A0A3Q0KMG9_SCHMA Loading...

Putative forkhead protein/ forkhead protein domain

AlphaFold DB , UniProt , Accession A0A3Q0KMG9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 976 aa.

						>A0A3Q0KMG9_SCHMA|A0A3Q0KMG9
MPDRRLMIDNKRLSTKITGPSCTVVSDKSVVIVGRKSHIPVDVCLDDSECVSRKHLEIHRKNKDIYLRCLSKNGIFIDGSFHVGKPDFVLLADGCKLRFPSTNIVIIVEVVELEPFCHPKKRASWRSSLDHTNRGEPTLSTDQNNRNMTDPVISPILKSKGFEENSHSSFCFESENCRNTPEERHDVSCNNLKIDNQNTISDLSLNSLQGSATSNCALLPVEPLFVQTDQHFNIPAIRAATTVLQNLIQNDNQPKSLNIDGESLFQSENSDVTTKMNHIARLFAFNSLAQLSQLNAHKSSTLTLSNLVNFPSHQLYDSRSTEHNCSTFDHGLSDLMKNPFVLSSNSPESQFKKSDIIEQNTLTVDDLDDTVDSSVVAVHQDITTYCNDHRNDDGNNNNTCSTQENESTINKLAANLASTTAIDRGSTFRKPPYSYAQLIIQAIASAPNQRLTLADIYAHISKTFPYYKPHEKGWQNSIRHNLSLNRYFIRVPRSQSEPGKGAFWQLDPYCETCLVSQAFRKRRQTSSKSSSSADSNQTNNANNNVNDDSNNNQNQYDDDDDDVDDEEQQYQEKKGEQMNVLSDNINNKNNIDNHTIDVNNSAFPVTSRELFFNDNSQHNPLNNNTYISNNSNTSASQYVFVQSNYCLKQPNHHLQNIQSLLHPHSLCLSNSLSSLSTPSSPSSVMLSSSGDQQQQYQDESGAVLPYSNGLSTVNGDRKLQSHPPTRTMILSHDLDTAALLANHSNSNINSNMNLGFKQILNGGNNISDSIQEDSHCLTTKLSVPSDFNNNLPSFLLPVSPNFNWGALNNNQEWLRLANIGCDNLSSSSLTAFHELWQLSDREFRKNNLFLASQLVKAHQNLNNLTLSTNNDGIITKNENIRNSTHEESFSTSDVPTDLSATTNINDFPLNRKHRHTDQLSISPISISSALSPPFWASKCSRSPEEEVEQEQADKHKETTMKNHFFLNPTTFYVMQS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	41	Very low	226 Å²	226	163.8 Å²	163.8	100%	1.113	80%	0.796	S	S	*	*				0	103.2	0	-75.6	-66.7	177.6	0	0	107.3
2	P	38	Very low	43.6	Very low	122 Å²	122	162.3 Å²	162.3	79%	0.792	78%	0.776	S	S	*	*			trans	-69.2	162.1	173.3	31	-34.6	0	0	0	111.1	R4	P2-R4 PolarHBondContact O-N 3.43Å
3	D	35.5	Very low	46.6	Very low	120 Å²	120	152.2 Å²	152.2	64%	0.642	73%	0.729	S	S	*	*			trans	-61.6	123.4	-165.8	-94.8	-74.9	0	0	0	115.5	R5	D3-R5 PolarHBondContact O-N 3.21Å
4	R	41.4	Very low	49.4	Very low	217 Å²	217	141.4 Å²	141.4	82%	0.819	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	5	165.9	-70.8	-168.5	178.8	-170.4	2.8	113.5	P2	P2-R4 PolarHBondContact O-N 3.43Å
5	R	40.1	Very low	52.1	Low	218 Å²	218	132 Å²	132	82%	0.823	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-0.7	-177.8	-85.5	-177.8	166.6	167.5	-4.5	115.3	D3	D3-R5 PolarHBondContact O-N 3.21Å
6	L	35.3	Very low	54.6	Low	158 Å²	158	125.1 Å²	125.1	83%	0.827	60%	0.599	S	S	*	*	S	Bend	trans	-114.7	20.2	175.9	-67.4	174	0	0	0	113.6
7	M	32.6	Very low	56.8	Low	178 Å²	178	117.9 Å²	117.9	88%	0.877	56%	0.564	S	S	*	*	S	Bend	trans	-116.3	26.2	173.5	-78.9	-167.1	154.2	0	0	113
8	I	38.7	Very low	58.8	Low	133 Å²	133	112.4 Å²	112.4	68%	0.682	54%	0.539	S	S	*	.	S	Bend	trans	-131.2	91.9	175.1	-54	173.3	0	0	0	106.2
9	D	42.7	Very low	60.3	Low	150 Å²	150	107.5 Å²	107.5	80%	0.802	52%	0.521	S	S	*	.			trans	168.7	-14	157.4	-93.2	-14.4	0	0	0	113.3	K11	D9-K11 PolarHBondContact O-N 2.56Å
10	N	47.3	Very low	61.4	Low	167 Å²	167	106.9 Å²	106.9	89%	0.893	53%	0.526	S	S	*	.			trans	-71.8	67.6	173.1	-77.8	-4.9	0	0	0	112.5	R12	N10-R12 PolarHBondContact O-N 2.93Å
11	K	61.8	Low	62.1	Low	113 Å²	113	104.7 Å²	104.7	49%	0.491	52%	0.521	S	S	.	.			trans	-60.7	125.7	168.5	-74.7	-174	163.1	-169.9	0	110.2	D9 L13 E112	D9-K11 PolarHBondContact O-N 2.56Å; K11-L13 PolarHBondContact O-N 2.77Å; K11-E112 VanDerWaalsContact CD-OE2 3.27Å; K11-E112 WeakPolarHBondContact CD-OE2 3.13Å; K11-E112 WeakPolarHBondContact CE-OE2 3.38Å; K11-E112 IonicContact NZ-OE2 2.68Å; K11-E112 PolarHBondContact NZ-OE2 3.13Å
12	R	71.8	Confident	64.2	Low	146 Å²	146	94.4 Å²	94.4	55%	0.551	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	84.5	-175.9	-176.4	168.9	173.4	148.4	-8.5	110.6	N10 S14 D27 L113	N10-R12 PolarHBondContact O-N 2.93Å; R12-S14 PolarHBondContact O-N 2.7Å; R12-S14 PolarHBondContact O-OG 2.94Å; R12-D27 IonicContact CZ-OD1 2.86Å; R12-D27 IonicContact CZ-OD2 3.92Å; R12-D27 VanDerWaalsContact NE-CG 3.34Å; R12-D27 IonicContact NE-OD1 3.7Å; R12-D27 PolarHBondContact NE-OD1 3.47Å; R12-D27 IonicContact NE-OD2 2.7Å; R12-D27 PolarHBondContact NE-OD2 2.95Å; R12-D27 IonicContact NH2-OD1 3.92Å; R12-D27 PolarHBondContact NH2-OD1 2.83Å; R12-D27 IonicContact NH2-OD2 3.36Å; R12-D27 PolarHBondContact NH2-OD2 3.37Å; R12-L113 HydrophobicContact CB-CB 4.28Å; R12-L113 PolarHBondContact N-O 3.21Å; R12-L113 WeakPolarHBondContact O-CB 3.34Å; R12-L113 PolarHBondContact O-N 2.83Å
13	L	82.4	Confident	66.7	Low	31 Å²	31	90.3 Å²	90.3	16%	0.162	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	134.7	170.7	-59.4	177.6	0	0	0	110.2	K11 R60 N62 K63 V110 V111 E112	K11-L13 PolarHBondContact O-N 2.77Å; L13-R60 VanDerWaalsContact C-NH1 3.35Å; L13-R60 PolarHBondContact O-NH1 2.91Å; L13-R60 PolarHBondContact O-NH2 3.15Å; L13-N62 WeakPolarHBondContact CD1-O 3.47Å; L13-K63 HydrophobicContact CD1-CG 3.59Å; L13-V110 HydrophobicContact CB-CG1 4.21Å; L13-V110 HydrophobicContact CD2-CG1 4.06Å; L13-V111 WeakPolarHBondContact CA-O 3.42Å; L13-E112 HydrophobicContact CD2-CB 4.24Å; L13-E112 HydrophobicContact CD2-CG 3.67Å
14	S	85.9	Confident	69.2	Low	0 Å²	0	84.8 Å²	84.8	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	151.9	-179.2	-57.4	0	0	0	0	110.4	R12 D27 V110 V111 L113	R12-S14 PolarHBondContact O-N 2.7Å; R12-S14 PolarHBondContact O-OG 2.94Å; S14-D27 PolarHBondContact OG-OD1 3.24Å; S14-V110 WeakPolarHBondContact O-CA 3.16Å; S14-V111 PolarHBondContact N-O 3.36Å; S14-V111 PolarHBondContact O-N 3.19Å; S14-L113 WeakPolarHBondContact OG-CD1 3.21Å; S14-L113 WeakPolarHBondContact OG-CG 3.36Å
15	T	89.9	Confident	71.6	Confident	1 Å²	1	76.6 Å²	76.6	1%	0.006	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	122.8	171.4	-53	0	0	0	0	109.1	I17 S26 I58 R60 I65 V108	T15-I17 HydrophobicContact CG2-CD1 4.48Å; T15-I17 HydrophobicContact CG2-CG1 4.11Å; T15-S26 PolarHBondContact N-O 3.33Å; T15-S26 PolarHBondContact O-N 3.22Å; T15-I58 HydrophobicContact CG2-CG2 4.03Å; T15-R60 WeakPolarHBondContact OG1-CD 3.3Å; T15-I65 HydrophobicContact CG2-CD1 4.36Å; T15-V108 HydrophobicContact CG2-CG1 3.89Å
16	K	91.8	Very high	73.8	Confident	22 Å²	22	66.5 Å²	66.5	10%	0.096	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	130.1	168.7	175.2	165.8	172.1	-76	0	109.4	T18 T23 V25 V108 E109 V111	K16-T18 PolarHBondContact NZ-OG1 2.94Å; K16-T23 HydrophobicContact CD-CG2 4.32Å; K16-T23 HydrophobicContact CG-CG2 4.2Å; K16-V25 HydrophobicContact CB-CG2 4.16Å; K16-V25 HydrophobicContact CD-CG2 4.14Å; K16-V25 HydrophobicContact CG-CG2 4.08Å; K16-V108 WeakPolarHBondContact O-CA 3.49Å; K16-E109 HydrophobicContact CB-CG 3.86Å; K16-E109 HydrophobicContact CD-CG 4.47Å; K16-E109 WeakPolarHBondContact CD-OE1 3.41Å; K16-E109 WeakPolarHBondContact CE-OE1 3.42Å; K16-E109 HydrophobicContact CG-CG 4.23Å; K16-E109 PolarHBondContact N-O 3.2Å; K16-E109 IonicContact NZ-OE1 2.7Å; K16-E109 PolarHBondContact NZ-OE1 3.15Å; K16-E109 PolarHBondContact O-N 2.79Å; K16-V111 HydrophobicContact CB-CG2 3.59Å; K16-V111 HydrophobicContact CD-CG2 3.82Å; K16-V111 HydrophobicContact CG-CG2 4.36Å
17	I	92.4	Very high	76.3	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.015	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	118.5	175.1	-59.7	173.4	0	0	0	107	T15 T23 V24 V31 V33 V43 I58 I106 I107 V108	T15-I17 HydrophobicContact CG2-CD1 4.48Å; T15-I17 HydrophobicContact CG2-CG1 4.11Å; I17-T23 WeakPolarHBondContact O-CA 3.49Å; I17-V24 PolarHBondContact N-O 3.36Å; I17-V24 PolarHBondContact O-N 3.42Å; I17-V31 HydrophobicContact CD1-CB 4.28Å; I17-V31 HydrophobicContact CD1-CG1 3.7Å; I17-V33 HydrophobicContact CD1-CG2 4.07Å; I17-V43 HydrophobicContact CB-CG2 4.41Å; I17-V43 HydrophobicContact CD1-CG2 3.83Å; I17-V43 HydrophobicContact CG2-CG1 4.46Å; I17-V43 HydrophobicContact CG2-CG2 4.46Å; I17-I58 HydrophobicContact CD1-CD1 3.57Å; I17-I58 HydrophobicContact CG1-CD1 4.24Å; I17-I106 HydrophobicContact CG2-CB 4.24Å; I17-I106 HydrophobicContact CG2-CD1 4.03Å; I17-I107 WeakPolarHBondContact CA-O 3.3Å; I17-V108 HydrophobicContact CG1-CG1 4.34Å; I17-V108 HydrophobicContact CG1-CG2 4.37Å
18	T	92.3	Very high	78.9	Confident	19 Å²	19	57.1 Å²	57.1	12%	0.117	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	110.9	-176.7	-48.4	0	0	0	0	108.5	K16 I106 I107	K16-T18 PolarHBondContact NZ-OG1 2.94Å; T18-I106 CarbonylContact O-C 3.52Å; T18-I106 VanDerWaalsContact O-CA 3.29Å; T18-I106 WeakPolarHBondContact O-CA 3.42Å; T18-I107 PolarHBondContact N-O 3.36Å; T18-I107 PolarHBondContact O-N 3.12Å
19	G	87.3	Confident	81.2	Confident	18 Å²	18	54.8 Å²	54.8	19%	0.186	30%	0.297	C	S	.	.			trans	-112.5	-174.3	178.2	0	0	0	0	0	113.1	S21 C22	G19-S21 VanDerWaalsContact C-N 3.34Å; G19-S21 PolarHBondContact O-N 3.19Å; G19-C22 PolarHBondContact N-O 3.08Å
20	P	83	Confident	83.5	Confident	95 Å²	95	49.8 Å²	49.8	62%	0.617	27%	0.272	S	S	*	.	S	Bend	trans	-74	-23.4	-177.7	30.5	-35.4	0	0	0	113.7	I104	P20-I104 HydrophobicContact CG-CG2 4.24Å
21	S	76.8	Confident	85.7	Confident	61 Å²	61	41.9 Å²	41.9	43%	0.427	23%	0.23	S	C	.	.	S	Bend	trans	-114.5	-25.4	-176.3	46.9	0	0	0	0	113.7	G19	G19-S21 VanDerWaalsContact C-N 3.34Å; G19-S21 PolarHBondContact O-N 3.19Å
22	C	82.4	Confident	87.2	Confident	11 Å²	11	37.8 Å²	37.8	7%	0.074	21%	0.213	C	C	.	.			trans	-142.8	148.8	-171.5	57.2	0	0	0	0	112.1	G19	G19-C22 PolarHBondContact N-O 3.08Å
23	T	89.1	Confident	88.2	Confident	36 Å²	36	30.8 Å²	30.8	22%	0.221	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	124.6	161.2	-64.6	0	0	0	0	108.3	K16 I17	K16-T23 HydrophobicContact CD-CG2 4.32Å; K16-T23 HydrophobicContact CG-CG2 4.2Å; I17-T23 WeakPolarHBondContact O-CA 3.49Å
24	V	89	Confident	88.6	Confident	3 Å²	3	29.3 Å²	29.3	2%	0.018	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	123.6	-179.5	-177	0	0	0	0	109	I17 V43	I17-V24 PolarHBondContact N-O 3.36Å; I17-V24 PolarHBondContact O-N 3.42Å; V24-V43 HydrophobicContact CB-CG2 3.96Å; V24-V43 HydrophobicContact CG1-CG2 4.12Å; V24-V43 HydrophobicContact CG2-CG1 4.3Å; V24-V43 HydrophobicContact CG2-CG2 4.07Å
25	V	90.4	Very high	88.9	Confident	45 Å²	45	31.9 Å²	31.9	27%	0.273	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	124.3	168.9	-176	0	0	0	0	107.8	K16 L113	K16-V25 HydrophobicContact CB-CG2 4.16Å; K16-V25 HydrophobicContact CD-CG2 4.14Å; K16-V25 HydrophobicContact CG-CG2 4.08Å; V25-L113 HydrophobicContact CG1-CD1 4.37Å
26	S	87.2	Confident	88.8	Confident	7 Å²	7	38.4 Å²	38.4	5%	0.049	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	125.7	-175.3	-173.3	0	0	0	0	111.2	T15 K28	T15-S26 PolarHBondContact N-O 3.33Å; T15-S26 PolarHBondContact O-N 3.22Å; S26-K28 VanDerWaalsContact C-N 3.26Å; S26-K28 WeakPolarHBondContact OG-CG 3.15Å; S26-K28 PolarHBondContact OG-N 2.95Å
27	D	86.9	Confident	88.7	Confident	57 Å²	57	39.5 Å²	39.5	31%	0.305	23%	0.227	S	C	.	.			trans	-73.5	-17.8	170.8	-71.5	-72.8	0	0	0	113.2	R12 S14 R60	R12-D27 IonicContact CZ-OD1 2.86Å; R12-D27 IonicContact CZ-OD2 3.92Å; R12-D27 VanDerWaalsContact NE-CG 3.34Å; R12-D27 IonicContact NE-OD1 3.7Å; R12-D27 PolarHBondContact NE-OD1 3.47Å; R12-D27 IonicContact NE-OD2 2.7Å; R12-D27 PolarHBondContact NE-OD2 2.95Å; R12-D27 IonicContact NH2-OD1 3.92Å; R12-D27 PolarHBondContact NH2-OD1 2.83Å; R12-D27 IonicContact NH2-OD2 3.36Å; R12-D27 PolarHBondContact NH2-OD2 3.37Å; S14-D27 PolarHBondContact OG-OD1 3.24Å; D27-R60 PolarHBondContact O-NH2 3.47Å
28	K	87.1	Confident	88.3	Confident	82 Å²	82	46.8 Å²	46.8	36%	0.357	26%	0.261	S	S	.	.			trans	-57.6	143.3	-172.2	-61.3	-175.9	175.9	-172.6	0	111.1	S26 V30 V31 D42	S26-K28 VanDerWaalsContact C-N 3.26Å; S26-K28 WeakPolarHBondContact OG-CG 3.15Å; S26-K28 PolarHBondContact OG-N 2.95Å; K28-V30 WeakPolarHBondContact CB-O 3.43Å; K28-V30 PolarHBondContact O-N 2.95Å; K28-V31 HydrophobicContact CB-CG2 4.39Å; K28-D42 WeakPolarHBondContact CE-OD1 3.33Å; K28-D42 IonicContact NZ-OD1 3.5Å; K28-D42 PolarHBondContact NZ-OD1 2.85Å
29	S	86.7	Confident	88.1	Confident	83 Å²	83	48 Å²	48	58%	0.58	27%	0.266	S	S	*	.	S	Bend	trans	-67.6	-24.7	171.3	50.2	0	0	0	0	112.4	H59 R60	S29-H59 CarbonylContact O-C 3.55Å; S29-H59 VanDerWaalsContact O-CA 3.32Å; S29-H59 WeakPolarHBondContact O-CA 3.11Å; S29-R60 PolarHBondContact O-N 3.31Å
30	V	91.7	Very high	88	Confident	46 Å²	46	52.3 Å²	52.3	28%	0.279	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	131.2	172.9	-173.4	0	0	0	0	109.1	K28 I32 E57 I58	K28-V30 WeakPolarHBondContact CB-O 3.43Å; K28-V30 PolarHBondContact O-N 2.95Å; V30-I32 HydrophobicContact CG1-CG1 4.46Å; V30-E57 HydrophobicContact CG1-CB 4.27Å; V30-I58 CarbonylContact C-O 3.55Å; V30-I58 WeakPolarHBondContact CA-O 3.39Å
31	V	92.9	Very high	88.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	119.4	176.9	-167.5	0	0	0	0	108.8	I17 K28 D42 V43 I58	I17-V31 HydrophobicContact CD1-CB 4.28Å; I17-V31 HydrophobicContact CD1-CG1 3.7Å; K28-V31 HydrophobicContact CB-CG2 4.39Å; V31-D42 HydrophobicContact CG1-CB 3.61Å; V31-V43 HydrophobicContact CG1-CG2 4.13Å; V31-I58 HydrophobicContact CB-CB 4.38Å; V31-I58 PolarHBondContact N-O 3.12Å; V31-I58 PolarHBondContact O-N 3.38Å
32	I	93.3	Very high	89	Confident	27 Å²	27	47.5 Å²	47.5	14%	0.138	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	127.3	-176.6	-53.2	-177.2	0	0	0	109.7	V30 V41 D42 V43 K54	V30-I32 HydrophobicContact CG1-CG1 4.46Å; I32-V41 HydrophobicContact CG2-CG1 4.09Å; I32-D42 PolarHBondContact N-OD2 3.45Å; I32-D42 PolarHBondContact O-N 2.91Å; I32-V43 PolarHBondContact O-N 2.9Å; I32-V43 VanDerWaalsContact O-N 3.09Å; I32-K54 HydrophobicContact CD1-CD 4.43Å; I32-K54 HydrophobicContact CG2-CB 4.16Å; I32-K54 HydrophobicContact CG2-CD 3.82Å; I32-K54 HydrophobicContact CG2-CG 3.74Å
33	V	93	Very high	89.4	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	135.1	-178.8	-172.1	0	0	0	0	110.2	I17 V43 L45 H55 L56 I58 F99 I106	I17-V33 HydrophobicContact CD1-CG2 4.07Å; V33-V43 WeakPolarHBondContact CA-O 3.4Å; V33-V43 HydrophobicContact CB-CB 4.45Å; V33-V43 HydrophobicContact CG1-CB 4.12Å; V33-V43 HydrophobicContact CG1-CG1 4.38Å; V33-V43 HydrophobicContact CG2-CB 4.07Å; V33-V43 HydrophobicContact CG2-CG2 4.32Å; V33-L45 HydrophobicContact CG1-CD1 3.53Å; V33-L45 HydrophobicContact CG1-CD2 4.18Å; V33-L45 HydrophobicContact CG1-CG 3.75Å; V33-H55 WeakPolarHBondContact O-CB 3.3Å; V33-H55 PolarHBondContact O-N 3.15Å; V33-L56 HydrophobicContact CB-CD1 3.77Å; V33-L56 HydrophobicContact CB-CG 3.95Å; V33-L56 HydrophobicContact CG2-CD1 3.69Å; V33-L56 HydrophobicContact CG2-CG 4.43Å; V33-L56 PolarHBondContact N-O 3.49Å; V33-L56 PolarHBondContact O-N 3.31Å; V33-I58 HydrophobicContact CG2-CD1 4.03Å; V33-F99 HydrophobicContact CG1-CZ 4.23Å; V33-I106 HydrophobicContact CG1-CD1 4.25Å
34	G	92.5	Very high	89.4	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.1	-166.6	-177.9	0	0	0	0	0	114	V43 L45 S52	G34-V43 PolarHBondContact N-O 3.13Å; G34-V43 VanDerWaalsContact N-O 3.12Å; G34-L45 PolarHBondContact O-N 3.1Å; G34-L45 VanDerWaalsContact O-N 3.15Å; G34-S52 WeakPolarHBondContact CA-O 3.37Å
35	R	91.9	Very high	89.2	Confident	53 Å²	53	48.3 Å²	48.3	20%	0.2	26%	0.262	C	S	.	.			trans	-89.7	158.6	172	75	163.9	164.7	160.4	-8.5	113	S37 D46 D47 S48 E49 V51 S52 R53	R35-S37 PolarHBondContact O-N 3.39Å; R35-D46 VanDerWaalsContact CA-O 3.25Å; R35-D46 WeakPolarHBondContact CA-O 3.41Å; R35-D46 VanDerWaalsContact CB-O 3.24Å; R35-D46 WeakPolarHBondContact CB-O 3.39Å; R35-D47 WeakPolarHBondContact CD-O 3.44Å; R35-D47 PolarHBondContact NH1-O 2.81Å; R35-S48 WeakPolarHBondContact CD-O 3.48Å; R35-E49 IonicContact CZ-OE1 3.64Å; R35-E49 IonicContact NH1-OE1 2.67Å; R35-E49 PolarHBondContact NH1-OE1 2.76Å; R35-E49 IonicContact NH2-OE1 3.48Å; R35-E49 PolarHBondContact NH2-OE1 2.87Å; R35-V51 HydrophobicContact CB-CB 4.18Å; R35-V51 HydrophobicContact CB-CG1 4.24Å; R35-V51 WeakPolarHBondContact CB-O 3.18Å; R35-V51 WeakPolarHBondContact CD-O 3.5Å; R35-V51 WeakPolarHBondContact CG-O 3.48Å; R35-V51 PolarHBondContact NE-O 2.97Å; R35-S52 PolarHBondContact N-O 3.35Å; R35-R53 HydrophobicContact CG-CG 4.42Å
36	K	87.7	Confident	88.5	Confident	138 Å²	138	49.6 Å²	49.6	60%	0.6	27%	0.268	S	S	*	.	S	Bend	trans	-55.9	126.9	172.2	-156.7	174.5	-174.5	173.4	0	110.6	C44 D46 D47	K36-C44 PolarHBondContact N-SG 3.28Å; K36-C44 VanDerWaalsContact N-SG 3.36Å; K36-D46 PolarHBondContact N-O 3.41Å; K36-D47 WeakPolarHBondContact CB-OD1 3.11Å; K36-D47 WeakPolarHBondContact CD-OD1 3.26Å
37	S	88.2	Confident	88.3	Confident	45 Å²	45	53 Å²	53	32%	0.315	29%	0.285	S	S	.	.	S	Bend	trans	-163.9	-178.4	178.4	72.3	0	0	0	0	110.8	R35 I39	R35-S37 PolarHBondContact O-N 3.39Å; S37-I39 PolarHBondContact O-N 3.26Å; S37-I39 PolarHBondContact OG-N 3.07Å; S37-I39 VanDerWaalsContact OG-N 3.09Å; S37-I39 PolarHBondContact OG-O 3Å
38	H	85.8	Confident	88	Confident	156 Å²	156	52 Å²	52	72%	0.722	28%	0.283	S	S	*	.	S	Bend	trans	-64.6	-14.3	169	63.1	-114.1	0	0	0	113.6	R53	H38-R53 PolarHBondContact CE1-NH1 2.88Å; H38-R53 PolarHBondContact NE2-NH1 3.07Å
39	I	86.6	Confident	87.9	Confident	45 Å²	45	55.1 Å²	55.1	23%	0.231	30%	0.299	C	S	.	.	S	Bend	trans	-87.6	122.8	177.5	-50.7	-175.4	0	0	0	108	S37 V41 R53 K54	S37-I39 PolarHBondContact O-N 3.26Å; S37-I39 PolarHBondContact OG-N 3.07Å; S37-I39 VanDerWaalsContact OG-N 3.09Å; S37-I39 PolarHBondContact OG-O 3Å; I39-V41 PolarHBondContact O-N 3.36Å; I39-R53 HydrophobicContact CD1-CB 3.97Å; I39-K54 HydrophobicContact CG2-CD 4.15Å; I39-K54 VanDerWaalsContact CG2-CE 3.45Å; I39-K54 HydrophobicContact CG2-CG 4.01Å
40	P	86	Confident	87.8	Confident	108 Å²	108	53.1 Å²	53.1	70%	0.701	28%	0.284	S	S	*	.			trans	-65.5	135.9	176.5	26.4	-33.6	0	0	0	111.2
41	V	90.6	Very high	87.7	Confident	32 Å²	32	51 Å²	51	19%	0.194	27%	0.271	C	S	.	.			trans	-128.5	152.1	172.6	-65.9	0	0	0	0	108.9	I32 I39 C44 R53 K54	I32-V41 HydrophobicContact CG2-CG1 4.09Å; I39-V41 PolarHBondContact O-N 3.36Å; V41-C44 HydrophobicContact CG2-CB 4.06Å; V41-R53 VanDerWaalsContact CG1-O 3.23Å; V41-R53 WeakPolarHBondContact CG1-O 3.35Å; V41-K54 HydrophobicContact CG1-CG 4.31Å
42	D	90.2	Very high	87.6	Confident	23 Å²	23	52.6 Å²	52.6	12%	0.123	28%	0.283	C	S	.	.	S	Bend	trans	-83.9	-28.9	179.2	-60.8	-63.7	0	0	0	112.3	K28 V31 I32	K28-D42 WeakPolarHBondContact CE-OD1 3.33Å; K28-D42 IonicContact NZ-OD1 3.5Å; K28-D42 PolarHBondContact NZ-OD1 2.85Å; V31-D42 HydrophobicContact CG1-CB 3.61Å; I32-D42 PolarHBondContact N-OD2 3.45Å; I32-D42 PolarHBondContact O-N 2.91Å
43	V	90.1	Very high	87.5	Confident	1 Å²	1	57 Å²	57	1%	0.006	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	114	170.8	-172.7	0	0	0	0	108.9	I17 V24 V31 I32 V33 G34 L45	I17-V43 HydrophobicContact CB-CG2 4.41Å; I17-V43 HydrophobicContact CD1-CG2 3.83Å; I17-V43 HydrophobicContact CG2-CG1 4.46Å; I17-V43 HydrophobicContact CG2-CG2 4.46Å; V24-V43 HydrophobicContact CB-CG2 3.96Å; V24-V43 HydrophobicContact CG1-CG2 4.12Å; V24-V43 HydrophobicContact CG2-CG1 4.3Å; V24-V43 HydrophobicContact CG2-CG2 4.07Å; V31-V43 HydrophobicContact CG1-CG2 4.13Å; I32-V43 PolarHBondContact O-N 2.9Å; I32-V43 VanDerWaalsContact O-N 3.09Å; V33-V43 WeakPolarHBondContact CA-O 3.4Å; V33-V43 HydrophobicContact CB-CB 4.45Å; V33-V43 HydrophobicContact CG1-CB 4.12Å; V33-V43 HydrophobicContact CG1-CG1 4.38Å; V33-V43 HydrophobicContact CG2-CB 4.07Å; V33-V43 HydrophobicContact CG2-CG2 4.32Å; G34-V43 PolarHBondContact N-O 3.13Å; G34-V43 VanDerWaalsContact N-O 3.12Å; V43-L45 HydrophobicContact CG1-CD2 3.65Å; V43-L45 HydrophobicContact CG1-CG 4.43Å
44	C	90.2	Very high	87.5	Confident	55 Å²	55	60.7 Å²	60.7	37%	0.372	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	122.1	170.3	-177.9	0	0	0	0	108.4	K36 V41	K36-C44 PolarHBondContact N-SG 3.28Å; K36-C44 VanDerWaalsContact N-SG 3.36Å; V41-C44 HydrophobicContact CG2-CB 4.06Å
45	L	84.8	Confident	87.5	Confident	12 Å²	12	60.7 Å²	60.7	6%	0.063	31%	0.313	C	S	.	.			trans	-95.7	-39.5	-174.9	-62.1	178.9	0	0	0	113.9	V33 G34 V43 F99 I104 I106	V33-L45 HydrophobicContact CG1-CD1 3.53Å; V33-L45 HydrophobicContact CG1-CD2 4.18Å; V33-L45 HydrophobicContact CG1-CG 3.75Å; G34-L45 PolarHBondContact O-N 3.1Å; G34-L45 VanDerWaalsContact O-N 3.15Å; V43-L45 HydrophobicContact CG1-CD2 3.65Å; V43-L45 HydrophobicContact CG1-CG 4.43Å; L45-F99 HydrophobicContact CD1-CD2 4Å; L45-F99 HydrophobicContact CD1-CE1 4Å; L45-F99 HydrophobicContact CD1-CE2 3.26Å; L45-F99 HydrophobicContact CD1-CZ 3.25Å; L45-I104 HydrophobicContact CB-CG2 4.4Å; L45-I104 HydrophobicContact CD1-CG2 4.13Å; L45-I106 HydrophobicContact CD1-CG2 4.08Å; L45-I106 HydrophobicContact CD2-CG2 3.64Å
46	D	76.1	Confident	87.5	Confident	72 Å²	72	58.1 Å²	58.1	39%	0.385	30%	0.304	S	S	.	.			trans	-165.6	168.8	-174	-166.5	-7.4	0	0	0	108.1	R35 K36 S48 I104	R35-D46 VanDerWaalsContact CA-O 3.25Å; R35-D46 WeakPolarHBondContact CA-O 3.41Å; R35-D46 VanDerWaalsContact CB-O 3.24Å; R35-D46 WeakPolarHBondContact CB-O 3.39Å; K36-D46 PolarHBondContact N-O 3.41Å; D46-S48 VanDerWaalsContact C-N 3.34Å; D46-S48 PolarHBondContact OD1-N 3.29Å; D46-S48 WeakPolarHBondContact OD2-CB 3.34Å; D46-I104 HydrophobicContact CB-CD1 3.71Å
47	D	81.4	Confident	87.9	Confident	79 Å²	79	53 Å²	53	42%	0.422	28%	0.282	S	S	.	.	S	Bend	trans	-85.1	-13.4	168.7	-65.6	-12.5	0	0	0	111.4	R35 K36	R35-D47 WeakPolarHBondContact CD-O 3.44Å; R35-D47 PolarHBondContact NH1-O 2.81Å; K36-D47 WeakPolarHBondContact CB-OD1 3.11Å; K36-D47 WeakPolarHBondContact CD-OD1 3.26Å
48	S	81.1	Confident	88.1	Confident	36 Å²	36	50.9 Å²	50.9	25%	0.252	27%	0.267	S	S	.	.			trans	-54.1	129.7	-173	178.5	0	0	0	0	115.8	R35 D46 C50 V51	R35-S48 WeakPolarHBondContact CD-O 3.48Å; D46-S48 VanDerWaalsContact C-N 3.34Å; D46-S48 PolarHBondContact OD1-N 3.29Å; D46-S48 WeakPolarHBondContact OD2-CB 3.34Å; S48-C50 PolarHBondContact O-N 3.14Å; S48-V51 PolarHBondContact O-N 2.91Å
49	E	84.7	Confident	88.4	Confident	147 Å²	147	45 Å²	45	69%	0.687	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-27.8	-179.3	-58	-107.6	99	0	0	114	R35 V51	R35-E49 IonicContact CZ-OE1 3.64Å; R35-E49 IonicContact NH1-OE1 2.67Å; R35-E49 PolarHBondContact NH1-OE1 2.76Å; R35-E49 IonicContact NH2-OE1 3.48Å; R35-E49 PolarHBondContact NH2-OE1 2.87Å; E49-V51 PolarHBondContact O-N 2.9Å
50	C	84.6	Confident	88.6	Confident	41 Å²	41	45 Å²	45	28%	0.277	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.6	175.7	-66.8	0	0	0	0	112.5	S48 N73 S101 T102	S48-C50 PolarHBondContact O-N 3.14Å; C50-N73 PolarHBondContact O-ND2 3.11Å; C50-S101 PolarHBondContact SG-O 2.88Å; C50-T102 HydrophobicContact CB-CG2 3.45Å; C50-T102 VanDerWaalsContact CB-CG2 3.45Å
51	V	89.4	Confident	88.7	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	-97.7	117	175.9	-176.3	0	0	0	0	109.1	R35 S48 E49 H55 F99 T102 I104	R35-V51 HydrophobicContact CB-CB 4.18Å; R35-V51 HydrophobicContact CB-CG1 4.24Å; R35-V51 WeakPolarHBondContact CB-O 3.18Å; R35-V51 WeakPolarHBondContact CD-O 3.5Å; R35-V51 WeakPolarHBondContact CG-O 3.48Å; R35-V51 PolarHBondContact NE-O 2.97Å; S48-V51 PolarHBondContact O-N 2.91Å; E49-V51 PolarHBondContact O-N 2.9Å; V51-H55 WeakPolarHBondContact CA-ND1 3.38Å; V51-H55 HydrophobicContact CG1-CB 4.12Å; V51-F99 HydrophobicContact CG1-CD1 4.31Å; V51-F99 HydrophobicContact CG1-CE1 4.28Å; V51-F99 HydrophobicContact CG2-CD1 4.18Å; V51-F99 HydrophobicContact CG2-CG 4.45Å; V51-T102 HydrophobicContact CG2-CG2 4.31Å; V51-I104 HydrophobicContact CG2-CD1 4.14Å
