Q471 S472 L473 R479	Q471-G475 PolarHBondContact O-N 3.07Å; S472-G475 WeakPolarHBondContact O-CA 3.37Å; S472-G475 PolarHBondContact O-N 2.8Å; S472-G475 VanDerWaalsContact O-N 3.08Å; L473-G475 VanDerWaalsContact C-N 3.32Å; L473-G475 PolarHBondContact O-N 3.07Å; G475-R479 PolarHBondContact O-N 2.72Å; G475-R479 VanDerWaalsContact O-N 3.1Å
476	E	94	Very high	89.1	Confident	82 Å²	82	104.9 Å²	104.9	38%	0.383	53%	0.529	S	S	.	.	H	α-helix	trans	-68.7	-44.1	172.9	-75.5	-176.7	174.5	0	0	112.5	S472 L473 K474 E478 R479 L480	S472-E476 PolarHBondContact O-N 2.99Å; L473-E476 PolarHBondContact O-N 3.48Å; K474-E476 VanDerWaalsContact C-N 3.34Å; K474-E476 PolarHBondContact O-N 3.11Å; E476-E478 VanDerWaalsContact C-N 3.3Å; E476-E478 PolarHBondContact O-N 2.85Å; E476-R479 PolarHBondContact O-N 3.46Å; E476-L480 WeakPolarHBondContact O-CB 3.33Å; E476-L480 WeakPolarHBondContact O-CG 3.2Å; E476-L480 PolarHBondContact O-N 3.15Å
477	I	90.3	Very high	87.8	Confident	79 Å²	79	106.6 Å²	106.6	41%	0.405	54%	0.538	S	S	.	.	H	α-helix	trans	-59.5	-42.9	174.9	-69.5	166.3	0	0	0	110.3	L473 K474 L480 R481	L473-I477 VanDerWaalsContact O-CG1 3.27Å; L473-I477 WeakPolarHBondContact O-CG1 3.33Å; L473-I477 PolarHBondContact O-N 2.88Å; K474-I477 PolarHBondContact O-N 3.46Å; I477-L480 PolarHBondContact O-N 3.44Å; I477-R481 HydrophobicContact CG2-CG 4.31Å; I477-R481 WeakPolarHBondContact O-CB 3.49Å; I477-R481 VanDerWaalsContact O-CG 3.26Å; I477-R481 WeakPolarHBondContact O-CG 3.49Å; I477-R481 PolarHBondContact O-N 3.42Å
478	E	90.4	Very high	85.6	Confident	129 Å²	129	107.7 Å²	107.7	60%	0.603	54%	0.542	S	S	*	.	H	α-helix	trans	-62.3	-43	176.8	-160.3	100.4	-132.2	0	0	111.8	K474 E476 S482	K474-E478 WeakPolarHBondContact O-CB 3.44Å; K474-E478 PolarHBondContact O-N 3.46Å; E476-E478 VanDerWaalsContact C-N 3.3Å; E476-E478 PolarHBondContact O-N 2.85Å; E478-S482 WeakPolarHBondContact O-CB 2.95Å; E478-S482 PolarHBondContact O-N 3.37Å; E478-S482 PolarHBondContact O-OG 2.91Å
479	R	91.7	Very high	82.8	Confident	148 Å²	148	106.5 Å²	106.5	56%	0.558	55%	0.554	S	S	*	*	H	α-helix	trans	-63.1	-46.2	175.1	-86.7	-176	-85	124.1	-6.8	111.8	G475 E476 S482 H483	G475-R479 PolarHBondContact O-N 2.72Å; G475-R479 VanDerWaalsContact O-N 3.1Å; E476-R479 PolarHBondContact O-N 3.46Å; R479-S482 PolarHBondContact O-N 3.36Å; R479-H483 PolarHBondContact O-N 2.91Å
480	L	88.8	Confident	80.5	Confident	121 Å²	121	106.7 Å²	106.7	63%	0.634	57%	0.566	S	S	*	*	H	α-helix	trans	-64	-44.2	177.9	-77.4	167.3	0	0	0	111.7	E476 I477 S482 H483 Y484	E476-L480 WeakPolarHBondContact O-CB 3.33Å; E476-L480 WeakPolarHBondContact O-CG 3.2Å; E476-L480 PolarHBondContact O-N 3.15Å; I477-L480 PolarHBondContact O-N 3.44Å; L480-S482 VanDerWaalsContact C-N 3.33Å; L480-S482 PolarHBondContact O-N 2.83Å; L480-H483 WeakPolarHBondContact O-CB 3.29Å; L480-H483 PolarHBondContact O-N 3.34Å; L480-Y484 WeakPolarHBondContact O-CB 3.35Å; L480-Y484 PolarHBondContact O-N 3.04Å
481	R	86.8	Confident	77.7	Confident	175 Å²	175	110.3 Å²	110.3	66%	0.66	59%	0.588	S	S	*	*	H	α-helix	trans	-60.8	-41.6	174.9	-76.9	175.6	178.6	179.5	0.5	111.9	I477 Y484 A485	I477-R481 HydrophobicContact CG2-CG 4.31Å; I477-R481 WeakPolarHBondContact O-CB 3.49Å; I477-R481 VanDerWaalsContact O-CG 3.26Å; I477-R481 WeakPolarHBondContact O-CG 3.49Å; I477-R481 PolarHBondContact O-N 3.42Å; R481-Y484 PolarHBondContact O-N 3.31Å; R481-A485 WeakPolarHBondContact O-CB 3.28Å; R481-A485 PolarHBondContact O-N 2.88Å
482	S	83.1	Confident	75	Confident	74 Å²	74	106.9 Å²	106.9	52%	0.517	58%	0.584	S	S	.	*	H	α-helix	trans	-63.3	-41.5	175.3	-59.7	0	0	0	0	111.8	E478 R479 L480 S486	E478-S482 WeakPolarHBondContact O-CB 2.95Å; E478-S482 PolarHBondContact O-N 3.37Å; E478-S482 PolarHBondContact O-OG 2.91Å; R479-S482 PolarHBondContact O-N 3.36Å; L480-S482 VanDerWaalsContact C-N 3.33Å; L480-S482 PolarHBondContact O-N 2.83Å; S482-S486 WeakPolarHBondContact O-CB 3.33Å; S482-S486 PolarHBondContact O-N 2.76Å
483	H	85	Confident	72.2	Confident	129 Å²	129	111.9 Å²	111.9	60%	0.597	60%	0.6	S	S	*	*	H	α-helix	trans	-64.5	-43.6	173.7	-110.6	-69.3	0	0	0	112.2	R479 L480 S486 I487	R479-H483 PolarHBondContact O-N 2.91Å; L480-H483 WeakPolarHBondContact O-CB 3.29Å; L480-H483 PolarHBondContact O-N 3.34Å; H483-S486 WeakPolarHBondContact O-CB 3.42Å; H483-S486 PolarHBondContact O-N 2.98Å; H483-I487 WeakPolarHBondContact O-CD1 3.38Å; H483-I487 VanDerWaalsContact O-CG1 3.25Å; H483-I487 WeakPolarHBondContact O-CG1 3.21Å; H483-I487 PolarHBondContact O-N 2.99Å