52	S	91.4	Very high	88.3	Confident	35 Å²	35	50.5 Å²	50.5	25%	0.245	25%	0.253	C	S	.	.			trans	-60.6	150.2	175.5	-50.9	0	0	0	0	113.1	G34 R35 K54 H55 S71	G34-S52 WeakPolarHBondContact CA-O 3.37Å; R35-S52 PolarHBondContact N-O 3.35Å; S52-K54 WeakPolarHBondContact CB-O 3.49Å; S52-K54 CarbonylContact O-C 3.54Å; S52-K54 PolarHBondContact O-N 2.94Å; S52-H55 PolarHBondContact N-ND1 3.48Å; S52-H55 VanDerWaalsContact N-ND1 3.1Å; S52-S71 PolarHBondContact OG-OG 3.48Å
53	R	91.5	Very high	88.1	Confident	119 Å²	119	55.2 Å²	55.2	45%	0.449	27%	0.273	S	S	.	.	S	Bend	trans	-51.1	-41.2	-179.2	-68.4	-178.7	-86	169.3	-11	113.1	R35 H38 I39 V41	R35-R53 HydrophobicContact CG-CG 4.42Å; H38-R53 PolarHBondContact CE1-NH1 2.88Å; H38-R53 PolarHBondContact NE2-NH1 3.07Å; I39-R53 HydrophobicContact CD1-CB 3.97Å; V41-R53 VanDerWaalsContact CG1-O 3.23Å; V41-R53 WeakPolarHBondContact CG1-O 3.35Å
54	K	92.2	Very high	88	Confident	77 Å²	77	58.9 Å²	58.9	34%	0.335	29%	0.292	S	S	.	.	S	Bend	trans	-120.4	122.3	153.8	-66.7	-173.5	170	-176	0	106.3	I32 I39 V41 S52 L70	I32-K54 HydrophobicContact CD1-CD 4.43Å; I32-K54 HydrophobicContact CG2-CB 4.16Å; I32-K54 HydrophobicContact CG2-CD 3.82Å; I32-K54 HydrophobicContact CG2-CG 3.74Å; I39-K54 HydrophobicContact CG2-CD 4.15Å; I39-K54 VanDerWaalsContact CG2-CE 3.45Å; I39-K54 HydrophobicContact CG2-CG 4.01Å; V41-K54 HydrophobicContact CG1-CG 4.31Å; S52-K54 WeakPolarHBondContact CB-O 3.49Å; S52-K54 CarbonylContact O-C 3.54Å; S52-K54 PolarHBondContact O-N 2.94Å; K54-L70 HydrophobicContact CB-CD1 3.93Å
55	H	92.4	Very high	88	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.276	C	S	.	.			trans	-102.3	-40.1	-175.4	-155.9	117.3	0	0	0	111.7	V33 V51 S52 L70 S71 G74 F99	V33-H55 WeakPolarHBondContact O-CB 3.3Å; V33-H55 PolarHBondContact O-N 3.15Å; V51-H55 WeakPolarHBondContact CA-ND1 3.38Å; V51-H55 HydrophobicContact CG1-CB 4.12Å; S52-H55 PolarHBondContact N-ND1 3.48Å; S52-H55 VanDerWaalsContact N-ND1 3.1Å; H55-L70 PolarHBondContact O-N 2.85Å; H55-S71 WeakPolarHBondContact CD2-CB 3.45Å; H55-S71 PolarHBondContact CE1-OG 3.07Å; H55-S71 VanDerWaalsContact CE1-OG 3.23Å; H55-S71 WeakPolarHBondContact NE2-CB 3.4Å; H55-S71 PolarHBondContact NE2-OG 3.13Å; H55-S71 PolarHBondContact O-N 3.14Å; H55-S71 VanDerWaalsContact O-N 3.11Å; H55-G74 PolarHBondContact NE2-O 3.16Å; H55-F99 HydrophobicContact CB-CE1 3.95Å; H55-F99 AromaticContact CD2-CD1 3.84Å; H55-F99 AromaticContact CD2-CE1 3.66Å; H55-F99 AromaticContact CE1-CD1 3.6Å; H55-F99 AromaticContact CG-CD1 3.85Å; H55-F99 AromaticContact CG-CE1 3.54Å; H55-F99 AromaticContact ND1-CD1 3.67Å; H55-F99 AromaticContact ND1-CE1 3.81Å; H55-F99 AromaticContact NE2-CD1 3.72Å
56	L	93.6	Very high	88.4	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	159.5	-179.5	62.6	92.6	0	0	0	111.3	V33 I58 L67 R68 I75 L97 F99	V33-L56 HydrophobicContact CB-CD1 3.77Å; V33-L56 HydrophobicContact CB-CG 3.95Å; V33-L56 HydrophobicContact CG2-CD1 3.69Å; V33-L56 HydrophobicContact CG2-CG 4.43Å; V33-L56 PolarHBondContact N-O 3.49Å; V33-L56 PolarHBondContact O-N 3.31Å; L56-I58 HydrophobicContact CD1-CD1 3.67Å; L56-I58 HydrophobicContact CD1-CG1 3.56Å; L56-L67 HydrophobicContact CD1-CD1 4.22Å; L56-L67 HydrophobicContact CD2-CD1 4.27Å; L56-R68 CarbonylContact C-O 3.57Å; L56-R68 WeakPolarHBondContact CA-O 3.43Å; L56-R68 WeakPolarHBondContact CB-O 3.42Å; L56-I75 HydrophobicContact CD2-CD1 3.32Å; L56-L97 HydrophobicContact CD2-CD1 4.5Å; L56-F99 HydrophobicContact CD2-CE1 3.95Å; L56-F99 HydrophobicContact CD2-CZ 3.67Å
57	E	94	Very high	89.2	Confident	31 Å²	31	55.4 Å²	55.4	15%	0.145	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.6	170.5	-52.6	179.2	150.3	0	0	108.9	V30 H59 L67 R68 L70	V30-E57 HydrophobicContact CG1-CB 4.27Å; E57-H59 WeakPolarHBondContact CB-NE2 3.43Å; E57-H59 IonicContact OE2-CD2 3.59Å; E57-H59 IonicContact OE2-CE1 3.25Å; E57-H59 IonicContact OE2-NE2 3.23Å; E57-H59 PolarHBondContact OE2-NE2 3.12Å; E57-L67 WeakPolarHBondContact O-CA 3.34Å; E57-R68 HydrophobicContact CB-CB 4.46Å; E57-R68 PolarHBondContact N-O 3.08Å; E57-R68 PolarHBondContact O-N 2.93Å; E57-R68 IonicContact OE2-CZ 2.58Å; E57-R68 IonicContact OE2-NH1 3.58Å; E57-R68 PolarHBondContact OE2-NH1 2.81Å; E57-L70 HydrophobicContact CG-CD1 3.73Å; E57-L70 HydrophobicContact CG-CG 4.16Å
58	I	93.5	Very high	89.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	109.9	173.3	-68.1	160.5	0	0	0	107.6	T15 I17 V30 V31 V33 L56 I65 V108	T15-I58 HydrophobicContact CG2-CG2 4.03Å; I17-I58 HydrophobicContact CD1-CD1 3.57Å; I17-I58 HydrophobicContact CG1-CD1 4.24Å; V30-I58 CarbonylContact C-O 3.55Å; V30-I58 WeakPolarHBondContact CA-O 3.39Å; V31-I58 HydrophobicContact CB-CB 4.38Å; V31-I58 PolarHBondContact N-O 3.12Å; V31-I58 PolarHBondContact O-N 3.38Å; V33-I58 HydrophobicContact CG2-CD1 4.03Å; L56-I58 HydrophobicContact CD1-CD1 3.67Å; L56-I58 HydrophobicContact CD1-CG1 3.56Å; I58-I65 HydrophobicContact CG2-CG2 3.55Å; I58-V108 HydrophobicContact CD1-CG1 4.16Å; I58-V108 HydrophobicContact CD1-CG2 3.89Å; I58-V108 HydrophobicContact CG2-CG1 4.23Å
59	H	92.7	Very high	90.3	Very high	33 Å²	33	53.6 Å²	53.6	15%	0.153	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	113.4	-178.7	-71.4	-122.4	0	0	0	109.4	S29 E57 Y66 F88	S29-H59 CarbonylContact O-C 3.55Å; S29-H59 VanDerWaalsContact O-CA 3.32Å; S29-H59 WeakPolarHBondContact O-CA 3.11Å; E57-H59 WeakPolarHBondContact CB-NE2 3.43Å; E57-H59 IonicContact OE2-CD2 3.59Å; E57-H59 IonicContact OE2-CE1 3.25Å; E57-H59 IonicContact OE2-NE2 3.23Å; E57-H59 PolarHBondContact OE2-NE2 3.12Å; H59-Y66 PolarHBondContact N-O 3.16Å; H59-Y66 PolarHBondContact O-N 2.87Å; H59-F88 HydrophobicContact CB-CE1 4.2Å; H59-F88 AromaticContact CD2-CE1 3.6Å; H59-F88 AromaticContact CE1-CE1 3.97Å; H59-F88 AromaticContact CE1-CZ 3.94Å; H59-F88 AromaticContact CG-CE1 3.68Å; H59-F88 AromaticContact ND1-CE1 3.9Å; H59-F88 AromaticContact ND1-CZ 3.97Å; H59-F88 AromaticContact NE2-CE1 3.78Å
60	R	90.1	Very high	90.6	Very high	43 Å²	43	50.1 Å²	50.1	16%	0.162	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	128.3	178.6	-178	175.1	60	101.8	-9.3	110.9	L13 T15 D27 S29 D64	L13-R60 VanDerWaalsContact C-NH1 3.35Å; L13-R60 PolarHBondContact O-NH1 2.91Å; L13-R60 PolarHBondContact O-NH2 3.15Å; T15-R60 WeakPolarHBondContact OG1-CD 3.3Å; D27-R60 PolarHBondContact O-NH2 3.47Å; S29-R60 PolarHBondContact O-N 3.31Å; R60-D64 WeakPolarHBondContact CA-O 3.42Å
61	K	87.4	Confident	90.9	Very high	122 Å²	122	48.2 Å²	48.2	53%	0.53	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	107.2	171.1	-65	-179.7	-178.8	173.3	0	108.4	K63 D64 Y66	K61-K63 PolarHBondContact O-N 2.96Å; K61-D64 PolarHBondContact N-O 3.17Å; K61-D64 PolarHBondContact O-N 2.92Å; K61-Y66 HydrophobicContact CB-CD2 4.48Å; K61-Y66 HydrophobicContact CB-CE2 4.11Å; K61-Y66 HydrophobicContact CD-CD2 4.15Å; K61-Y66 HydrophobicContact CD-CE2 3.84Å; K61-Y66 HydrophobicContact CG-CD2 4.3Å; K61-Y66 HydrophobicContact CG-CE2 4.22Å
62	N	84	Confident	90.8	Very high	134 Å²	134	57.9 Å²	57.9	72%	0.717	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	-108.8	-173.8	-55.8	-24.9	0	0	0	111.8	L13	L13-N62 WeakPolarHBondContact CD1-O 3.47Å
63	K	83.9	Confident	90.5	Very high	122 Å²	122	59.6 Å²	59.6	53%	0.53	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-8.5	175.2	-66.1	-167.4	174.3	-132	0	113.6	L13 K61 V110 E112	L13-K63 HydrophobicContact CD1-CG 3.59Å; K61-K63 PolarHBondContact O-N 2.96Å; K63-V110 WeakPolarHBondContact O-CG2 3.38Å; K63-E112 IonicContact NZ-OE1 3.48Å; K63-E112 PolarHBondContact NZ-OE1 2.94Å
64	D	88	Confident	90.5	Very high	78 Å²	78	53.9 Å²	53.9	42%	0.417	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	137.8	-177.7	-54.5	-42.7	0	0	0	110.8	R60 K61 Y66 L90	R60-D64 WeakPolarHBondContact CA-O 3.42Å; K61-D64 PolarHBondContact N-O 3.17Å; K61-D64 PolarHBondContact O-N 2.92Å; D64-Y66 HydrophobicContact CB-CD2 4.43Å; D64-Y66 HydrophobicContact CB-CE2 3.68Å; D64-L90 HydrophobicContact CB-CD1 4.09Å
65	I	91.5	Very high	90.5	Very high	4 Å²	4	50.2 Å²	50.2	2%	0.021	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	123.4	176.5	-59.3	-170.2	0	0	0	109.6	T15 I58 L91 V108 V110	T15-I65 HydrophobicContact CG2-CD1 4.36Å; I58-I65 HydrophobicContact CG2-CG2 3.55Å; I65-L91 HydrophobicContact CB-CB 4.3Å; I65-L91 HydrophobicContact CG2-CB 4.25Å; I65-L91 HydrophobicContact CG2-CD1 4Å; I65-L91 HydrophobicContact CG2-CG 4.29Å; I65-L91 PolarHBondContact O-N 3.35Å; I65-V108 HydrophobicContact CD1-CG1 3.8Å; I65-V108 HydrophobicContact CG2-CG1 4.27Å; I65-V110 HydrophobicContact CD1-CG2 3.57Å; I65-V110 HydrophobicContact CG1-CG2 3.64Å
66	Y	92.5	Very high	90.5	Very high	61 Å²	61	52.8 Å²	52.8	24%	0.239	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	127.5	175.7	-62.9	-90.9	0	0	0	110.4	H59 K61 D64 F88 V89 L90	H59-Y66 PolarHBondContact N-O 3.16Å; H59-Y66 PolarHBondContact O-N 2.87Å; K61-Y66 HydrophobicContact CB-CD2 4.48Å; K61-Y66 HydrophobicContact CB-CE2 4.11Å; K61-Y66 HydrophobicContact CD-CD2 4.15Å; K61-Y66 HydrophobicContact CD-CE2 3.84Å; K61-Y66 HydrophobicContact CG-CD2 4.3Å; K61-Y66 HydrophobicContact CG-CE2 4.22Å; D64-Y66 HydrophobicContact CB-CD2 4.43Å; D64-Y66 HydrophobicContact CB-CE2 3.68Å; Y66-F88 HydrophobicContact CD1-CB 4.25Å; Y66-V89 CarbonylContact C-O 3.49Å; Y66-V89 WeakPolarHBondContact CA-O 3.43Å; Y66-L90 HydrophobicContact CD1-CB 4.36Å; Y66-L90 HydrophobicContact CD1-CD1 4.2Å; Y66-L90 HydrophobicContact CE1-CB 4.25Å; Y66-L90 HydrophobicContact CE1-CD1 3.82Å; Y66-L90 HydrophobicContact CE2-CD1 4.35Å
67	L	93.3	Very high	90.5	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	135.7	175.1	179.4	147.5	0	0	0	111	L56 E57 C69 I75 I77 F88 V89 L91 L97	L56-L67 HydrophobicContact CD1-CD1 4.22Å; L56-L67 HydrophobicContact CD2-CD1 4.27Å; E57-L67 WeakPolarHBondContact O-CA 3.34Å; L67-C69 HydrophobicContact CD2-CB 4.18Å; L67-I75 HydrophobicContact CD2-CG2 4.34Å; L67-I77 HydrophobicContact CD2-CD1 4.13Å; L67-F88 WeakPolarHBondContact O-CA 3.39Å; L67-V89 PolarHBondContact N-O 2.92Å; L67-V89 PolarHBondContact O-N 2.95Å; L67-L91 HydrophobicContact CB-CD1 3.98Å; L67-L91 HydrophobicContact CB-CD2 3.89Å; L67-L91 HydrophobicContact CB-CG 3.91Å; L67-L91 HydrophobicContact CD1-CD1 4.15Å; L67-L91 HydrophobicContact CD1-CD2 4.46Å; L67-L97 HydrophobicContact CD1-CD1 3.43Å; L67-L97 VanDerWaalsContact CD1-CD1 3.43Å; L67-L97 HydrophobicContact CD1-CD2 3.77Å; L67-L97 HydrophobicContact CD1-CG 4.25Å
68	R	93.1	Very high	90.3	Very high	66 Å²	66	56.3 Å²	56.3	25%	0.249	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	127.3	162.4	175.9	-174.3	-75.7	149	-13.4	109.2	L56 E57 L70 P86 F88	L56-R68 CarbonylContact C-O 3.57Å; L56-R68 WeakPolarHBondContact CA-O 3.43Å; L56-R68 WeakPolarHBondContact CB-O 3.42Å; E57-R68 HydrophobicContact CB-CB 4.46Å; E57-R68 PolarHBondContact N-O 3.08Å; E57-R68 PolarHBondContact O-N 2.93Å; E57-R68 IonicContact OE2-CZ 2.58Å; E57-R68 IonicContact OE2-NH1 3.58Å; E57-R68 PolarHBondContact OE2-NH1 2.81Å; R68-L70 HydrophobicContact CG-CD2 4.06Å; R68-P86 PolarHBondContact NE-O 2.91Å; R68-F88 HydrophobicContact CB-CD1 4.01Å; R68-F88 HydrophobicContact CB-CE1 3.95Å; R68-F88 VanDerWaalsContact CZ-CZ 3.43Å; R68-F88 VanDerWaalsContact NH2-CZ 3.29Å
69	C	93	Very high	89.9	Confident	10 Å²	10	59.2 Å²	59.2	7%	0.068	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	111.8	174.2	-170.7	0	0	0	0	110.1	L67 I75	L67-C69 HydrophobicContact CD2-CB 4.18Å; C69-I75 HydrophobicContact CB-CG2 4.35Å
70	L	91.2	Very high	89.6	Confident	75 Å²	75	61.1 Å²	61.1	39%	0.393	31%	0.311	S	S	.	.			trans	-85.8	-14.9	177.9	-61.2	179.6	0	0	0	112.8	K54 H55 E57 R68	K54-L70 HydrophobicContact CB-CD1 3.93Å; H55-L70 PolarHBondContact O-N 2.85Å; E57-L70 HydrophobicContact CG-CD1 3.73Å; E57-L70 HydrophobicContact CG-CG 4.16Å; R68-L70 HydrophobicContact CG-CD2 4.06Å
71	S	89.6	Confident	89.6	Confident	1 Å²	1	64 Å²	64	1%	0.007	33%	0.325	C	S	.	.			trans	-84.4	131	-173.1	170.8	0	0	0	0	112.8	S52 H55 N73 G74 G84	S52-S71 PolarHBondContact OG-OG 3.48Å; H55-S71 WeakPolarHBondContact CD2-CB 3.45Å; H55-S71 PolarHBondContact CE1-OG 3.07Å; H55-S71 VanDerWaalsContact CE1-OG 3.23Å; H55-S71 WeakPolarHBondContact NE2-CB 3.4Å; H55-S71 PolarHBondContact NE2-OG 3.13Å; H55-S71 PolarHBondContact O-N 3.14Å; H55-S71 VanDerWaalsContact O-N 3.11Å; S71-N73 PolarHBondContact O-N 3.08Å; S71-N73 WeakPolarHBondContact OG-CB 3.5Å; S71-N73 PolarHBondContact OG-N 3.12Å; S71-N73 VanDerWaalsContact OG-N 3.08Å; S71-G74 PolarHBondContact O-N 3.06Å; S71-G74 VanDerWaalsContact O-N 3.08Å; S71-G84 WeakPolarHBondContact O-CA 3.33Å
72	K	87.3	Confident	89.5	Confident	203 Å²	203	61.1 Å²	61.1	88%	0.883	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-24.5	169	-69.1	-172.6	177.6	-176.2	0	112.8	G74	K72-G74 PolarHBondContact O-N 3.25Å
73	N	86.8	Confident	89.3	Confident	70 Å²	70	58.8 Å²	58.8	37%	0.374	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-16.1	178.3	-60.4	-10.3	0	0	0	112.3	C50 S71 F81 P100	C50-N73 PolarHBondContact O-ND2 3.11Å; S71-N73 PolarHBondContact O-N 3.08Å; S71-N73 WeakPolarHBondContact OG-CB 3.5Å; S71-N73 PolarHBondContact OG-N 3.12Å; S71-N73 VanDerWaalsContact OG-N 3.08Å; N73-F81 WeakPolarHBondContact O-CE2 3.26Å; N73-F81 WeakPolarHBondContact O-CZ 3.48Å; N73-P100 WeakPolarHBondContact O-CG 3.4Å
74	G	90.3	Very high	88.8	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.294	C	S	.	.			trans	70.5	-171.9	-172.9	0	0	0	0	0	113.3	H55 S71 K72 H82 P100	H55-G74 PolarHBondContact NE2-O 3.16Å; S71-G74 PolarHBondContact O-N 3.06Å; S71-G74 VanDerWaalsContact O-N 3.08Å; K72-G74 PolarHBondContact O-N 3.25Å; G74-H82 CarbonylContact C-O 3.57Å; G74-H82 WeakPolarHBondContact CA-O 3.46Å; G74-P100 VanDerWaalsContact O-CD 3.23Å; G74-P100 WeakPolarHBondContact O-CD 3.43Å; G74-P100 VanDerWaalsContact O-CG 3.31Å; G74-P100 WeakPolarHBondContact O-CG 3.25Å
75	I	92.7	Very high	87.9	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	148.2	175.7	-163.5	162.6	0	0	0	111.9	L56 L67 C69 I77 H82 L97 R98 F99	L56-I75 HydrophobicContact CD2-CD1 3.32Å; L67-I75 HydrophobicContact CD2-CG2 4.34Å; C69-I75 HydrophobicContact CB-CG2 4.35Å; I75-I77 HydrophobicContact CG2-CD1 4.25Å; I75-I77 HydrophobicContact CG2-CG1 3.94Å; I75-H82 PolarHBondContact N-O 2.99Å; I75-H82 PolarHBondContact O-N 2.78Å; I75-L97 HydrophobicContact CD1-CB 3.87Å; I75-L97 HydrophobicContact CG1-CB 4.48Å; I75-R98 WeakPolarHBondContact CG1-O 3.47Å; I75-F99 HydrophobicContact CD1-CD1 4.34Å; I75-F99 HydrophobicContact CD1-CE1 4.05Å; I75-F99 HydrophobicContact CD1-CE2 4.24Å; I75-F99 HydrophobicContact CD1-CZ 3.98Å
76	F	92.3	Very high	86.7	Confident	53 Å²	53	61.6 Å²	61.6	23%	0.232	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	125	169.7	-66.9	-92.5	0	0	0	109.6	S80 F81 L97 R98 P100	F76-S80 WeakPolarHBondContact CA-O 3.33Å; F76-F81 HydrophobicContact CD1-CB 3.89Å; F76-F81 HydrophobicContact CD1-CD2 4.22Å; F76-F81 HydrophobicContact CD2-CD2 4.11Å; F76-F81 HydrophobicContact CE1-CB 3.74Å; F76-F81 HydrophobicContact CE1-CD2 4.04Å; F76-F81 HydrophobicContact CE1-CG 4.2Å; F76-F81 AromaticContact CE2-CD2 3.91Å; F76-F81 HydrophobicContact CE2-CD2 3.91Å; F76-F81 HydrophobicContact CE2-CE2 4.4Å; F76-F81 HydrophobicContact CG-CD2 4.25Å; F76-F81 HydrophobicContact CZ-CB 4.35Å; F76-F81 AromaticContact CZ-CD2 3.87Å; F76-F81 HydrophobicContact CZ-CD2 3.87Å; F76-F81 HydrophobicContact CZ-CG 4.33Å; F76-L97 CarbonylContact O-C 3.49Å; F76-L97 WeakPolarHBondContact O-CA 3.29Å; F76-R98 HydrophobicContact CB-CB 4.1Å; F76-R98 PolarHBondContact N-O 3.08Å; F76-R98 PolarHBondContact O-N 3.47Å; F76-P100 HydrophobicContact CD2-CG 3.96Å; F76-P100 HydrophobicContact CE2-CB 4.12Å; F76-P100 HydrophobicContact CE2-CG 3.91Å
77	I	92.7	Very high	86.2	Confident	13 Å²	13	63.4 Å²	63.4	7%	0.067	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	110.1	178.4	-51.4	-174.4	0	0	0	106.9	L67 I75 G79 S80 H82 V89 L91 C95 L97	L67-I77 HydrophobicContact CD2-CD1 4.13Å; I75-I77 HydrophobicContact CG2-CD1 4.25Å; I75-I77 HydrophobicContact CG2-CG1 3.94Å; I77-G79 PolarHBondContact O-N 3.47Å; I77-G79 VanDerWaalsContact O-N 3.08Å; I77-S80 PolarHBondContact N-O 2.97Å; I77-S80 WeakPolarHBondContact O-CB 3.32Å; I77-S80 PolarHBondContact O-N 3.17Å; I77-H82 HydrophobicContact CD1-CB 4.05Å; I77-H82 HydrophobicContact CG1-CB 4.37Å; I77-V89 HydrophobicContact CD1-CB 4.32Å; I77-V89 HydrophobicContact CD1-CG1 4.02Å; I77-V89 HydrophobicContact CD1-CG2 4.42Å; I77-L91 HydrophobicContact CD1-CD2 4.23Å; I77-L91 HydrophobicContact CG2-CD2 3.74Å; I77-C95 WeakPolarHBondContact CG2-SG 3.21Å; I77-L97 HydrophobicContact CB-CD2 4.22Å; I77-L97 HydrophobicContact CG1-CD2 3.89Å; I77-L97 HydrophobicContact CG2-CD2 3.95Å
78	D	89.9	Confident	86	Confident	92 Å²	92	67.4 Å²	67.4	49%	0.492	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.2	38.9	-172.8	-64.9	-48.4	0	0	0	113.7	C95 K96	D78-C95 PolarHBondContact OD2-SG 3.46Å; D78-K96 PolarHBondContact N-O 3.38Å; D78-K96 WeakPolarHBondContact OD1-CB 3.44Å; D78-K96 PolarHBondContact OD1-N 3.48Å
79	G	85.8	Confident	85.8	Confident	61 Å²	61	66.3 Å²	66.3	63%	0.629	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.9	-16.5	-178.1	0	0	0	0	0	115.3	I77	I77-G79 PolarHBondContact O-N 3.47Å; I77-G79 VanDerWaalsContact O-N 3.08Å
80	S	86.9	Confident	85.7	Confident	74 Å²	74	70.8 Å²	70.8	52%	0.517	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	122.4	178.1	-63.5	0	0	0	0	111.7	F76 I77 H82	F76-S80 WeakPolarHBondContact CA-O 3.33Å; I77-S80 PolarHBondContact N-O 2.97Å; I77-S80 WeakPolarHBondContact O-CB 3.32Å; I77-S80 PolarHBondContact O-N 3.17Å; S80-H82 PolarHBondContact O-N 3.22Å; S80-H82 PolarHBondContact O-ND1 3.34Å
81	F	89.7	Confident	85.6	Confident	103 Å²	103	67.9 Å²	67.9	45%	0.452	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	122.1	-177.2	-177	-117.3	0	0	0	112.6	N73 F76 V83 P100	N73-F81 WeakPolarHBondContact O-CE2 3.26Å; N73-F81 WeakPolarHBondContact O-CZ 3.48Å; F76-F81 HydrophobicContact CD1-CB 3.89Å; F76-F81 HydrophobicContact CD1-CD2 4.22Å; F76-F81 HydrophobicContact CD2-CD2 4.11Å; F76-F81 HydrophobicContact CE1-CB 3.74Å; F76-F81 HydrophobicContact CE1-CD2 4.04Å; F76-F81 HydrophobicContact CE1-CG 4.2Å; F76-F81 AromaticContact CE2-CD2 3.91Å; F76-F81 HydrophobicContact CE2-CD2 3.91Å; F76-F81 HydrophobicContact CE2-CE2 4.4Å; F76-F81 HydrophobicContact CG-CD2 4.25Å; F76-F81 HydrophobicContact CZ-CB 4.35Å; F76-F81 AromaticContact CZ-CD2 3.87Å; F76-F81 HydrophobicContact CZ-CD2 3.87Å; F76-F81 HydrophobicContact CZ-CG 4.33Å; F81-V83 HydrophobicContact CD1-CG2 4.22Å; F81-V83 HydrophobicContact CE1-CG2 3.57Å; F81-V83 HydrophobicContact CZ-CG2 4.18Å; F81-P100 HydrophobicContact CD2-CG 4.45Å; F81-P100 HydrophobicContact CE2-CG 3.79Å
82	H	84.5	Confident	85.4	Confident	62 Å²	62	70.8 Å²	70.8	29%	0.287	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	113.1	178.3	-68.7	73.8	0	0	0	109.6	G74 I75 I77 S80	G74-H82 CarbonylContact C-O 3.57Å; G74-H82 WeakPolarHBondContact CA-O 3.46Å; I75-H82 PolarHBondContact N-O 2.99Å; I75-H82 PolarHBondContact O-N 2.78Å; I77-H82 HydrophobicContact CD1-CB 4.05Å; I77-H82 HydrophobicContact CG1-CB 4.37Å; S80-H82 PolarHBondContact O-N 3.22Å; S80-H82 PolarHBondContact O-ND1 3.34Å
83	V	80.4	Confident	85.2	Confident	84 Å²	84	66.6 Å²	66.6	51%	0.509	38%	0.382	S	S	.	.			trans	-68.4	148.4	173.4	178.8	0	0	0	0	109.9	F81 K85	F81-V83 HydrophobicContact CD1-CG2 4.22Å; F81-V83 HydrophobicContact CE1-CG2 3.57Å; F81-V83 HydrophobicContact CZ-CG2 4.18Å; V83-K85 PolarHBondContact O-N 2.87Å
84	G	72.8	Confident	85.2	Confident	31 Å²	31	64.6 Å²	64.6	32%	0.32	38%	0.378	S	S	.	.			trans	-54.5	106.2	173.9	0	0	0	0	0	112.5	S71	S71-G84 WeakPolarHBondContact O-CA 3.33Å
85	K	69.2	Low	85.2	Confident	133 Å²	133	64.7 Å²	64.7	58%	0.578	38%	0.378	S	S	*	.			trans	-126.2	154.5	175.4	-77.6	-171	173.7	-170	0	108.9	V83 D87	V83-K85 PolarHBondContact O-N 2.87Å; K85-D87 PolarHBondContact O-N 3.14Å
86	P	67.3	Low	85.2	Confident	100 Å²	100	70.3 Å²	70.3	65%	0.649	40%	0.403	S	S	*	.	S	Bend	trans	-67.1	-19.5	179	29.1	-36.3	0	0	0	113.4	R68	R68-P86 PolarHBondContact NE-O 2.91Å
87	D	82	Confident	85.2	Confident	98 Å²	98	67.8 Å²	67.8	52%	0.524	39%	0.392	S	S	.	.	S	Bend	trans	-64.6	152.5	-175.1	-48.8	-47	0	0	0	113	K85	K85-D87 PolarHBondContact O-N 3.14Å
88	F	88.2	Confident	85.2	Confident	87 Å²	87	72 Å²	72	38%	0.382	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-93.4	127	173.8	-72.5	-73.3	0	0	0	111	H59 Y66 L67 R68	H59-F88 HydrophobicContact CB-CE1 4.2Å; H59-F88 AromaticContact CD2-CE1 3.6Å; H59-F88 AromaticContact CE1-CE1 3.97Å; H59-F88 AromaticContact CE1-CZ 3.94Å; H59-F88 AromaticContact CG-CE1 3.68Å; H59-F88 AromaticContact ND1-CE1 3.9Å; H59-F88 AromaticContact ND1-CZ 3.97Å; H59-F88 AromaticContact NE2-CE1 3.78Å; Y66-F88 HydrophobicContact CD1-CB 4.25Å; L67-F88 WeakPolarHBondContact O-CA 3.39Å; R68-F88 HydrophobicContact CB-CD1 4.01Å; R68-F88 HydrophobicContact CB-CE1 3.95Å; R68-F88 VanDerWaalsContact CZ-CZ 3.43Å; R68-F88 VanDerWaalsContact NH2-CZ 3.29Å
89	V	89.6	Confident	85.3	Confident	43 Å²	43	67.6 Å²	67.6	26%	0.261	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	123.3	170.5	-175.3	0	0	0	0	108.6	Y66 L67 I77 L91	Y66-V89 CarbonylContact C-O 3.49Å; Y66-V89 WeakPolarHBondContact CA-O 3.43Å; L67-V89 PolarHBondContact N-O 2.92Å; L67-V89 PolarHBondContact O-N 2.95Å; I77-V89 HydrophobicContact CD1-CB 4.32Å; I77-V89 HydrophobicContact CD1-CG1 4.02Å; I77-V89 HydrophobicContact CD1-CG2 4.42Å; V89-L91 HydrophobicContact CG1-CD2 4.44Å; V89-L91 PolarHBondContact O-N 2.96Å
90	L	90.4	Very high	85.3	Confident	104 Å²	104	65.3 Å²	65.3	55%	0.545	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	124.9	170	179.8	67.7	0	0	0	108.9	D64 Y66	D64-L90 HydrophobicContact CB-CD1 4.09Å; Y66-L90 HydrophobicContact CD1-CB 4.36Å; Y66-L90 HydrophobicContact CD1-CD1 4.2Å; Y66-L90 HydrophobicContact CE1-CB 4.25Å; Y66-L90 HydrophobicContact CE1-CD1 3.82Å; Y66-L90 HydrophobicContact CE2-CD1 4.35Å
91	L	89.1	Confident	85.3	Confident	13 Å²	13	66.8 Å²	66.8	7%	0.068	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	146.2	174.1	-57.6	-168.3	0	0	0	110.5	I65 L67 I77 V89 C95 L97	I65-L91 HydrophobicContact CB-CB 4.3Å; I65-L91 HydrophobicContact CG2-CB 4.25Å; I65-L91 HydrophobicContact CG2-CD1 4Å; I65-L91 HydrophobicContact CG2-CG 4.29Å; I65-L91 PolarHBondContact O-N 3.35Å; L67-L91 HydrophobicContact CB-CD1 3.98Å; L67-L91 HydrophobicContact CB-CD2 3.89Å; L67-L91 HydrophobicContact CB-CG 3.91Å; L67-L91 HydrophobicContact CD1-CD1 4.15Å; L67-L91 HydrophobicContact CD1-CD2 4.46Å; I77-L91 HydrophobicContact CD1-CD2 4.23Å; I77-L91 HydrophobicContact CG2-CD2 3.74Å; V89-L91 HydrophobicContact CG1-CD2 4.44Å; V89-L91 PolarHBondContact O-N 2.96Å; L91-C95 HydrophobicContact CB-CB 4.04Å; L91-C95 HydrophobicContact CD1-CB 4.35Å; L91-L97 HydrophobicContact CD1-CD1 4.24Å; L91-L97 HydrophobicContact CD1-CD2 4.18Å; L91-L97 HydrophobicContact CD2-CD2 4.29Å
92	A	86.5	Confident	85.2	Confident	63 Å²	63	62.7 Å²	62.7	52%	0.521	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-71	156.9	162.5	0	0	0	0	0	110.6	G94 C95	A92-G94 PolarHBondContact O-N 2.96Å; A92-C95 WeakPolarHBondContact O-CB 3.37Å; A92-C95 PolarHBondContact O-N 3.24Å
93	D	82.8	Confident	85.4	Confident	114 Å²	114	67.4 Å²	67.4	61%	0.61	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	130.8	171.9	-163.2	21.3	0	0	0	110.1	E109 V110	D93-E109 WeakPolarHBondContact OD1-CA 3.45Å; D93-E109 WeakPolarHBondContact OD1-CB 3.31Å; D93-V110 PolarHBondContact OD1-N 2.91Å
94	G	85.4	Confident	85.8	Confident	28 Å²	28	64.2 Å²	64.2	29%	0.289	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	14.4	-172.3	0	0	0	0	0	115.5	A92 I107 V108	A92-G94 PolarHBondContact O-N 2.96Å; G94-I107 WeakPolarHBondContact O-CG2 3.46Å; G94-V108 CarbonylContact C-O 3.54Å; G94-V108 VanDerWaalsContact CA-O 3.28Å; G94-V108 WeakPolarHBondContact CA-O 3.35Å; G94-V108 PolarHBondContact N-O 3.25Å
95	C	90.7	Very high	86.8	Confident	2 Å²	2	65.5 Å²	65.5	1%	0.014	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	139	-179.7	177.2	0	0	0	0	113.2	I77 D78 L91 A92 I107 V108	I77-C95 WeakPolarHBondContact CG2-SG 3.21Å; D78-C95 PolarHBondContact OD2-SG 3.46Å; L91-C95 HydrophobicContact CB-CB 4.04Å; L91-C95 HydrophobicContact CD1-CB 4.35Å; A92-C95 WeakPolarHBondContact O-CB 3.37Å; A92-C95 PolarHBondContact O-N 3.24Å; C95-I107 WeakPolarHBondContact O-CA 3.45Å; C95-V108 PolarHBondContact N-O 3.23Å; C95-V108 PolarHBondContact O-N 2.64Å
96	K	92.6	Very high	87.9	Confident	118 Å²	118	59.2 Å²	59.2	51%	0.513	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	117.6	179.1	-60.2	-179.3	-179.1	173.8	0	111.5	D78 V105 I107	D78-K96 PolarHBondContact N-O 3.38Å; D78-K96 WeakPolarHBondContact OD1-CB 3.44Å; D78-K96 PolarHBondContact OD1-N 3.48Å; K96-V105 HydrophobicContact CB-CG1 4.47Å; K96-I107 HydrophobicContact CG-CG1 4.32Å
97	L	93.4	Very high	89.2	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	120.7	178	-52.5	176.5	0	0	0	109.9	L56 L67 I75 F76 I77 L91 V105 I106 V108	L56-L97 HydrophobicContact CD2-CD1 4.5Å; L67-L97 HydrophobicContact CD1-CD1 3.43Å; L67-L97 VanDerWaalsContact CD1-CD1 3.43Å; L67-L97 HydrophobicContact CD1-CD2 3.77Å; L67-L97 HydrophobicContact CD1-CG 4.25Å; I75-L97 HydrophobicContact CD1-CB 3.87Å; I75-L97 HydrophobicContact CG1-CB 4.48Å; F76-L97 CarbonylContact O-C 3.49Å; F76-L97 WeakPolarHBondContact O-CA 3.29Å; I77-L97 HydrophobicContact CB-CD2 4.22Å; I77-L97 HydrophobicContact CG1-CD2 3.89Å; I77-L97 HydrophobicContact CG2-CD2 3.95Å; L91-L97 HydrophobicContact CD1-CD1 4.24Å; L91-L97 HydrophobicContact CD1-CD2 4.18Å; L91-L97 HydrophobicContact CD2-CD2 4.29Å; L97-V105 CarbonylContact O-C 3.58Å; L97-V105 WeakPolarHBondContact O-CA 3.46Å; L97-I106 HydrophobicContact CB-CD1 4.38Å; L97-I106 HydrophobicContact CB-CG1 3.76Å; L97-I106 HydrophobicContact CD1-CD1 4.14Å; L97-I106 HydrophobicContact CD1-CG1 4.22Å; L97-I106 HydrophobicContact CG-CG1 4.43Å; L97-I106 PolarHBondContact N-O 3.42Å; L97-I106 PolarHBondContact O-N 3.49Å; L97-V108 HydrophobicContact CD1-CG2 3.59Å; L97-V108 HydrophobicContact CG-CG2 4.24Å
98	R	93	Very high	89.7	Confident	102 Å²	102	52.2 Å²	52.2	39%	0.385	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	129.1	178.9	169.3	175.2	164.1	-95.1	-3.4	111.6	I75 F76 V105	I75-R98 WeakPolarHBondContact CG1-O 3.47Å; F76-R98 HydrophobicContact CB-CB 4.1Å; F76-R98 PolarHBondContact N-O 3.08Å; F76-R98 PolarHBondContact O-N 3.47Å; R98-V105 HydrophobicContact CB-CG1 4.47Å; R98-V105 HydrophobicContact CB-CG2 4.03Å; R98-V105 HydrophobicContact CG-CG2 4.08Å
99	F	92	Very high	89.8	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.284	C	S	.	.			trans	-81.3	122.8	-176.4	-70.2	-95.9	0	0	0	111.3	V33 L45 V51 H55 L56 I75 T102 I104 I106	V33-F99 HydrophobicContact CG1-CZ 4.23Å; L45-F99 HydrophobicContact CD1-CD2 4Å; L45-F99 HydrophobicContact CD1-CE1 4Å; L45-F99 HydrophobicContact CD1-CE2 3.26Å; L45-F99 HydrophobicContact CD1-CZ 3.25Å; V51-F99 HydrophobicContact CG1-CD1 4.31Å; V51-F99 HydrophobicContact CG1-CE1 4.28Å; V51-F99 HydrophobicContact CG2-CD1 4.18Å; V51-F99 HydrophobicContact CG2-CG 4.45Å; H55-F99 HydrophobicContact CB-CE1 3.95Å; H55-F99 AromaticContact CD2-CD1 3.84Å; H55-F99 AromaticContact CD2-CE1 3.66Å; H55-F99 AromaticContact CE1-CD1 3.6Å; H55-F99 AromaticContact CG-CD1 3.85Å; H55-F99 AromaticContact CG-CE1 3.54Å; H55-F99 AromaticContact ND1-CD1 3.67Å; H55-F99 AromaticContact ND1-CE1 3.81Å; H55-F99 AromaticContact NE2-CD1 3.72Å; L56-F99 HydrophobicContact CD2-CE1 3.95Å; L56-F99 HydrophobicContact CD2-CZ 3.67Å; I75-F99 HydrophobicContact CD1-CD1 4.34Å; I75-F99 HydrophobicContact CD1-CE1 4.05Å; I75-F99 HydrophobicContact CD1-CE2 4.24Å; I75-F99 HydrophobicContact CD1-CZ 3.98Å; F99-T102 HydrophobicContact CB-CG2 4.43Å; F99-T102 VanDerWaalsContact CB-OG1 3.31Å; F99-T102 WeakPolarHBondContact CB-OG1 3.11Å; F99-T102 PolarHBondContact O-N 2.85Å; F99-T102 PolarHBondContact O-OG1 3.11Å; F99-I104 HydrophobicContact CB-CB 4.46Å; F99-I104 HydrophobicContact CD2-CB 4.21Å; F99-I104 HydrophobicContact CD2-CG2 3.92Å; F99-I104 HydrophobicContact CE2-CG2 4.41Å; F99-I104 PolarHBondContact N-O 3.28Å; F99-I106 HydrophobicContact CE2-CD1 3.86Å; F99-I106 HydrophobicContact CE2-CG1 4.03Å; F99-I106 HydrophobicContact CE2-CG2 4.25Å; F99-I106 HydrophobicContact CZ-CD1 4.09Å
100	P	85.4	Confident	89.8	Confident	13 Å²	13	49.8 Å²	49.8	8%	0.084	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	147.7	178.3	-25.2	35.5	0	0	0	112.1	N73 G74 F76 F81 T102	N73-P100 WeakPolarHBondContact O-CG 3.4Å; G74-P100 VanDerWaalsContact O-CD 3.23Å; G74-P100 WeakPolarHBondContact O-CD 3.43Å; G74-P100 VanDerWaalsContact O-CG 3.31Å; G74-P100 WeakPolarHBondContact O-CG 3.25Å; F76-P100 HydrophobicContact CD2-CG 3.96Å; F76-P100 HydrophobicContact CE2-CB 4.12Å; F76-P100 HydrophobicContact CE2-CG 3.91Å; F81-P100 HydrophobicContact CD2-CG 4.45Å; F81-P100 HydrophobicContact CE2-CG 3.79Å; P100-T102 PolarHBondContact O-N 2.83Å; P100-T102 VanDerWaalsContact O-N 3.13Å
101	S	87	Confident	89.6	Confident	105 Å²	105	46.9 Å²	46.9	73%	0.734	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	20	-175.6	-54.4	0	0	0	0	115.1	C50	C50-S101 PolarHBondContact SG-O 2.88Å
102	T	87.9	Confident	89.3	Confident	17 Å²	17	49.9 Å²	49.9	10%	0.104	28%	0.278	C	S	.	.	S	Bend	trans	-137.6	170.9	171.4	78.6	0	0	0	0	111.6	C50 V51 F99 P100 I104	C50-T102 HydrophobicContact CB-CG2 3.45Å; C50-T102 VanDerWaalsContact CB-CG2 3.45Å; V51-T102 HydrophobicContact CG2-CG2 4.31Å; F99-T102 HydrophobicContact CB-CG2 4.43Å; F99-T102 VanDerWaalsContact CB-OG1 3.31Å; F99-T102 WeakPolarHBondContact CB-OG1 3.11Å; F99-T102 PolarHBondContact O-N 2.85Å; F99-T102 PolarHBondContact O-OG1 3.11Å; P100-T102 PolarHBondContact O-N 2.83Å; P100-T102 VanDerWaalsContact O-N 3.13Å; T102-I104 HydrophobicContact CG2-CD1 4.41Å; T102-I104 WeakPolarHBondContact OG1-CB 3.43Å; T102-I104 PolarHBondContact OG1-N 3.3Å
103	N	88	Confident	88.6	Confident	161 Å²	161	49.7 Å²	49.7	86%	0.861	27%	0.268	S	S	*	.			trans	-94.7	6.3	167.2	-64.7	-21.1	0	0	0	112.6	V105	N103-V105 PolarHBondContact O-N 2.83Å
104	I	89.3	Confident	87.6	Confident	16 Å²	16	51 Å²	51	8%	0.082	27%	0.27	C	S	.	.			trans	-75.6	122.3	-176.6	-56.2	170.6	0	0	0	109.1	P20 L45 D46 V51 F99 T102 I106	P20-I104 HydrophobicContact CG-CG2 4.24Å; L45-I104 HydrophobicContact CB-CG2 4.4Å; L45-I104 HydrophobicContact CD1-CG2 4.13Å; D46-I104 HydrophobicContact CB-CD1 3.71Å; V51-I104 HydrophobicContact CG2-CD1 4.14Å; F99-I104 HydrophobicContact CB-CB 4.46Å; F99-I104 HydrophobicContact CD2-CB 4.21Å; F99-I104 HydrophobicContact CD2-CG2 3.92Å; F99-I104 HydrophobicContact CE2-CG2 4.41Å; F99-I104 PolarHBondContact N-O 3.28Å; T102-I104 HydrophobicContact CG2-CD1 4.41Å; T102-I104 WeakPolarHBondContact OG1-CB 3.43Å; T102-I104 PolarHBondContact OG1-N 3.3Å; I104-I106 HydrophobicContact CG2-CG2 4.4Å
105	V	92.1	Very high	86.1	Confident	59 Å²	59	54.3 Å²	54.3	36%	0.358	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	131.6	172.2	-171.4	0	0	0	0	107.8	K96 L97 R98 N103	K96-V105 HydrophobicContact CB-CG1 4.47Å; L97-V105 CarbonylContact O-C 3.58Å; L97-V105 WeakPolarHBondContact O-CA 3.46Å; R98-V105 HydrophobicContact CB-CG1 4.47Å; R98-V105 HydrophobicContact CB-CG2 4.03Å; R98-V105 HydrophobicContact CG-CG2 4.08Å; N103-V105 PolarHBondContact O-N 2.83Å
106	I	93.6	Very high	83.7	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	149.3	171.1	67.6	178.8	0	0	0	109.9	I17 T18 V33 L45 L97 F99 I104	I17-I106 HydrophobicContact CG2-CB 4.24Å; I17-I106 HydrophobicContact CG2-CD1 4.03Å; T18-I106 CarbonylContact O-C 3.52Å; T18-I106 VanDerWaalsContact O-CA 3.29Å; T18-I106 WeakPolarHBondContact O-CA 3.42Å; V33-I106 HydrophobicContact CG1-CD1 4.25Å; L45-I106 HydrophobicContact CD1-CG2 4.08Å; L45-I106 HydrophobicContact CD2-CG2 3.64Å; L97-I106 HydrophobicContact CB-CD1 4.38Å; L97-I106 HydrophobicContact CB-CG1 3.76Å; L97-I106 HydrophobicContact CD1-CD1 4.14Å; L97-I106 HydrophobicContact CD1-CG1 4.22Å; L97-I106 HydrophobicContact CG-CG1 4.43Å; L97-I106 PolarHBondContact N-O 3.42Å; L97-I106 PolarHBondContact O-N 3.49Å; F99-I106 HydrophobicContact CE2-CD1 3.86Å; F99-I106 HydrophobicContact CE2-CG1 4.03Å; F99-I106 HydrophobicContact CE2-CG2 4.25Å; F99-I106 HydrophobicContact CZ-CD1 4.09Å; I104-I106 HydrophobicContact CG2-CG2 4.4Å
107	I	93.9	Very high	80.9	Confident	51 Å²	51	64.2 Å²	64.2	26%	0.262	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	133.2	175.7	-49	-175.5	0	0	0	107.7	I17 T18 G94 C95 K96	I17-I107 WeakPolarHBondContact CA-O 3.3Å; T18-I107 PolarHBondContact N-O 3.36Å; T18-I107 PolarHBondContact O-N 3.12Å; G94-I107 WeakPolarHBondContact O-CG2 3.46Å; C95-I107 WeakPolarHBondContact O-CA 3.45Å; K96-I107 HydrophobicContact CG-CG1 4.32Å
108	V	93	Very high	77.9	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.006	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	124.4	-177.7	-171.4	0	0	0	0	109.8	T15 K16 I17 I58 I65 G94 C95 L97	T15-V108 HydrophobicContact CG2-CG1 3.89Å; K16-V108 WeakPolarHBondContact O-CA 3.49Å; I17-V108 HydrophobicContact CG1-CG1 4.34Å; I17-V108 HydrophobicContact CG1-CG2 4.37Å; I58-V108 HydrophobicContact CD1-CG1 4.16Å; I58-V108 HydrophobicContact CD1-CG2 3.89Å; I58-V108 HydrophobicContact CG2-CG1 4.23Å; I65-V108 HydrophobicContact CD1-CG1 3.8Å; I65-V108 HydrophobicContact CG2-CG1 4.27Å; G94-V108 CarbonylContact C-O 3.54Å; G94-V108 VanDerWaalsContact CA-O 3.28Å; G94-V108 WeakPolarHBondContact CA-O 3.35Å; G94-V108 PolarHBondContact N-O 3.25Å; C95-V108 PolarHBondContact N-O 3.23Å; C95-V108 PolarHBondContact O-N 2.64Å; L97-V108 HydrophobicContact CD1-CG2 3.59Å; L97-V108 HydrophobicContact CG-CG2 4.24Å
109	E	90.8	Very high	75.4	Confident	56 Å²	56	71.2 Å²	71.2	26%	0.262	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	156.7	-176.5	67.5	-166.3	167.3	0	0	112	K16 D93 V111	K16-E109 HydrophobicContact CB-CG 3.86Å; K16-E109 HydrophobicContact CD-CG 4.47Å; K16-E109 WeakPolarHBondContact CD-OE1 3.41Å; K16-E109 WeakPolarHBondContact CE-OE1 3.42Å; K16-E109 HydrophobicContact CG-CG 4.23Å; K16-E109 PolarHBondContact N-O 3.2Å; K16-E109 IonicContact NZ-OE1 2.7Å; K16-E109 PolarHBondContact NZ-OE1 3.15Å; K16-E109 PolarHBondContact O-N 2.79Å; D93-E109 WeakPolarHBondContact OD1-CA 3.45Å; D93-E109 WeakPolarHBondContact OD1-CB 3.31Å; E109-V111 HydrophobicContact CG-CG2 4.22Å
110	V	88.9	Confident	73	Confident	23 Å²	23	80.8 Å²	80.8	14%	0.139	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	120.8	172.3	-175.6	0	0	0	0	109.9	L13 S14 K63 I65 D93	L13-V110 HydrophobicContact CB-CG1 4.21Å; L13-V110 HydrophobicContact CD2-CG1 4.06Å; S14-V110 WeakPolarHBondContact O-CA 3.16Å; K63-V110 WeakPolarHBondContact O-CG2 3.38Å; I65-V110 HydrophobicContact CD1-CG2 3.57Å; I65-V110 HydrophobicContact CG1-CG2 3.64Å; D93-V110 PolarHBondContact OD1-N 2.91Å
111	V	87.1	Confident	70.8	Confident	42 Å²	42	88.1 Å²	88.1	26%	0.255	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	130.7	175	-179	0	0	0	0	109.9	L13 S14 K16 E109 L113	L13-V111 WeakPolarHBondContact CA-O 3.42Å; S14-V111 PolarHBondContact N-O 3.36Å; S14-V111 PolarHBondContact O-N 3.19Å; K16-V111 HydrophobicContact CB-CG2 3.59Å; K16-V111 HydrophobicContact CD-CG2 3.82Å; K16-V111 HydrophobicContact CG-CG2 4.36Å; E109-V111 HydrophobicContact CG-CG2 4.22Å; V111-L113 HydrophobicContact CG1-CD2 4.11Å; V111-L113 PolarHBondContact O-N 3.36Å
112	E	82.6	Confident	68.4	Low	77 Å²	77	92.5 Å²	92.5	36%	0.36	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	106.3	167.3	-42.2	-158.3	132.5	0	0	108.6	K11 L13 K63 E114	K11-E112 VanDerWaalsContact CD-OE2 3.27Å; K11-E112 WeakPolarHBondContact CD-OE2 3.13Å; K11-E112 WeakPolarHBondContact CE-OE2 3.38Å; K11-E112 IonicContact NZ-OE2 2.68Å; K11-E112 PolarHBondContact NZ-OE2 3.13Å; L13-E112 HydrophobicContact CD2-CB 4.24Å; L13-E112 HydrophobicContact CD2-CG 3.67Å; K63-E112 IonicContact NZ-OE1 3.48Å; K63-E112 PolarHBondContact NZ-OE1 2.94Å; E112-E114 PolarHBondContact O-N 3.15Å
113	L	70.3	Confident	66.1	Low	58 Å²	58	95.8 Å²	95.8	30%	0.304	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	120.3	174.4	-66	-177.4	0	0	0	110.6	R12 S14 V25 V111	R12-L113 HydrophobicContact CB-CB 4.28Å; R12-L113 PolarHBondContact N-O 3.21Å; R12-L113 WeakPolarHBondContact O-CB 3.34Å; R12-L113 PolarHBondContact O-N 2.83Å; S14-L113 WeakPolarHBondContact OG-CD1 3.21Å; S14-L113 WeakPolarHBondContact OG-CG 3.36Å; V25-L113 HydrophobicContact CG1-CD1 4.37Å; V111-L113 HydrophobicContact CG1-CD2 4.11Å; V111-L113 PolarHBondContact O-N 3.36Å
114	E	61.9	Low	63.7	Low	141 Å²	141	92.4 Å²	92.4	66%	0.659	48%	0.479	S	S	*	.			trans	-58	136.2	166.1	-82.3	-68	134.1	0	0	110.8	E112 F116	E112-E114 PolarHBondContact O-N 3.15Å; E114-F116 PolarHBondContact O-N 3.33Å; E114-F116 VanDerWaalsContact O-N 3.08Å
115	P	54	Low	61.1	Low	99 Å²	99	100.7 Å²	100.7	64%	0.643	51%	0.51	S	S	*	.			trans	-67	110.8	179.7	26.6	-33.5	0	0	0	111.1	C117	P115-C117 PolarHBondContact O-N 2.92Å
116	F	41.4	Very low	58.4	Low	206 Å²	206	107.5 Å²	107.5	90%	0.904	53%	0.529	S	S	*	.			trans	-56.4	91.8	-176.6	-107	-89.4	0	0	0	113.4	E114 H118	E114-F116 PolarHBondContact O-N 3.33Å; E114-F116 VanDerWaalsContact O-N 3.08Å; F116-H118 PolarHBondContact O-N 3.23Å; F116-H118 VanDerWaalsContact O-N 3.11Å
117	C	34.2	Very low	55.7	Low	122 Å²	122	112.6 Å²	112.6	82%	0.824	57%	0.565	S	S	*	*			trans	-77	100.4	177.4	-167.4	0	0	0	0	110.3	P115	P115-C117 PolarHBondContact O-N 2.92Å
118	H	30	Very low	53	Low	150 Å²	150	114.7 Å²	114.7	69%	0.694	58%	0.584	S	S	*	*			trans	-45.1	121.5	-171.9	-112.8	-38.6	0	0	0	113.5	F116 K120 K121	F116-H118 PolarHBondContact O-N 3.23Å; F116-H118 VanDerWaalsContact O-N 3.11Å; H118-K120 PolarHBondContact O-N 3.08Å; H118-K121 PolarHBondContact O-N 3.04Å
119	P	41	Very low	50.3	Low	99 Å²	99	121.7 Å²	121.7	64%	0.643	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-62.4	-24.9	-171.6	21.9	-33.2	0	0	0	113.8	K121 R122	P119-K121 PolarHBondContact O-N 3.49Å; P119-K121 VanDerWaalsContact O-N 3.07Å; P119-R122 PolarHBondContact O-N 3.5Å; P119-R122 VanDerWaalsContact O-N 3.15Å
120	K	41.2	Very low	47.6	Very low	201 Å²	201	125.7 Å²	125.7	87%	0.874	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-64	-9.8	-179.5	-67.4	-173.9	176.5	-179.6	0	115.1	H118	H118-K120 PolarHBondContact O-N 3.08Å
121	K	39.4	Very low	45	Very low	167 Å²	167	133 Å²	133	73%	0.726	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-100.1	-13.7	173.6	-74.5	-175.4	176.4	177.3	0	114.8	H118 P119 A123	H118-K121 PolarHBondContact O-N 3.04Å; P119-K121 PolarHBondContact O-N 3.49Å; P119-K121 VanDerWaalsContact O-N 3.07Å; K121-A123 PolarHBondContact O-N 3.12Å
122	R	37	Very low	42.3	Very low	197 Å²	197	136.9 Å²	136.9	74%	0.743	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-20.2	-171.2	-155.4	167.8	-175.4	169.3	-1	114.2	P119	P119-R122 PolarHBondContact O-N 3.5Å; P119-R122 VanDerWaalsContact O-N 3.15Å
123	A	37.6	Very low	39.9	Very low	85 Å²	85	141.1 Å²	141.1	70%	0.702	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-37.4	178.7	0	0	0	0	0	113.7	K121 W125	K121-A123 PolarHBondContact O-N 3.12Å; A123-W125 VanDerWaalsContact C-N 3.28Å; A123-W125 PolarHBondContact O-N 3.28Å
124	S	38.9	Very low	38.1	Very low	90 Å²	90	150.8 Å²	150.8	63%	0.629	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-25.4	-177.6	163.3	0	0	0	0	113.7
125	W	34	Very low	36.7	Very low	190 Å²	190	147.9 Å²	147.9	72%	0.72	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-13.8	-171.8	-74	77	0	0	0	114.5	A123	A123-W125 VanDerWaalsContact C-N 3.28Å; A123-W125 PolarHBondContact O-N 3.28Å
126	R	36.6	Very low	35.7	Very low	202 Å²	202	152.4 Å²	152.4	76%	0.762	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-10.2	174.8	-82.3	-171.6	166	-175.7	-4.9	114.2
127	S	37	Very low	35.2	Very low	107 Å²	107	148.6 Å²	148.6	75%	0.748	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	5.6	178.9	-168	0	0	0	0	114.3
128	S	36.2	Very low	35.3	Very low	96 Å²	96	149.5 Å²	149.5	67%	0.671	78%	0.776	S	S	*	*	S	Bend	trans	-128.4	14.2	-166.5	-167.9	0	0	0	0	114.2
129	L	35.4	Very low	35.3	Very low	148 Å²	148	150 Å²	150	78%	0.775	78%	0.783	S	S	*	*	S	Bend	trans	-122.4	-6.5	-175.1	-121	71.9	0	0	0	115.2
130	D	35	Very low	34.9	Very low	139 Å²	139	150.3 Å²	150.3	74%	0.743	79%	0.787	S	S	*	*	S	Bend	trans	-95.5	17.1	-174.9	-68.9	-46	0	0	0	114.2
131	H	34.1	Very low	34.4	Very low	176 Å²	176	146 Å²	146	82%	0.815	78%	0.778	S	S	*	*	S	Bend	trans	-127.9	27.7	-167.8	-75.6	-2.8	0	0	0	116.1
132	T	30	Very low	34.2	Very low	124 Å²	124	144.1 Å²	144.1	76%	0.761	78%	0.776	S	S	*	*			trans	-147.1	92.6	166.4	50.4	0	0	0	0	112.7
133	N	32.1	Very low	34.1	Very low	166 Å²	166	141.4 Å²	141.4	89%	0.888	77%	0.772	S	S	*	*	S	Bend	trans	-176.4	74.6	153.3	-100.9	-27.1	0	0	0	112.7
134	R	32.4	Very low	33.9	Very low	262 Å²	262	142.9 Å²	142.9	99%	0.989	77%	0.768	S	S	*	*			trans	-179.8	119.1	158.1	-102.4	162.2	-155.2	-114.9	4.9	108.6
135	G	33.7	Very low	33.5	Very low	80 Å²	80	143.6 Å²	143.6	83%	0.825	77%	0.765	S	S	*	*			trans	147.1	119.3	179.9	0	0	0	0	0	111.3
136	E	32.6	Very low	33.5	Very low	194 Å²	194	144.3 Å²	144.3	91%	0.907	77%	0.767	S	S	*	*			trans	-82.6	155	179.4	-64.3	-178.9	123.9	0	0	111.9
137	P	31.3	Very low	33.2	Very low	126 Å²	126	141.8 Å²	141.8	82%	0.818	77%	0.769	S	S	*	*			trans	-92.3	131.7	179.9	34.6	-32.2	0	0	0	113.1
138	T	35.9	Very low	32.9	Very low	140 Å²	140	145 Å²	145	86%	0.859	77%	0.774	S	S	*	*			trans	-134.9	146.4	162.2	47.3	0	0	0	0	111.4
139	L	29.3	Very low	32.8	Very low	160 Å²	160	146.2 Å²	146.2	84%	0.838	78%	0.778	S	S	*	*			trans	-67.6	141.1	-174.9	-83.7	56.8	0	0	0	111.3
140	S	33.1	Very low	32.6	Very low	106 Å²	106	146.4 Å²	146.4	74%	0.741	78%	0.78	S	S	*	*				-175.6	131.2	82.7	29.4	0	0	0	0	109.7
141	T	31.7	Very low	32.7	Very low	111 Å²	111	144.8 Å²	144.8	68%	0.681	78%	0.777	S	S	*	*				87.5	133.4	79	-44.8	0	0	0	0	112.8
142	D	34.3	Very low	32.5	Very low	127 Å²	127	142.6 Å²	142.6	68%	0.679	78%	0.775	S	S	*	*			trans	68.6	148	166.5	-69.5	-15.4	0	0	0	120.4
143	Q	34.5	Very low	32.7	Very low	140 Å²	140	143.9 Å²	143.9	65%	0.654	78%	0.776	S	S	*	*			cis	-161.2	154.7	-34.1	-131.5	179.9	83	0	0	109.7
144	N	33.6	Very low	32.9	Very low	116 Å²	116	141 Å²	141	62%	0.62	77%	0.769	S	S	*	*			trans	65.4	124.2	146	-74.5	-16.7	0	0	0	123.9
145	N	31.6	Very low	33.2	Very low	106 Å²	106	133.2 Å²	133.2	57%	0.567	75%	0.752	S	S	*	*				88.5	114.4	124.8	-78.9	-44.5	0	0	0	122.7
146	R	33.5	Very low	33	Very low	204 Å²	204	136 Å²	136	77%	0.77	75%	0.747	S	S	*	*				84	113.9	126.3	-66	167.3	-162	-163.4	0.2	120.1
147	N	30.3	Very low	32.8	Very low	150 Å²	150	131.2 Å²	131.2	80%	0.802	73%	0.727	S	S	*	*				34	115.5	125.1	-52.2	9	0	0	0	118.4
148	M	29.7	Very low	32.7	Very low	174 Å²	174	131.2 Å²	131.2	86%	0.857	71%	0.714	S	S	*	*				-164.1	152.5	111	-113.3	-176.2	164.7	0	0	114
149	T	35.7	Very low	32.5	Very low	122 Å²	122	128.3 Å²	128.3	75%	0.748	70%	0.699	S	S	*	*			trans	50.8	104	151.2	56.5	0	0	0	0	120.7
150	D	31	Very low	32.4	Very low	152 Å²	152	127.4 Å²	127.4	81%	0.813	69%	0.689	S	S	*	*				-36.6	155	129.4	-101.1	-38.9	0	0	0	112.5
151	P	36.7	Very low	32	Very low	105 Å²	105	125.9 Å²	125.9	68%	0.682	69%	0.689	S	S	*	*				-155.3	-176.8	57.4	40.6	-18.8	0	0	0	118.1
152	V	30.2	Very low	31.8	Very low	129 Å²	129	130.7 Å²	130.7	78%	0.782	70%	0.701	S	S	*	*			trans	61.1	140	167.6	-109.9	0	0	0	0	115.5
153	I	34.2	Very low	31.3	Very low	151 Å²	151	132.9 Å²	132.9	77%	0.774	71%	0.708	S	S	*	*			cis	-137.1	122.1	19.7	-56.8	171.1	0	0	0	110.7
154	S	35.6	Very low	30.9	Very low	107 Å²	107	134.1 Å²	134.1	75%	0.748	71%	0.713	S	S	*	*			trans	-98.2	167.2	144.3	-34.7	0	0	0	0	107.2
155	P	37.9	Very low	30.4	Very low	97 Å²	97	135.2 Å²	135.2	63%	0.63	72%	0.719	S	S	*	*				-161.7	-171	64.6	38.1	-12.8	0	0	0	117.6
156	I	29.8	Very low	30.1	Very low	139 Å²	139	134.1 Å²	134.1	71%	0.713	72%	0.72	S	S	*	*			trans	76.6	137.6	134.8	-95.2	164.9	0	0	0	117.9
157	L	29.9	Very low	29.9	Very low	93 Å²	93	131.9 Å²	131.9	49%	0.487	72%	0.718	S	S	.	*			cis	-143.4	148.2	6.5	-88.9	160.4	0	0	0	109	K193	L157-K193 VanDerWaalsContact CD1-NZ 3.29Å; L157-K193 VanDerWaalsContact CD2-NZ 3.29Å
158	K	28.9	Very low	29.7	Very low	126 Å²	126	128.7 Å²	128.7	55%	0.548	71%	0.708	S	S	.	*				58	142.7	77.3	-66.3	-164	-161.4	-166.8	0	114.6	D195	K158-D195 WeakPolarHBondContact CD-OD1 3.38Å; K158-D195 IonicContact NZ-OD1 2.68Å; K158-D195 PolarHBondContact NZ-OD1 3.49Å; K158-D195 IonicContact NZ-OD2 2.7Å; K158-D195 PolarHBondContact NZ-OD2 2.98Å
159	S	30	Very low	29.7	Very low	79 Å²	79	123.2 Å²	123.2	55%	0.552	69%	0.686	S	S	*	*			cis	-171.5	164.3	7.5	32.6	0	0	0	0	114.3
160	K	27.7	Very low	29.5	Very low	142 Å²	142	124 Å²	124	62%	0.617	68%	0.679	S	S	*	*			trans	54.9	112.6	143.1	-73.1	175.4	173.6	-171.5	0	119.9	I194 D195	K160-I194 PolarHBondContact NZ-O 3.31Å; K160-D195 PolarHBondContact NZ-O 3.31Å
161	G	25.6	Very low	29.4	Very low	73 Å²	73	120.3 Å²	120.3	75%	0.753	67%	0.665	S	S	*	*				89.1	119.6	111.2	0	0	0	0	0	119.4
162	F	26.7	Very low	29.1	Very low	212 Å²	212	122.7 Å²	122.7	93%	0.93	66%	0.664	S	S	*	*			trans	-151.6	152.8	130.1	-123.4	-83.5	0	0	0	108.9
163	E	24.8	Very low	29.2	Very low	174 Å²	174	123.8 Å²	123.8	81%	0.813	66%	0.661	S	S	*	*			trans	-93.3	165.1	177.7	-67.2	170.1	121.6	0	0	111.1
164	E	24.7	Very low	29.2	Very low	166 Å²	166	122.3 Å²	122.3	78%	0.776	66%	0.664	S	S	*	*			trans	67.3	148.3	158.9	-73.4	-170	-175.1	0	0	122.1
165	N	22.7	Very low	28.9	Very low	138 Å²	138	123.1 Å²	123.1	74%	0.738	66%	0.656	S	S	*	*			trans	52.3	84.4	143.9	-62.7	-33.5	0	0	0	120.5
166	S	26.9	Very low	28.5	Very low	84 Å²	84	126.2 Å²	126.2	59%	0.587	67%	0.668	S	S	*	*			trans	-163.5	133	140.5	44.2	0	0	0	0	110.8	Y638	S166-Y638 WeakPolarHBondContact CB-OH 3.45Å; S166-Y638 PolarHBondContact OG-OH 2.99Å; S166-Y638 VanDerWaalsContact OG-OH 3.12Å
167	H	29	Very low	28.5	Very low	156 Å²	156	125.6 Å²	125.6	72%	0.722	67%	0.674	S	S	*	*				68.1	90.6	57.5	-75	-114.1	0	0	0	113.9	Y638	H167-Y638 PolarHBondContact O-OH 2.91Å
168	S	25.7	Very low	28.6	Very low	84 Å²	84	131.5 Å²	131.5	59%	0.587	69%	0.69	S	S	*	*			trans	-148.4	77.5	167.8	65.5	0	0	0	0	111.9
169	S	30.9	Very low	28.8	Very low	58 Å²	58	130.7 Å²	130.7	41%	0.406	69%	0.691	S	S	.	*			trans	-85.4	114.4	164.1	47	0	0	0	0	108.9	C171	S169-C171 PolarHBondContact O-N 2.98Å
170	F	30.4	Very low	28.9	Very low	139 Å²	139	131.8 Å²	131.8	61%	0.61	70%	0.695	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79.6	106.1	175.6	-86.6	-91.6	0	0	0	110.2