484	Y	74.4	Confident	69.3	Low	164 Å²	164	115.9 Å²	115.9	64%	0.643	62%	0.616	S	S	*	*	H	α-helix	trans	-65	-44.7	179.4	-146.4	-89.8	0	0	0	111.2	L480 R481 S486 I487 T488	L480-Y484 WeakPolarHBondContact O-CB 3.35Å; L480-Y484 PolarHBondContact O-N 3.04Å; R481-Y484 PolarHBondContact O-N 3.31Å; Y484-S486 PolarHBondContact O-N 2.97Å; Y484-I487 PolarHBondContact O-N 3.39Å; Y484-T488 HydrophobicContact CD1-CG2 4.17Å; Y484-T488 HydrophobicContact CE1-CG2 3.95Å; Y484-T488 PolarHBondContact O-N 3.12Å; Y484-T488 PolarHBondContact O-OG1 3.3Å
485	A	73.6	Confident	66.8	Low	70 Å²	70	115.3 Å²	115.3	58%	0.579	63%	0.625	S	S	*	*	H	α-helix	trans	-61.9	-29.2	173.7	0	0	0	0	0	112.9	R481	R481-A485 WeakPolarHBondContact O-CB 3.28Å; R481-A485 PolarHBondContact O-N 2.88Å
486	S	70.7	Confident	64.9	Low	100 Å²	100	119.1 Å²	119.1	70%	0.699	64%	0.644	S	S	*	*	H	α-helix	trans	-76.7	-21.5	173	-172.1	0	0	0	0	113.5	S482 H483 Y484	S482-S486 WeakPolarHBondContact O-CB 3.33Å; S482-S486 PolarHBondContact O-N 2.76Å; H483-S486 WeakPolarHBondContact O-CB 3.42Å; H483-S486 PolarHBondContact O-N 2.98Å; Y484-S486 PolarHBondContact O-N 2.97Å
487	I	66.3	Low	62.3	Low	127 Å²	127	125.2 Å²	125.2	65%	0.651	67%	0.665	S	S	*	*	H	α-helix	trans	-94.1	-28.7	-179.5	-65.4	163.3	0	0	0	111	H483 Y484	H483-I487 WeakPolarHBondContact O-CD1 3.38Å; H483-I487 VanDerWaalsContact O-CG1 3.25Å; H483-I487 WeakPolarHBondContact O-CG1 3.21Å; H483-I487 PolarHBondContact O-N 2.99Å; Y484-I487 PolarHBondContact O-N 3.39Å
488	T	48.7	Very low	59.6	Low	82 Å²	82	129.3 Å²	129.3	50%	0.503	69%	0.687	S	S	.	*			trans	-106.4	95.1	179.1	56.7	0	0	0	0	112.5	Y484	Y484-T488 HydrophobicContact CD1-CG2 4.17Å; Y484-T488 HydrophobicContact CE1-CG2 3.95Å; Y484-T488 PolarHBondContact O-N 3.12Å; Y484-T488 PolarHBondContact O-OG1 3.3Å
489	S	35.9	Very low	57	Low	110 Å²	110	131.8 Å²	131.8	77%	0.769	70%	0.698	S	S	*	*			trans	-111.2	149.8	151.2	-155.6	0	0	0	0	107.6
490	P	48.3	Very low	54.8	Low	119 Å²	119	130.2 Å²	130.2	77%	0.773	71%	0.707	S	S	*	*			trans	-79.8	127.3	-136.2	32.5	-34.3	0	0	0	113.4
491	V	32.4	Very low	52	Low	146 Å²	146	131.8 Å²	131.8	89%	0.885	72%	0.717	S	S	*	*			trans	-140.7	131	155.3	-176.9	0	0	0	0	109.5
492	A	38.9	Very low	50.6	Low	72 Å²	72	128.5 Å²	128.5	60%	0.595	72%	0.718	S	S	*	*			trans	-38.8	163.9	177.7	0	0	0	0	0	120.7
493	E	37.1	Very low	48.2	Very low	170 Å²	170	132.7 Å²	132.7	79%	0.794	73%	0.733	S	S	*	*			trans	72.6	149.9	145.2	-75	160.3	-169.1	0	0	117.9
494	E	33.1	Very low	46.1	Very low	169 Å²	169	132.8 Å²	132.8	79%	0.79	74%	0.742	S	S	*	*			cis	-171.1	150.5	-7.3	-116.7	176.3	175.4	0	0	106.5
495	T	40	Very low	44.8	Very low	125 Å²	125	131 Å²	131	77%	0.767	75%	0.75	S	S	*	*			trans	-54.5	159	165.1	21.8	0	0	0	0	114.1
496	P	54.1	Low	42.7	Very low	111 Å²	111	131.3 Å²	131.3	72%	0.721	76%	0.761	S	S	*	*				-162.3	151.1	79.1	35.5	-10.7	0	0	0	121.6
497	Y	38	Very low	40.8	Very low	209 Å²	209	131.8 Å²	131.8	82%	0.82	76%	0.764	S	S	*	*			trans	43.7	136.5	137.4	-69.1	-91.5	0	0	0	125.4
498	L	34.1	Very low	39.1	Very low	165 Å²	165	132.3 Å²	132.3	86%	0.864	77%	0.768	S	S	*	*				171.7	139.8	102.1	-84.8	173.2	0	0	0	115.5
499	Q	35.8	Very low	38.3	Very low	181 Å²	181	134.8 Å²	134.8	85%	0.846	78%	0.783	S	S	*	*			trans	-59.3	-174.4	171.9	-104	174.4	-45.3	0	0	116.1
500	P	45.1	Very low	38.9	Very low	115 Å²	115	135.6 Å²	135.6	75%	0.747	79%	0.786	S	S	*	*			cis	-142.6	178	2.4	26.2	0.7	0	0	0	118.1
501	D	30.8	Very low	38.6	Very low	155 Å²	155	134.3 Å²	134.3	83%	0.829	79%	0.785	S	S	*	*			trans	-63.7	-175.4	161.3	-88.9	-37.7	0	0	0	115.4
502	P	58.3	Low	38.9	Very low	106 Å²	106	133.1 Å²	133.1	69%	0.688	78%	0.783	S	S	*	*			cis	-139.3	178.2	-9.4	25	0.5	0	0	0	116.5
503	I	30.8	Very low	38.6	Very low	162 Å²	162	141 Å²	141	83%	0.831	80%	0.797	S	S	*	*			trans	145.5	124.9	132.1	-68.1	163.8	0	0	0	113.2
504	V	41.3	Very low	38.8	Very low	130 Å²	130	140 Å²	140	79%	0.788	80%	0.797	S	S	*	*			trans	-82.3	169.4	179.5	163.6	0	0	0	0	111.3
505	P	48.1	Very low	38.9	Very low	126 Å²	126	140 Å²	140	82%	0.818	80%	0.797	S	S	*	*			cis	-137.2	171.7	11.3	18	9.2	0	0	0	118.5
506	G	29.7	Very low	38.6	Very low	78 Å²	78	142 Å²	142	80%	0.804	80%	0.798	S	S	*	*			trans	144.8	105.9	135.6	0	0	0	0	0	119.4
507	S	30.7	Very low	37.6	Very low	109 Å²	109	143.3 Å²	143.3	76%	0.762	80%	0.799	S	S	*	*			trans	51.2	124.1	152.4	-101.1	0	0	0	0	124.5
508	D	30.6	Very low	37.1	Very low	139 Å²	139	140.2 Å²	140.2	74%	0.743	80%	0.802	S	S	*	*			trans	73.4	89.7	131.5	-54.1	-33.3	0	0	0	122.5
509	V	30.8	Very low	37.9	Very low	134 Å²	134	141 Å²	141	81%	0.812	81%	0.806	S	S	*	*			trans	35.6	126.3	131.5	-166.9	0	0	0	0	121.4
510	P	49.4	Very low	37.6	Very low	127 Å²	127	134.6 Å²	134.6	83%	0.825	79%	0.789	S	S	*	*			trans	-129.7	-170.7	145.9	38.8	-23.6	0	0	0	114.4
511	A	40.5	Very low	37.6	Very low	91 Å²	91	139.1 Å²	139.1	75%	0.752	80%	0.799	S	S	*	*			trans	-87.9	171	-160.8	0	0	0	0	0	119.1