171	C	30.1	Very low	29.1	Very low	74 Å²	74	128.5 Å²	128.5	50%	0.5	69%	0.688	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.3	126.6	163.3	-61.3	0	0	0	0	108.9	S169	S169-C171 PolarHBondContact O-N 2.98Å
172	F	29.2	Very low	29.3	Very low	155 Å²	155	133.8 Å²	133.8	68%	0.68	69%	0.693	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99.6	116.8	163.4	-79.6	-93.3	0	0	0	108.9
173	E	32.1	Very low	29.6	Very low	152 Å²	152	132.7 Å²	132.7	71%	0.71	69%	0.691	S	S	*	*			trans	-124	136.8	165.7	-71.3	-176.8	128.1	0	0	108.2
174	S	33.9	Very low	29.7	Very low	120 Å²	120	134.7 Å²	134.7	84%	0.839	69%	0.691	S	S	*	*			trans	-90.1	130.6	-175.5	54.6	0	0	0	0	112.1
175	E	30	Very low	30.1	Very low	124 Å²	124	136.2 Å²	136.2	58%	0.579	70%	0.698	S	S	*	*			trans	-53.9	142.7	179.4	-63.8	177	-179.8	0	0	113.8
176	N	30.2	Very low	30.2	Very low	163 Å²	163	136.1 Å²	136.1	87%	0.872	70%	0.697	S	S	*	*			trans	-149.5	55.8	151.6	-155.9	24.1	0	0	0	113.5
177	C	28.6	Very low	30.4	Very low	126 Å²	126	139.2 Å²	139.2	85%	0.851	71%	0.712	S	S	*	*			trans	-148.5	122.7	166.9	-89.9	0	0	0	0	112.2
178	R	32.3	Very low	30.4	Very low	216 Å²	216	137.1 Å²	137.1	82%	0.815	72%	0.715	S	S	*	*			trans	-138.1	142.7	164.7	-65.9	-178.6	178.3	-177.6	-1.2	106.1
179	N	33	Very low	30.5	Very low	109 Å²	109	138.2 Å²	138.2	58%	0.583	72%	0.722	S	S	*	*				-150.3	165.9	53.1	-102.3	22.1	0	0	0	111.4	S976	N179-S976 PolarHBondContact ND2-O 3.46Å; N179-S976 PolarHBondContact ND2-OXT 3.48Å
180	T	32.4	Very low	30.6	Very low	102 Å²	102	141.9 Å²	141.9	63%	0.626	74%	0.737	S	S	*	*			cis	-143.9	-73.1	-41.4	-1.1	0	0	0	0	115.2
181	P	32	Very low	30.6	Very low	73 Å²	73	141.8 Å²	141.8	47%	0.474	74%	0.743	S	S	.	*			trans	-137.5	163.5	-146.3	41.3	-22.4	0	0	0	119.7
182	E	29.7	Very low	30.5	Very low	184 Å²	184	146.8 Å²	146.8	86%	0.86	76%	0.763	S	S	*	*			trans	64.4	144.3	144.7	-71.6	161.2	175.3	0	0	120.4
183	E	32.6	Very low	30.6	Very low	190 Å²	190	144.6 Å²	144.6	89%	0.888	75%	0.754	S	S	*	*			cis	-119.9	-178.3	28.2	-62.4	-177.3	121.3	0	0	116.3
184	R	26.4	Very low	30.6	Very low	216 Å²	216	144.6 Å²	144.6	82%	0.815	76%	0.757	S	S	*	*			trans	-141.2	155.5	174.7	-78	-173.4	177.9	-175.5	2.1	112
185	H	34.7	Very low	30.5	Very low	197 Å²	197	141.8 Å²	141.8	91%	0.912	73%	0.733	S	S	*	*			trans	-147.7	146.7	149.2	-93.3	-65.1	0	0	0	112
186	D	24.2	Very low	30.6	Very low	136 Å²	136	141.5 Å²	141.5	73%	0.727	74%	0.735	S	S	*	*			trans	-102.1	153.6	-172.3	-45.3	-88.1	0	0	0	114.2
187	V	31.6	Very low	30.7	Very low	149 Å²	149	141.4 Å²	141.4	90%	0.903	73%	0.73	S	S	*	*			trans	-145.2	139.2	148.7	-177.5	0	0	0	0	112.9
188	S	28.6	Very low	30.8	Very low	112 Å²	112	142.2 Å²	142.2	78%	0.783	73%	0.725	S	S	*	*			trans	-38.3	175.6	177.4	-155.5	0	0	0	0	122.9
189	C	28.5	Very low	30.7	Very low	107 Å²	107	137.1 Å²	137.1	72%	0.723	72%	0.718	S	S	*	*			trans	-105.7	172.3	-171.3	-49.9	0	0	0	0	114.8
190	N	30.9	Very low	30.5	Very low	135 Å²	135	139.5 Å²	139.5	72%	0.722	73%	0.729	S	S	*	*				172.1	128.7	118.7	-89.5	-44.6	0	0	0	118
191	N	30.4	Very low	30.5	Very low	138 Å²	138	139.4 Å²	139.4	74%	0.738	73%	0.733	S	S	*	*			trans	44.1	132.9	136.8	-54.9	-38.6	0	0	0	125
192	L	29.3	Very low	30.3	Very low	178 Å²	178	142.7 Å²	142.7	93%	0.932	75%	0.747	S	S	*	*				-164.4	177.6	124.1	-106.4	166	0	0	0	112.8
193	K	30.4	Very low	30.3	Very low	109 Å²	109	141.3 Å²	141.3	47%	0.474	74%	0.744	S	S	.	*			trans	-167.6	151	-148.8	168.9	-168.9	171.4	-165.6	0	114.5	L157	L157-K193 VanDerWaalsContact CD1-NZ 3.29Å; L157-K193 VanDerWaalsContact CD2-NZ 3.29Å
194	I	33.5	Very low	30.3	Very low	152 Å²	152	137 Å²	137	78%	0.779	74%	0.735	S	S	*	*			trans	-176.4	170.3	149.8	-97.2	151.8	0	0	0	112	K160	K160-I194 PolarHBondContact NZ-O 3.31Å
195	D	30.4	Very low	30.3	Very low	61 Å²	61	134.2 Å²	134.2	33%	0.326	74%	0.735	S	S	.	*			trans	-98.4	-128.9	-157	-75.6	-80.1	0	0	0	116.9	K158 K160	K158-D195 WeakPolarHBondContact CD-OD1 3.38Å; K158-D195 IonicContact NZ-OD1 2.68Å; K158-D195 PolarHBondContact NZ-OD1 3.49Å; K158-D195 IonicContact NZ-OD2 2.7Å; K158-D195 PolarHBondContact NZ-OD2 2.98Å; K160-D195 PolarHBondContact NZ-O 3.31Å
196	N	33.8	Very low	30	Very low	119 Å²	119	131.7 Å²	131.7	64%	0.636	73%	0.729	S	S	*	*			cis	-163.6	124.8	-2.7	-169.9	56.7	0	0	0	116.2
197	Q	31.6	Very low	30.2	Very low	161 Å²	161	129.9 Å²	129.9	75%	0.752	73%	0.727	S	S	*	*			trans	76.1	162.5	146.2	-79.1	170	-1.9	0	0	126
198	N	30.6	Very low	30.1	Very low	142 Å²	142	129.8 Å²	129.8	76%	0.759	72%	0.721	S	S	*	*			trans	83.8	145.5	173.7	-62.9	-3	0	0	0	119.2
199	T	29.3	Very low	30	Very low	109 Å²	109	133.8 Å²	133.8	67%	0.669	73%	0.727	S	S	*	*				-175.8	157.9	-52	24	0	0	0	0	111.7
200	I	29.9	Very low	30.1	Very low	159 Å²	159	132.6 Å²	132.6	82%	0.815	73%	0.732	S	S	*	*			trans	72.3	159	158.7	-68.3	152.6	0	0	0	116.9
201	S	31.4	Very low	30	Very low	100 Å²	100	131.6 Å²	131.6	70%	0.699	74%	0.736	S	S	*	*				-175.1	170.8	-54.2	85.2	0	0	0	0	107.4
202	D	28.6	Very low	29.8	Very low	143 Å²	143	129.2 Å²	129.2	77%	0.765	74%	0.735	S	S	*	*			cis	-160.8	-153.7	-14.7	-152.7	-90.9	0	0	0	108.3
203	L	30.5	Very low	29.9	Very low	154 Å²	154	127.5 Å²	127.5	81%	0.806	73%	0.732	S	S	*	*			trans	76.5	150.5	164	-52.7	171.9	0	0	0	118.7
204	S	31	Very low	30	Very low	101 Å²	101	127 Å²	127	71%	0.706	74%	0.743	S	S	*	*			cis	-165.6	119.9	-28.3	56.4	0	0	0	0	113.9
205	L	27.6	Very low	29.7	Very low	156 Å²	156	127.4 Å²	127.4	82%	0.817	75%	0.746	S	S	*	*			trans	21.1	157	140.7	-85.4	164.1	0	0	0	125.6
206	N	28.7	Very low	29.6	Very low	145 Å²	145	131.1 Å²	131.1	78%	0.775	78%	0.776	S	S	*	*			trans	95.3	143.8	158.8	-57.3	-38.6	0	0	0	117.7
207	S	27.7	Very low	29.2	Very low	98 Å²	98	130 Å²	130	69%	0.685	78%	0.783	S	S	*	*			cis	-169.2	-177.8	-9.9	50.8	0	0	0	0	113.1
208	L	29.1	Very low	29.1	Very low	147 Å²	147	130.5 Å²	130.5	77%	0.77	79%	0.79	S	S	*	*			trans	70.5	133.2	179.5	-74.2	70.5	0	0	0	115.9
209	Q	26	Very low	28.9	Very low	196 Å²	196	131.2 Å²	131.2	92%	0.916	79%	0.793	S	S	*	*			cis	95.5	116.5	18.8	-64.2	-174	-71.5	0	0	117.3
210	G	30.6	Very low	28.7	Very low	81 Å²	81	132.1 Å²	132.1	84%	0.835	80%	0.801	S	S	*	*			trans	-171.1	144.2	170.2	0	0	0	0	0	111.6
211	S	29.7	Very low	28.6	Very low	115 Å²	115	131 Å²	131	80%	0.804	80%	0.801	S	S	*	*			trans	-72.7	154.7	-176.6	55.2	0	0	0	0	112.7
212	A	26.8	Very low	28.6	Very low	87 Å²	87	134.4 Å²	134.4	72%	0.719	81%	0.806	S	S	*	*			cis	60.2	145.8	49	0	0	0	0	0	113.3
213	T	30.4	Very low	28.6	Very low	142 Å²	142	132.7 Å²	132.7	87%	0.871	80%	0.802	S	S	*	*			cis	-87.5	-149.4	2.3	55.7	0	0	0	0	110.9
214	S	33.1	Very low	28.4	Very low	99 Å²	99	132.8 Å²	132.8	69%	0.692	80%	0.803	S	S	*	*			cis	-149.7	-167.6	7.2	71.9	0	0	0	0	111.1
215	N	26.6	Very low	28.1	Very low	160 Å²	160	137.4 Å²	137.4	86%	0.856	81%	0.811	S	S	*	*			trans	-142.8	139.3	176.8	-71.2	-59	0	0	0	112.3
216	C	28	Very low	28.2	Very low	140 Å²	140	135.6 Å²	135.6	95%	0.946	81%	0.806	S	S	*	*			trans	-134.9	125	149	-97.1	0	0	0	0	107.3
217	A	26.1	Very low	28	Very low	96 Å²	96	136.2 Å²	136.2	79%	0.793	80%	0.804	S	S	*	*			trans	-109.8	118.2	-166.9	0	0	0	0	0	112.4
218	L	28.5	Very low	28	Very low	171 Å²	171	137.4 Å²	137.4	90%	0.895	81%	0.807	S	S	*	*			trans	-134.6	116.6	158.8	-76.7	178.5	0	0	0	110.2
219	L	27.3	Very low	27.8	Very low	156 Å²	156	135.4 Å²	135.4	82%	0.817	80%	0.798	S	S	*	*			trans	-0.5	122.4	167.5	-55.7	173.2	0	0	0	118.7
220	P	24.8	Very low	28	Very low	128 Å²	128	135 Å²	135	83%	0.831	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-75.9	128.1	165.1	32	-31.9	0	0	0	110.8
221	V	29.1	Very low	28.1	Very low	135 Å²	135	139 Å²	139	82%	0.818	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-90.9	127.4	168.5	-179.6	0	0	0	0	108.5
222	E	29.6	Very low	28.4	Very low	173 Å²	173	141.2 Å²	141.2	81%	0.808	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-68	126.7	-178.6	-64.6	-173.1	135.8	0	0	111.7	L224	E222-L224 PolarHBondContact O-N 3.26Å
223	P	28.8	Very low	28.8	Very low	106 Å²	106	141.7 Å²	141.7	69%	0.688	78%	0.778	S	S	*	*			trans	-76.7	104.4	170.2	30.3	-31.8	0	0	0	109.9	F225	P223-F225 VanDerWaalsContact C-N 3.33Å; P223-F225 PolarHBondContact O-N 2.98Å
224	L	26.9	Very low	29.1	Very low	157 Å²	157	139.5 Å²	139.5	82%	0.822	76%	0.76	S	S	*	*			trans	-68.3	86	173.6	-79.9	168.9	0	0	0	111.3	E222 V226	E222-L224 PolarHBondContact O-N 3.26Å; L224-V226 PolarHBondContact O-N 3.37Å
225	F	25.1	Very low	29.3	Very low	197 Å²	197	139.3 Å²	139.3	86%	0.864	76%	0.756	S	S	*	*			trans	-68.1	113.4	167	-99.4	-97	0	0	0	110.5	P223	P223-F225 VanDerWaalsContact C-N 3.33Å; P223-F225 PolarHBondContact O-N 2.98Å
226	V	28.6	Very low	29.8	Very low	119 Å²	119	134 Å²	134	72%	0.721	74%	0.735	S	S	*	*			trans	-131.6	131.2	165.6	-179.8	0	0	0	0	108.3	L224	L224-V226 PolarHBondContact O-N 3.37Å
227	Q	25.4	Very low	30.5	Very low	157 Å²	157	131.7 Å²	131.7	73%	0.734	71%	0.712	S	S	*	*			trans	-114.8	103.8	-169.1	174.1	-171.8	-24.7	0	0	109.7
228	T	27.1	Very low	31.3	Very low	123 Å²	123	134.7 Å²	134.7	76%	0.755	70%	0.703	S	S	*	*			trans	-153.1	155.7	174	47.7	0	0	0	0	112
229	D	26.2	Very low	31.9	Very low	105 Å²	105	128.9 Å²	128.9	56%	0.561	68%	0.68	S	S	*	*			trans	-83.3	149.1	-161.7	-51.8	-88.5	0	0	0	116.8	H231	D229-H231 VanDerWaalsContact C-N 3.35Å; D229-H231 PolarHBondContact O-N 3.08Å; D229-H231 PolarHBondContact O-ND1 3.22Å
230	Q	28.3	Very low	32.5	Very low	189 Å²	189	124 Å²	124	88%	0.883	66%	0.661	S	S	*	*	S	Bend	trans	42.8	38	157.1	-60.1	-161.5	15.5	0	0	118.8
231	H	34	Very low	33.4	Very low	165 Å²	165	121.1 Å²	121.1	76%	0.764	64%	0.642	S	S	*	*			trans	-124	132.5	172.5	-73.4	77.6	0	0	0	112.5	D229 N233	D229-H231 VanDerWaalsContact C-N 3.35Å; D229-H231 PolarHBondContact O-N 3.08Å; D229-H231 PolarHBondContact O-ND1 3.22Å; H231-N233 PolarHBondContact O-N 3.08Å
232	F	35.3	Very low	34.4	Very low	161 Å²	161	117.8 Å²	117.8	71%	0.706	62%	0.622	S	S	*	*			trans	-54.9	121.7	169	-94.7	-99.4	0	0	0	109.2	I234 I237 L848	F232-I234 HydrophobicContact CB-CG1 4.34Å; F232-I234 PolarHBondContact O-N 2.88Å; F232-I237 HydrophobicContact CD1-CD1 4.23Å; F232-L848 HydrophobicContact CD2-CD2 4.44Å
233	N	35.2	Very low	35.1	Very low	96 Å²	96	113.5 Å²	113.5	51%	0.513	61%	0.608	S	S	.	*			trans	-78	68.8	-179.2	-163.9	-21.3	0	0	0	110.6	H231 P235 A236 I237	H231-N233 PolarHBondContact O-N 3.08Å; N233-P235 VanDerWaalsContact C-CD 3.42Å; N233-P235 VanDerWaalsContact C-N 3.26Å; N233-P235 WeakPolarHBondContact OD1-CD 3.4Å; N233-A236 HydrophobicContact CB-CB 4.05Å; N233-A236 PolarHBondContact O-N 3.07Å; N233-A236 WeakPolarHBondContact OD1-CB 3.18Å; N233-A236 PolarHBondContact OD1-N 2.95Å; N233-I237 WeakPolarHBondContact O-CG1 3.3Å; N233-I237 PolarHBondContact O-N 3.48Å
234	I	38	Very low	35.8	Very low	97 Å²	97	113.3 Å²	113.3	50%	0.497	60%	0.6	S	S	.	*	H	α-helix	trans	-53.2	-37.5	176.8	-64.7	171.3	0	0	0	111.6	F232 R238	F232-I234 HydrophobicContact CB-CG1 4.34Å; F232-I234 PolarHBondContact O-N 2.88Å; I234-R238 WeakPolarHBondContact O-CB 3.16Å; I234-R238 PolarHBondContact O-N 3.17Å
235	P	36.5	Very low	36.6	Very low	94 Å²	94	110.6 Å²	110.6	61%	0.61	58%	0.583	S	S	*	*	H	α-helix	trans	-59.8	-48.2	170.8	-26.4	36.3	0	0	0	113.8	N233 R238 A239	N233-P235 VanDerWaalsContact C-CD 3.42Å; N233-P235 VanDerWaalsContact C-N 3.26Å; N233-P235 WeakPolarHBondContact OD1-CD 3.4Å; P235-R238 PolarHBondContact O-N 3.09Å; P235-A239 WeakPolarHBondContact O-CB 3.11Å; P235-A239 PolarHBondContact O-N 3.26Å
236	A	36.8	Very low	37.4	Very low	50 Å²	50	105.8 Å²	105.8	41%	0.413	57%	0.567	S	S	.	*	H	α-helix	trans	-67.7	-38.7	178.8	0	0	0	0	0	112.5	N233 A239 A240	N233-A236 HydrophobicContact CB-CB 4.05Å; N233-A236 PolarHBondContact O-N 3.07Å; N233-A236 WeakPolarHBondContact OD1-CB 3.18Å; N233-A236 PolarHBondContact OD1-N 2.95Å; A236-A239 PolarHBondContact O-N 3.06Å; A236-A240 WeakPolarHBondContact O-CB 3.18Å; A236-A240 PolarHBondContact O-N 3.04Å
237	I	41.8	Very low	37.8	Very low	90 Å²	90	105.5 Å²	105.5	46%	0.462	56%	0.56	S	S	.	*	H	α-helix	trans	-62.7	-48.5	173.1	-65.9	168.7	0	0	0	109.6	F232 N233 A239 A240 T241	F232-I237 HydrophobicContact CD1-CD1 4.23Å; N233-I237 WeakPolarHBondContact O-CG1 3.3Å; N233-I237 PolarHBondContact O-N 3.48Å; I237-A239 VanDerWaalsContact C-N 3.3Å; I237-A239 PolarHBondContact O-N 2.68Å; I237-A240 PolarHBondContact O-N 3.44Å; I237-T241 WeakPolarHBondContact O-CB 3.23Å; I237-T241 PolarHBondContact O-N 3.1Å; I237-T241 PolarHBondContact O-OG1 2.84Å
238	R	42.9	Very low	38.6	Very low	160 Å²	160	104.1 Å²	104.1	60%	0.604	56%	0.556	S	S	*	*	H	α-helix	trans	-62.5	-35.9	178.8	-172.8	177.1	-70.3	162.5	-2.9	112.1	I234 P235 T242	I234-R238 WeakPolarHBondContact O-CB 3.16Å; I234-R238 PolarHBondContact O-N 3.17Å; P235-R238 PolarHBondContact O-N 3.09Å; R238-T242 PolarHBondContact O-N 3.25Å; R238-T242 PolarHBondContact O-OG1 3.49Å; R238-T242 VanDerWaalsContact O-OG1 3.11Å
239	A	42.9	Very low	39.2	Very low	49 Å²	49	104.2 Å²	104.2	41%	0.405	55%	0.548	S	S	.	.	H	α-helix	trans	-69	-42.6	173.5	0	0	0	0	0	112.5	P235 A236 I237 T241 T242 V243	P235-A239 WeakPolarHBondContact O-CB 3.11Å; P235-A239 PolarHBondContact O-N 3.26Å; A236-A239 PolarHBondContact O-N 3.06Å; I237-A239 VanDerWaalsContact C-N 3.3Å; I237-A239 PolarHBondContact O-N 2.68Å; A239-T241 VanDerWaalsContact C-N 3.32Å; A239-T241 PolarHBondContact O-N 3.26Å; A239-T242 PolarHBondContact O-N 2.94Å; A239-T242 PolarHBondContact O-OG1 2.83Å; A239-V243 WeakPolarHBondContact O-CB 3.31Å; A239-V243 VanDerWaalsContact O-CG2 3.32Å; A239-V243 WeakPolarHBondContact O-CG2 3.38Å; A239-V243 PolarHBondContact O-N 3.34Å
240	A	40.1	Very low	39.7	Very low	52 Å²	52	105.2 Å²	105.2	43%	0.43	55%	0.554	S	S	.	*	H	α-helix	trans	-63	-39.4	173.1	0	0	0	0	0	111.4	A236 I237 V243 L244	A236-A240 WeakPolarHBondContact O-CB 3.18Å; A236-A240 PolarHBondContact O-N 3.04Å; I237-A240 PolarHBondContact O-N 3.44Å; A240-V243 PolarHBondContact O-N 3.48Å; A240-L244 WeakPolarHBondContact O-CB 3.37Å; A240-L244 WeakPolarHBondContact O-CG 3.44Å; A240-L244 PolarHBondContact O-N 2.82Å
241	T	43.9	Very low	39.9	Very low	68 Å²	68	103.4 Å²	103.4	42%	0.417	55%	0.55	S	S	.	*	H	α-helix	trans	-66.2	-41.8	175.4	-52.6	0	0	0	0	112.1	I237 A239 L244 Q245	I237-T241 WeakPolarHBondContact O-CB 3.23Å; I237-T241 PolarHBondContact O-N 3.1Å; I237-T241 PolarHBondContact O-OG1 2.84Å; A239-T241 VanDerWaalsContact C-N 3.32Å; A239-T241 PolarHBondContact O-N 3.26Å; T241-L244 PolarHBondContact O-N 3.47Å; T241-Q245 WeakPolarHBondContact O-CB 3.41Å; T241-Q245 WeakPolarHBondContact O-CG 3.27Å; T241-Q245 PolarHBondContact O-N 3.43Å
242	T	48.2	Very low	39.7	Very low	65 Å²	65	101.7 Å²	101.7	40%	0.399	55%	0.547	S	S	.	.	H	α-helix	trans	-72.7	-31.2	175.9	50.7	0	0	0	0	112.9	R238 A239 N246	R238-T242 PolarHBondContact O-N 3.25Å; R238-T242 PolarHBondContact O-OG1 3.49Å; R238-T242 VanDerWaalsContact O-OG1 3.11Å; A239-T242 PolarHBondContact O-N 2.94Å; A239-T242 PolarHBondContact O-OG1 2.83Å; T242-N246 VanDerWaalsContact O-CB 3.27Å; T242-N246 WeakPolarHBondContact O-CB 3.39Å; T242-N246 VanDerWaalsContact O-CG 3.24Å; T242-N246 PolarHBondContact O-N 3.21Å; T242-N246 PolarHBondContact O-ND2 3.36Å
243	V	45.7	Very low	39.4	Very low	84 Å²	84	102 Å²	102	51%	0.509	55%	0.55	S	S	.	*	H	α-helix	trans	-64	-44.2	168.8	169.2	0	0	0	0	110.5	A239 A240 N246 L247	A239-V243 WeakPolarHBondContact O-CB 3.31Å; A239-V243 VanDerWaalsContact O-CG2 3.32Å; A239-V243 WeakPolarHBondContact O-CG2 3.38Å; A239-V243 PolarHBondContact O-N 3.34Å; A240-V243 PolarHBondContact O-N 3.48Å; V243-N246 PolarHBondContact O-N 3.28Å; V243-L247 HydrophobicContact CG1-CD1 3.95Å; V243-L247 WeakPolarHBondContact O-CB 3.41Å; V243-L247 VanDerWaalsContact O-CG 3.29Å; V243-L247 WeakPolarHBondContact O-CG 3.4Å; V243-L247 PolarHBondContact O-N 3.07Å
244	L	42.5	Very low	39	Very low	101 Å²	101	103.4 Å²	103.4	53%	0.529	57%	0.565	S	S	.	*	H	α-helix	trans	-65.7	-41	175.5	-75.7	167.1	0	0	0	112.8	A240 T241 L247 I248	A240-L244 WeakPolarHBondContact O-CB 3.37Å; A240-L244 WeakPolarHBondContact O-CG 3.44Å; A240-L244 PolarHBondContact O-N 2.82Å; T241-L244 PolarHBondContact O-N 3.47Å; L244-L247 PolarHBondContact O-N 3.48Å; L244-I248 WeakPolarHBondContact O-CB 3.47Å; L244-I248 WeakPolarHBondContact O-CD1 3.43Å; L244-I248 VanDerWaalsContact O-CG1 3.22Å; L244-I248 WeakPolarHBondContact O-CG1 3.45Å; L244-I248 PolarHBondContact O-N 3.19Å
245	Q	44.1	Very low	38.7	Very low	101 Å²	101	108 Å²	108	47%	0.472	58%	0.581	S	S	.	*	H	α-helix	trans	-64.1	-44.2	174	-77.7	-179.9	-74.8	0	0	111.6	T241 L247 I248 Q249	T241-Q245 WeakPolarHBondContact O-CB 3.41Å; T241-Q245 WeakPolarHBondContact O-CG 3.27Å; T241-Q245 PolarHBondContact O-N 3.43Å; Q245-L247 VanDerWaalsContact C-N 3.27Å; Q245-L247 PolarHBondContact O-N 3.41Å; Q245-I248 PolarHBondContact O-N 3.45Å; Q245-Q249 VanDerWaalsContact O-CB 3.27Å; Q245-Q249 WeakPolarHBondContact O-CB 3.43Å; Q245-Q249 VanDerWaalsContact O-CG 3.24Å; Q245-Q249 WeakPolarHBondContact O-CG 3.34Å; Q245-Q249 PolarHBondContact O-N 2.89Å; Q245-Q249 PolarHBondContact O-OE1 3.24Å
246	N	41.3	Very low	38.3	Very low	96 Å²	96	109.3 Å²	109.3	51%	0.513	59%	0.592	S	S	.	*	H	α-helix	trans	-65.1	-27.9	175.8	-74.7	-41.8	0	0	0	113	T242 V243 N250	T242-N246 VanDerWaalsContact O-CB 3.27Å; T242-N246 WeakPolarHBondContact O-CB 3.39Å; T242-N246 VanDerWaalsContact O-CG 3.24Å; T242-N246 PolarHBondContact O-N 3.21Å; T242-N246 PolarHBondContact O-ND2 3.36Å; V243-N246 PolarHBondContact O-N 3.28Å; N246-N250 PolarHBondContact O-ND2 3.17Å
247	L	37.5	Very low	37.8	Very low	112 Å²	112	115.1 Å²	115.1	59%	0.586	62%	0.616	S	S	*	*	H	α-helix	trans	-74.6	-44.2	171.3	-73	166.1	0	0	0	111.5	V243 L244 Q245 Q249 N250	V243-L247 HydrophobicContact CG1-CD1 3.95Å; V243-L247 WeakPolarHBondContact O-CB 3.41Å; V243-L247 VanDerWaalsContact O-CG 3.29Å; V243-L247 WeakPolarHBondContact O-CG 3.4Å; V243-L247 PolarHBondContact O-N 3.07Å; L244-L247 PolarHBondContact O-N 3.48Å; Q245-L247 VanDerWaalsContact C-N 3.27Å; Q245-L247 PolarHBondContact O-N 3.41Å; L247-Q249 VanDerWaalsContact C-N 3.3Å; L247-Q249 PolarHBondContact O-N 2.99Å; L247-N250 PolarHBondContact O-N 3.5Å
248	I	41.6	Very low	37.1	Very low	128 Å²	128	117.5 Å²	117.5	66%	0.656	63%	0.629	S	S	*	*	H	α-helix	trans	-69.9	-24.2	-179.7	-68.5	165.5	0	0	0	112.5	L244 Q245	L244-I248 WeakPolarHBondContact O-CB 3.47Å; L244-I248 WeakPolarHBondContact O-CD1 3.43Å; L244-I248 VanDerWaalsContact O-CG1 3.22Å; L244-I248 WeakPolarHBondContact O-CG1 3.45Å; L244-I248 PolarHBondContact O-N 3.19Å; Q245-I248 PolarHBondContact O-N 3.45Å
249	Q	39.9	Very low	36.7	Very low	125 Å²	125	116.1 Å²	116.1	58%	0.584	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-4.8	-178.4	-71.1	176.9	-56.8	0	0	114.8	Q245 L247	Q245-Q249 VanDerWaalsContact O-CB 3.27Å; Q245-Q249 WeakPolarHBondContact O-CB 3.43Å; Q245-Q249 VanDerWaalsContact O-CG 3.24Å; Q245-Q249 WeakPolarHBondContact O-CG 3.34Å; Q245-Q249 PolarHBondContact O-N 2.89Å; Q245-Q249 PolarHBondContact O-OE1 3.24Å; L247-Q249 VanDerWaalsContact C-N 3.3Å; L247-Q249 PolarHBondContact O-N 2.99Å
250	N	36.9	Very low	36	Very low	126 Å²	126	121 Å²	121	67%	0.674	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	-17.7	-178.8	-88.1	-68.2	0	0	0	115.2	N246 L247 N252	N246-N250 PolarHBondContact O-ND2 3.17Å; L247-N250 PolarHBondContact O-N 3.5Å; N250-N252 VanDerWaalsContact C-N 3.27Å; N250-N252 PolarHBondContact O-N 3.12Å
251	D	33.1	Very low	35.5	Very low	151 Å²	151	122.2 Å²	122.2	81%	0.807	67%	0.669	S	S	*	*			trans	-82.3	67	175.6	-80.9	-38.1	0	0	0	112.3
252	N	29.7	Very low	34.7	Very low	129 Å²	129	128.2 Å²	128.2	69%	0.69	69%	0.693	S	S	*	*			trans	-134.9	69.7	172.7	-93.2	-62	0	0	0	111.7	N250	N250-N252 VanDerWaalsContact C-N 3.27Å; N250-N252 PolarHBondContact O-N 3.12Å
253	Q	29	Very low	33.7	Very low	167 Å²	167	130.2 Å²	130.2	78%	0.78	71%	0.709	S	S	*	*			trans	-139.1	107.5	167.7	-79.5	-60.8	-68.4	0	0	111.3	K255	Q253-K255 PolarHBondContact O-N 2.87Å
254	P	27.7	Very low	32.7	Very low	126 Å²	126	132.8 Å²	132.8	82%	0.818	72%	0.72	S	S	*	*			trans	-76.7	121.4	176.8	30.6	-32.5	0	0	0	110.7
255	K	31.2	Very low	32.1	Very low	193 Å²	193	136.6 Å²	136.6	84%	0.839	73%	0.732	S	S	*	*			trans	-119.4	111.7	164	-76.1	-176.6	177.4	175.3	0	109.1	Q253 L257	Q253-K255 PolarHBondContact O-N 2.87Å; K255-L257 PolarHBondContact O-N 3.19Å
256	S	28	Very low	31.1	Very low	122 Å²	122	140.4 Å²	140.4	85%	0.853	75%	0.75	S	S	*	*			trans	-66.7	118.8	177.5	51.5	0	0	0	0	110.9
257	L	25.4	Very low	30.5	Very low	173 Å²	173	140.9 Å²	140.9	91%	0.906	76%	0.761	S	S	*	*			trans	-87.2	151.9	156.1	-87.5	163.4	0	0	0	109.6	K255	K255-L257 PolarHBondContact O-N 3.19Å
258	N	27.5	Very low	30.1	Very low	139 Å²	139	143.9 Å²	143.9	74%	0.743	77%	0.772	S	S	*	*			trans	-149.1	157.9	174.2	-168	19.2	0	0	0	108.6
259	I	34.8	Very low	29.7	Very low	131 Å²	131	144.2 Å²	144.2	67%	0.672	78%	0.775	S	S	*	*			trans	73.7	87.7	177.4	-46.5	174.9	0	0	0	114.3
260	D	27.8	Very low	29.6	Very low	152 Å²	152	142.8 Å²	142.8	81%	0.813	78%	0.778	S	S	*	*				43.3	135.9	113.7	-39.3	-30.8	0	0	0	120.8
261	G	28.8	Very low	30	Very low	77 Å²	77	141 Å²	141	79%	0.794	77%	0.769	S	S	*	*			trans	148.1	104.2	160.6	0	0	0	0	0	114
262	E	27.5	Very low	30.5	Very low	195 Å²	195	137.7 Å²	137.7	91%	0.911	75%	0.754	S	S	*	*			trans	-63.5	131.6	177.8	-57	174.8	121.3	0	0	112.5
263	S	27.2	Very low	31	Very low	106 Å²	106	135.8 Å²	135.8	74%	0.741	75%	0.747	S	S	*	*				171	149.6	129.1	47.9	0	0	0	0	114.9
264	L	24.3	Very low	31.9	Very low	139 Å²	139	132.1 Å²	132.1	73%	0.728	74%	0.737	S	S	*	*			trans	65.6	152.8	164.4	-89.4	70.6	0	0	0	119.2
265	F	30.1	Very low	32.7	Very low	180 Å²	180	131.6 Å²	131.6	79%	0.789	72%	0.721	S	S	*	*			trans	57.2	111.5	177.2	-54.5	-73.7	0	0	0	115.2
266	Q	24.6	Very low	33.3	Very low	182 Å²	182	128.6 Å²	128.6	85%	0.85	71%	0.712	S	S	*	*			cis	68.4	128.4	25.8	-136.9	-177.3	40.3	0	0	114.8
267	S	27.1	Very low	33.9	Very low	105 Å²	105	126.9 Å²	126.9	73%	0.734	69%	0.693	S	S	*	*			trans	91.5	139	172.7	76.1	0	0	0	0	120.2
268	E	29.8	Very low	34.7	Very low	175 Å²	175	124.4 Å²	124.4	82%	0.818	68%	0.677	S	S	*	*			trans	57.9	92	150.1	-69	170	-148.1	0	0	121.2
269	N	33.1	Very low	35.8	Very low	136 Å²	136	122.6 Å²	122.6	73%	0.727	67%	0.666	S	S	*	*			trans	-160.9	2.6	142.1	-110.3	-54.9	0	0	0	115.8	D271	N269-D271 VanDerWaalsContact C-N 3.32Å; N269-D271 PolarHBondContact O-N 2.75Å
270	S	37.8	Very low	36	Very low	94 Å²	94	119.1 Å²	119.1	66%	0.657	66%	0.657	S	S	*	*	H	α-helix	trans	-67.3	-27.8	-178.1	46.8	0	0	0	0	114.4	T274	S270-T274 PolarHBondContact O-N 3.42Å; S270-T274 PolarHBondContact O-OG1 3.29Å; S270-T274 VanDerWaalsContact O-OG1 3.05Å
271	D	45.2	Very low	36.6	Very low	88 Å²	88	120.2 Å²	120.2	47%	0.471	65%	0.65	S	S	.	*	H	α-helix	trans	-70.6	-35.2	-168.6	-168.7	25.5	0	0	0	113.5	N269 T274 K275	N269-D271 VanDerWaalsContact C-N 3.32Å; N269-D271 PolarHBondContact O-N 2.75Å; D271-T274 PolarHBondContact O-N 2.62Å; D271-K275 VanDerWaalsContact O-CB 3.29Å; D271-K275 WeakPolarHBondContact O-CB 3.35Å; D271-K275 VanDerWaalsContact O-CG 3.28Å; D271-K275 WeakPolarHBondContact O-CG 3.44Å; D271-K275 PolarHBondContact O-N 2.8Å; D271-K275 WeakPolarHBondContact OD1-CD 3.43Å; D271-K275 WeakPolarHBondContact OD1-CE 3.2Å; D271-K275 IonicContact OD1-NZ 3.68Å; D271-K275 PolarHBondContact OD1-NZ 2.92Å; D271-K275 WeakPolarHBondContact OD2-CE 3.28Å; D271-K275 IonicContact OD2-NZ 3.42Å; D271-K275 PolarHBondContact OD2-NZ 3.35Å