512	S	39.5	Very low	37.6	Very low	121 Å²	121	139.7 Å²	139.7	85%	0.846	80%	0.797	S	S	*	*			trans	63.9	116.6	148.9	-73.8	0	0	0	0	124.2
513	R	33.3	Very low	36.9	Very low	238 Å²	238	142.1 Å²	142.1	90%	0.898	81%	0.805	S	S	*	*			trans	49.4	100.1	133.2	-152.4	169.3	-174.9	169	0.8	122.8
514	N	40	Very low	37.4	Very low	148 Å²	148	141 Å²	141	79%	0.791	80%	0.796	S	S	*	*			trans	44	122.2	133	-72.8	2.8	0	0	0	124.9
515	Q	35.2	Very low	38	Very low	170 Å²	170	139.8 Å²	139.8	79%	0.794	79%	0.79	S	S	*	*				-179.8	118.4	98	-98.2	177.9	20.9	0	0	113.1
516	Q	33.7	Very low	38.6	Very low	166 Å²	166	135.9 Å²	135.9	78%	0.776	77%	0.768	S	S	*	*			trans	46.6	139.7	130.1	-73.2	169.5	-15.8	0	0	120.3
517	D	34.2	Very low	40.6	Very low	139 Å²	139	134.1 Å²	134.1	74%	0.743	74%	0.74	S	S	*	*			cis	-173.6	138.8	18.1	-124.2	-12.2	0	0	0	106.9
518	V	27.3	Very low	42.7	Very low	145 Å²	145	132.8 Å²	132.8	88%	0.879	73%	0.727	S	S	*	*			trans	-155.9	125.8	149	-177.2	0	0	0	0	110.1
519	L	51.4	Low	45.1	Very low	181 Å²	181	126.1 Å²	126.1	95%	0.948	69%	0.692	S	S	*	*			trans	-61.6	123.8	174	-74.8	156.8	0	0	0	112.7
520	G	27.7	Very low	47.1	Very low	47 Å²	47	123.5 Å²	123.5	49%	0.485	68%	0.679	S	S	.	*			trans	-151.6	140.6	165.9	0	0	0	0	0	109	Q522	G520-Q522 WeakPolarHBondContact O-CG 3.48Å; G520-Q522 PolarHBondContact O-N 2.98Å
521	Q	45.6	Very low	48.2	Very low	209 Å²	209	120.7 Å²	120.7	98%	0.977	66%	0.655	S	S	*	*			trans	-45.3	109.1	179.2	-77.2	169.7	-36.3	0	0	111.4
522	Q	30.6	Very low	49.9	Very low	168 Å²	168	118.5 Å²	118.5	79%	0.785	63%	0.633	S	S	*	*			trans	-144.1	123.3	-178.6	-71.2	179.3	4.6	0	0	108.8	G520 H524	G520-Q522 WeakPolarHBondContact O-CG 3.48Å; G520-Q522 PolarHBondContact O-N 2.98Å; Q522-H524 PolarHBondContact O-N 3.11Å
523	D	44.6	Very low	51.5	Low	157 Å²	157	122.7 Å²	122.7	84%	0.84	63%	0.631	S	S	*	*			trans	-30	119.9	166.5	-69.7	-54	0	0	0	110.4	P525	D523-P525 WeakPolarHBondContact O-CD 3.41Å
524	H	40.3	Very low	53.5	Low	139 Å²	139	116.9 Å²	116.9	64%	0.644	61%	0.614	S	S	*	*			trans	-53.4	114.7	170.9	-72.4	-72.2	0	0	0	106.9	Q522 A526	Q522-H524 PolarHBondContact O-N 3.11Å; H524-A526 PolarHBondContact O-N 3.5Å
525	P	54.2	Low	55	Low	104 Å²	104	113.3 Å²	113.3	68%	0.675	60%	0.601	S	S	*	*			trans	-60	118	175.2	22.8	-29.2	0	0	0	105.7	D523 L527	D523-P525 WeakPolarHBondContact O-CD 3.41Å; P525-L527 PolarHBondContact O-N 2.85Å
526	A	60.5	Low	56.7	Low	43 Å²	43	107.8 Å²	107.8	36%	0.355	57%	0.574	S	S	.	*			trans	-59.4	111.4	179.8	0	0	0	0	0	107.1	H524 V528 P537	H524-A526 PolarHBondContact O-N 3.5Å; A526-V528 PolarHBondContact O-N 2.93Å; A526-P537 HydrophobicContact CB-CB 4.34Å
527	L	72.7	Confident	58.1	Low	42 Å²	42	104.4 Å²	104.4	22%	0.22	57%	0.567	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.6	124.4	179.7	-72.7	179.9	0	0	0	107.2	P525 F536 I539 L544	P525-L527 PolarHBondContact O-N 2.85Å; L527-F536 PolarHBondContact N-O 3.41Å; L527-F536 VanDerWaalsContact N-O 3.1Å; L527-F536 PolarHBondContact O-N 3.47Å; L527-I539 HydrophobicContact CB-CG1 4.37Å; L527-I539 HydrophobicContact CD1-CG1 4.33Å; L527-I539 WeakPolarHBondContact CD1-O 3.41Å; L527-L544 HydrophobicContact CB-CD1 4.1Å; L527-L544 HydrophobicContact CB-CD2 3.94Å; L527-L544 HydrophobicContact CB-CG 4.43Å; L527-L544 HydrophobicContact CD1-CB 4.35Å; L527-L544 HydrophobicContact CD1-CD2 4.42Å
528	V	75.5	Confident	59.6	Low	80 Å²	80	99.9 Å²	99.9	49%	0.485	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.4	124.3	-175.1	-176.7	0	0	0	0	108.6	A526 S530 R533 E534	A526-V528 PolarHBondContact O-N 2.93Å; V528-S530 PolarHBondContact O-N 2.92Å; V528-R533 HydrophobicContact CG1-CB 4.45Å; V528-E534 WeakPolarHBondContact CA-O 3.34Å
529	C	79.8	Confident	61.7	Low	0 Å²	0	95.5 Å²	95.5	0%	0	52%	0.523	C	S	.	.	P	Polyproline II helix	trans	-65.4	130.9	174.4	174.1	0	0	0	0	110.3	H531 C532 R533 E534 F536 L544 H551	C529-H531 PolarHBondContact O-N 3.3Å; C529-H531 PolarHBondContact SG-N 2.86Å; C529-H531 VanDerWaalsContact SG-N 3.41Å; C529-C532 WeakPolarHBondContact CB-SG 3.49Å; C529-C532 PolarHBondContact SG-N 2.92Å; C529-R533 WeakPolarHBondContact O-CA 3.5Å; C529-R533 PolarHBondContact O-N 3.41Å; C529-E534 PolarHBondContact N-O 3.36Å; C529-E534 VanDerWaalsContact N-O 3.11Å; C529-F536 HydrophobicContact CB-CE2 4.27Å; C529-L544 HydrophobicContact CB-CD1 4.28Å; C529-H551 VanDerWaalsContact SG-CD2 3.59Å; C529-H551 PolarHBondContact SG-NE2 3.32Å
530	S	72.6	Confident	62.9	Low	78 Å²	78	90.5 Å²	90.5	55%	0.545	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-22.7	179.8	57.6	0	0	0	0	113.6	V528 E548	V528-S530 PolarHBondContact O-N 2.92Å; S530-E548 VanDerWaalsContact CB-OE1 3.31Å; S530-E548 WeakPolarHBondContact CB-OE1 3.47Å; S530-E548 PolarHBondContact N-OE1 3.25Å; S530-E548 PolarHBondContact OG-OE1 3.44Å
531	H	73.8	Confident	64.9	Low	69 Å²	69	93 Å²	93	32%	0.319	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-57.2	-178	-63.8	-60	0	0	0	112.5	C529 H551 I560	C529-H531 PolarHBondContact O-N 3.3Å; C529-H531 PolarHBondContact SG-N 2.86Å; C529-H531 VanDerWaalsContact SG-N 3.41Å; H531-H551 HydrophobicContact CB-CB 4.33Å; H531-I560 VanDerWaalsContact C-CD1 3.41Å; H531-I560 HydrophobicContact CB-CD1 3.63Å; H531-I560 HydrophobicContact CB-CG1 4.17Å; H531-I560 WeakPolarHBondContact O-CD1 3.49Å
532	C	76.1	Confident	66.2	Low	44 Å²	44	88.1 Å²	88.1	30%	0.297	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-10	-178	69.2	0	0	0	0	114.6	C529 E534 H547	C529-C532 WeakPolarHBondContact CB-SG 3.49Å; C529-C532 PolarHBondContact SG-N 2.92Å; C532-E534 HydrophobicContact CB-CG 4.36Å; C532-E534 PolarHBondContact O-N 2.94Å; C532-E534 VanDerWaalsContact O-N 3.12Å; C532-H547 PolarHBondContact SG-NE2 3.26Å
533	R	73.2	Confident	68.3	Low	210 Å²	210	84.7 Å²	84.7	79%	0.792	46%	0.464	S	S	*	.			trans	57.3	17	-176.4	-58.5	-174.5	177	176.3	-0.6	114.9	V528 C529	V528-R533 HydrophobicContact CG1-CB 4.45Å; C529-R533 WeakPolarHBondContact O-CA 3.5Å; C529-R533 PolarHBondContact O-N 3.41Å
534	E	74.8	Confident	70	Confident	116 Å²	116	77.5 Å²	77.5	54%	0.542	43%	0.425	S	S	.	.			trans	-78.8	140.7	173.6	-63.7	-164.5	164.2	0	0	111	V528 C529 C532 F536	V528-E534 WeakPolarHBondContact CA-O 3.34Å; C529-E534 PolarHBondContact N-O 3.36Å; C529-E534 VanDerWaalsContact N-O 3.11Å; C532-E534 HydrophobicContact CB-CG 4.36Å; C532-E534 PolarHBondContact O-N 2.94Å; C532-E534 VanDerWaalsContact O-N 3.12Å; E534-F536 HydrophobicContact CB-CE2 3.78Å; E534-F536 HydrophobicContact CB-CZ 3.77Å; E534-F536 WeakPolarHBondContact O-CD2 3.41Å; E534-F536 WeakPolarHBondContact O-CE2 3.4Å
535	S	70.3	Confident	71.6	Confident	73 Å²	73	74.7 Å²	74.7	51%	0.51	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	120.3	-176.2	70.6	0	0	0	0	110.6	P537	S535-P537 VanDerWaalsContact O-CD 3.31Å; S535-P537 WeakPolarHBondContact O-CD 3.28Å
536	F	72.8	Confident	72.7	Confident	53 Å²	53	75.6 Å²	75.6	23%	0.232	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	100.6	-177.5	-61.2	-80.2	0	0	0	110.6	L527 C529 E534 I539 L544 H547	L527-F536 PolarHBondContact N-O 3.41Å; L527-F536 VanDerWaalsContact N-O 3.1Å; L527-F536 PolarHBondContact O-N 3.47Å; C529-F536 HydrophobicContact CB-CE2 4.27Å; E534-F536 HydrophobicContact CB-CE2 3.78Å; E534-F536 HydrophobicContact CB-CZ 3.77Å; E534-F536 WeakPolarHBondContact O-CD2 3.41Å; E534-F536 WeakPolarHBondContact O-CE2 3.4Å; F536-I539 HydrophobicContact CB-CD1 3.37Å; F536-I539 HydrophobicContact CB-CG1 3.63Å; F536-I539 HydrophobicContact CB-CG2 4.25Å; F536-I539 HydrophobicContact CD2-CD1 4.15Å; F536-I539 HydrophobicContact CG-CD1 3.87Å; F536-L544 HydrophobicContact CD2-CD1 4.31Å; F536-H547 AromaticContact CE2-CD2 3.78Å; F536-H547 AromaticContact CE2-NE2 3.5Å; F536-H547 WeakPolarHBondContact CE2-NE2 3.35Å; F536-H547 AromaticContact CZ-CE1 3.81Å; F536-H547 AromaticContact CZ-NE2 3.67Å
537	P	62.9	Low	73.6	Confident	96 Å²	96	75.9 Å²	75.9	62%	0.623	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	125.6	174.8	27.5	-30.1	0	0	0	110.9	A526 S535	A526-P537 HydrophobicContact CB-CB 4.34Å; S535-P537 VanDerWaalsContact O-CD 3.31Å; S535-P537 WeakPolarHBondContact O-CD 3.28Å
538	G	64.1	Low	73.9	Confident	43 Å²	43	76 Å²	76	44%	0.443	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.3	4.9	171.8	0	0	0	0	0	116.5
539	I	72.5	Confident	73.8	Confident	53 Å²	53	79.4 Å²	79.4	27%	0.272	41%	0.411	S	S	.	.			trans	-87.7	150.9	169.8	67.8	168.9	0	0	0	111	L527 F536 E543 L544	L527-I539 HydrophobicContact CB-CG1 4.37Å; L527-I539 HydrophobicContact CD1-CG1 4.33Å; L527-I539 WeakPolarHBondContact CD1-O 3.41Å; F536-I539 HydrophobicContact CB-CD1 3.37Å; F536-I539 HydrophobicContact CB-CG1 3.63Å; F536-I539 HydrophobicContact CB-CG2 4.25Å; F536-I539 HydrophobicContact CD2-CD1 4.15Å; F536-I539 HydrophobicContact CG-CD1 3.87Å; I539-E543 HydrophobicContact CB-CB 4.13Å; I539-L544 HydrophobicContact CD1-CB 3.96Å; I539-L544 HydrophobicContact CD1-CD1 3.92Å
540	T	75.6	Confident	73.6	Confident	77 Å²	77	83 Å²	83	47%	0.472	44%	0.436	S	S	.	.			trans	-79.6	157.6	174.1	62.1	0	0	0	0	111.1	L542 E543 L544	T540-L542 PolarHBondContact O-N 3.25Å; T540-L542 VanDerWaalsContact O-N 3.17Å; T540-E543 PolarHBondContact N-OE2 3.42Å; T540-E543 WeakPolarHBondContact O-CB 3.38Å; T540-E543 PolarHBondContact O-N 2.88Å; T540-E543 VanDerWaalsContact OG1-CD 3.27Å; T540-E543 WeakPolarHBondContact OG1-CG 3.36Å; T540-E543 PolarHBondContact OG1-N 2.97Å; T540-E543 PolarHBondContact OG1-OE2 3.46Å; T540-L544 PolarHBondContact O-N 3.44Å