272	V	44.4	Very low	37.3	Very low	82 Å²	82	121.1 Å²	121.1	50%	0.497	64%	0.636	S	S	.	*	H	α-helix	trans	-66.2	-48.3	179.3	-178.2	0	0	0	0	111.1	T274 K275 M276	V272-T274 VanDerWaalsContact C-N 3.32Å; V272-T274 PolarHBondContact O-N 3.33Å; V272-K275 PolarHBondContact O-N 2.94Å; V272-M276 WeakPolarHBondContact O-CB 3.12Å; V272-M276 PolarHBondContact O-N 3.03Å
273	T	40.3	Very low	37.8	Very low	89 Å²	89	119.1 Å²	119.1	55%	0.546	62%	0.624	S	S	.	*	H	α-helix	trans	-66.6	-34.5	-180	-46.4	0	0	0	0	111.7	N277	T273-N277 WeakPolarHBondContact O-CB 3.43Å; T273-N277 PolarHBondContact O-N 3.23Å; T273-N277 PolarHBondContact O-ND2 3.19Å
274	T	46.9	Very low	38.3	Very low	91 Å²	91	116.5 Å²	116.5	56%	0.558	61%	0.609	S	S	*	*	H	α-helix	trans	-70.1	-43.4	173.7	-60.5	0	0	0	0	111.7	S270 D271 V272 N277 H278	S270-T274 PolarHBondContact O-N 3.42Å; S270-T274 PolarHBondContact O-OG1 3.29Å; S270-T274 VanDerWaalsContact O-OG1 3.05Å; D271-T274 PolarHBondContact O-N 2.62Å; V272-T274 VanDerWaalsContact C-N 3.32Å; V272-T274 PolarHBondContact O-N 3.33Å; T274-N277 PolarHBondContact O-N 2.87Å; T274-H278 WeakPolarHBondContact O-CB 3.45Å; T274-H278 PolarHBondContact O-N 2.92Å
275	K	44.4	Very low	38.9	Very low	114 Å²	114	117.4 Å²	117.4	50%	0.496	61%	0.607	S	S	.	*	H	α-helix	trans	-63.3	-42.5	174.3	-77.2	168.2	175.8	164	0	112.2	D271 V272 N277 H278 I279	D271-K275 VanDerWaalsContact O-CB 3.29Å; D271-K275 WeakPolarHBondContact O-CB 3.35Å; D271-K275 VanDerWaalsContact O-CG 3.28Å; D271-K275 WeakPolarHBondContact O-CG 3.44Å; D271-K275 PolarHBondContact O-N 2.8Å; D271-K275 WeakPolarHBondContact OD1-CD 3.43Å; D271-K275 WeakPolarHBondContact OD1-CE 3.2Å; D271-K275 IonicContact OD1-NZ 3.68Å; D271-K275 PolarHBondContact OD1-NZ 2.92Å; D271-K275 WeakPolarHBondContact OD2-CE 3.28Å; D271-K275 IonicContact OD2-NZ 3.42Å; D271-K275 PolarHBondContact OD2-NZ 3.35Å; V272-K275 PolarHBondContact O-N 2.94Å; K275-N277 PolarHBondContact O-N 3.03Å; K275-H278 PolarHBondContact O-N 3.11Å; K275-I279 WeakPolarHBondContact O-CB 3.34Å; K275-I279 VanDerWaalsContact O-CG1 3.28Å; K275-I279 WeakPolarHBondContact O-CG1 3.47Å; K275-I279 PolarHBondContact O-N 3.48Å
276	M	45	Very low	39.2	Very low	130 Å²	130	113.8 Å²	113.8	64%	0.64	60%	0.596	S	S	*	*	H	α-helix	trans	-60.1	-44.1	172.4	-79.4	-171	166.2	0	0	112.1	V272 H278 I279 A280	V272-M276 WeakPolarHBondContact O-CB 3.12Å; V272-M276 PolarHBondContact O-N 3.03Å; M276-H278 VanDerWaalsContact C-N 3.32Å; M276-H278 PolarHBondContact O-N 3.26Å; M276-I279 PolarHBondContact O-N 3.13Å; M276-A280 WeakPolarHBondContact O-CB 3.11Å; M276-A280 PolarHBondContact O-N 3.48Å
277	N	40.7	Very low	39.8	Very low	87 Å²	87	108.1 Å²	108.1	47%	0.465	58%	0.577	S	S	.	*	H	α-helix	trans	-63.2	-36.4	174.1	-91	-85.8	0	0	0	112.6	T273 T274 K275 R281	T273-N277 WeakPolarHBondContact O-CB 3.43Å; T273-N277 PolarHBondContact O-N 3.23Å; T273-N277 PolarHBondContact O-ND2 3.19Å; T274-N277 PolarHBondContact O-N 2.87Å; K275-N277 PolarHBondContact O-N 3.03Å; N277-R281 WeakPolarHBondContact O-CB 3.28Å; N277-R281 VanDerWaalsContact O-CG 3.23Å; N277-R281 WeakPolarHBondContact O-CG 3.28Å; N277-R281 PolarHBondContact O-N 3.15Å
278	H	41.7	Very low	40.1	Very low	121 Å²	121	108.4 Å²	108.4	56%	0.56	57%	0.569	S	S	*	*	H	α-helix	trans	-69.9	-42	177.4	-153.1	67.8	0	0	0	111.5	T274 K275 M276 R281 L282	T274-H278 WeakPolarHBondContact O-CB 3.45Å; T274-H278 PolarHBondContact O-N 2.92Å; K275-H278 PolarHBondContact O-N 3.11Å; M276-H278 VanDerWaalsContact C-N 3.32Å; M276-H278 PolarHBondContact O-N 3.26Å; H278-R281 PolarHBondContact O-N 3.04Å; H278-L282 WeakPolarHBondContact O-CB 3.42Å; H278-L282 VanDerWaalsContact O-CG 3.28Å; H278-L282 WeakPolarHBondContact O-CG 3.35Å; H278-L282 PolarHBondContact O-N 2.98Å
279	I	49.5	Very low	40.4	Very low	100 Å²	100	101.6 Å²	101.6	51%	0.513	54%	0.543	S	S	.	.	H	α-helix	trans	-62.4	-44.2	173.5	-68	162.9	0	0	0	111	K275 M276 L282 F283	K275-I279 WeakPolarHBondContact O-CB 3.34Å; K275-I279 VanDerWaalsContact O-CG1 3.28Å; K275-I279 WeakPolarHBondContact O-CG1 3.47Å; K275-I279 PolarHBondContact O-N 3.48Å; M276-I279 PolarHBondContact O-N 3.13Å; I279-L282 PolarHBondContact O-N 3.04Å; I279-F283 HydrophobicContact CG2-CD2 4.43Å; I279-F283 PolarHBondContact O-N 2.93Å
280	A	40.5	Very low	40.5	Very low	58 Å²	58	101.2 Å²	101.2	48%	0.479	54%	0.537	S	S	.	.	H	α-helix	trans	-62.9	-42	175.9	0	0	0	0	0	112	M276 F283 A284	M276-A280 WeakPolarHBondContact O-CB 3.11Å; M276-A280 PolarHBondContact O-N 3.48Å; A280-F283 PolarHBondContact O-N 2.8Å; A280-A284 WeakPolarHBondContact O-CB 3.2Å; A280-A284 PolarHBondContact O-N 3.28Å
281	R	40.6	Very low	40.3	Very low	176 Å²	176	101.5 Å²	101.5	66%	0.664	53%	0.53	S	S	*	.	H	α-helix	trans	-63.5	-41.1	173.4	-75.6	174.7	-175.9	-152	1.1	112	N277 H278 A284 F285	N277-R281 WeakPolarHBondContact O-CB 3.28Å; N277-R281 VanDerWaalsContact O-CG 3.23Å; N277-R281 WeakPolarHBondContact O-CG 3.28Å; N277-R281 PolarHBondContact O-N 3.15Å; H278-R281 PolarHBondContact O-N 3.04Å; R281-A284 PolarHBondContact O-N 3.43Å; R281-F285 WeakPolarHBondContact O-CB 3.44Å; R281-F285 PolarHBondContact O-N 2.94Å
282	L	43.2	Very low	39.7	Very low	96 Å²	96	100.9 Å²	100.9	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-64.7	-39.1	175.4	-73.7	165.8	0	0	0	112.2	H278 I279 F285 N286	H278-L282 WeakPolarHBondContact O-CB 3.42Å; H278-L282 VanDerWaalsContact O-CG 3.28Å; H278-L282 WeakPolarHBondContact O-CG 3.35Å; H278-L282 PolarHBondContact O-N 2.98Å; I279-L282 PolarHBondContact O-N 3.04Å; L282-F285 PolarHBondContact O-N 2.84Å; L282-N286 PolarHBondContact O-N 3.37Å
283	F	37.8	Very low	39.3	Very low	153 Å²	153	103.9 Å²	103.9	67%	0.671	54%	0.542	S	S	*	.	H	α-helix	trans	-63.7	-43.4	172.4	-109.2	-89.7	0	0	0	112.6	I279 A280 S287	I279-F283 HydrophobicContact CG2-CD2 4.43Å; I279-F283 PolarHBondContact O-N 2.93Å; A280-F283 PolarHBondContact O-N 2.8Å; F283-S287 WeakPolarHBondContact O-CB 3.47Å; F283-S287 PolarHBondContact O-N 2.75Å; F283-S287 PolarHBondContact O-OG 3.23Å
284	A	36.6	Very low	39	Very low	51 Å²	51	106.3 Å²	106.3	42%	0.421	55%	0.551	S	S	.	*	H	α-helix	trans	-64.2	-41	174.3	0	0	0	0	0	111.7	A280 R281 S287 L288	A280-A284 WeakPolarHBondContact O-CB 3.2Å; A280-A284 PolarHBondContact O-N 3.28Å; R281-A284 PolarHBondContact O-N 3.43Å; A284-S287 WeakPolarHBondContact O-CB 3.48Å; A284-S287 PolarHBondContact O-N 3.41Å; A284-L288 PolarHBondContact O-N 2.83Å
285	F	37.3	Very low	38.3	Very low	158 Å²	158	108.2 Å²	108.2	69%	0.693	56%	0.557	S	S	*	*	H	α-helix	trans	-66.9	-41	178.9	-133.1	-90.9	0	0	0	112.2	R281 L282 S287 L288 A289	R281-F285 WeakPolarHBondContact O-CB 3.44Å; R281-F285 PolarHBondContact O-N 2.94Å; L282-F285 PolarHBondContact O-N 2.84Å; F285-S287 VanDerWaalsContact C-N 3.33Å; F285-S287 PolarHBondContact O-N 3.35Å; F285-L288 PolarHBondContact O-N 3.13Å; F285-A289 VanDerWaalsContact O-CB 3.27Å; F285-A289 WeakPolarHBondContact O-CB 3.36Å; F285-A289 PolarHBondContact O-N 2.92Å
286	N	37	Very low	37.7	Very low	104 Å²	104	106.4 Å²	106.4	56%	0.556	56%	0.563	S	S	*	*	H	α-helix	trans	-62.5	-40.3	172.3	-105.7	-38	0	0	0	111.9	L282 A289 Q290	L282-N286 PolarHBondContact O-N 3.37Å; N286-A289 PolarHBondContact O-N 2.83Å; N286-Q290 WeakPolarHBondContact O-CG 3.31Å; N286-Q290 PolarHBondContact O-N 3.08Å
287	S	36.1	Very low	37.2	Very low	63 Å²	63	109 Å²	109	44%	0.441	57%	0.574	S	S	.	*	H	α-helix	trans	-63.9	-41.3	177.1	-54.8	0	0	0	0	111.8	F283 A284 F285 L291	F283-S287 WeakPolarHBondContact O-CB 3.47Å; F283-S287 PolarHBondContact O-N 2.75Å; F283-S287 PolarHBondContact O-OG 3.23Å; A284-S287 WeakPolarHBondContact O-CB 3.48Å; A284-S287 PolarHBondContact O-N 3.41Å; F285-S287 VanDerWaalsContact C-N 3.33Å; F285-S287 PolarHBondContact O-N 3.35Å; S287-L291 WeakPolarHBondContact O-CG 3.41Å; S287-L291 PolarHBondContact O-N 3.36Å
288	L	34.5	Very low	36.7	Very low	111 Å²	111	113.5 Å²	113.5	58%	0.581	59%	0.589	S	S	*	*	H	α-helix	trans	-73	-32.9	175.8	-74.6	164.4	0	0	0	113	A284 F285 L291 S292	A284-L288 PolarHBondContact O-N 2.83Å; F285-L288 PolarHBondContact O-N 3.13Å; L288-L291 HydrophobicContact CD2-CD1 4.48Å; L288-L291 PolarHBondContact O-N 3.38Å; L288-S292 PolarHBondContact O-N 3.11Å
289	A	35.9	Very low	36.1	Very low	32 Å²	32	114 Å²	114	26%	0.264	61%	0.606	S	S	.	*	H	α-helix	trans	-67.4	-35.2	174.8	0	0	0	0	0	112.4	F285 N286 L291 S292 Q293	F285-A289 VanDerWaalsContact O-CB 3.27Å; F285-A289 WeakPolarHBondContact O-CB 3.36Å; F285-A289 PolarHBondContact O-N 2.92Å; N286-A289 PolarHBondContact O-N 2.83Å; A289-L291 VanDerWaalsContact C-N 3.35Å; A289-S292 PolarHBondContact O-N 3.23Å; A289-S292 PolarHBondContact O-OG 3.43Å; A289-Q293 WeakPolarHBondContact O-CG 3.5Å; A289-Q293 PolarHBondContact O-N 2.83Å; A289-Q293 VanDerWaalsContact O-N 3.11Å
290	Q	35.5	Very low	35.2	Very low	127 Å²	127	113.7 Å²	113.7	59%	0.593	61%	0.613	S	S	*	*	H	α-helix	trans	-67.9	-35.7	171.9	-70.2	177	12	0	0	111.6	N286 L294	N286-Q290 WeakPolarHBondContact O-CG 3.31Å; N286-Q290 PolarHBondContact O-N 3.08Å; Q290-L294 WeakPolarHBondContact O-CG 3.47Å; Q290-L294 PolarHBondContact O-N 3.18Å
291	L	33.6	Very low	34.5	Very low	100 Å²	100	117 Å²	117	52%	0.524	63%	0.628	S	S	.	*	H	α-helix	trans	-71.6	-29.3	174.1	-70.3	169	0	0	0	113.9	S287 L288 A289 N295	S287-L291 WeakPolarHBondContact O-CG 3.41Å; S287-L291 PolarHBondContact O-N 3.36Å; L288-L291 HydrophobicContact CD2-CD1 4.48Å; L288-L291 PolarHBondContact O-N 3.38Å; A289-L291 VanDerWaalsContact C-N 3.35Å; L291-N295 PolarHBondContact O-ND2 3.04Å
292	S	32.7	Very low	33.9	Very low	75 Å²	75	117 Å²	117	52%	0.524	64%	0.639	S	S	.	*	H	α-helix	trans	-75.5	-38.2	174.5	71.5	0	0	0	0	112.1	L288 A289 L294 N295 A296	L288-S292 PolarHBondContact O-N 3.11Å; A289-S292 PolarHBondContact O-N 3.23Å; A289-S292 PolarHBondContact O-OG 3.43Å; S292-L294 VanDerWaalsContact C-N 3.33Å; S292-L294 PolarHBondContact O-N 2.91Å; S292-N295 PolarHBondContact O-N 3.05Å; S292-A296 PolarHBondContact O-N 3.36Å
293	Q	36.2	Very low	33.3	Very low	146 Å²	146	118.2 Å²	118.2	68%	0.682	65%	0.651	S	S	*	*	H	α-helix	trans	-65.7	-33.8	174.5	-70.3	-179.5	13.3	0	0	112.6	A289 N295 A296	A289-Q293 WeakPolarHBondContact O-CG 3.5Å; A289-Q293 PolarHBondContact O-N 2.83Å; A289-Q293 VanDerWaalsContact O-N 3.11Å; Q293-N295 VanDerWaalsContact C-N 3.27Å; Q293-N295 PolarHBondContact O-N 3.21Å; Q293-A296 PolarHBondContact O-N 3.46Å
294	L	33.4	Very low	32.7	Very low	140 Å²	140	120 Å²	120	73%	0.733	67%	0.667	S	S	*	*	H	α-helix	trans	-67.8	-20.8	174.5	-80	165.7	0	0	0	114.3	Q290 S292	Q290-L294 WeakPolarHBondContact O-CG 3.47Å; Q290-L294 PolarHBondContact O-N 3.18Å; S292-L294 VanDerWaalsContact C-N 3.33Å; S292-L294 PolarHBondContact O-N 2.91Å
295	N	32	Very low	32.2	Very low	131 Å²	131	121.2 Å²	121.2	70%	0.701	67%	0.672	S	S	*	*	H	α-helix	trans	-95.2	-4.9	177.6	-79.5	-62.4	0	0	0	114.3	L291 S292 Q293 H297	L291-N295 PolarHBondContact O-ND2 3.04Å; S292-N295 PolarHBondContact O-N 3.05Å; Q293-N295 VanDerWaalsContact C-N 3.27Å; Q293-N295 PolarHBondContact O-N 3.21Å; N295-H297 PolarHBondContact O-N 2.83Å; N295-H297 VanDerWaalsContact O-N 3.07Å
296	A	31	Very low	31.8	Very low	75 Å²	75	120.6 Å²	120.6	62%	0.62	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	1.8	-173.8	0	0	0	0	0	115.7	S292 Q293	S292-A296 PolarHBondContact O-N 3.36Å; Q293-A296 PolarHBondContact O-N 3.46Å
297	H	34.7	Very low	31.4	Very low	185 Å²	185	124.1 Å²	124.1	86%	0.856	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.5	21	-170.6	-86	-58.2	0	0	0	116.4	N295	N295-H297 PolarHBondContact O-N 2.83Å; N295-H297 VanDerWaalsContact O-N 3.07Å
298	K	31.5	Very low	31	Very low	182 Å²	182	127.6 Å²	127.6	79%	0.791	71%	0.712	S	S	*	*			trans	-115.9	95.8	162.2	-74.9	-172	176.9	-178	0	111
299	S	27.8	Very low	30.6	Very low	130 Å²	130	129.8 Å²	129.8	91%	0.909	72%	0.724	S	S	*	*			trans	-97.4	97.3	177.3	-172.2	0	0	0	0	111
300	S	31.6	Very low	30.2	Very low	95 Å²	95	138.2 Å²	138.2	66%	0.664	76%	0.756	S	S	*	*			trans	-152.5	81.6	170.3	59	0	0	0	0	110.6
301	T	26.1	Very low	29.9	Very low	128 Å²	128	137.9 Å²	137.9	79%	0.785	76%	0.764	S	S	*	*			trans	33.7	91.2	152.9	54.8	0	0	0	0	118
302	L	27.4	Very low	29.5	Very low	174 Å²	174	138.5 Å²	138.5	91%	0.911	78%	0.777	S	S	*	*			trans	-130.5	142.4	148.6	-75	177.5	0	0	0	108.9
303	T	30.3	Very low	29.4	Very low	122 Å²	122	143 Å²	143	75%	0.748	79%	0.789	S	S	*	*			trans	-81.9	138.3	-170.4	45	0	0	0	0	112.9	S305	T303-S305 VanDerWaalsContact C-N 3.29Å; T303-S305 PolarHBondContact O-N 3.34Å; T303-S305 PolarHBondContact OG1-OG 3.44Å
304	L	26.1	Very low	29	Very low	192 Å²	192	143.2 Å²	143.2	100%	1.005	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	80.3	170	-83.9	159.8	0	0	0	110.4
305	S	26.4	Very low	28.8	Very low	76 Å²	76	144.6 Å²	144.6	53%	0.531	80%	0.797	S	S	.	*	T	Hydrogen-bonded Turn	trans	-138.3	-23.6	-179.1	60.6	0	0	0	0	116.2	T303	T303-S305 VanDerWaalsContact C-N 3.29Å; T303-S305 PolarHBondContact O-N 3.34Å; T303-S305 PolarHBondContact OG1-OG 3.44Å
306	N	28.3	Very low	28.6	Very low	145 Å²	145	147.8 Å²	147.8	78%	0.775	80%	0.801	S	S	*	*	S	Bend	trans	-117.9	22.4	-165.3	-69.2	10	0	0	0	116
307	L	27.8	Very low	28.5	Very low	177 Å²	177	150.4 Å²	150.4	93%	0.927	81%	0.805	S	S	*	*	S	Bend	trans	-131.4	26.7	177.8	-81.2	175.3	0	0	0	114.8
308	V	27.6	Very low	28.1	Very low	136 Å²	136	145.5 Å²	145.5	82%	0.824	79%	0.791	S	S	*	*			trans	-116.9	84.5	168	-177.4	0	0	0	0	108.8
309	N	26.5	Very low	28	Very low	157 Å²	157	147.5 Å²	147.5	84%	0.84	79%	0.794	S	S	*	*			trans	-173	99.6	165.9	-101.4	-32.1	0	0	0	111
310	F	27.5	Very low	28	Very low	210 Å²	210	146 Å²	146	92%	0.921	78%	0.784	S	S	*	*			trans	-161.2	145.6	140.2	-100.6	-73.8	0	0	0	107.5
311	P	29.9	Very low	27.9	Very low	120 Å²	120	147.9 Å²	147.9	78%	0.779	79%	0.791	S	S	*	*			trans	-94.3	147.8	-152.9	35.5	-34.5	0	0	0	114.4
312	S	24.7	Very low	28	Very low	112 Å²	112	147.2 Å²	147.2	78%	0.783	78%	0.779	S	S	*	*			trans	-91.2	113.8	168.1	-48.7	0	0	0	0	110.6
313	H	30.2	Very low	28.5	Very low	170 Å²	170	147.3 Å²	147.3	79%	0.787	78%	0.775	S	S	*	*			trans	-168.3	147.6	160.1	-115.5	-73.2	0	0	0	113.2
314	Q	27.9	Very low	28.3	Very low	151 Å²	151	147.3 Å²	147.3	71%	0.706	77%	0.77	S	S	*	*			trans	66.1	130.1	179.4	-42.6	-59.7	-13.6	0	0	113.3
315	L	30.5	Very low	28.5	Very low	168 Å²	168	144.5 Å²	144.5	88%	0.88	77%	0.765	S	S	*	*			cis	-135.4	161.9	40.6	-77.3	163	0	0	0	115
316	Y	26.7	Very low	28.6	Very low	199 Å²	199	145.6 Å²	145.6	78%	0.78	77%	0.773	S	S	*	*			trans	-59.4	170.6	164.9	-102.3	-141.3	0	0	0	113.1
317	D	29	Very low	28.5	Very low	129 Å²	129	143.8 Å²	143.8	69%	0.69	77%	0.767	S	S	*	*			cis	-146.6	173.5	21.9	-149.3	-29.9	0	0	0	114.1
318	S	26.1	Very low	28.7	Very low	83 Å²	83	144.8 Å²	144.8	58%	0.58	76%	0.764	S	S	*	*			trans	-64.4	155.8	-171.7	56.9	0	0	0	0	120.1
319	R	29.9	Very low	28.8	Very low	223 Å²	223	143.2 Å²	143.2	84%	0.842	75%	0.751	S	S	*	*				177	119.6	110.3	-88.8	165.9	-173.5	-163.9	0.4	109.1
320	S	27.7	Very low	29	Very low	100 Å²	100	144.4 Å²	144.4	70%	0.699	75%	0.751	S	S	*	*				63.7	127.3	70.2	84.2	0	0	0	0	112.6
321	T	30.1	Very low	29.2	Very low	133 Å²	133	137.6 Å²	137.6	82%	0.816	74%	0.741	S	S	*	*			cis	-152.2	178.7	2.2	62.1	0	0	0	0	107.7
322	E	28.7	Very low	29.1	Very low	114 Å²	114	140 Å²	140	53%	0.533	75%	0.746	S	S	.	*			cis	-155.7	165	-0.4	-155.1	-147.5	-140.5	0	0	108.6	N324	E322-N324 PolarHBondContact OE1-ND2 3.42Å; E322-N324 PolarHBondContact OE2-ND2 3.36Å; E322-N324 VanDerWaalsContact OE2-ND2 3.12Å
323	H	36.1	Very low	29.3	Very low	177 Å²	177	139.6 Å²	139.6	82%	0.819	74%	0.743	S	S	*	*				179.7	145.9	116.6	-91.4	-39.7	0	0	0	112.9
324	N	27.7	Very low	29.4	Very low	121 Å²	121	138.6 Å²	138.6	65%	0.647	74%	0.744	S	S	*	*			trans	-98.4	147.7	-163.2	-61.2	-65	0	0	0	115.1	E322	E322-N324 PolarHBondContact OE1-ND2 3.42Å; E322-N324 PolarHBondContact OE2-ND2 3.36Å; E322-N324 VanDerWaalsContact OE2-ND2 3.12Å
325	C	28.8	Very low	29.6	Very low	134 Å²	134	138.1 Å²	138.1	91%	0.905	75%	0.745	S	S	*	*			trans	-143.4	95.6	143.5	-114.3	0	0	0	0	111.8
326	S	28.3	Very low	29.6	Very low	99 Å²	99	138.4 Å²	138.4	69%	0.692	74%	0.744	S	S	*	*			trans	-43.1	161.6	150.8	34.7	0	0	0	0	113.6
327	T	27.9	Very low	30	Very low	106 Å²	106	139 Å²	139	65%	0.65	75%	0.751	S	S	*	*			cis	-170	153.7	-5.4	-93.9	0	0	0	0	107
328	F	31	Very low	30	Very low	199 Å²	199	140.6 Å²	140.6	87%	0.873	76%	0.759	S	S	*	*			trans	150.4	156.7	145.8	-102.8	-90.1	0	0	0	110.8
329	D	30.2	Very low	30.6	Very low	103 Å²	103	141.6 Å²	141.6	55%	0.551	76%	0.764	S	S	*	*				-164.3	144.3	-70	-122.9	-13.9	0	0	0	109
330	H	30.1	Very low	30.6	Very low	181 Å²	181	139.9 Å²	139.9	84%	0.838	76%	0.763	S	S	*	*			trans	49.1	155	156.3	-59.6	-41.9	0	0	0	122.9
331	G	30.9	Very low	30.7	Very low	68 Å²	68	140.7 Å²	140.7	70%	0.701	76%	0.763	S	S	*	*			trans	130.6	58.2	174.6	0	0	0	0	0	113.7
332	L	29.2	Very low	30.7	Very low	169 Å²	169	141.9 Å²	141.9	89%	0.885	76%	0.764	S	S	*	*				57.8	121.5	95.3	-81.8	169.1	0	0	0	116.1
333	S	28	Very low	30.5	Very low	105 Å²	105	141.3 Å²	141.3	73%	0.734	77%	0.772	S	S	*	*			trans	-55.7	151.8	170.7	50.8	0	0	0	0	115.7
334	D	32.1	Very low	30.2	Very low	149 Å²	149	137.3 Å²	137.3	80%	0.797	77%	0.765	S	S	*	*			trans	-158.2	163.9	139.8	-133.5	-30.5	0	0	0	114.9
335	L	31.8	Very low	30.3	Very low	140 Å²	140	138.6 Å²	138.6	73%	0.733	77%	0.771	S	S	*	*			trans	54.4	93.7	162	-64.1	160.2	0	0	0	118.3
336	M	30.6	Very low	30.3	Very low	175 Å²	175	137.6 Å²	137.6	86%	0.862	77%	0.766	S	S	*	*				51.4	115.9	73.2	-69	-160	172	0	0	118.4
337	K	35.4	Very low	30.6	Very low	211 Å²	211	137.8 Å²	137.8	92%	0.917	77%	0.765	S	S	*	*				-166.5	153.7	114.4	-103.2	157.8	-173.4	172	0	113.9
338	N	30.4	Very low	30.6	Very low	163 Å²	163	141.2 Å²	141.2	87%	0.872	77%	0.773	S	S	*	*			trans	-105.8	173.8	-156.8	-99.4	-26.1	0	0	0	115.2
339	P	38.1	Very low	30.5	Very low	104 Å²	104	136.9 Å²	136.9	68%	0.675	77%	0.768	S	S	*	*			trans	-106.8	173.1	-169.7	41.8	-36.9	0	0	0	115.8
340	F	30.1	Very low	30.4	Very low	186 Å²	186	139.7 Å²	139.7	82%	0.816	78%	0.777	S	S	*	*			trans	-160.3	134.4	156.8	-114.5	-94.4	0	0	0	106.5
341	V	28.1	Very low	30.4	Very low	117 Å²	117	138.9 Å²	138.9	71%	0.709	77%	0.772	S	S	*	*			cis	88.3	141	37.4	178.1	0	0	0	0	113.6
342	L	31.3	Very low	30.4	Very low	158 Å²	158	144.1 Å²	144.1	83%	0.827	78%	0.775	S	S	*	*			trans	89.6	142.8	-173.9	-53.5	175.2	0	0	0	115.7
343	S	25.2	Very low	30.4	Very low	102 Å²	102	145.3 Å²	145.3	71%	0.713	77%	0.773	S	S	*	*			cis	155.2	137.6	-45	-177.7	0	0	0	0	110.7
344	S	28.7	Very low	30.5	Very low	94 Å²	94	144.4 Å²	144.4	66%	0.657	77%	0.767	S	S	*	*			trans	85	137.3	156.5	79.5	0	0	0	0	122.6
345	N	30.3	Very low	30.7	Very low	147 Å²	147	143.9 Å²	143.9	79%	0.786	77%	0.765	S	S	*	*			trans	79.4	95.1	147.5	-54.2	-21.2	0	0	0	123
346	S	27.7	Very low	30.8	Very low	114 Å²	114	144.1 Å²	144.1	80%	0.797	77%	0.765	S	S	*	*				30.9	155.9	104.1	-133.6	0	0	0	0	121.3
347	P	35.6	Very low	30.9	Very low	102 Å²	102	142.2 Å²	142.2	66%	0.662	76%	0.757	S	S	*	*			cis	-138.8	-165.3	-47	40.2	-22	0	0	0	114
348	E	26.9	Very low	30.7	Very low	179 Å²	179	140 Å²	140	84%	0.836	75%	0.75	S	S	*	*			trans	77.6	145.7	154.7	-73.3	-170.3	140.7	0	0	124.1
349	S	29.6	Very low	30.8	Very low	108 Å²	108	140.6 Å²	140.6	76%	0.755	75%	0.747	S	S	*	*			trans	100.9	91.3	145.9	74.8	0	0	0	0	123.7
350	Q	27.3	Very low	30.4	Very low	161 Å²	161	141.9 Å²	141.9	75%	0.752	75%	0.748	S	S	*	*				66.5	157.5	127.8	-59.2	-162.5	21.8	0	0	124.4
351	F	30.1	Very low	30.3	Very low	164 Å²	164	139.1 Å²	139.1	72%	0.719	75%	0.747	S	S	*	*			trans	77.1	141.8	170.2	-52.9	-66.3	0	0	0	116.8
352	K	32.3	Very low	30.3	Very low	179 Å²	179	141 Å²	141	78%	0.778	75%	0.753	S	S	*	*			cis	-155.7	162.6	-2.1	-132.7	155.8	-167.6	161.6	0	113.5
353	K	28.6	Very low	30.3	Very low	193 Å²	193	139.6 Å²	139.6	84%	0.839	75%	0.751	S	S	*	*			trans	-39	163.5	157.3	-102.5	-172.3	172	-171.6	0	115.1
354	S	31.3	Very low	30.7	Very low	87 Å²	87	141 Å²	141	61%	0.608	75%	0.754	S	S	*	*			cis	-161	-163	8.1	43.4	0	0	0	0	112.3
355	D	36.3	Very low	30.9	Very low	138 Å²	138	143.5 Å²	143.5	74%	0.738	76%	0.76	S	S	*	*			trans	94.9	134.3	160.2	-55.7	7	0	0	0	114.8
356	I	33.9	Very low	31.3	Very low	144 Å²	144	143.7 Å²	143.7	74%	0.738	76%	0.761	S	S	*	*			cis	-146.7	126.5	0.5	-106.5	154	0	0	0	112.1
357	I	32.1	Very low	31.9	Very low	136 Å²	136	145.6 Å²	145.6	70%	0.697	76%	0.762	S	S	*	*			trans	39.4	113.3	138.8	-55.3	171.4	0	0	0	122.7
358	E	30	Very low	32	Very low	164 Å²	164	147.7 Å²	147.7	77%	0.766	77%	0.768	S	S	*	*			trans	42.5	128.8	131.9	-53.1	172.7	169.8	0	0	123.8
359	Q	33.9	Very low	32.6	Very low	176 Å²	176	145.3 Å²	145.3	82%	0.822	76%	0.761	S	S	*	*				-168.7	122.2	104.2	-100.4	171.2	44.2	0	0	114.8
360	N	29.8	Very low	32.9	Very low	130 Å²	130	146 Å²	146	70%	0.695	76%	0.76	S	S	*	*			trans	35.3	124.8	141.6	-47.9	-18.9	0	0	0	120.8
361	T	26.9	Very low	33.4	Very low	128 Å²	128	145.3 Å²	145.3	79%	0.785	77%	0.767	S	S	*	*			cis	73.4	119.7	45.2	71.9	0	0	0	0	117.2
362	L	28.9	Very low	33.6	Very low	158 Å²	158	143.6 Å²	143.6	83%	0.827	77%	0.765	S	S	*	*			trans	172.9	99.7	153.5	-92.4	163.3	0	0	0	106.5
363	T	30.4	Very low	33.8	Very low	128 Å²	128	140.2 Å²	140.2	79%	0.785	76%	0.764	S	S	*	*				78.8	154.2	88.8	57.4	0	0	0	0	116.3
364	V	34.1	Very low	34.3	Very low	130 Å²	130	134.8 Å²	134.8	79%	0.788	75%	0.75	S	S	*	*			trans	-121.7	156.9	-166.4	-167.9	0	0	0	0	109.7
365	D	31.9	Very low	34.6	Very low	148 Å²	148	135.9 Å²	135.9	79%	0.791	75%	0.753	S	S	*	*			trans	-179.5	-177.7	136.7	-87.2	-23.1	0	0	0	111.2
366	D	39.2	Very low	34.7	Very low	151 Å²	151	134.4 Å²	134.4	81%	0.807	75%	0.749	S	S	*	*			trans	69.8	101.9	-168.4	-59.3	-23.9	0	0	0	114.7
367	L	41.3	Very low	34.7	Very low	153 Å²	153	130.5 Å²	130.5	80%	0.801	74%	0.738	S	S	*	*			cis	69.6	121	49.8	-57.3	171.6	0	0	0	114.7
368	D	37.5	Very low	35	Very low	147 Å²	147	128.5 Å²	128.5	79%	0.786	73%	0.732	S	S	*	*			cis	-141.2	-117.4	-18.9	-155.4	-37.3	0	0	0	110.1
369	D	38.3	Very low	35.3	Very low	129 Å²	129	127.9 Å²	127.9	69%	0.69	73%	0.729	S	S	*	*			cis	-155.5	157.3	-3.2	-176.3	21	0	0	0	110.6
370	T	37.1	Very low	35.5	Very low	122 Å²	122	125.5 Å²	125.5	75%	0.748	72%	0.718	S	S	*	*			trans	61.1	117.6	174.5	61.9	0	0	0	0	119.5
371	V	36.7	Very low	35.9	Very low	146 Å²	146	125.3 Å²	125.3	89%	0.885	72%	0.717	S	S	*	*			trans	-101.2	140.1	173.2	-85.1	0	0	0	0	113.1
372	D	35.1	Very low	36.4	Very low	128 Å²	128	125.4 Å²	125.4	68%	0.684	71%	0.711	S	S	*	*			trans	-85.2	118.4	168.3	-170.3	-40.8	0	0	0	110	S374	D372-S374 PolarHBondContact O-N 2.82Å; D372-S374 VanDerWaalsContact O-N 3.13Å; D372-S374 WeakPolarHBondContact OD1-CB 3.32Å; D372-S374 PolarHBondContact OD1-N 2.9Å; D372-S374 PolarHBondContact OD1-OG 3.48Å
373	S	35.4	Very low	36.8	Very low	109 Å²	109	122.2 Å²	122.2	76%	0.762	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	4.1	-166.8	-150.6	0	0	0	0	114.8
374	S	40.6	Very low	37.2	Very low	79 Å²	79	120.5 Å²	120.5	55%	0.552	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-20.4	-171.7	54	0	0	0	0	115.6	D372	D372-S374 PolarHBondContact O-N 2.82Å; D372-S374 VanDerWaalsContact O-N 3.13Å; D372-S374 WeakPolarHBondContact OD1-CB 3.32Å; D372-S374 PolarHBondContact OD1-N 2.9Å; D372-S374 PolarHBondContact OD1-OG 3.48Å
375	V	37.2	Very low	37.2	Very low	109 Å²	109	124.3 Å²	124.3	66%	0.661	69%	0.689	S	S	*	*	S	Bend	trans	-93.5	-24.1	-168.4	-178	0	0	0	0	113.8
376	V	37.5	Very low	37.3	Very low	108 Å²	108	122.4 Å²	122.4	66%	0.655	69%	0.686	S	S	*	*	S	Bend	trans	-84.2	-31	-171.9	-171.6	0	0	0	0	112.8	V378 H379	V376-V378 VanDerWaalsContact C-N 3.3Å; V376-V378 PolarHBondContact O-N 2.82Å; V376-H379 PolarHBondContact O-N 3.11Å; V376-H379 VanDerWaalsContact O-N 3.11Å
377	A	35.5	Very low	37	Very low	61 Å²	61	122 Å²	122	50%	0.504	68%	0.684	S	S	.	*	G	3₁₀ helix	trans	-56.6	-40.5	-176.9	0	0	0	0	0	113.3	H379 Q380	A377-H379 PolarHBondContact O-N 3.49Å; A377-H379 VanDerWaalsContact O-N 3.12Å; A377-Q380 PolarHBondContact O-N 3.27Å
378	V	37.4	Very low	36.6	Very low	95 Å²	95	121.8 Å²	121.8	58%	0.576	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-65.8	-17.1	-177.3	-172.6	0	0	0	0	112.9	V376	V376-V378 VanDerWaalsContact C-N 3.3Å; V376-V378 PolarHBondContact O-N 2.82Å
379	H	36	Very low	36.8	Very low	150 Å²	150	122 Å²	122	69%	0.694	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-83.6	-15.7	174.9	-98.2	63.7	0	0	0	114.3	V376 A377	V376-H379 PolarHBondContact O-N 3.11Å; V376-H379 VanDerWaalsContact O-N 3.11Å; A377-H379 PolarHBondContact O-N 3.49Å; A377-H379 VanDerWaalsContact O-N 3.12Å
380	Q	38.5	Very low	36.6	Very low	127 Å²	127	125.7 Å²	125.7	59%	0.593	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	-33.1	-176.2	-152.8	70	33.1	0	0	113	A377 T383 T384	A377-Q380 PolarHBondContact O-N 3.27Å; Q380-T383 PolarHBondContact O-OG1 3.27Å; Q380-T383 VanDerWaalsContact O-OG1 3.07Å; Q380-T384 PolarHBondContact O-OG1 2.68Å
381	D	37.4	Very low	36.5	Very low	126 Å²	126	127.8 Å²	127.8	67%	0.674	69%	0.69	S	S	*	*	S	Bend	trans	-76.6	-23.5	-175.5	-69.4	-25.6	0	0	0	113.4
382	I	38.5	Very low	36.7	Very low	130 Å²	130	127.7 Å²	127.7	67%	0.667	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-30.8	-179.7	-59.8	179.6	0	0	0	111.6	T384	I382-T384 VanDerWaalsContact C-N 3.31Å; I382-T384 PolarHBondContact O-N 2.7Å
383	T	37.3	Very low	36.9	Very low	90 Å²	90	129 Å²	129	55%	0.552	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-12.4	179	48.4	0	0	0	0	114.3	Q380	Q380-T383 PolarHBondContact O-OG1 3.27Å; Q380-T383 VanDerWaalsContact O-OG1 3.07Å
384	T	38.8	Very low	36.9	Very low	92 Å²	92	127 Å²	127	56%	0.564	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-14.3	-168.1	-49.4	0	0	0	0	112.9	Q380 I382 C386	Q380-T384 PolarHBondContact O-OG1 2.68Å; I382-T384 VanDerWaalsContact C-N 3.31Å; I382-T384 PolarHBondContact O-N 2.7Å; T384-C386 PolarHBondContact O-N 2.81Å
385	Y	34.4	Very low	36.7	Very low	211 Å²	211	129.8 Å²	129.8	83%	0.827	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	12.2	-175.2	-158.8	-105.7	0	0	0	115.1
386	C	32.9	Very low	36.7	Very low	108 Å²	108	131 Å²	131	73%	0.73	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132	9.5	-171.6	-64.8	0	0	0	0	116.1	T384	T384-C386 PolarHBondContact O-N 2.81Å
387	N	34.2	Very low	36.6	Very low	142 Å²	142	132.4 Å²	132.4	76%	0.759	70%	0.704	S	S	*	*	S	Bend	trans	-119.2	-0.9	-175.7	-79.7	-49.1	0	0	0	115.8
388	D	32.5	Very low	36.7	Very low	148 Å²	148	137.5 Å²	137.5	79%	0.791	72%	0.723	S	S	*	*			trans	-112.4	77.2	-176	-95.7	-51.7	0	0	0	113.2
389	H	40.9	Very low	36.4	Very low	151 Å²	151	139.8 Å²	139.8	70%	0.699	74%	0.737	S	S	*	*			trans	-167.3	121	143.3	-106.5	18.6	0	0	0	115.4
390	R	34.7	Very low	36	Very low	207 Å²	207	138.1 Å²	138.1	78%	0.781	74%	0.742	S	S	*	*			trans	72	93.8	146.5	-56.3	174.5	-163.9	-164.8	3.1	118.6
391	N	35.9	Very low	35.7	Very low	166 Å²	166	137.4 Å²	137.4	89%	0.888	75%	0.751	S	S	*	*				-68.6	131.1	124.7	-56.3	-48.9	0	0	0	107.7
392	D	39.2	Very low	35.6	Very low	144 Å²	144	137.3 Å²	137.3	77%	0.77	75%	0.754	S	S	*	*				-167.6	160	105.8	-140.5	-19.3	0	0	0	111.4
393	D	39.1	Very low	35.8	Very low	156 Å²	156	139.6 Å²	139.6	83%	0.834	76%	0.763	S	S	*	*			trans	53.6	147.7	162.2	-91.4	-36.8	0	0	0	122.8
394	G	35.9	Very low	36.1	Very low	68 Å²	68	143 Å²	143	70%	0.701	77%	0.772	S	S	*	*				113.7	28.9	126	0	0	0	0	0	121.1	N396	G394-N396 PolarHBondContact O-N 2.95Å
395	N	36.4	Very low	36.5	Very low	136 Å²	136	143.9 Å²	143.9	73%	0.727	77%	0.773	S	S	*	*			trans	15.4	104.9	151.9	174.1	43.6	0	0	0	118.2
396	N	38.1	Very low	37.1	Very low	136 Å²	136	140.8 Å²	140.8	73%	0.727	77%	0.767	S	S	*	*				-171.5	152.9	121.7	-105.9	-67.8	0	0	0	114.3	G394	G394-N396 PolarHBondContact O-N 2.95Å
397	N	34.4	Very low	38.1	Very low	137 Å²	137	138.2 Å²	138.2	73%	0.733	75%	0.75	S	S	*	*			trans	-54.6	130.1	-177.3	-51.4	-66.2	0	0	0	114.8
398	N	38.5	Very low	39.4	Very low	167 Å²	167	135 Å²	135	89%	0.893	74%	0.736	S	S	*	*			trans	-163.2	126.4	132.3	-98	-36.5	0	0	0	111.2
399	T	31.4	Very low	41	Very low	143 Å²	143	133.3 Å²	133.3	88%	0.877	73%	0.725	S	S	*	*			trans	-81.7	130.1	-177.3	44.6	0	0	0	0	112.8
400	C	27.1	Very low	42.4	Very low	116 Å²	116	131.1 Å²	131.1	78%	0.784	72%	0.718	S	S	*	*			trans	-152	138.3	150.4	-152.6	0	0	0	0	112.2
401	S	31.3	Very low	43.8	Very low	112 Å²	112	127.2 Å²	127.2	78%	0.783	71%	0.707	S	S	*	*			trans	-44.3	125.6	-172.3	49.1	0	0	0	0	118.4
402	T	35.6	Very low	45.1	Very low	123 Å²	123	124.5 Å²	124.5	76%	0.755	69%	0.692	S	S	*	*			trans	-134.8	73.4	164.8	35.3	0	0	0	0	111.6
403	Q	43.8	Very low	46.3	Very low	179 Å²	179	120.2 Å²	120.2	84%	0.836	68%	0.677	S	S	*	*			trans	-128.2	-6.1	175.9	-78.1	-170.9	-31.5	0	0	115.4
404	E	42.7	Very low	47.3	Very low	160 Å²	160	115.3 Å²	115.3	75%	0.748	66%	0.658	S	S	*	*	S	Bend	trans	-87	-20.1	-173.9	-57.4	-167.1	141	0	0	114	S407	E404-S407 PolarHBondContact O-OG 2.86Å
405	N	46.9	Very low	48.3	Very low	112 Å²	112	116.5 Å²	116.5	60%	0.599	65%	0.648	S	S	*	*	H	α-helix	trans	-74.9	-42	-167.5	-65.9	-9.9	0	0	0	113.9	S407 T408 I409	N405-S407 VanDerWaalsContact C-N 3.29Å; N405-S407 PolarHBondContact O-N 2.91Å; N405-T408 PolarHBondContact O-N 2.85Å; N405-T408 VanDerWaalsContact O-N 3.08Å; N405-I409 PolarHBondContact O-N 3.22Å; N405-I409 VanDerWaalsContact O-N 3.16Å
406	E	48.1	Very low	49.2	Very low	146 Å²	146	115.8 Å²	115.8	68%	0.682	64%	0.644	S	S	*	*	H	α-helix	trans	-59.8	-39.1	179.3	-73.7	-172	112	0	0	112.2	T408 I409 N410	E406-T408 PolarHBondContact O-N 3.19Å; E406-I409 PolarHBondContact O-N 3.1Å; E406-N410 WeakPolarHBondContact O-CB 3.48Å; E406-N410 PolarHBondContact O-N 3.02Å; E406-N410 PolarHBondContact O-ND2 2.99Å
407	S	54.1	Low	49.7	Very low	54 Å²	54	112 Å²	112	38%	0.378	63%	0.631	S	S	.	*	H	α-helix	trans	-61.9	-28.6	179.2	92.7	0	0	0	0	112.3	E404 N405 K411	E404-S407 PolarHBondContact O-OG 2.86Å; N405-S407 VanDerWaalsContact C-N 3.29Å; N405-S407 PolarHBondContact O-N 2.91Å; S407-K411 WeakPolarHBondContact O-CB 3.48Å; S407-K411 WeakPolarHBondContact O-CD 3.39Å; S407-K411 WeakPolarHBondContact O-CE 3.4Å; S407-K411 WeakPolarHBondContact O-CG 3.32Å; S407-K411 PolarHBondContact O-N 2.99Å; S407-K411 PolarHBondContact OG-NZ 2.9Å
408	T	61.7	Low	50.3	Low	75 Å²	75	109.5 Å²	109.5	46%	0.46	62%	0.624	S	S	.	*	H	α-helix	trans	-82.8	-40.8	-179	-56.1	0	0	0	0	111.1	N405 E406 K411 L412	N405-T408 PolarHBondContact O-N 2.85Å; N405-T408 VanDerWaalsContact O-N 3.08Å; E406-T408 PolarHBondContact O-N 3.19Å; T408-K411 PolarHBondContact O-N 2.98Å; T408-L412 HydrophobicContact CG2-CD1 4.35Å; T408-L412 WeakPolarHBondContact O-CG 3.42Å; T408-L412 PolarHBondContact O-N 3.02Å
409	I	65.3	Low	50.7	Low	111 Å²	111	106.7 Å²	106.7	57%	0.569	61%	0.613	S	S	*	*	H	α-helix	trans	-62	-46.7	173.8	-64	170	0	0	0	110.1	N405 E406 K411 L412 A413	N405-I409 PolarHBondContact O-N 3.22Å; N405-I409 VanDerWaalsContact O-N 3.16Å; E406-I409 PolarHBondContact O-N 3.1Å; I409-K411 PolarHBondContact O-N 3.17Å; I409-L412 PolarHBondContact O-N 3.27Å; I409-L412 VanDerWaalsContact O-N 3.15Å; I409-A413 PolarHBondContact O-N 3.49Å
410	N	69.3	Low	51.4	Low	105 Å²	105	104.6 Å²	104.6	56%	0.561	60%	0.6	S	S	*	*	H	α-helix	trans	-65.1	-35.8	178.4	-71	-26.4	0	0	0	112.6	E406 A414	E406-N410 WeakPolarHBondContact O-CB 3.48Å; E406-N410 PolarHBondContact O-N 3.02Å; E406-N410 PolarHBondContact O-ND2 2.99Å; N410-A414 VanDerWaalsContact O-CB 3.3Å; N410-A414 WeakPolarHBondContact O-CB 3.43Å; N410-A414 PolarHBondContact O-N 3.18Å
411	K	65.8	Low	52.1	Low	126 Å²	126	102 Å²	102	55%	0.548	59%	0.587	S	S	.	*	H	α-helix	trans	-65.9	-39.9	171.4	-75.3	162.7	-166.2	153.8	0	112.2	S407 T408 I409 A414 N415	S407-K411 WeakPolarHBondContact O-CB 3.48Å; S407-K411 WeakPolarHBondContact O-CD 3.39Å; S407-K411 WeakPolarHBondContact O-CE 3.4Å; S407-K411 WeakPolarHBondContact O-CG 3.32Å; S407-K411 PolarHBondContact O-N 2.99Å; S407-K411 PolarHBondContact OG-NZ 2.9Å; T408-K411 PolarHBondContact O-N 2.98Å; I409-K411 PolarHBondContact O-N 3.17Å; K411-A414 PolarHBondContact O-N 2.91Å; K411-N415 WeakPolarHBondContact O-CB 3.13Å; K411-N415 PolarHBondContact O-N 2.95Å; K411-N415 PolarHBondContact O-ND2 3.05Å; K411-N415 VanDerWaalsContact O-ND2 3.14Å
412	L	62.4	Low	53	Low	108 Å²	108	102.1 Å²	102.1	57%	0.565	58%	0.578	S	S	*	*	H	α-helix	trans	-67	-43	176.6	-74.1	168	0	0	0	111.8	T408 I409 N415 L416	T408-L412 HydrophobicContact CG2-CD1 4.35Å; T408-L412 WeakPolarHBondContact O-CG 3.42Å; T408-L412 PolarHBondContact O-N 3.02Å; I409-L412 PolarHBondContact O-N 3.27Å; I409-L412 VanDerWaalsContact O-N 3.15Å; L412-N415 PolarHBondContact O-N 2.93Å; L412-L416 WeakPolarHBondContact O-CB 3.38Å; L412-L416 PolarHBondContact O-N 2.97Å
413	A	65.2	Low	53.4	Low	55 Å²	55	101 Å²	101	46%	0.455	57%	0.568	S	S	.	*	H	α-helix	trans	-60.3	-46.2	173.3	0	0	0	0	0	111.8	I409 N415 L416 A417	I409-A413 PolarHBondContact O-N 3.49Å; A413-N415 PolarHBondContact O-N 2.8Å; A413-L416 PolarHBondContact O-N 3.05Å; A413-A417 WeakPolarHBondContact O-CB 3.45Å; A413-A417 PolarHBondContact O-N 2.87Å
414	A	60.4	Low	53.4	Low	52 Å²	52	102.3 Å²	102.3	43%	0.43	57%	0.565	S	S	.	*	H	α-helix	trans	-62.6	-40.6	176.3	0	0	0	0	0	112.7	N410 K411 S418	N410-A414 VanDerWaalsContact O-CB 3.3Å; N410-A414 WeakPolarHBondContact O-CB 3.43Å; N410-A414 PolarHBondContact O-N 3.18Å; K411-A414 PolarHBondContact O-N 2.91Å; A414-S418 VanDerWaalsContact O-CB 3.26Å; A414-S418 WeakPolarHBondContact O-CB 3.49Å; A414-S418 PolarHBondContact O-N 3.01Å; A414-S418 PolarHBondContact O-OG 3.01Å
415	N	55.4	Low	53.4	Low	94 Å²	94	98.1 Å²	98.1	50%	0.503	57%	0.565	S	S	.	*	H	α-helix	trans	-67.2	-38.6	175.8	-74.8	-29.8	0	0	0	112.2	K411 L412 A413 S418 T419	K411-N415 WeakPolarHBondContact O-CB 3.13Å; K411-N415 PolarHBondContact O-N 2.95Å; K411-N415 PolarHBondContact O-ND2 3.05Å; K411-N415 VanDerWaalsContact O-ND2 3.14Å; L412-N415 PolarHBondContact O-N 2.93Å; A413-N415 PolarHBondContact O-N 2.8Å; N415-S418 CarbonylContact O-C 3.59Å; N415-S418 PolarHBondContact O-N 3.33Å; N415-T419 PolarHBondContact O-N 2.73Å; N415-T419 PolarHBondContact O-OG1 2.76Å
416	L	55.3	Low	53.5	Low	121 Å²	121	94.3 Å²	94.3	63%	0.634	55%	0.547	S	S	*	.	H	α-helix	trans	-69.6	-43.2	177.9	-166	66	0	0	0	111	L412 A413 S418 T419 T420	L412-L416 WeakPolarHBondContact O-CB 3.38Å; L412-L416 PolarHBondContact O-N 2.97Å; A413-L416 PolarHBondContact O-N 3.05Å; L416-S418 VanDerWaalsContact C-N 3.32Å; L416-S418 PolarHBondContact O-N 3.12Å; L416-T419 WeakPolarHBondContact O-CA 3.47Å; L416-T419 WeakPolarHBondContact O-CB 3.39Å; L416-T419 PolarHBondContact O-N 3.44Å; L416-T420 PolarHBondContact O-N 2.82Å; L416-T420 VanDerWaalsContact O-N 3.08Å; L416-T420 PolarHBondContact O-OG1 3.09Å
417	A	48.3	Very low	54	Low	55 Å²	55	90.3 Å²	90.3	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-60.5	-39.3	170.9	0	0	0	0	0	111.9	A413 T419 T420 A421	A413-A417 WeakPolarHBondContact O-CB 3.45Å; A413-A417 PolarHBondContact O-N 2.87Å; A417-T419 PolarHBondContact O-N 2.95Å; A417-T420 PolarHBondContact O-N 3Å; A417-T420 PolarHBondContact O-OG1 2.82Å; A417-A421 WeakPolarHBondContact O-CB 3.28Å; A417-A421 PolarHBondContact O-N 2.87Å
418	S	47.6	Very low	54.7	Low	85 Å²	85	95.3 Å²	95.3	59%	0.594	55%	0.548	S	S	*	.	H	α-helix	trans	-70.5	-9.9	173.6	-56.8	0	0	0	0	113.8	A414 N415 L416	A414-S418 VanDerWaalsContact O-CB 3.26Å; A414-S418 WeakPolarHBondContact O-CB 3.49Å; A414-S418 PolarHBondContact O-N 3.01Å; A414-S418 PolarHBondContact O-OG 3.01Å; N415-S418 CarbonylContact O-C 3.59Å; N415-S418 PolarHBondContact O-N 3.33Å; L416-S418 VanDerWaalsContact C-N 3.32Å; L416-S418 PolarHBondContact O-N 3.12Å
419	T	47.6	Very low	55.6	Low	108 Å²	108	100.7 Å²	100.7	66%	0.663	56%	0.56	S	S	*	*	H	α-helix	trans	-96.4	-31.5	176.1	-56.2	0	0	0	0	111.5	N415 L416 A417	N415-T419 PolarHBondContact O-N 2.73Å; N415-T419 PolarHBondContact O-OG1 2.76Å; L416-T419 WeakPolarHBondContact O-CA 3.47Å; L416-T419 WeakPolarHBondContact O-CB 3.39Å; L416-T419 PolarHBondContact O-N 3.44Å; A417-T419 PolarHBondContact O-N 2.95Å
420	T	45.9	Very low	56.8	Low	99 Å²	99	101.2 Å²	101.2	61%	0.607	56%	0.558	S	S	*	*	H	α-helix	trans	-87.1	-26.8	173.3	56	0	0	0	0	112.8	L416 A417 I422	L416-T420 PolarHBondContact O-N 2.82Å; L416-T420 VanDerWaalsContact O-N 3.08Å; L416-T420 PolarHBondContact O-OG1 3.09Å; A417-T420 PolarHBondContact O-N 3Å; A417-T420 PolarHBondContact O-OG1 2.82Å; T420-I422 PolarHBondContact O-N 2.85Å
421	A	40.6	Very low	57.8	Low	62 Å²	62	97 Å²	97	51%	0.512	54%	0.536	S	S	.	.			trans	-73.3	75.7	161.1	0	0	0	0	0	110.4	A417	A417-A421 WeakPolarHBondContact O-CB 3.28Å; A417-A421 PolarHBondContact O-N 2.87Å
422	I	51.2	Low	59.1	Low	114 Å²	114	93.5 Å²	93.5	59%	0.585	53%	0.526	S	S	*	.			trans	-49	143.3	143.5	-62.6	176.3	0	0	0	107	T420 R424	T420-I422 PolarHBondContact O-N 2.85Å; I422-R424 VanDerWaalsContact C-N 3.33Å; I422-R424 WeakPolarHBondContact O-CG 3.45Å; I422-R424 PolarHBondContact O-N 2.85Å
423	D	43.7	Very low	60.6	Low	100 Å²	100	90 Å²	90	54%	0.535	51%	0.506	S	S	.	.			trans	-57.4	92.4	174.9	175	21.5	0	0	0	111.5	G425 S426	D423-G425 PolarHBondContact O-N 2.84Å; D423-G425 WeakPolarHBondContact OD1-CA 3.39Å; D423-G425 PolarHBondContact OD1-N 3.1Å; D423-S426 PolarHBondContact OD1-N 3.04Å; D423-S426 WeakPolarHBondContact OD2-CB 3.5Å; D423-S426 PolarHBondContact OD2-OG 3.05Å
424	R	45	Very low	62	Low	206 Å²	206	88.8 Å²	88.8	78%	0.777	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-0.5	171.4	-62.5	-178.1	-168.4	-172.6	3.2	111.8	I422	I422-R424 VanDerWaalsContact C-N 3.33Å; I422-R424 WeakPolarHBondContact O-CG 3.45Å; I422-R424 PolarHBondContact O-N 2.85Å
425	G	42.7	Very low	63.8	Low	73 Å²	73	89 Å²	89	75%	0.753	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-14.4	172.4	0	0	0	0	0	113.9	D423	D423-G425 PolarHBondContact O-N 2.84Å; D423-G425 WeakPolarHBondContact OD1-CA 3.39Å; D423-G425 PolarHBondContact OD1-N 3.1Å
426	S	48	Very low	65.7	Low	32 Å²	32	84.9 Å²	84.9	22%	0.224	46%	0.463	C	S	.	.			trans	-131.7	56.6	173	78	0	0	0	0	113.8	D423 F428 R429	D423-S426 PolarHBondContact OD1-N 3.04Å; D423-S426 WeakPolarHBondContact OD2-CB 3.5Å; D423-S426 PolarHBondContact OD2-OG 3.05Å; S426-F428 PolarHBondContact O-N 3.29Å; S426-R429 PolarHBondContact O-N 3.25Å; S426-R429 WeakPolarHBondContact OG-CD 3.23Å
427	T	57.9	Low	67.6	Low	61 Å²	61	80.6 Å²	80.6	37%	0.374	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-19.7	176.2	49.9	0	0	0	0	115.3	Y466	T427-Y466 PolarHBondContact O-N 3.42Å
428	F	68.8	Low	69.9	Low	159 Å²	159	78 Å²	78	70%	0.697	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	16.7	178.3	-54.3	-70.9	0	0	0	114.7	S426 Y466	S426-F428 PolarHBondContact O-N 3.29Å; F428-Y466 WeakPolarHBondContact O-CD2 3.29Å
429	R	82.4	Confident	72.3	Confident	189 Å²	189	73.9 Å²	73.9	71%	0.713	39%	0.389	S	S	*	.	S	Bend	trans	-96.9	141.9	170.8	-74.5	-170.4	-177.8	-104	-0.7	112.7	S426 P431 Y466	S426-R429 PolarHBondContact O-N 3.25Å; S426-R429 WeakPolarHBondContact OG-CD 3.23Å; R429-P431 WeakPolarHBondContact O-CD 3.48Å; R429-Y466 VanDerWaalsContact C-CD2 3.49Å
430	K	89.5	Confident	74.6	Confident	122 Å²	122	69 Å²	69	53%	0.53	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-60.3	120.8	-179.5	-163.6	168.6	-167.8	164.8	0	110.7	Y466	K430-Y466 HydrophobicContact CB-CD1 4.46Å; K430-Y466 HydrophobicContact CB-CD2 4.2Å; K430-Y466 HydrophobicContact CB-CE1 4.07Å; K430-Y466 HydrophobicContact CB-CE2 3.73Å; K430-Y466 HydrophobicContact CD-CE1 4.29Å; K430-Y466 HydrophobicContact CG-CD1 4.36Å; K430-Y466 HydrophobicContact CG-CE1 3.75Å; K430-Y466 HydrophobicContact CG-CE2 4.3Å
431	P	91.2	Very high	77	Confident	16 Å²	16	64.8 Å²	64.8	10%	0.104	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-61.1	145.9	-176.8	-26.3	34.8	0	0	0	113.3	R429 Y433 F464 Y467	R429-P431 WeakPolarHBondContact O-CD 3.48Å; P431-Y433 HydrophobicContact CB-CD2 3.99Å; P431-Y433 PolarHBondContact O-N 2.94Å; P431-F464 HydrophobicContact CB-CD1 3.83Å; P431-F464 HydrophobicContact CB-CE1 4Å; P431-F464 HydrophobicContact CB-CG 4.24Å; P431-F464 HydrophobicContact CG-CB 3.67Å; P431-F464 HydrophobicContact CG-CD1 3.41Å; P431-F464 VanDerWaalsContact CG-CD1 3.41Å; P431-F464 HydrophobicContact CG-CD2 4.34Å; P431-F464 HydrophobicContact CG-CE1 4.11Å; P431-F464 HydrophobicContact CG-CG 3.54Å; P431-Y467 HydrophobicContact CG-CD2 4.46Å; P431-Y467 HydrophobicContact CG-CE2 3.86Å
432	P	92.1	Very high	79.6	Confident	53 Å²	53	61.9 Å²	61.9	34%	0.344	31%	0.308	S	S	.	.	S	Bend	trans	-78.6	40.8	-177.3	34.9	-38.6	0	0	0	113.5	K521 R522	P432-K521 HydrophobicContact CB-CB 4.31Å; P432-K521 HydrophobicContact CG-CB 4.22Å; P432-K521 HydrophobicContact CG-CD 4.06Å; P432-K521 HydrophobicContact CG-CG 3.91Å; P432-R522 PolarHBondContact O-N 3.15Å
433	Y	93.7	Very high	81.8	Confident	35 Å²	35	56.4 Å²	56.4	14%	0.137	28%	0.28	C	S	.	.	S	Bend	trans	-128.9	146.4	-176.1	-57.7	-58	0	0	0	110.4	P431 L438 F464 F519 K521	P431-Y433 HydrophobicContact CB-CD2 3.99Å; P431-Y433 PolarHBondContact O-N 2.94Å; Y433-L438 HydrophobicContact CD2-CD2 4.26Å; Y433-F464 HydrophobicContact CD2-CE1 4.23Å; Y433-F464 AromaticContact CD2-CZ 3.82Å; Y433-F464 HydrophobicContact CD2-CZ 3.82Å; Y433-F464 HydrophobicContact CE2-CE1 4.05Å; Y433-F464 AromaticContact CE2-CZ 3.8Å; Y433-F464 HydrophobicContact CE2-CZ 3.8Å; Y433-F519 WeakPolarHBondContact CE1-O 3.33Å; Y433-K521 HydrophobicContact CE1-CG 3.98Å
434	S	95.2	Very high	84.2	Confident	28 Å²	28	53.4 Å²	53.4	20%	0.196	27%	0.269	C	S	.	.			trans	-74.5	160	171.5	74.9	0	0	0	0	111.8	A436 Q437 L438	S434-A436 PolarHBondContact O-N 3.38Å; S434-Q437 WeakPolarHBondContact O-CA 3.35Å; S434-Q437 WeakPolarHBondContact O-CB 3.44Å; S434-Q437 PolarHBondContact O-N 3.44Å; S434-Q437 WeakPolarHBondContact OG-CG 3.33Å; S434-Q437 PolarHBondContact OG-N 2.93Å; S434-L438 WeakPolarHBondContact O-CG 3.32Å; S434-L438 PolarHBondContact O-N 2.67Å
435	Y	96.9	Very high	86.5	Confident	58 Å²	58	46.8 Å²	46.8	23%	0.227	26%	0.255	C	S	.	.	H	α-helix	trans	-54.3	-40.7	172.3	-66.1	-57.2	0	0	0	112.5	L438 I439 Y467 W474 I478	Y435-L438 HydrophobicContact CD1-CD1 4.29Å; Y435-L438 PolarHBondContact O-N 3.37Å; Y435-I439 WeakPolarHBondContact O-CD1 3.49Å; Y435-I439 VanDerWaalsContact O-CG1 3.25Å; Y435-I439 WeakPolarHBondContact O-CG1 3.07Å; Y435-I439 PolarHBondContact O-N 3.5Å; Y435-Y467 HydrophobicContact CE1-CE1 4.02Å; Y435-W474 HydrophobicContact CE1-CB 4.06Å; Y435-I478 HydrophobicContact CD1-CD1 3.99Å; Y435-I478 HydrophobicContact CD1-CG1 4.38Å; Y435-I478 HydrophobicContact CG-CD1 4.46Å
436	A	96.2	Very high	89	Confident	7 Å²	7	43.8 Å²	43.8	6%	0.058	22%	0.223	C	C	.	.	H	α-helix	trans	-60.6	-43.7	172.1	0	0	0	0	0	112.7	S434 L438 I439 I440 F488	S434-A436 PolarHBondContact O-N 3.38Å; A436-L438 PolarHBondContact O-N 3.04Å; A436-I439 PolarHBondContact O-N 3.33Å; A436-I440 WeakPolarHBondContact O-CD1 3.24Å; A436-I440 WeakPolarHBondContact O-CG1 3.23Å; A436-I440 PolarHBondContact O-N 2.93Å; A436-F488 HydrophobicContact CB-CE2 4.23Å; A436-F488 HydrophobicContact CB-CZ 4.23Å
437	Q	95.8	Very high	91	Very high	30 Å²	30	48.3 Å²	48.3	14%	0.14	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-41.2	175.1	-74.1	176.2	-63.9	0	0	112.2	S434 I439 I440 Q441 Q517 R520	S434-Q437 WeakPolarHBondContact O-CA 3.35Å; S434-Q437 WeakPolarHBondContact O-CB 3.44Å; S434-Q437 PolarHBondContact O-N 3.44Å; S434-Q437 WeakPolarHBondContact OG-CG 3.33Å; S434-Q437 PolarHBondContact OG-N 2.93Å; Q437-I439 VanDerWaalsContact C-N 3.35Å; Q437-I439 PolarHBondContact O-N 2.83Å; Q437-I440 PolarHBondContact O-N 3.27Å; Q437-Q441 VanDerWaalsContact O-CG 3.29Å; Q437-Q441 WeakPolarHBondContact O-CG 3.36Å; Q437-Q441 PolarHBondContact O-N 3.28Å; Q437-Q517 PolarHBondContact NE2-O 2.85Å; Q437-R520 PolarHBondContact NE2-O 2.91Å
438	L	96.4	Very high	92.6	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.4	-40	176.1	-65.6	172	0	0	0	112	Y433 S434 Y435 A436 Q441 A442 I460 F464 Y467	Y433-L438 HydrophobicContact CD2-CD2 4.26Å; S434-L438 WeakPolarHBondContact O-CG 3.32Å; S434-L438 PolarHBondContact O-N 2.67Å; Y435-L438 HydrophobicContact CD1-CD1 4.29Å; Y435-L438 PolarHBondContact O-N 3.37Å; A436-L438 PolarHBondContact O-N 3.04Å; L438-Q441 PolarHBondContact O-N 2.86Å; L438-A442 WeakPolarHBondContact O-CB 3.25Å; L438-A442 PolarHBondContact O-N 3.27Å; L438-I460 HydrophobicContact CB-CD1 3.88Å; L438-I460 HydrophobicContact CB-CG1 4.19Å; L438-F464 HydrophobicContact CD2-CD2 3.64Å; L438-F464 HydrophobicContact CD2-CE2 3.32Å; L438-F464 HydrophobicContact CD2-CZ 4.11Å; L438-Y467 HydrophobicContact CD1-CD2 4.41Å; L438-Y467 HydrophobicContact CD1-CE2 3.54Å
439	I	97.3	Very high	93.7	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-65.5	-43.4	174.2	-64.1	158.2	0	0	0	110.9	Y435 A436 Q437 A442 I443 I456 I478 N481 L482 F488	Y435-I439 WeakPolarHBondContact O-CD1 3.49Å; Y435-I439 VanDerWaalsContact O-CG1 3.25Å; Y435-I439 WeakPolarHBondContact O-CG1 3.07Å; Y435-I439 PolarHBondContact O-N 3.5Å; A436-I439 PolarHBondContact O-N 3.33Å; Q437-I439 VanDerWaalsContact C-N 3.35Å; Q437-I439 PolarHBondContact O-N 2.83Å; I439-A442 PolarHBondContact O-N 3.34Å; I439-I443 HydrophobicContact CG2-CD1 3.69Å; I439-I443 HydrophobicContact CG2-CG1 4.3Å; I439-I443 WeakPolarHBondContact O-CG1 3.34Å; I439-I443 PolarHBondContact O-N 2.95Å; I439-I456 HydrophobicContact CG1-CG2 4.25Å; I439-I456 HydrophobicContact CG2-CD1 4.47Å; I439-I478 HydrophobicContact CD1-CD1 3.96Å; I439-I478 HydrophobicContact CD1-CG2 4.26Å; I439-I478 HydrophobicContact CG1-CD1 3.73Å; I439-I478 HydrophobicContact CG1-CG2 4.27Å; I439-N481 HydrophobicContact CD1-CB 3.76Å; I439-L482 HydrophobicContact CD1-CD2 4.17Å; I439-L482 HydrophobicContact CD1-CG 3.98Å; I439-L482 HydrophobicContact CG2-CD2 3.68Å; I439-F488 HydrophobicContact CB-CE1 3.95Å; I439-F488 HydrophobicContact CB-CE2 4.31Å; I439-F488 HydrophobicContact CB-CZ 3.66Å; I439-F488 HydrophobicContact CD1-CE2 3.98Å; I439-F488 HydrophobicContact CD1-CZ 4.19Å; I439-F488 HydrophobicContact CG2-CD1 3.81Å; I439-F488 HydrophobicContact CG2-CE1 3.33Å; I439-F488 HydrophobicContact CG2-CE2 4.13Å; I439-F488 HydrophobicContact CG2-CG 4.4Å; I439-F488 HydrophobicContact CG2-CZ 3.51Å