541	Q	71.7	Confident	73.9	Confident	98 Å²	98	80.3 Å²	80.3	46%	0.458	42%	0.415	S	S	.	.	H	α-helix	trans	-55.4	-34.3	177.4	-173.8	64.5	24.2	0	0	112.6	L544 E545	Q541-L544 PolarHBondContact O-N 2.85Å; Q541-E545 WeakPolarHBondContact O-CG 3.18Å; Q541-E545 PolarHBondContact O-N 3.36Å
542	L	72	Confident	74.1	Confident	108 Å²	108	81.8 Å²	81.8	57%	0.565	42%	0.418	S	S	*	.	H	α-helix	trans	-68.4	-35.2	177.1	-173.3	68.1	0	0	0	112.4	T540 Q546	T540-L542 PolarHBondContact O-N 3.25Å; T540-L542 VanDerWaalsContact O-N 3.17Å; L542-Q546 WeakPolarHBondContact O-CG 3.45Å; L542-Q546 PolarHBondContact O-N 2.84Å
543	E	75.2	Confident	74.3	Confident	95 Å²	95	81.7 Å²	81.7	44%	0.444	42%	0.416	S	S	.	.	H	α-helix	trans	-73.2	-33.5	175.1	-70.9	164	147.9	0	0	111.3	I539 T540 Q546 H547	I539-E543 HydrophobicContact CB-CB 4.13Å; T540-E543 PolarHBondContact N-OE2 3.42Å; T540-E543 WeakPolarHBondContact O-CB 3.38Å; T540-E543 PolarHBondContact O-N 2.88Å; T540-E543 VanDerWaalsContact OG1-CD 3.27Å; T540-E543 WeakPolarHBondContact OG1-CG 3.36Å; T540-E543 PolarHBondContact OG1-N 2.97Å; T540-E543 PolarHBondContact OG1-OE2 3.46Å; E543-Q546 PolarHBondContact O-N 3.25Å; E543-H547 WeakPolarHBondContact O-CB 3.46Å; E543-H547 PolarHBondContact O-N 3.49Å
544	L	78.8	Confident	74.6	Confident	7 Å²	7	71.7 Å²	71.7	4%	0.037	38%	0.379	C	S	.	.	H	α-helix	trans	-64.8	-44.7	170.5	-173.5	75.8	0	0	0	111.2	L527 C529 F536 I539 T540 Q541 Q546 H547 E548	L527-L544 HydrophobicContact CB-CD1 4.1Å; L527-L544 HydrophobicContact CB-CD2 3.94Å; L527-L544 HydrophobicContact CB-CG 4.43Å; L527-L544 HydrophobicContact CD1-CB 4.35Å; L527-L544 HydrophobicContact CD1-CD2 4.42Å; C529-L544 HydrophobicContact CB-CD1 4.28Å; F536-L544 HydrophobicContact CD2-CD1 4.31Å; I539-L544 HydrophobicContact CD1-CB 3.96Å; I539-L544 HydrophobicContact CD1-CD1 3.92Å; T540-L544 PolarHBondContact O-N 3.44Å; Q541-L544 PolarHBondContact O-N 2.85Å; L544-Q546 VanDerWaalsContact C-N 3.33Å; L544-Q546 PolarHBondContact O-N 3.29Å; L544-H547 CarbonylContact O-C 3.57Å; L544-H547 WeakPolarHBondContact O-CB 3.37Å; L544-H547 PolarHBondContact O-N 3.18Å; L544-H547 VanDerWaalsContact O-N 3.13Å; L544-E548 WeakPolarHBondContact O-CG 3.22Å; L544-E548 PolarHBondContact O-N 3.37Å
545	E	75.8	Confident	74.7	Confident	80 Å²	80	70.6 Å²	70.6	37%	0.374	38%	0.382	S	S	.	.	H	α-helix	trans	-63.2	-37.4	177.1	-77.3	172.2	-167	0	0	112.3	Q541 H547 E548 Q549	Q541-E545 WeakPolarHBondContact O-CG 3.18Å; Q541-E545 PolarHBondContact O-N 3.36Å; E545-H547 VanDerWaalsContact C-N 3.34Å; E545-E548 PolarHBondContact O-N 3.08Å; E545-Q549 WeakPolarHBondContact O-CB 3.36Å; E545-Q549 WeakPolarHBondContact O-CG 3.29Å; E545-Q549 PolarHBondContact O-N 3Å
546	Q	76.9	Confident	75.1	Confident	122 Å²	122	73.7 Å²	73.7	57%	0.57	39%	0.386	S	S	*	.	H	α-helix	trans	-65.6	-37.9	172.7	-76.6	177.8	17.2	0	0	112.2	L542 E543 L544 S550	L542-Q546 WeakPolarHBondContact O-CG 3.45Å; L542-Q546 PolarHBondContact O-N 2.84Å; E543-Q546 PolarHBondContact O-N 3.25Å; L544-Q546 VanDerWaalsContact C-N 3.33Å; L544-Q546 PolarHBondContact O-N 3.29Å; Q546-S550 PolarHBondContact O-N 3.4Å; Q546-S550 VanDerWaalsContact O-N 3.14Å
547	H	79.7	Confident	75.6	Confident	49 Å²	49	72.9 Å²	72.9	23%	0.227	39%	0.387	C	S	.	.	H	α-helix	trans	-67	-42.7	173.3	173.4	73.3	0	0	0	111.5	C532 F536 E543 L544 E545 Q549 S550 H551	C532-H547 PolarHBondContact SG-NE2 3.26Å; F536-H547 AromaticContact CE2-CD2 3.78Å; F536-H547 AromaticContact CE2-NE2 3.5Å; F536-H547 WeakPolarHBondContact CE2-NE2 3.35Å; F536-H547 AromaticContact CZ-CE1 3.81Å; F536-H547 AromaticContact CZ-NE2 3.67Å; E543-H547 WeakPolarHBondContact O-CB 3.46Å; E543-H547 PolarHBondContact O-N 3.49Å; L544-H547 CarbonylContact O-C 3.57Å; L544-H547 WeakPolarHBondContact O-CB 3.37Å; L544-H547 PolarHBondContact O-N 3.18Å; L544-H547 VanDerWaalsContact O-N 3.13Å; E545-H547 VanDerWaalsContact C-N 3.34Å; H547-Q549 VanDerWaalsContact C-N 3.31Å; H547-Q549 PolarHBondContact O-N 2.82Å; H547-S550 WeakPolarHBondContact O-CB 3.34Å; H547-S550 PolarHBondContact O-N 3.45Å; H547-S550 PolarHBondContact O-OG 3.5Å; H547-H551 AromaticContact CD2-NE2 3.89Å; H547-H551 AromaticContact CE1-NE2 3.77Å; H547-H551 AromaticContact NE2-CE1 4Å; H547-H551 AromaticContact NE2-NE2 3.32Å; H547-H551 PolarHBondContact NE2-NE2 2.85Å