440	I	96.3	Very high	94.3	Very high	6 Å²	6	42.4 Å²	42.4	3%	0.031	23%	0.23	C	C	.	.	H	α-helix	trans	-62.9	-43.7	177.4	-62	156	0	0	0	110.5	A436 Q437 A442 I443 A444 Y487 F488 L506 L514 V515 A518	A436-I440 WeakPolarHBondContact O-CD1 3.24Å; A436-I440 WeakPolarHBondContact O-CG1 3.23Å; A436-I440 PolarHBondContact O-N 2.93Å; Q437-I440 PolarHBondContact O-N 3.27Å; I440-A442 PolarHBondContact O-N 2.92Å; I440-I443 PolarHBondContact O-N 3.44Å; I440-A444 WeakPolarHBondContact O-CB 3.45Å; I440-A444 PolarHBondContact O-N 3.35Å; I440-Y487 HydrophobicContact CD1-CE2 4.22Å; I440-F488 HydrophobicContact CG1-CE1 3.8Å; I440-F488 HydrophobicContact CG1-CZ 3.97Å; I440-L506 HydrophobicContact CB-CD2 4.5Å; I440-L506 HydrophobicContact CG1-CD2 3.92Å; I440-L506 HydrophobicContact CG2-CD1 4.06Å; I440-L506 HydrophobicContact CG2-CD2 4.41Å; I440-L514 HydrophobicContact CD1-CB 4.06Å; I440-L514 HydrophobicContact CD1-CD2 4.07Å; I440-L514 HydrophobicContact CD1-CG 4.49Å; I440-L514 HydrophobicContact CG1-CB 4.4Å; I440-L514 HydrophobicContact CG2-CB 4.13Å; I440-V515 HydrophobicContact CG2-CG2 4.26Å; I440-A518 HydrophobicContact CB-CB 4.01Å; I440-A518 HydrophobicContact CG2-CB 3.58Å
441	Q	95.6	Very high	94.6	Very high	10 Å²	10	37.8 Å²	37.8	5%	0.047	21%	0.211	C	C	.	.	H	α-helix	trans	-58.5	-45.9	174.5	-70.4	174.8	21.8	0	0	111.3	Q437 L438 S445 A518 F519	Q437-Q441 VanDerWaalsContact O-CG 3.29Å; Q437-Q441 WeakPolarHBondContact O-CG 3.36Å; Q437-Q441 PolarHBondContact O-N 3.28Å; L438-Q441 PolarHBondContact O-N 2.86Å; Q441-S445 WeakPolarHBondContact O-CB 3.28Å; Q441-S445 PolarHBondContact O-N 3.05Å; Q441-S445 VanDerWaalsContact O-N 3.09Å; Q441-A518 HydrophobicContact CG-CB 3.91Å; Q441-A518 PolarHBondContact NE2-O 2.87Å; Q441-F519 HydrophobicContact CB-CE1 4.48Å; Q441-F519 HydrophobicContact CG-CD1 4.1Å; Q441-F519 HydrophobicContact CG-CE1 3.75Å; Q441-F519 HydrophobicContact CG-CZ 4.02Å
442	A	96.6	Very high	94.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.5	-52.9	178.2	0	0	0	0	0	111.9	L438 I439 I440 A444 S445 L451 H459	L438-A442 WeakPolarHBondContact O-CB 3.25Å; L438-A442 PolarHBondContact O-N 3.27Å; I439-A442 PolarHBondContact O-N 3.34Å; I440-A442 PolarHBondContact O-N 2.92Å; A442-A444 PolarHBondContact O-N 3.44Å; A442-S445 PolarHBondContact O-N 3.09Å; A442-S445 VanDerWaalsContact O-N 3.17Å; A442-S445 PolarHBondContact O-OG 3.14Å; A442-L451 HydrophobicContact CB-CD1 3.94Å; A442-L451 VanDerWaalsContact O-CD1 3.3Å; A442-L451 WeakPolarHBondContact O-CD1 3.44Å; A442-H459 HydrophobicContact CB-CB 4Å
443	I	96.6	Very high	95.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.6	-41.1	-178	-64.4	173.3	0	0	0	111.3	I439 I440 S445 A446 Q449 I456 F488 W504 L506	I439-I443 HydrophobicContact CG2-CD1 3.69Å; I439-I443 HydrophobicContact CG2-CG1 4.3Å; I439-I443 WeakPolarHBondContact O-CG1 3.34Å; I439-I443 PolarHBondContact O-N 2.95Å; I440-I443 PolarHBondContact O-N 3.44Å; I443-S445 PolarHBondContact O-N 3.24Å; I443-A446 WeakPolarHBondContact O-CB 3.33Å; I443-A446 PolarHBondContact O-N 3.18Å; I443-A446 VanDerWaalsContact O-N 3.15Å; I443-Q449 WeakPolarHBondContact CG2-O 3.48Å; I443-I456 HydrophobicContact CG1-CD1 4.5Å; I443-F488 HydrophobicContact CD1-CD1 4.18Å; I443-F488 HydrophobicContact CD1-CE1 4.44Å; I443-W504 HydrophobicContact CD1-CB 4.37Å; I443-L506 HydrophobicContact CB-CG 4.39Å; I443-L506 HydrophobicContact CG2-CD1 4.32Å; I443-L506 HydrophobicContact CG2-CG 3.96Å
444	A	94.2	Very high	95.2	Very high	37 Å²	37	38.8 Å²	38.8	31%	0.306	22%	0.224	S	C	.	.	H	α-helix	trans	-69.6	-18.8	178	0	0	0	0	0	114	I440 A442 A446 V515	I440-A444 WeakPolarHBondContact O-CB 3.45Å; I440-A444 PolarHBondContact O-N 3.35Å; A442-A444 PolarHBondContact O-N 3.44Å; A444-A446 VanDerWaalsContact C-N 3.33Å; A444-V515 HydrophobicContact CB-CG1 4.37Å; A444-V515 HydrophobicContact CB-CG2 3.83Å
445	S	93.7	Very high	95.3	Very high	67 Å²	67	40.6 Å²	40.6	47%	0.469	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-12	172.8	76.9	0	0	0	0	113.7	Q441 A442 I443 H459	Q441-S445 WeakPolarHBondContact O-CB 3.28Å; Q441-S445 PolarHBondContact O-N 3.05Å; Q441-S445 VanDerWaalsContact O-N 3.09Å; A442-S445 PolarHBondContact O-N 3.09Å; A442-S445 VanDerWaalsContact O-N 3.17Å; A442-S445 PolarHBondContact O-OG 3.14Å; I443-S445 PolarHBondContact O-N 3.24Å; S445-H459 PolarHBondContact OG-CE1 3.02Å; S445-H459 PolarHBondContact OG-ND1 3.2Å
446	A	93.7	Very high	95.3	Very high	10 Å²	10	37.8 Å²	37.8	8%	0.083	22%	0.22	C	C	.	.	S	Bend	trans	-84	134.7	-176.4	0	0	0	0	0	111.1	I443 A444 N448 Q449 L451	I443-A446 WeakPolarHBondContact O-CB 3.33Å; I443-A446 PolarHBondContact O-N 3.18Å; I443-A446 VanDerWaalsContact O-N 3.15Å; A444-A446 VanDerWaalsContact C-N 3.33Å; A446-N448 PolarHBondContact O-N 3.2Å; A446-Q449 PolarHBondContact O-N 3.4Å; A446-L451 HydrophobicContact CB-CD1 4.41Å; A446-L451 HydrophobicContact CB-CD2 3.51Å; A446-L451 HydrophobicContact CB-CG 3.71Å
447	P	91.6	Very high	95.3	Very high	127 Å²	127	39.2 Å²	39.2	83%	0.825	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.9	-177.5	26	-35.6	0	0	0	113.6
448	N	90.7	Very high	95.4	Very high	108 Å²	108	40.3 Å²	40.3	58%	0.578	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104	10.6	179.5	-63.5	-28.5	0	0	0	113.3	A446 R450	A446-N448 PolarHBondContact O-N 3.2Å; N448-R450 HydrophobicContact CB-CG 3.97Å; N448-R450 PolarHBondContact O-N 3.49Å
449	Q	92.7	Very high	95.3	Very high	101 Å²	101	42.3 Å²	42.3	47%	0.472	25%	0.248	S	C	.	.	S	Bend	trans	50.1	23.5	-175.3	-63.3	168.2	-73.2	0	0	114.3	I443 A446 Q505 E511	I443-Q449 WeakPolarHBondContact CG2-O 3.48Å; A446-Q449 PolarHBondContact O-N 3.4Å; Q449-Q505 VanDerWaalsContact O-CB 3.28Å; Q449-Q505 WeakPolarHBondContact O-CB 3.47Å; Q449-E511 PolarHBondContact NE2-OE1 3.28Å; Q449-E511 PolarHBondContact NE2-OE2 3.1Å
450	R	94.5	Very high	95.3	Very high	75 Å²	75	42.3 Å²	42.3	28%	0.283	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	138.9	-177.4	78.2	-169.7	-164.6	-157	1.9	110.2	N448 E497 F503 W504 Q505	N448-R450 HydrophobicContact CB-CG 3.97Å; N448-R450 PolarHBondContact O-N 3.49Å; R450-E497 IonicContact NH2-OE1 2.64Å; R450-E497 IonicContact NH2-OE2 3.68Å; R450-F503 HydrophobicContact CB-CB 4.42Å; R450-F503 HydrophobicContact CG-CB 4.44Å; R450-F503 HydrophobicContact CG-CD1 4.02Å; R450-F503 HydrophobicContact CG-CG 4.24Å; R450-W504 CarbonylContact C-O 3.47Å; R450-W504 VanDerWaalsContact CA-O 3.28Å; R450-W504 WeakPolarHBondContact CA-O 3.47Å; R450-Q505 HydrophobicContact CB-CB 3.93Å
451	L	96.4	Very high	95.2	Very high	25 Å²	25	43.3 Å²	43.3	13%	0.131	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	156.4	176.9	-74.1	-175.2	0	0	0	111.3	A442 A446 D455 I456 F503 W504	A442-L451 HydrophobicContact CB-CD1 3.94Å; A442-L451 VanDerWaalsContact O-CD1 3.3Å; A442-L451 WeakPolarHBondContact O-CD1 3.44Å; A446-L451 HydrophobicContact CB-CD1 4.41Å; A446-L451 HydrophobicContact CB-CD2 3.51Å; A446-L451 HydrophobicContact CB-CG 3.71Å; L451-D455 HydrophobicContact CB-CB 4.21Å; L451-D455 HydrophobicContact CD1-CB 4.42Å; L451-D455 HydrophobicContact CD2-CB 3.85Å; L451-D455 HydrophobicContact CG-CB 4.39Å; L451-I456 HydrophobicContact CB-CD1 4.38Å; L451-I456 HydrophobicContact CB-CG1 3.8Å; L451-I456 HydrophobicContact CD1-CG1 4.08Å; L451-F503 CarbonylContact O-C 3.43Å; L451-W504 PolarHBondContact N-O 3.33Å; L451-W504 PolarHBondContact O-N 2.8Å
452	T	96.7	Very high	95.1	Very high	12 Å²	12	51.8 Å²	51.8	7%	0.074	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	164.2	168.1	82.3	0	0	0	0	109.9	A454 D455 I456 F503	T452-A454 PolarHBondContact O-N 2.85Å; T452-A454 PolarHBondContact OG1-N 3.09Å; T452-D455 WeakPolarHBondContact CA-OD2 3.16Å; T452-D455 WeakPolarHBondContact CB-OD2 3.5Å; T452-D455 WeakPolarHBondContact CG2-OD2 3.49Å; T452-D455 PolarHBondContact N-OD2 3.15Å; T452-D455 PolarHBondContact O-N 3.12Å; T452-D455 VanDerWaalsContact O-N 3.12Å; T452-D455 PolarHBondContact OG1-N 3.36Å; T452-D455 PolarHBondContact OG1-OD1 3.25Å; T452-D455 PolarHBondContact OG1-OD2 3.37Å; T452-I456 WeakPolarHBondContact O-CG1 3.29Å; T452-I456 PolarHBondContact O-N 2.83Å; T452-F503 HydrophobicContact CG2-CD1 3.69Å; T452-F503 HydrophobicContact CG2-CE1 3.62Å
453	L	96.9	Very high	95	Very high	51 Å²	51	54.8 Å²	54.8	27%	0.267	31%	0.311	S	S	.	.	H	α-helix	trans	-57.7	-31.7	177.4	-179.8	62.3	0	0	0	112.9	Y457 I478 R479 L482	L453-Y457 HydrophobicContact CD1-CD1 4.49Å; L453-Y457 HydrophobicContact CD1-CE1 3.72Å; L453-Y457 HydrophobicContact CD1-CE2 4.47Å; L453-Y457 HydrophobicContact CG-CE1 4.2Å; L453-Y457 HydrophobicContact CG-CE2 4.05Å; L453-Y457 WeakPolarHBondContact O-CD2 3.28Å; L453-Y457 PolarHBondContact O-N 3.27Å; L453-I478 HydrophobicContact CD1-CG2 4.27Å; L453-R479 HydrophobicContact CD1-CG 4.1Å; L453-R479 HydrophobicContact CD2-CG 3.98Å; L453-L482 HydrophobicContact CD1-CD1 3.62Å
454	A	95.8	Very high	94.8	Very high	62 Å²	62	56 Å²	56	51%	0.512	32%	0.316	S	S	.	.	H	α-helix	trans	-71.2	-41.1	177.2	0	0	0	0	0	111.7	T452 I456 Y457 A458	T452-A454 PolarHBondContact O-N 2.85Å; T452-A454 PolarHBondContact OG1-N 3.09Å; A454-I456 VanDerWaalsContact C-N 3.34Å; A454-I456 PolarHBondContact O-N 2.84Å; A454-Y457 WeakPolarHBondContact O-CB 3.4Å; A454-Y457 PolarHBondContact O-N 3.08Å; A454-A458 PolarHBondContact O-N 2.84Å
455	D	96.2	Very high	94.7	Very high	66 Å²	66	57.5 Å²	57.5	35%	0.353	32%	0.323	S	S	.	.	H	α-helix	trans	-70.1	-33.6	-179.4	-39.3	-44	0	0	0	111.2	L451 T452 A458 H459	L451-D455 HydrophobicContact CB-CB 4.21Å; L451-D455 HydrophobicContact CD1-CB 4.42Å; L451-D455 HydrophobicContact CD2-CB 3.85Å; L451-D455 HydrophobicContact CG-CB 4.39Å; T452-D455 WeakPolarHBondContact CA-OD2 3.16Å; T452-D455 WeakPolarHBondContact CB-OD2 3.5Å; T452-D455 WeakPolarHBondContact CG2-OD2 3.49Å; T452-D455 PolarHBondContact N-OD2 3.15Å; T452-D455 PolarHBondContact O-N 3.12Å; T452-D455 VanDerWaalsContact O-N 3.12Å; T452-D455 PolarHBondContact OG1-N 3.36Å; T452-D455 PolarHBondContact OG1-OD1 3.25Å; T452-D455 PolarHBondContact OG1-OD2 3.37Å; D455-A458 PolarHBondContact O-N 3.4Å; D455-H459 VanDerWaalsContact O-CB 3.32Å; D455-H459 WeakPolarHBondContact O-CB 3.38Å; D455-H459 PolarHBondContact O-N 3.33Å
456	I	97.3	Very high	94.8	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-61.1	-44.6	171.7	-67.5	168	0	0	0	110.4	I439 I443 L451 T452 A454 I460 I478 L482 W504	I439-I456 HydrophobicContact CG1-CG2 4.25Å; I439-I456 HydrophobicContact CG2-CD1 4.47Å; I443-I456 HydrophobicContact CG1-CD1 4.5Å; L451-I456 HydrophobicContact CB-CD1 4.38Å; L451-I456 HydrophobicContact CB-CG1 3.8Å; L451-I456 HydrophobicContact CD1-CG1 4.08Å; T452-I456 WeakPolarHBondContact O-CG1 3.29Å; T452-I456 PolarHBondContact O-N 2.83Å; A454-I456 VanDerWaalsContact C-N 3.34Å; A454-I456 PolarHBondContact O-N 2.84Å; I456-I460 HydrophobicContact CG2-CD1 3.86Å; I456-I460 WeakPolarHBondContact O-CB 3.39Å; I456-I460 VanDerWaalsContact O-CG1 3.26Å; I456-I460 WeakPolarHBondContact O-CG1 3.4Å; I456-I460 PolarHBondContact O-N 2.85Å; I456-I460 VanDerWaalsContact O-N 3.08Å; I456-I478 HydrophobicContact CG2-CG2 3.97Å; I456-L482 HydrophobicContact CD1-CD1 4.23Å; I456-L482 HydrophobicContact CD1-CD2 4.3Å; I456-W504 HydrophobicContact CD1-CB 4.22Å; I456-W504 HydrophobicContact CD1-CG 4.48Å
457	Y	97.1	Very high	94.8	Very high	36 Å²	36	57.5 Å²	57.5	14%	0.141	31%	0.311	C	S	.	.	H	α-helix	trans	-62.4	-48.6	174.5	-58.6	-29.9	0	0	0	111.3	L453 A454 H459 I460 S461 W474 Q475 I478 R479	L453-Y457 HydrophobicContact CD1-CD1 4.49Å; L453-Y457 HydrophobicContact CD1-CE1 3.72Å; L453-Y457 HydrophobicContact CD1-CE2 4.47Å; L453-Y457 HydrophobicContact CG-CE1 4.2Å; L453-Y457 HydrophobicContact CG-CE2 4.05Å; L453-Y457 WeakPolarHBondContact O-CD2 3.28Å; L453-Y457 PolarHBondContact O-N 3.27Å; A454-Y457 WeakPolarHBondContact O-CB 3.4Å; A454-Y457 PolarHBondContact O-N 3.08Å; Y457-H459 PolarHBondContact O-N 2.96Å; Y457-I460 PolarHBondContact O-N 3.01Å; Y457-S461 PolarHBondContact O-N 2.88Å; Y457-S461 PolarHBondContact O-OG 3.26Å; Y457-W474 HydrophobicContact CD1-CH2 4.11Å; Y457-W474 AromaticContact CD1-CZ3 3.86Å; Y457-W474 HydrophobicContact CD1-CZ3 3.86Å; Y457-W474 HydrophobicContact CG-CH2 4.27Å; Y457-W474 HydrophobicContact CG-CZ3 4.48Å; Y457-Q475 HydrophobicContact CD1-CB 4.37Å; Y457-Q475 HydrophobicContact CD1-CG 3.94Å; Y457-Q475 HydrophobicContact CD2-CG 4.48Å; Y457-Q475 HydrophobicContact CE1-CB 3.77Å; Y457-Q475 HydrophobicContact CE1-CG 3.85Å; Y457-Q475 HydrophobicContact CE2-CG 4.4Å; Y457-Q475 HydrophobicContact CG-CG 4.27Å; Y457-I478 HydrophobicContact CD1-CG2 4.25Å; Y457-I478 HydrophobicContact CE1-CB 4.2Å; Y457-I478 HydrophobicContact CE1-CG2 3.9Å; Y457-R479 WeakPolarHBondContact OH-CG 3.49Å; Y457-R479 PolarHBondContact OH-NH1 2.84Å
458	A	96.1	Very high	94.8	Very high	54 Å²	54	56.5 Å²	56.5	45%	0.446	29%	0.293	S	S	.	.	H	α-helix	trans	-59.7	-46.6	-178.4	0	0	0	0	0	111.8	A454 D455 S461 K462	A454-A458 PolarHBondContact O-N 2.84Å; D455-A458 PolarHBondContact O-N 3.4Å; A458-S461 PolarHBondContact O-N 2.98Å; A458-S461 PolarHBondContact O-OG 3.5Å; A458-K462 VanDerWaalsContact O-CB 3.3Å; A458-K462 WeakPolarHBondContact O-CB 3.46Å; A458-K462 PolarHBondContact O-N 3.38Å
459	H	95.9	Very high	94.8	Very high	41 Å²	41	55.5 Å²	55.5	19%	0.19	29%	0.293	C	S	.	.	H	α-helix	trans	-56.6	-51.9	174.1	179.7	101.6	0	0	0	111.1	A442 S445 D455 Y457 S461 K462 T463	A442-H459 HydrophobicContact CB-CB 4Å; S445-H459 PolarHBondContact OG-CE1 3.02Å; S445-H459 PolarHBondContact OG-ND1 3.2Å; D455-H459 VanDerWaalsContact O-CB 3.32Å; D455-H459 WeakPolarHBondContact O-CB 3.38Å; D455-H459 PolarHBondContact O-N 3.33Å; Y457-H459 PolarHBondContact O-N 2.96Å; H459-S461 VanDerWaalsContact C-N 3.34Å; H459-S461 PolarHBondContact O-N 2.82Å; H459-K462 PolarHBondContact O-N 2.83Å; H459-K462 VanDerWaalsContact O-N 3.16Å; H459-T463 PolarHBondContact CD2-OG1 3.05Å; H459-T463 PolarHBondContact NE2-OG1 3.3Å; H459-T463 VanDerWaalsContact NE2-OG1 3.11Å; H459-T463 WeakPolarHBondContact O-CB 3.02Å; H459-T463 PolarHBondContact O-N 3.08Å; H459-T463 PolarHBondContact O-OG1 2.87Å; H459-T463 VanDerWaalsContact O-OG1 3.08Å
460	I	96.4	Very high	94.8	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-61.6	-42.8	-176.6	-69.3	171.2	0	0	0	110.9	L438 I456 Y457 F464 Y467 W474 I478	L438-I460 HydrophobicContact CB-CD1 3.88Å; L438-I460 HydrophobicContact CB-CG1 4.19Å; I456-I460 HydrophobicContact CG2-CD1 3.86Å; I456-I460 WeakPolarHBondContact O-CB 3.39Å; I456-I460 VanDerWaalsContact O-CG1 3.26Å; I456-I460 WeakPolarHBondContact O-CG1 3.4Å; I456-I460 PolarHBondContact O-N 2.85Å; I456-I460 VanDerWaalsContact O-N 3.08Å; Y457-I460 PolarHBondContact O-N 3.01Å; I460-F464 WeakPolarHBondContact O-CB 3.28Å; I460-F464 PolarHBondContact O-N 3.06Å; I460-Y467 HydrophobicContact CG2-CD2 3.5Å; I460-Y467 HydrophobicContact CG2-CE2 4.25Å; I460-Y467 HydrophobicContact CG2-CG 3.85Å; I460-W474 HydrophobicContact CB-CH2 4.43Å; I460-W474 HydrophobicContact CB-CZ3 4.17Å; I460-W474 HydrophobicContact CD1-CZ3 4.45Å; I460-W474 HydrophobicContact CG2-CE3 4.43Å; I460-W474 HydrophobicContact CG2-CH2 4.34Å; I460-W474 HydrophobicContact CG2-CZ3 3.95Å; I460-I478 HydrophobicContact CD1-CD1 3.52Å; I460-I478 HydrophobicContact CD1-CG1 4.26Å
461	S	94.7	Very high	94.6	Very high	27 Å²	27	57.7 Å²	57.7	19%	0.189	31%	0.306	C	S	.	.	H	α-helix	trans	-68.8	-30.7	176.3	61.3	0	0	0	0	114.1	Y457 A458 H459 Y467	Y457-S461 PolarHBondContact O-N 2.88Å; Y457-S461 PolarHBondContact O-OG 3.26Å; A458-S461 PolarHBondContact O-N 2.98Å; A458-S461 PolarHBondContact O-OG 3.5Å; H459-S461 VanDerWaalsContact C-N 3.34Å; H459-S461 PolarHBondContact O-N 2.82Å; S461-Y467 WeakPolarHBondContact CA-O 3.49Å; S461-Y467 WeakPolarHBondContact CB-O 3.33Å
462	K	94.3	Very high	94.5	Very high	187 Å²	187	64.4 Å²	64.4	81%	0.813	33%	0.334	S	S	*	.	H	α-helix	trans	-75.7	-41.2	177.2	-177.6	175.4	178.8	177.1	0	111.9	A458 H459	A458-K462 VanDerWaalsContact O-CB 3.3Å; A458-K462 WeakPolarHBondContact O-CB 3.46Å; A458-K462 PolarHBondContact O-N 3.38Å; H459-K462 PolarHBondContact O-N 2.83Å; H459-K462 VanDerWaalsContact O-N 3.16Å
463	T	93.3	Very high	94.4	Very high	64 Å²	64	65.9 Å²	65.9	39%	0.393	35%	0.352	S	S	.	.	H	α-helix	trans	-78	-31.7	-179.6	-55.1	0	0	0	0	111.8	H459	H459-T463 PolarHBondContact CD2-OG1 3.05Å; H459-T463 PolarHBondContact NE2-OG1 3.3Å; H459-T463 VanDerWaalsContact NE2-OG1 3.11Å; H459-T463 WeakPolarHBondContact O-CB 3.02Å; H459-T463 PolarHBondContact O-N 3.08Å; H459-T463 PolarHBondContact O-OG1 2.87Å; H459-T463 VanDerWaalsContact O-OG1 3.08Å
464	F	93.6	Very high	94.4	Very high	24 Å²	24	63.6 Å²	63.6	11%	0.105	34%	0.34	C	S	.	.			trans	-135.7	91.9	-176	-57.4	-70.5	0	0	0	111.5	P431 Y433 L438 I460 Y466 Y467	P431-F464 HydrophobicContact CB-CD1 3.83Å; P431-F464 HydrophobicContact CB-CE1 4Å; P431-F464 HydrophobicContact CB-CG 4.24Å; P431-F464 HydrophobicContact CG-CB 3.67Å; P431-F464 HydrophobicContact CG-CD1 3.41Å; P431-F464 VanDerWaalsContact CG-CD1 3.41Å; P431-F464 HydrophobicContact CG-CD2 4.34Å; P431-F464 HydrophobicContact CG-CE1 4.11Å; P431-F464 HydrophobicContact CG-CG 3.54Å; Y433-F464 HydrophobicContact CD2-CE1 4.23Å; Y433-F464 AromaticContact CD2-CZ 3.82Å; Y433-F464 HydrophobicContact CD2-CZ 3.82Å; Y433-F464 HydrophobicContact CE2-CE1 4.05Å; Y433-F464 AromaticContact CE2-CZ 3.8Å; Y433-F464 HydrophobicContact CE2-CZ 3.8Å; L438-F464 HydrophobicContact CD2-CD2 3.64Å; L438-F464 HydrophobicContact CD2-CE2 3.32Å; L438-F464 HydrophobicContact CD2-CZ 4.11Å; I460-F464 WeakPolarHBondContact O-CB 3.28Å; I460-F464 PolarHBondContact O-N 3.06Å; F464-Y466 PolarHBondContact O-N 3.45Å; F464-Y467 HydrophobicContact CB-CD2 4Å; F464-Y467 PolarHBondContact O-N 3.48Å
465	P	92.1	Very high	94.5	Very high	69 Å²	69	61.9 Å²	61.9	45%	0.448	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-16.8	-175.7	-28.4	36.6	0	0	0	116.2	Y467	P465-Y467 VanDerWaalsContact C-N 3.26Å; P465-Y467 PolarHBondContact O-N 3.05Å
466	Y	93.9	Very high	94.5	Very high	72 Å²	72	63.2 Å²	63.2	28%	0.282	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-42.6	166.5	177.6	-89.2	0	0	0	113	T427 F428 R429 K430 F464 K468	T427-Y466 PolarHBondContact O-N 3.42Å; F428-Y466 WeakPolarHBondContact O-CD2 3.29Å; R429-Y466 VanDerWaalsContact C-CD2 3.49Å; K430-Y466 HydrophobicContact CB-CD1 4.46Å; K430-Y466 HydrophobicContact CB-CD2 4.2Å; K430-Y466 HydrophobicContact CB-CE1 4.07Å; K430-Y466 HydrophobicContact CB-CE2 3.73Å; K430-Y466 HydrophobicContact CD-CE1 4.29Å; K430-Y466 HydrophobicContact CG-CD1 4.36Å; K430-Y466 HydrophobicContact CG-CE1 3.75Å; K430-Y466 HydrophobicContact CG-CE2 4.3Å; F464-Y466 PolarHBondContact O-N 3.45Å; Y466-K468 PolarHBondContact O-N 2.96Å
467	Y	95.3	Very high	94.5	Very high	6 Å²	6	64.9 Å²	64.9	2%	0.024	34%	0.34	C	S	.	.	S	Bend	trans	-86.3	88.9	-175.5	-68.5	-64	0	0	0	111.4	P431 Y435 L438 I460 S461 F464 P465 W474	P431-Y467 HydrophobicContact CG-CD2 4.46Å; P431-Y467 HydrophobicContact CG-CE2 3.86Å; Y435-Y467 HydrophobicContact CE1-CE1 4.02Å; L438-Y467 HydrophobicContact CD1-CD2 4.41Å; L438-Y467 HydrophobicContact CD1-CE2 3.54Å; I460-Y467 HydrophobicContact CG2-CD2 3.5Å; I460-Y467 HydrophobicContact CG2-CE2 4.25Å; I460-Y467 HydrophobicContact CG2-CG 3.85Å; S461-Y467 WeakPolarHBondContact CA-O 3.49Å; S461-Y467 WeakPolarHBondContact CB-O 3.33Å; F464-Y467 HydrophobicContact CB-CD2 4Å; F464-Y467 PolarHBondContact O-N 3.48Å; P465-Y467 VanDerWaalsContact C-N 3.26Å; P465-Y467 PolarHBondContact O-N 3.05Å; Y467-W474 HydrophobicContact CD1-CB 3.7Å; Y467-W474 AromaticContact CD1-CD1 3.82Å; Y467-W474 AromaticContact CD1-CD2 3.89Å; Y467-W474 HydrophobicContact CD1-CD2 3.89Å; Y467-W474 HydrophobicContact CD1-CE3 4.41Å; Y467-W474 AromaticContact CD1-CG 3.55Å; Y467-W474 HydrophobicContact CD1-CG 3.55Å; Y467-W474 HydrophobicContact CE1-CB 3.9Å; Y467-W474 HydrophobicContact CE1-CG 4.26Å; Y467-W474 HydrophobicContact CG-CD2 4.28Å; Y467-W474 HydrophobicContact CG-CG 4.38Å
468	K	92	Very high	94.6	Very high	105 Å²	105	63.1 Å²	63.1	46%	0.457	33%	0.333	S	S	.	.			trans	-65.2	132.7	-176.6	-64.6	174	-174.8	171	0	111.6	Y466 H470 E471 W474	Y466-K468 PolarHBondContact O-N 2.96Å; K468-H470 PolarHBondContact O-N 2.92Å; K468-H470 VanDerWaalsContact O-N 3.15Å; K468-E471 HydrophobicContact CB-CB 4.3Å; K468-E471 PolarHBondContact O-N 3.12Å; K468-E471 VanDerWaalsContact O-N 3.12Å; K468-W474 PolarHBondContact O-NE1 3.2Å
469	P	90.8	Very high	94.7	Very high	88 Å²	88	64.9 Å²	64.9	57%	0.571	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-14	-172.6	27.5	-36	0	0	0	114.9	Q475	P469-Q475 PolarHBondContact O-NE2 3.47Å
470	H	91.1	Very high	94.7	Very high	146 Å²	146	67.8 Å²	67.8	68%	0.676	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-10.9	175.7	50	-106.9	0	0	0	113.9	K468	K468-H470 PolarHBondContact O-N 2.92Å; K468-H470 VanDerWaalsContact O-N 3.15Å
471	E	91.8	Very high	94.8	Very high	75 Å²	75	69 Å²	69	35%	0.35	35%	0.348	S	S	.	.			trans	-83.7	128.7	-175.5	-166.9	-147.2	115.4	0	0	111.2	K468 W474 Q475	K468-E471 HydrophobicContact CB-CB 4.3Å; K468-E471 PolarHBondContact O-N 3.12Å; K468-E471 VanDerWaalsContact O-N 3.12Å; E471-W474 VanDerWaalsContact CD-CD1 3.46Å; E471-W474 VanDerWaalsContact OE1-CD1 3.24Å; E471-W474 PolarHBondContact OE1-N 3.33Å; E471-Q475 VanDerWaalsContact O-CD 3.28Å; E471-Q475 VanDerWaalsContact O-CG 3.3Å; E471-Q475 WeakPolarHBondContact O-CG 3.45Å; E471-Q475 PolarHBondContact O-NE2 3.33Å
472	K	93.6	Very high	94.9	Very high	166 Å²	166	67.9 Å²	67.9	72%	0.722	34%	0.34	S	S	*	.	H	α-helix	trans	-87.7	-19.6	-171.9	-65	175.8	-175.2	168.8	0	114.1	N476	K472-N476 PolarHBondContact O-N 3.23Å
473	G	95	Very high	94.9	Very high	43 Å²	43	63.4 Å²	63.4	44%	0.443	33%	0.332	S	S	.	.	H	α-helix	trans	-64.6	-65.3	-173.8	0	0	0	0	0	112.5	Q475 N476 S477	G473-Q475 PolarHBondContact O-N 2.75Å; G473-N476 WeakPolarHBondContact O-CB 2.96Å; G473-N476 PolarHBondContact O-N 3.47Å; G473-S477 PolarHBondContact O-N 3.27Å; G473-S477 VanDerWaalsContact O-N 3.17Å; G473-S477 PolarHBondContact O-OG 2.58Å
474	W	96.4	Very high	95	Very high	3 Å²	3	65.2 Å²	65.2	1%	0.011	34%	0.339	C	S	.	.	H	α-helix	trans	-58.1	-35.2	176.3	71.5	-99.5	0	0	0	112.4	Y435 Y457 I460 Y467 K468 E471 N476 S477 I478	Y435-W474 HydrophobicContact CE1-CB 4.06Å; Y457-W474 HydrophobicContact CD1-CH2 4.11Å; Y457-W474 AromaticContact CD1-CZ3 3.86Å; Y457-W474 HydrophobicContact CD1-CZ3 3.86Å; Y457-W474 HydrophobicContact CG-CH2 4.27Å; Y457-W474 HydrophobicContact CG-CZ3 4.48Å; I460-W474 HydrophobicContact CB-CH2 4.43Å; I460-W474 HydrophobicContact CB-CZ3 4.17Å; I460-W474 HydrophobicContact CD1-CZ3 4.45Å; I460-W474 HydrophobicContact CG2-CE3 4.43Å; I460-W474 HydrophobicContact CG2-CH2 4.34Å; I460-W474 HydrophobicContact CG2-CZ3 3.95Å; Y467-W474 HydrophobicContact CD1-CB 3.7Å; Y467-W474 AromaticContact CD1-CD1 3.82Å; Y467-W474 AromaticContact CD1-CD2 3.89Å; Y467-W474 HydrophobicContact CD1-CD2 3.89Å; Y467-W474 HydrophobicContact CD1-CE3 4.41Å; Y467-W474 AromaticContact CD1-CG 3.55Å; Y467-W474 HydrophobicContact CD1-CG 3.55Å; Y467-W474 HydrophobicContact CE1-CB 3.9Å; Y467-W474 HydrophobicContact CE1-CG 4.26Å; Y467-W474 HydrophobicContact CG-CD2 4.28Å; Y467-W474 HydrophobicContact CG-CG 4.38Å; K468-W474 PolarHBondContact O-NE1 3.2Å; E471-W474 VanDerWaalsContact CD-CD1 3.46Å; E471-W474 VanDerWaalsContact OE1-CD1 3.24Å; E471-W474 PolarHBondContact OE1-N 3.33Å; W474-N476 VanDerWaalsContact C-N 3.29Å; W474-N476 PolarHBondContact O-N 3.39Å; W474-S477 WeakPolarHBondContact O-CB 3.47Å; W474-S477 PolarHBondContact O-N 2.86Å; W474-S477 VanDerWaalsContact O-N 3.15Å; W474-I478 HydrophobicContact CE3-CG1 3.81Å; W474-I478 HydrophobicContact CZ3-CG1 4.11Å; W474-I478 WeakPolarHBondContact O-CG1 3.17Å; W474-I478 PolarHBondContact O-N 3.42Å