548	E	77.5	Confident	76.1	Confident	45 Å²	45	73.7 Å²	73.7	21%	0.21	39%	0.39	C	S	.	.	H	α-helix	trans	-61.9	-38.9	176	-74.9	-175.4	148	0	0	112.2	S530 L544 E545 S550 H551	S530-E548 VanDerWaalsContact CB-OE1 3.31Å; S530-E548 WeakPolarHBondContact CB-OE1 3.47Å; S530-E548 PolarHBondContact N-OE1 3.25Å; S530-E548 PolarHBondContact OG-OE1 3.44Å; L544-E548 WeakPolarHBondContact O-CG 3.22Å; L544-E548 PolarHBondContact O-N 3.37Å; E545-E548 PolarHBondContact O-N 3.08Å; E548-S550 PolarHBondContact O-N 3.03Å; E548-H551 WeakPolarHBondContact O-CB 3.45Å; E548-H551 PolarHBondContact O-N 2.98Å
549	Q	74.1	Confident	76.8	Confident	151 Å²	151	76.3 Å²	76.3	71%	0.706	39%	0.392	S	S	*	.	H	α-helix	trans	-71.6	-15.2	173.9	-71	169.3	36.3	0	0	113.8	E545 H547 H551	E545-Q549 WeakPolarHBondContact O-CB 3.36Å; E545-Q549 WeakPolarHBondContact O-CG 3.29Å; E545-Q549 PolarHBondContact O-N 3Å; H547-Q549 VanDerWaalsContact C-N 3.31Å; H547-Q549 PolarHBondContact O-N 2.82Å; Q549-H551 VanDerWaalsContact C-N 3.29Å
550	S	75.4	Confident	77	Confident	75 Å²	75	77 Å²	77	52%	0.524	40%	0.395	S	S	.	.	H	α-helix	trans	-78.5	-16.2	174.2	79.8	0	0	0	0	112.7	Q546 H547 E548	Q546-S550 PolarHBondContact O-N 3.4Å; Q546-S550 VanDerWaalsContact O-N 3.14Å; H547-S550 WeakPolarHBondContact O-CB 3.34Å; H547-S550 PolarHBondContact O-N 3.45Å; H547-S550 PolarHBondContact O-OG 3.5Å; E548-S550 PolarHBondContact O-N 3.03Å
551	H	78.2	Confident	77.2	Confident	22 Å²	22	73.4 Å²	73.4	10%	0.102	37%	0.373	C	S	.	.	S	Bend	trans	-74	128.6	175	-68.4	-62.1	0	0	0	111.4	C529 H531 H547 E548 Q549 V553 I560 D562	C529-H551 VanDerWaalsContact SG-CD2 3.59Å; C529-H551 PolarHBondContact SG-NE2 3.32Å; H531-H551 HydrophobicContact CB-CB 4.33Å; H547-H551 AromaticContact CD2-NE2 3.89Å; H547-H551 AromaticContact CE1-NE2 3.77Å; H547-H551 AromaticContact NE2-CE1 4Å; H547-H551 AromaticContact NE2-NE2 3.32Å; H547-H551 PolarHBondContact NE2-NE2 2.85Å; E548-H551 WeakPolarHBondContact O-CB 3.45Å; E548-H551 PolarHBondContact O-N 2.98Å; Q549-H551 VanDerWaalsContact C-N 3.29Å; H551-V553 HydrophobicContact CB-CG2 4.01Å; H551-V553 PolarHBondContact O-N 2.85Å; H551-V553 VanDerWaalsContact O-N 3.15Å; H551-I560 HydrophobicContact CB-CG2 4.39Å; H551-D562 WeakPolarHBondContact CA-OD1 3.46Å; H551-D562 IonicContact CE1-OD2 2.64Å; H551-D562 PolarHBondContact CE1-OD2 3.39Å; H551-D562 IonicContact CG-OD2 3.03Å; H551-D562 IonicContact ND1-OD1 3.73Å; H551-D562 IonicContact ND1-OD2 3.27Å; H551-D562 PolarHBondContact ND1-OD2 3.39Å
552	R	78.9	Confident	77.5	Confident	100 Å²	100	71.2 Å²	71.2	38%	0.377	37%	0.365	S	S	.	.			trans	-82.2	86.7	174	-70.9	176.8	171.6	-146.4	-16.1	109.3	C561 D562	R552-C561 HydrophobicContact CB-CB 4.37Å; R552-C561 WeakPolarHBondContact O-CA 3.26Å; R552-C561 VanDerWaalsContact O-CB 3.31Å; R552-C561 WeakPolarHBondContact O-CB 3.22Å; R552-C561 PolarHBondContact O-N 3.01Å; R552-D562 PolarHBondContact N-OD1 3.4Å
553	V	80.3	Confident	77.4	Confident	43 Å²	43	76 Å²	76	26%	0.261	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-94.4	130.3	-178.9	-172.8	0	0	0	0	110.7	H551 M559 I560	H551-V553 HydrophobicContact CB-CG2 4.01Å; H551-V553 PolarHBondContact O-N 2.85Å; H551-V553 VanDerWaalsContact O-N 3.15Å; V553-M559 WeakPolarHBondContact CA-O 3.49Å; V553-I560 HydrophobicContact CG2-CG1 4.26Å
554	C	79.6	Confident	77.5	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	37%	0.374	C	S	.	.			trans	-68.1	125.2	172.8	177.9	0	0	0	0	110.3	F556 T558 M559 H572	C554-F556 PolarHBondContact O-N 2.93Å; C554-T558 VanDerWaalsContact O-CA 3.27Å; C554-T558 WeakPolarHBondContact O-CA 3.39Å; C554-T558 PolarHBondContact O-N 2.93Å; C554-M559 PolarHBondContact N-O 3.36Å; C554-H572 PolarHBondContact SG-NE2 2.86Å; C554-H572 VanDerWaalsContact SG-NE2 3.38Å
555	P	77.6	Confident	77.4	Confident	93 Å²	93	80.7 Å²	80.7	60%	0.604	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-16.1	-174.7	25.3	-32.2	0	0	0	114.2
556	F	78.3	Confident	77.5	Confident	137 Å²	137	81 Å²	81	60%	0.601	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-34	-175.4	-61.2	-71.9	0	0	0	113.8	C554 V573 H576	C554-F556 PolarHBondContact O-N 2.93Å; F556-V573 HydrophobicContact CD2-CG1 4.19Å; F556-V573 HydrophobicContact CE2-CG1 3.93Å; F556-H576 HydrophobicContact CB-CB 3.85Å; F556-H576 HydrophobicContact CD2-CB 4Å; F556-H576 HydrophobicContact CG-CB 4Å
557	C	82.7	Confident	77.7	Confident	37 Å²	37	78.2 Å²	78.2	25%	0.25	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120	1	-179.3	68.8	0	0	0	0	114.5	M559 H572 H576	C557-M559 PolarHBondContact O-N 3.44Å; C557-M559 VanDerWaalsContact O-N 3.08Å; C557-H572 PolarHBondContact SG-NE2 3.21Å; C557-H576 WeakPolarHBondContact CB-NE2 3.28Å; C557-H576 PolarHBondContact SG-NE2 2.98Å; C557-H576 VanDerWaalsContact SG-NE2 3.38Å
558	T	73.8	Confident	77.6	Confident	112 Å²	112	80.1 Å²	80.1	69%	0.687	41%	0.41	S	S	*	.			trans	60.2	13.8	178	64.4	0	0	0	0	115.3	C554	C554-T558 VanDerWaalsContact O-CA 3.27Å; C554-T558 WeakPolarHBondContact O-CA 3.39Å; C554-T558 PolarHBondContact O-N 2.93Å
559	M	77.9	Confident	77.8	Confident	98 Å²	98	79.6 Å²	79.6	48%	0.483	41%	0.407	S	S	.	.			trans	-68.9	139.9	173.1	-71.7	-148.8	-60.4	0	0	111.1	V553 C554 C557	V553-M559 WeakPolarHBondContact CA-O 3.49Å; C554-M559 PolarHBondContact N-O 3.36Å; C557-M559 PolarHBondContact O-N 3.44Å; C557-M559 VanDerWaalsContact O-N 3.08Å
560	I	77.9	Confident	78.2	Confident	68 Å²	68	76.5 Å²	76.5	35%	0.349	39%	0.393	S	S	.	.	B	Isolated β-bridge	trans	-89.2	120.1	176.7	-58	159.1	0	0	0	108.2	H531 H551 V553 D562	H531-I560 VanDerWaalsContact C-CD1 3.41Å; H531-I560 HydrophobicContact CB-CD1 3.63Å; H531-I560 HydrophobicContact CB-CG1 4.17Å; H531-I560 WeakPolarHBondContact O-CD1 3.49Å; H551-I560 HydrophobicContact CB-CG2 4.39Å; V553-I560 HydrophobicContact CG2-CG1 4.26Å; I560-D562 WeakPolarHBondContact CG2-OD2 3.44Å
561	C	78.6	Confident	78.6	Confident	1 Å²	1	78.6 Å²	78.6	1%	0.007	40%	0.398	C	S	.	.			trans	-115.8	26	-168.3	-58.1	0	0	0	0	112.9	R552 F563 M564 F569	R552-C561 HydrophobicContact CB-CB 4.37Å; R552-C561 WeakPolarHBondContact O-CA 3.26Å; R552-C561 VanDerWaalsContact O-CB 3.31Å; R552-C561 WeakPolarHBondContact O-CB 3.22Å; R552-C561 PolarHBondContact O-N 3.01Å; C561-F563 PolarHBondContact O-N 2.88Å; C561-F563 VanDerWaalsContact O-N 3.11Å; C561-M564 HydrophobicContact CB-CB 4.34Å; C561-M564 HydrophobicContact CB-CE 3.86Å; C561-M564 HydrophobicContact CB-CG 4.12Å; C561-M564 HydrophobicContact CB-SD 3.86Å; C561-M564 WeakPolarHBondContact O-CB 3.44Å; C561-M564 PolarHBondContact O-N 3.21Å; C561-M564 WeakPolarHBondContact SG-CE 3.4Å; C561-F569 HydrophobicContact CB-CD2 3.54Å; C561-F569 HydrophobicContact CB-CE2 4.02Å
562	D	77.6	Confident	78.8	Confident	53 Å²	53	79.6 Å²	79.6	28%	0.283	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-30.1	-173.7	-57.1	-23.3	0	0	0	114.3	H551 R552 I560	H551-D562 WeakPolarHBondContact CA-OD1 3.46Å; H551-D562 IonicContact CE1-OD2 2.64Å; H551-D562 PolarHBondContact CE1-OD2 3.39Å; H551-D562 IonicContact CG-OD2 3.03Å; H551-D562 IonicContact ND1-OD1 3.73Å; H551-D562 IonicContact ND1-OD2 3.27Å; H551-D562 PolarHBondContact ND1-OD2 3.39Å; R552-D562 PolarHBondContact N-OD1 3.4Å; I560-D562 WeakPolarHBondContact CG2-OD2 3.44Å
563	F	70.6	Confident	79	Confident	207 Å²	207	76.4 Å²	76.4	91%	0.908	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	0.8	-178.9	-55.4	-75.7	0	0	0	113.4	C561	C561-F563 PolarHBondContact O-N 2.88Å; C561-F563 VanDerWaalsContact O-N 3.11Å
564	M	76.5	Confident	79.2	Confident	62 Å²	62	83.3 Å²	83.3	31%	0.305	42%	0.417	S	S	.	.	S	Bend	trans	-87.3	137.6	178.2	-62.1	-172	-153.3	0	0	111	C561 I568	C561-M564 HydrophobicContact CB-CB 4.34Å; C561-M564 HydrophobicContact CB-CE 3.86Å; C561-M564 HydrophobicContact CB-CG 4.12Å; C561-M564 HydrophobicContact CB-SD 3.86Å; C561-M564 WeakPolarHBondContact O-CB 3.44Å; C561-M564 PolarHBondContact O-N 3.21Å; C561-M564 WeakPolarHBondContact SG-CE 3.4Å; M564-I568 HydrophobicContact SD-CG2 4.2Å
565	E	77.3	Confident	79.2	Confident	140 Å²	140	86.5 Å²	86.5	65%	0.654	45%	0.45	S	S	*	.			trans	-59.9	147	166.9	-69.9	-173.9	171.7	0	0	110.3	S567 I568 F569	E565-S567 PolarHBondContact O-N 3.45Å; E565-S567 VanDerWaalsContact O-N 3.14Å; E565-I568 HydrophobicContact CB-CD1 4.26Å; E565-I568 HydrophobicContact CB-CG1 4.4Å; E565-I568 PolarHBondContact O-N 3.32Å; E565-F569 PolarHBondContact O-N 3.22Å
566	Q	77.8	Confident	79.1	Confident	86 Å²	86	88.5 Å²	88.5	40%	0.402	45%	0.451	S	S	.	.	H	α-helix	trans	-52.1	-40.5	-174.2	-174.7	68.2	27.2	0	0	113	F569 E570	Q566-F569 PolarHBondContact O-N 2.86Å; Q566-E570 WeakPolarHBondContact CG-OE1 3.46Å; Q566-E570 PolarHBondContact NE2-OE1 2.96Å; Q566-E570 WeakPolarHBondContact O-CG 3.47Å; Q566-E570 PolarHBondContact O-N 3.4Å
567	S	80.6	Confident	79.1	Confident	64 Å²	64	86.1 Å²	86.1	45%	0.448	44%	0.444	S	S	.	.	H	α-helix	trans	-62.5	-42	177.4	45.8	0	0	0	0	112.8	E565 E570 D571	E565-S567 PolarHBondContact O-N 3.45Å; E565-S567 VanDerWaalsContact O-N 3.14Å; S567-E570 PolarHBondContact O-N 3.05Å; S567-D571 WeakPolarHBondContact O-CB 3.19Å; S567-D571 PolarHBondContact O-N 3.48Å
568	I	78.4	Confident	78.9	Confident	88 Å²	88	88.6 Å²	88.6	45%	0.451	45%	0.454	S	S	.	.	H	α-helix	trans	-71.2	-36.4	-179.4	-57.9	175.9	0	0	0	110.5	M564 E565 H572	M564-I568 HydrophobicContact SD-CG2 4.2Å; E565-I568 HydrophobicContact CB-CD1 4.26Å; E565-I568 HydrophobicContact CB-CG1 4.4Å; E565-I568 PolarHBondContact O-N 3.32Å; I568-H572 VanDerWaalsContact O-CB 3.29Å; I568-H572 WeakPolarHBondContact O-CB 3.36Å; I568-H572 PolarHBondContact O-N 2.78Å
569	F	81	Confident	79.2	Confident	35 Å²	35	87.3 Å²	87.3	15%	0.154	44%	0.441	C	S	.	.	H	α-helix	trans	-64.4	-44.9	173.5	174.5	-104.7	0	0	0	111.7	C561 E565 Q566 H572 V573	C561-F569 HydrophobicContact CB-CD2 3.54Å; C561-F569 HydrophobicContact CB-CE2 4.02Å; E565-F569 PolarHBondContact O-N 3.22Å; Q566-F569 PolarHBondContact O-N 2.86Å; F569-H572 WeakPolarHBondContact O-CB 3.22Å; F569-H572 PolarHBondContact O-N 3.48Å; F569-V573 HydrophobicContact CD1-CG2 4.48Å; F569-V573 HydrophobicContact CD2-CG2 4.34Å; F569-V573 HydrophobicContact CE1-CG2 4.07Å; F569-V573 HydrophobicContact CE2-CG2 3.93Å; F569-V573 HydrophobicContact CZ-CG2 3.78Å; F569-V573 WeakPolarHBondContact O-CG2 3.27Å; F569-V573 PolarHBondContact O-N 2.79Å
570	E	82.9	Confident	79.3	Confident	85 Å²	85	86.7 Å²	86.7	40%	0.397	44%	0.438	S	S	.	.	H	α-helix	trans	-63.2	-46.7	176.9	-74.6	172.4	-164.3	0	0	111.3	Q566 S567 H572 V573 Y574	Q566-E570 WeakPolarHBondContact CG-OE1 3.46Å; Q566-E570 PolarHBondContact NE2-OE1 2.96Å; Q566-E570 WeakPolarHBondContact O-CG 3.47Å; Q566-E570 PolarHBondContact O-N 3.4Å; S567-E570 PolarHBondContact O-N 3.05Å; E570-H572 VanDerWaalsContact C-N 3.26Å; E570-H572 PolarHBondContact O-N 3.36Å; E570-V573 PolarHBondContact O-N 2.83Å; E570-V573 VanDerWaalsContact O-N 3.13Å; E570-Y574 HydrophobicContact CB-CD2 4.3Å; E570-Y574 HydrophobicContact CB-CE2 4.28Å; E570-Y574 WeakPolarHBondContact O-CB 3.39Å; E570-Y574 WeakPolarHBondContact O-CD2 3.44Å; E570-Y574 PolarHBondContact O-N 3.23Å
571	D	83.6	Confident	79.4	Confident	119 Å²	119	87.9 Å²	87.9	64%	0.636	44%	0.444	S	S	*	.	H	α-helix	trans	-58.5	-37.9	174.8	-77.7	-12.5	0	0	0	112.3	S567 G575	S567-D571 WeakPolarHBondContact O-CB 3.19Å; S567-D571 PolarHBondContact O-N 3.48Å; D571-G575 PolarHBondContact O-N 3.25Å
572	H	82.6	Confident	79.4	Confident	44 Å²	44	93.7 Å²	93.7	20%	0.204	47%	0.473	C	S	.	.	H	α-helix	trans	-66.7	-41.5	175.6	172.3	64.8	0	0	0	112.5	C554 C557 I568 F569 E570 G575 H576	C554-H572 PolarHBondContact SG-NE2 2.86Å; C554-H572 VanDerWaalsContact SG-NE2 3.38Å; C557-H572 PolarHBondContact SG-NE2 3.21Å; I568-H572 VanDerWaalsContact O-CB 3.29Å; I568-H572 WeakPolarHBondContact O-CB 3.36Å; I568-H572 PolarHBondContact O-N 2.78Å; F569-H572 WeakPolarHBondContact O-CB 3.22Å; F569-H572 PolarHBondContact O-N 3.48Å; E570-H572 VanDerWaalsContact C-N 3.26Å; E570-H572 PolarHBondContact O-N 3.36Å; H572-G575 PolarHBondContact O-N 3.06Å; H572-H576 AromaticContact CE1-NE2 3.59Å; H572-H576 AromaticContact NE2-NE2 3.95Å
573	V	82.7	Confident	79.5	Confident	33 Å²	33	96.6 Å²	96.6	20%	0.2	49%	0.487	C	S	.	.	H	α-helix	trans	-70.5	-39	177.4	174.6	0	0	0	0	111.3	F556 F569 E570 G575 H576	F556-V573 HydrophobicContact CD2-CG1 4.19Å; F556-V573 HydrophobicContact CE2-CG1 3.93Å; F569-V573 HydrophobicContact CD1-CG2 4.48Å; F569-V573 HydrophobicContact CD2-CG2 4.34Å; F569-V573 HydrophobicContact CE1-CG2 4.07Å; F569-V573 HydrophobicContact CE2-CG2 3.93Å; F569-V573 HydrophobicContact CZ-CG2 3.78Å; F569-V573 WeakPolarHBondContact O-CG2 3.27Å; F569-V573 PolarHBondContact O-N 2.79Å; E570-V573 PolarHBondContact O-N 2.83Å; E570-V573 VanDerWaalsContact O-N 3.13Å; V573-G575 VanDerWaalsContact C-N 3.27Å; V573-G575 PolarHBondContact O-N 2.8Å; V573-H576 PolarHBondContact O-N 2.8Å
574	Y	85.3	Confident	80.2	Confident	187 Å²	187	88.1 Å²	88.1	73%	0.733	45%	0.454	S	S	*	.	H	α-helix	trans	-72	-19.3	174.8	-77.3	-64.7	0	0	0	113.7	E570 H576	E570-Y574 HydrophobicContact CB-CD2 4.3Å; E570-Y574 HydrophobicContact CB-CE2 4.28Å; E570-Y574 WeakPolarHBondContact O-CB 3.39Å; E570-Y574 WeakPolarHBondContact O-CD2 3.44Å; E570-Y574 PolarHBondContact O-N 3.23Å; Y574-H576 VanDerWaalsContact C-N 3.34Å
575	G	78.6	Confident	80.5	Confident	68 Å²	68	90.3 Å²	90.3	70%	0.701	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-15.8	176.1	0	0	0	0	0	114.4	D571 H572 V573	D571-G575 PolarHBondContact O-N 3.25Å; H572-G575 PolarHBondContact O-N 3.06Å; V573-G575 VanDerWaalsContact C-N 3.27Å; V573-G575 PolarHBondContact O-N 2.8Å
576	H	75.8	Confident	80.8	Confident	134 Å²	134	85.7 Å²	85.7	62%	0.62	45%	0.45	S	S	*	.			trans	-84.1	0	166.9	-79.9	-65.8	0	0	0	110.3	F556 C557 H572 V573 Y574	F556-H576 HydrophobicContact CB-CB 3.85Å; F556-H576 HydrophobicContact CD2-CB 4Å; F556-H576 HydrophobicContact CG-CB 4Å; C557-H576 WeakPolarHBondContact CB-NE2 3.28Å; C557-H576 PolarHBondContact SG-NE2 2.98Å; C557-H576 VanDerWaalsContact SG-NE2 3.38Å; H572-H576 AromaticContact CE1-NE2 3.59Å; H572-H576 AromaticContact NE2-NE2 3.95Å; V573-H576 PolarHBondContact O-N 2.8Å; Y574-H576 VanDerWaalsContact C-N 3.34Å

Retrieved 576 of 576 residues in 192.2 ms (Link to these results)

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