475	Q	97.2	Very high	95	Very high	26 Å²	26	65.5 Å²	65.5	12%	0.121	34%	0.341	C	S	.	.	H	α-helix	trans	-63.5	-32.8	175.7	-66.3	-177	12.4	0	0	112.7	Y457 P469 E471 G473 R479	Y457-Q475 HydrophobicContact CD1-CB 4.37Å; Y457-Q475 HydrophobicContact CD1-CG 3.94Å; Y457-Q475 HydrophobicContact CD2-CG 4.48Å; Y457-Q475 HydrophobicContact CE1-CB 3.77Å; Y457-Q475 HydrophobicContact CE1-CG 3.85Å; Y457-Q475 HydrophobicContact CE2-CG 4.4Å; Y457-Q475 HydrophobicContact CG-CG 4.27Å; P469-Q475 PolarHBondContact O-NE2 3.47Å; E471-Q475 VanDerWaalsContact O-CD 3.28Å; E471-Q475 VanDerWaalsContact O-CG 3.3Å; E471-Q475 WeakPolarHBondContact O-CG 3.45Å; E471-Q475 PolarHBondContact O-NE2 3.33Å; G473-Q475 PolarHBondContact O-N 2.75Å; Q475-R479 VanDerWaalsContact C-NH1 3.33Å; Q475-R479 WeakPolarHBondContact O-CG 3.35Å; Q475-R479 PolarHBondContact O-N 3.48Å; Q475-R479 VanDerWaalsContact O-N 3.13Å; Q475-R479 PolarHBondContact O-NH1 3.49Å; Q475-R479 VanDerWaalsContact O-NH1 3.15Å
476	N	97.4	Very high	95.1	Very high	94 Å²	94	73 Å²	73	50%	0.503	36%	0.361	S	S	.	.	H	α-helix	trans	-67.6	-43.7	172.6	-156.8	45.9	0	0	0	111.2	K472 G473 W474 I478 R479 H480	K472-N476 PolarHBondContact O-N 3.23Å; G473-N476 WeakPolarHBondContact O-CB 2.96Å; G473-N476 PolarHBondContact O-N 3.47Å; W474-N476 VanDerWaalsContact C-N 3.29Å; W474-N476 PolarHBondContact O-N 3.39Å; N476-I478 VanDerWaalsContact C-N 3.29Å; N476-I478 PolarHBondContact O-N 2.99Å; N476-R479 VanDerWaalsContact CA-NH2 3.29Å; N476-R479 PolarHBondContact O-N 2.87Å; N476-R479 PolarHBondContact OD1-NH2 3.39Å; N476-H480 WeakPolarHBondContact O-CB 3.41Å; N476-H480 PolarHBondContact O-N 2.91Å
477	S	97.4	Very high	95.1	Very high	35 Å²	35	72.2 Å²	72.2	25%	0.245	36%	0.358	C	S	.	.	H	α-helix	trans	-59.2	-38.8	175.1	-56.3	0	0	0	0	112.4	G473 W474 N481	G473-S477 PolarHBondContact O-N 3.27Å; G473-S477 VanDerWaalsContact O-N 3.17Å; G473-S477 PolarHBondContact O-OG 2.58Å; W474-S477 WeakPolarHBondContact O-CB 3.47Å; W474-S477 PolarHBondContact O-N 2.86Å; W474-S477 VanDerWaalsContact O-N 3.15Å; S477-N481 WeakPolarHBondContact O-CB 3.48Å; S477-N481 PolarHBondContact O-N 3.36Å; S477-N481 PolarHBondContact O-ND2 3.45Å
478	I	97.8	Very high	95.2	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-63.6	-49	173.6	-68.8	-68.9	0	0	0	111.5	Y435 I439 L453 I456 Y457 I460 W474 N476 H480 N481 L482	Y435-I478 HydrophobicContact CD1-CD1 3.99Å; Y435-I478 HydrophobicContact CD1-CG1 4.38Å; Y435-I478 HydrophobicContact CG-CD1 4.46Å; I439-I478 HydrophobicContact CD1-CD1 3.96Å; I439-I478 HydrophobicContact CD1-CG2 4.26Å; I439-I478 HydrophobicContact CG1-CD1 3.73Å; I439-I478 HydrophobicContact CG1-CG2 4.27Å; L453-I478 HydrophobicContact CD1-CG2 4.27Å; I456-I478 HydrophobicContact CG2-CG2 3.97Å; Y457-I478 HydrophobicContact CD1-CG2 4.25Å; Y457-I478 HydrophobicContact CE1-CB 4.2Å; Y457-I478 HydrophobicContact CE1-CG2 3.9Å; I460-I478 HydrophobicContact CD1-CD1 3.52Å; I460-I478 HydrophobicContact CD1-CG1 4.26Å; W474-I478 HydrophobicContact CE3-CG1 3.81Å; W474-I478 HydrophobicContact CZ3-CG1 4.11Å; W474-I478 WeakPolarHBondContact O-CG1 3.17Å; W474-I478 PolarHBondContact O-N 3.42Å; N476-I478 VanDerWaalsContact C-N 3.29Å; N476-I478 PolarHBondContact O-N 2.99Å; I478-H480 VanDerWaalsContact C-N 3.33Å; I478-H480 PolarHBondContact O-N 3.3Å; I478-N481 PolarHBondContact O-N 3.37Å; I478-L482 HydrophobicContact CG2-CD1 4.1Å; I478-L482 WeakPolarHBondContact O-CG 3.39Å; I478-L482 PolarHBondContact O-N 2.87Å
479	R	98	Very high	95.4	Very high	90 Å²	90	69.9 Å²	69.9	34%	0.34	35%	0.35	S	S	.	.	H	α-helix	trans	-58.4	-45.6	176.8	-70.4	-176.7	-60	-91.9	10.4	111.8	L453 Y457 Q475 N476 L482 S483	L453-R479 HydrophobicContact CD1-CG 4.1Å; L453-R479 HydrophobicContact CD2-CG 3.98Å; Y457-R479 WeakPolarHBondContact OH-CG 3.49Å; Y457-R479 PolarHBondContact OH-NH1 2.84Å; Q475-R479 VanDerWaalsContact C-NH1 3.33Å; Q475-R479 WeakPolarHBondContact O-CG 3.35Å; Q475-R479 PolarHBondContact O-N 3.48Å; Q475-R479 VanDerWaalsContact O-N 3.13Å; Q475-R479 PolarHBondContact O-NH1 3.49Å; Q475-R479 VanDerWaalsContact O-NH1 3.15Å; N476-R479 VanDerWaalsContact CA-NH2 3.29Å; N476-R479 PolarHBondContact O-N 2.87Å; N476-R479 PolarHBondContact OD1-NH2 3.39Å; R479-L482 PolarHBondContact O-N 3.25Å; R479-S483 PolarHBondContact O-N 3.49Å; R479-S483 VanDerWaalsContact O-N 3.17Å; R479-S483 PolarHBondContact O-OG 2.86Å
480	H	97	Very high	95.7	Very high	102 Å²	102	73.3 Å²	73.3	47%	0.472	35%	0.351	S	S	.	.	H	α-helix	trans	-59.2	-47.3	176.1	170.5	83.1	0	0	0	111.7	N476 I478 L482 S483 L484	N476-H480 WeakPolarHBondContact O-CB 3.41Å; N476-H480 PolarHBondContact O-N 2.91Å; I478-H480 VanDerWaalsContact C-N 3.33Å; I478-H480 PolarHBondContact O-N 3.3Å; H480-L482 VanDerWaalsContact C-N 3.35Å; H480-L482 PolarHBondContact O-N 2.9Å; H480-S483 WeakPolarHBondContact CA-OG 3.48Å; H480-S483 PolarHBondContact O-N 3.44Å; H480-S483 VanDerWaalsContact O-N 3.12Å; H480-S483 PolarHBondContact O-OG 2.86Å; H480-L484 VanDerWaalsContact NE2-CD1 3.35Å; H480-L484 WeakPolarHBondContact NE2-CD1 3.41Å; H480-L484 VanDerWaalsContact O-CB 3.31Å; H480-L484 WeakPolarHBondContact O-CB 3.19Å; H480-L484 PolarHBondContact O-N 3.02Å
481	N	97.5	Very high	95.8	Very high	27 Å²	27	68.2 Å²	68.2	14%	0.144	33%	0.33	C	S	.	.	H	α-helix	trans	-62.6	-38.2	178.7	-88.3	-102.4	0	0	0	112.8	I439 S477 I478 S483 L484 N485 F488	I439-N481 HydrophobicContact CD1-CB 3.76Å; S477-N481 WeakPolarHBondContact O-CB 3.48Å; S477-N481 PolarHBondContact O-N 3.36Å; S477-N481 PolarHBondContact O-ND2 3.45Å; I478-N481 PolarHBondContact O-N 3.37Å; N481-S483 VanDerWaalsContact C-N 3.32Å; N481-S483 PolarHBondContact O-N 3.19Å; N481-L484 PolarHBondContact O-N 2.92Å; N481-N485 PolarHBondContact O-N 2.81Å; N481-N485 PolarHBondContact O-ND2 2.64Å; N481-F488 WeakPolarHBondContact O-CD2 3.48Å
482	L	97	Very high	95.9	Very high	4 Å²	4	69.2 Å²	69.2	2%	0.021	34%	0.343	C	S	.	.	H	α-helix	trans	-63.5	-33.7	174	-73.3	168.3	0	0	0	112.8	I439 L453 I456 I478 R479 H480 F488 W504	I439-L482 HydrophobicContact CD1-CD2 4.17Å; I439-L482 HydrophobicContact CD1-CG 3.98Å; I439-L482 HydrophobicContact CG2-CD2 3.68Å; L453-L482 HydrophobicContact CD1-CD1 3.62Å; I456-L482 HydrophobicContact CD1-CD1 4.23Å; I456-L482 HydrophobicContact CD1-CD2 4.3Å; I478-L482 HydrophobicContact CG2-CD1 4.1Å; I478-L482 WeakPolarHBondContact O-CG 3.39Å; I478-L482 PolarHBondContact O-N 2.87Å; R479-L482 PolarHBondContact O-N 3.25Å; H480-L482 VanDerWaalsContact C-N 3.35Å; H480-L482 PolarHBondContact O-N 2.9Å; L482-F488 HydrophobicContact CD2-CB 4Å; L482-F488 HydrophobicContact CD2-CD1 4.4Å; L482-F488 HydrophobicContact CD2-CD2 4.11Å; L482-F488 HydrophobicContact CD2-CG 3.93Å; L482-W504 HydrophobicContact CB-CD2 4.38Å; L482-W504 HydrophobicContact CB-CE3 4.25Å; L482-W504 HydrophobicContact CB-CH2 3.93Å; L482-W504 HydrophobicContact CB-CZ2 4.08Å; L482-W504 HydrophobicContact CB-CZ3 4.01Å; L482-W504 HydrophobicContact CD1-CD2 4.3Å; L482-W504 HydrophobicContact CD1-CG 4.43Å; L482-W504 HydrophobicContact CD1-CZ2 4.48Å; L482-W504 HydrophobicContact CD2-CB 4.3Å; L482-W504 HydrophobicContact CD2-CD2 3.88Å; L482-W504 HydrophobicContact CD2-CE3 3.95Å; L482-W504 HydrophobicContact CD2-CG 4.04Å; L482-W504 HydrophobicContact CG-CD2 4.43Å; L482-W504 WeakPolarHBondContact O-CZ3 3.47Å
483	S	95.7	Very high	95.8	Very high	92 Å²	92	64.3 Å²	64.3	64%	0.643	32%	0.32	S	S	*	.	H	α-helix	trans	-84.3	-27.8	175.6	50.9	0	0	0	0	114.8	R479 H480 N481	R479-S483 PolarHBondContact O-N 3.49Å; R479-S483 VanDerWaalsContact O-N 3.17Å; R479-S483 PolarHBondContact O-OG 2.86Å; H480-S483 WeakPolarHBondContact CA-OG 3.48Å; H480-S483 PolarHBondContact O-N 3.44Å; H480-S483 VanDerWaalsContact O-N 3.12Å; H480-S483 PolarHBondContact O-OG 2.86Å; N481-S483 VanDerWaalsContact C-N 3.32Å; N481-S483 PolarHBondContact O-N 3.19Å
484	L	94	Very high	95.5	Very high	103 Å²	103	64.9 Å²	64.9	54%	0.539	32%	0.317	S	S	.	.	H	α-helix	trans	-80.6	-41.8	-175.3	-179.5	151.6	0	0	0	112.3	H480 N481	H480-L484 VanDerWaalsContact NE2-CD1 3.35Å; H480-L484 WeakPolarHBondContact NE2-CD1 3.41Å; H480-L484 VanDerWaalsContact O-CB 3.31Å; H480-L484 WeakPolarHBondContact O-CB 3.19Å; H480-L484 PolarHBondContact O-N 3.02Å; N481-L484 PolarHBondContact O-N 2.92Å
485	N	95	Very high	95.1	Very high	29 Å²	29	74.4 Å²	74.4	16%	0.155	36%	0.362	C	S	.	.			trans	-90.6	111.7	-172.5	-66.3	-83.8	0	0	0	110.8	N481 Y487 F488	N481-N485 PolarHBondContact O-N 2.81Å; N481-N485 PolarHBondContact O-ND2 2.64Å; N485-Y487 HydrophobicContact CB-CD1 4.1Å; N485-Y487 HydrophobicContact CB-CD2 4.32Å; N485-Y487 HydrophobicContact CB-CE1 3.62Å; N485-Y487 HydrophobicContact CB-CE2 3.9Å; N485-Y487 HydrophobicContact CB-CG 4.42Å; N485-Y487 VanDerWaalsContact CG-OH 3.26Å; N485-Y487 PolarHBondContact O-N 2.84Å; N485-Y487 WeakPolarHBondContact OD1-CE1 3.25Å; N485-Y487 PolarHBondContact OD1-OH 3.5Å; N485-F488 HydrophobicContact CB-CD2 3.68Å; N485-F488 HydrophobicContact CB-CE2 3.9Å; N485-F488 PolarHBondContact O-N 3.01Å
486	R	93.2	Very high	94.5	Very high	226 Å²	226	77.9 Å²	77.9	85%	0.853	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-21.4	-177.2	-61.8	-175.5	-174.2	171.9	4	114.9	F488	R486-F488 VanDerWaalsContact C-N 3.31Å
487	Y	94.7	Very high	94	Very high	56 Å²	56	77.1 Å²	77.1	22%	0.22	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-3	178.1	56.4	-101.7	0	0	0	114.6	I440 N485 L506 D507 C510 L514	I440-Y487 HydrophobicContact CD1-CE2 4.22Å; N485-Y487 HydrophobicContact CB-CD1 4.1Å; N485-Y487 HydrophobicContact CB-CD2 4.32Å; N485-Y487 HydrophobicContact CB-CE1 3.62Å; N485-Y487 HydrophobicContact CB-CE2 3.9Å; N485-Y487 HydrophobicContact CB-CG 4.42Å; N485-Y487 VanDerWaalsContact CG-OH 3.26Å; N485-Y487 PolarHBondContact O-N 2.84Å; N485-Y487 WeakPolarHBondContact OD1-CE1 3.25Å; N485-Y487 PolarHBondContact OD1-OH 3.5Å; Y487-L506 WeakPolarHBondContact O-CA 3.42Å; Y487-D507 PolarHBondContact O-N 2.8Å; Y487-C510 VanDerWaalsContact CB-SG 3.56Å; Y487-L514 HydrophobicContact CD2-CD1 3.38Å; Y487-L514 HydrophobicContact CD2-CD2 4.25Å; Y487-L514 HydrophobicContact CD2-CG 4.48Å; Y487-L514 HydrophobicContact CE2-CD1 4.02Å; Y487-L514 HydrophobicContact CE2-CD2 4.15Å; Y487-L514 HydrophobicContact CG-CD1 3.68Å; Y487-L514 HydrophobicContact CG-CD2 4.47Å
488	F	96.6	Very high	93.4	Very high	8 Å²	8	81.3 Å²	81.3	4%	0.035	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	102.4	164.1	-61.6	-49.9	0	0	0	109.1	A436 I439 I440 I443 N481 L482 N485 R486 W504 L506	A436-F488 HydrophobicContact CB-CE2 4.23Å; A436-F488 HydrophobicContact CB-CZ 4.23Å; I439-F488 HydrophobicContact CB-CE1 3.95Å; I439-F488 HydrophobicContact CB-CE2 4.31Å; I439-F488 HydrophobicContact CB-CZ 3.66Å; I439-F488 HydrophobicContact CD1-CE2 3.98Å; I439-F488 HydrophobicContact CD1-CZ 4.19Å; I439-F488 HydrophobicContact CG2-CD1 3.81Å; I439-F488 HydrophobicContact CG2-CE1 3.33Å; I439-F488 HydrophobicContact CG2-CE2 4.13Å; I439-F488 HydrophobicContact CG2-CG 4.4Å; I439-F488 HydrophobicContact CG2-CZ 3.51Å; I440-F488 HydrophobicContact CG1-CE1 3.8Å; I440-F488 HydrophobicContact CG1-CZ 3.97Å; I443-F488 HydrophobicContact CD1-CD1 4.18Å; I443-F488 HydrophobicContact CD1-CE1 4.44Å; N481-F488 WeakPolarHBondContact O-CD2 3.48Å; L482-F488 HydrophobicContact CD2-CB 4Å; L482-F488 HydrophobicContact CD2-CD1 4.4Å; L482-F488 HydrophobicContact CD2-CD2 4.11Å; L482-F488 HydrophobicContact CD2-CG 3.93Å; N485-F488 HydrophobicContact CB-CD2 3.68Å; N485-F488 HydrophobicContact CB-CE2 3.9Å; N485-F488 PolarHBondContact O-N 3.01Å; R486-F488 VanDerWaalsContact C-N 3.31Å; F488-W504 HydrophobicContact CB-CE3 4.22Å; F488-W504 HydrophobicContact CB-CZ3 4.49Å; F488-L506 HydrophobicContact CD1-CD2 3.9Å; F488-L506 HydrophobicContact CE1-CD2 3.73Å
489	I	95.8	Very high	93	Very high	55 Å²	55	83.4 Å²	83.4	28%	0.282	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	130.7	-174.3	60.4	176.8	0	0	0	111.3	Q505 D507	I489-Q505 HydrophobicContact CD1-CG 3.94Å; I489-Q505 HydrophobicContact CG1-CG 3.54Å; I489-Q505 PolarHBondContact N-O 3Å; I489-Q505 PolarHBondContact O-N 3.08Å; I489-Q505 VanDerWaalsContact O-N 3.17Å; I489-D507 HydrophobicContact CG2-CB 4.4Å
490	R	96.5	Very high	92.6	Very high	160 Å²	160	88.7 Å²	88.7	60%	0.604	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	106.7	-173.8	-171.9	-172.4	68.4	84.1	-0.6	111	A502 W504	R490-A502 HydrophobicContact CG-CB 3.52Å; R490-W504 HydrophobicContact CB-CE3 4.02Å; R490-W504 HydrophobicContact CB-CH2 4Å; R490-W504 HydrophobicContact CB-CZ2 4.45Å; R490-W504 HydrophobicContact CB-CZ3 3.76Å; R490-W504 HydrophobicContact CG-CH2 4.18Å; R490-W504 HydrophobicContact CG-CZ2 4.17Å; R490-W504 HydrophobicContact CG-CZ3 4.37Å
491	V	94.1	Very high	92.3	Very high	39 Å²	39	86.6 Å²	86.6	24%	0.236	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	122.2	-175.2	178	0	0	0	0	111.1	A502 F503 Q505	V491-A502 WeakPolarHBondContact O-CB 3.38Å; V491-F503 HydrophobicContact CB-CB 4.23Å; V491-F503 PolarHBondContact N-O 3.21Å; V491-F503 PolarHBondContact O-N 3.02Å; V491-Q505 HydrophobicContact CG2-CG 3.75Å
492	P	93.8	Very high	92.2	Very high	95 Å²	95	86 Å²	86	62%	0.617	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-57.1	144.2	171.5	-23.1	34.1	0	0	0	111.9
493	R	92.7	Very high	92.2	Very high	64 Å²	64	86.7 Å²	86.7	24%	0.242	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-68.4	150	169.4	-63.3	-175.5	-176.3	-102.9	9.5	110.3	E497 G499 K500 G501 F503	R493-E497 WeakPolarHBondContact CD-O 3.36Å; R493-G499 WeakPolarHBondContact CD-O 3.49Å; R493-G499 PolarHBondContact NE-O 3.32Å; R493-K500 PolarHBondContact NH2-O 3.21Å; R493-G501 WeakPolarHBondContact CD-O 3.47Å; R493-G501 PolarHBondContact NE-O 3.01Å; R493-F503 HydrophobicContact CG-CD2 4Å; R493-F503 HydrophobicContact CG-CE2 3.91Å
494	S	88.7	Confident	92.2	Very high	54 Å²	54	84.3 Å²	84.3	38%	0.378	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-68.1	157.3	166.9	54.5	0	0	0	0	110.7	S496 E497	S494-S496 WeakPolarHBondContact CB-OG 3.38Å; S494-S496 PolarHBondContact O-N 3.41Å; S494-S496 PolarHBondContact OG-OG 3.45Å; S494-E497 PolarHBondContact O-N 2.98Å; S494-E497 VanDerWaalsContact O-N 3.14Å
495	Q	86.3	Confident	92.3	Very high	204 Å²	204	82 Å²	82	95%	0.953	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-17.4	174.1	-64.1	180	3.6	0	0	112.8
496	S	86.5	Confident	92.4	Very high	98 Å²	98	80.8 Å²	80.8	69%	0.685	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-19.7	174.4	62.5	0	0	0	0	114.2	S494 P498	S494-S496 WeakPolarHBondContact CB-OG 3.38Å; S494-S496 PolarHBondContact O-N 3.41Å; S494-S496 PolarHBondContact OG-OG 3.45Å; S496-P498 VanDerWaalsContact C-CD 3.43Å; S496-P498 WeakPolarHBondContact O-CD 3.49Å
497	E	85.8	Confident	92.4	Very high	79 Å²	79	72 Å²	72	37%	0.369	39%	0.389	S	S	.	.	S	Bend	trans	-121.3	70.2	-176.8	-70.1	177.2	-155.3	0	0	110.6	R450 R493 S494 G499 F503	R450-E497 IonicContact NH2-OE1 2.64Å; R450-E497 IonicContact NH2-OE2 3.68Å; R493-E497 WeakPolarHBondContact CD-O 3.36Å; S494-E497 PolarHBondContact O-N 2.98Å; S494-E497 VanDerWaalsContact O-N 3.14Å; E497-G499 PolarHBondContact O-N 3.14Å; E497-G499 VanDerWaalsContact O-N 3.11Å; E497-F503 WeakPolarHBondContact OE2-CE2 3.5Å; E497-F503 VanDerWaalsContact OE2-CZ 3.28Å; E497-F503 WeakPolarHBondContact OE2-CZ 3.2Å
498	P	84.8	Confident	92.2	Very high	123 Å²	123	73.2 Å²	73.2	80%	0.799	40%	0.404	S	S	*	.			trans	-62.9	114.8	177.3	26.8	-34.1	0	0	0	110.4	S496	S496-P498 VanDerWaalsContact C-CD 3.43Å; S496-P498 WeakPolarHBondContact O-CD 3.49Å
499	G	89.4	Confident	91.9	Very high	43 Å²	43	83.5 Å²	83.5	44%	0.443	45%	0.445	S	S	.	.			trans	-160.3	161.5	-175.3	0	0	0	0	0	113.5	R493 E497 G501	R493-G499 WeakPolarHBondContact CD-O 3.49Å; R493-G499 PolarHBondContact NE-O 3.32Å; E497-G499 PolarHBondContact O-N 3.14Å; E497-G499 VanDerWaalsContact O-N 3.11Å; G499-G501 PolarHBondContact O-N 3.07Å
500	K	89.2	Confident	91.5	Very high	202 Å²	202	82.6 Å²	82.6	88%	0.878	44%	0.443	S	S	*	.	S	Bend	trans	-69.7	129.5	-176.2	-172.1	174.7	-179.2	177.5	0	111.4	R493	R493-K500 PolarHBondContact NH2-O 3.21Å
501	G	91.9	Very high	91.2	Very high	57 Å²	57	76.5 Å²	76.5	59%	0.588	42%	0.421	S	S	*	.	S	Bend	trans	68.8	-171.4	176.2	0	0	0	0	0	114.4	R493 G499	R493-G501 WeakPolarHBondContact CD-O 3.47Å; R493-G501 PolarHBondContact NE-O 3.01Å; G499-G501 PolarHBondContact O-N 3.07Å
502	A	94.8	Very high	90.9	Very high	14 Å²	14	80.1 Å²	80.1	12%	0.116	44%	0.444	C	S	.	.			trans	-98.5	165.1	179.9	0	0	0	0	0	111.9	R490 V491	R490-A502 HydrophobicContact CG-CB 3.52Å; V491-A502 WeakPolarHBondContact O-CB 3.38Å
503	F	96.1	Very high	90.5	Very high	19 Å²	19	79 Å²	79	8%	0.083	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	154.4	160.1	-69.6	-69.9	0	0	0	110	R450 L451 T452 V491 R493 E497	R450-F503 HydrophobicContact CB-CB 4.42Å; R450-F503 HydrophobicContact CG-CB 4.44Å; R450-F503 HydrophobicContact CG-CD1 4.02Å; R450-F503 HydrophobicContact CG-CG 4.24Å; L451-F503 CarbonylContact O-C 3.43Å; T452-F503 HydrophobicContact CG2-CD1 3.69Å; T452-F503 HydrophobicContact CG2-CE1 3.62Å; V491-F503 HydrophobicContact CB-CB 4.23Å; V491-F503 PolarHBondContact N-O 3.21Å; V491-F503 PolarHBondContact O-N 3.02Å; R493-F503 HydrophobicContact CG-CD2 4Å; R493-F503 HydrophobicContact CG-CE2 3.91Å; E497-F503 WeakPolarHBondContact OE2-CE2 3.5Å; E497-F503 VanDerWaalsContact OE2-CZ 3.28Å; E497-F503 WeakPolarHBondContact OE2-CZ 3.2Å
504	W	97.4	Very high	90.4	Very high	42 Å²	42	77 Å²	77	16%	0.159	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	129.9	169.4	-64.8	94.7	0	0	0	107.8	I443 R450 L451 I456 L482 F488 R490	I443-W504 HydrophobicContact CD1-CB 4.37Å; R450-W504 CarbonylContact C-O 3.47Å; R450-W504 VanDerWaalsContact CA-O 3.28Å; R450-W504 WeakPolarHBondContact CA-O 3.47Å; L451-W504 PolarHBondContact N-O 3.33Å; L451-W504 PolarHBondContact O-N 2.8Å; I456-W504 HydrophobicContact CD1-CB 4.22Å; I456-W504 HydrophobicContact CD1-CG 4.48Å; L482-W504 HydrophobicContact CB-CD2 4.38Å; L482-W504 HydrophobicContact CB-CE3 4.25Å; L482-W504 HydrophobicContact CB-CH2 3.93Å; L482-W504 HydrophobicContact CB-CZ2 4.08Å; L482-W504 HydrophobicContact CB-CZ3 4.01Å; L482-W504 HydrophobicContact CD1-CD2 4.3Å; L482-W504 HydrophobicContact CD1-CG 4.43Å; L482-W504 HydrophobicContact CD1-CZ2 4.48Å; L482-W504 HydrophobicContact CD2-CB 4.3Å; L482-W504 HydrophobicContact CD2-CD2 3.88Å; L482-W504 HydrophobicContact CD2-CE3 3.95Å; L482-W504 HydrophobicContact CD2-CG 4.04Å; L482-W504 HydrophobicContact CG-CD2 4.43Å; L482-W504 WeakPolarHBondContact O-CZ3 3.47Å; F488-W504 HydrophobicContact CB-CE3 4.22Å; F488-W504 HydrophobicContact CB-CZ3 4.49Å; R490-W504 HydrophobicContact CB-CE3 4.02Å; R490-W504 HydrophobicContact CB-CH2 4Å; R490-W504 HydrophobicContact CB-CZ2 4.45Å; R490-W504 HydrophobicContact CB-CZ3 3.76Å; R490-W504 HydrophobicContact CG-CH2 4.18Å; R490-W504 HydrophobicContact CG-CZ2 4.17Å; R490-W504 HydrophobicContact CG-CZ3 4.37Å
505	Q	95.7	Very high	90.4	Very high	54 Å²	54	76.5 Å²	76.5	25%	0.252	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	167.7	173.1	67.6	-175.7	42.9	0	0	109.6	Q449 R450 I489 V491	Q449-Q505 VanDerWaalsContact O-CB 3.28Å; Q449-Q505 WeakPolarHBondContact O-CB 3.47Å; R450-Q505 HydrophobicContact CB-CB 3.93Å; I489-Q505 HydrophobicContact CD1-CG 3.94Å; I489-Q505 HydrophobicContact CG1-CG 3.54Å; I489-Q505 PolarHBondContact N-O 3Å; I489-Q505 PolarHBondContact O-N 3.08Å; I489-Q505 VanDerWaalsContact O-N 3.17Å; V491-Q505 HydrophobicContact CG2-CG 3.75Å
506	L	95.9	Very high	90.4	Very high	4 Å²	4	69.8 Å²	69.8	2%	0.021	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	151.2	170.3	-62.9	168.9	0	0	0	109.8	I440 I443 Y487 F488 P508 E511 L514 V515	I440-L506 HydrophobicContact CB-CD2 4.5Å; I440-L506 HydrophobicContact CG1-CD2 3.92Å; I440-L506 HydrophobicContact CG2-CD1 4.06Å; I440-L506 HydrophobicContact CG2-CD2 4.41Å; I443-L506 HydrophobicContact CB-CG 4.39Å; I443-L506 HydrophobicContact CG2-CD1 4.32Å; I443-L506 HydrophobicContact CG2-CG 3.96Å; Y487-L506 WeakPolarHBondContact O-CA 3.42Å; F488-L506 HydrophobicContact CD1-CD2 3.9Å; F488-L506 HydrophobicContact CE1-CD2 3.73Å; L506-P508 WeakPolarHBondContact O-CD 3.28Å; L506-E511 HydrophobicContact CB-CB 4.12Å; L506-E511 HydrophobicContact CB-CG 4.22Å; L506-E511 HydrophobicContact CD1-CG 3.87Å; L506-L514 HydrophobicContact CD2-CD1 4.1Å; L506-V515 HydrophobicContact CD1-CG2 4.07Å
507	D	94.2	Very high	90.4	Very high	41 Å²	41	69.2 Å²	69.2	22%	0.219	39%	0.388	C	S	.	.			trans	-66.8	118.2	167.4	167.7	26.6	0	0	0	110.1	Y487 I489 Y509 C510 E511	Y487-D507 PolarHBondContact O-N 2.8Å; I489-D507 HydrophobicContact CG2-CB 4.4Å; D507-Y509 PolarHBondContact O-N 3.18Å; D507-Y509 VanDerWaalsContact O-N 3.08Å; D507-Y509 WeakPolarHBondContact OD1-CD2 3.2Å; D507-Y509 PolarHBondContact OD1-N 3.1Å; D507-C510 PolarHBondContact O-N 3.45Å; D507-C510 PolarHBondContact OD2-SG 2.9Å; D507-E511 PolarHBondContact O-N 3.02Å
508	P	90.7	Very high	90.4	Very high	82 Å²	82	65.5 Å²	65.5	53%	0.532	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-27.6	-176.1	-27.3	36.1	0	0	0	114.5	L506 C510	L506-P508 WeakPolarHBondContact O-CD 3.28Å; P508-C510 PolarHBondContact O-N 3.02Å
509	Y	89.2	Confident	90.5	Very high	225 Å²	225	65.5 Å²	65.5	88%	0.882	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-23.6	178.4	-67.3	-69.1	0	0	0	113.5	D507	D507-Y509 PolarHBondContact O-N 3.18Å; D507-Y509 VanDerWaalsContact O-N 3.08Å; D507-Y509 WeakPolarHBondContact OD1-CD2 3.2Å; D507-Y509 PolarHBondContact OD1-N 3.1Å
510	C	88.1	Confident	90.2	Very high	35 Å²	35	70.8 Å²	70.8	24%	0.236	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.7	-4.9	-177.6	63	0	0	0	0	115.1	Y487 D507 P508 T512 C513 L514	Y487-C510 VanDerWaalsContact CB-SG 3.56Å; D507-C510 PolarHBondContact O-N 3.45Å; D507-C510 PolarHBondContact OD2-SG 2.9Å; P508-C510 PolarHBondContact O-N 3.02Å; C510-T512 PolarHBondContact O-N 3.48Å; C510-C513 WeakPolarHBondContact O-CA 3.46Å; C510-C513 WeakPolarHBondContact O-CB 3.46Å; C510-C513 PolarHBondContact O-N 3.27Å; C510-L514 HydrophobicContact CB-CD1 4.42Å; C510-L514 HydrophobicContact CB-CG 4.49Å; C510-L514 WeakPolarHBondContact O-CG 3.37Å; C510-L514 PolarHBondContact O-N 3.35Å
511	E	89.6	Confident	89.7	Confident	32 Å²	32	68.2 Å²	68.2	15%	0.15	35%	0.353	C	S	.	.	H	α-helix	trans	-44.3	-59.7	179.9	175.8	171.2	-151.4	0	0	113.3	Q449 L506 D507 C513 L514 V515	Q449-E511 PolarHBondContact NE2-OE1 3.28Å; Q449-E511 PolarHBondContact NE2-OE2 3.1Å; L506-E511 HydrophobicContact CB-CB 4.12Å; L506-E511 HydrophobicContact CB-CG 4.22Å; L506-E511 HydrophobicContact CD1-CG 3.87Å; D507-E511 PolarHBondContact O-N 3.02Å; E511-C513 PolarHBondContact O-N 3.43Å; E511-C513 VanDerWaalsContact O-N 3.12Å; E511-L514 PolarHBondContact O-N 3.33Å; E511-V515 HydrophobicContact CG-CG2 4.05Å; E511-V515 WeakPolarHBondContact O-CG2 3.19Å; E511-V515 PolarHBondContact O-N 2.89Å
512	T	87.7	Confident	88.7	Confident	116 Å²	116	73.5 Å²	73.5	71%	0.712	36%	0.355	S	S	*	.	H	α-helix	trans	-55.2	-36.3	-178.2	-50.9	0	0	0	0	112.4	C510 S516	C510-T512 PolarHBondContact O-N 3.48Å; T512-S516 WeakPolarHBondContact O-CB 3.45Å; T512-S516 PolarHBondContact O-N 2.88Å
513	C	86.6	Confident	87.2	Confident	70 Å²	70	84 Å²	84	47%	0.473	39%	0.392	S	S	.	.	H	α-helix	trans	-70.8	-45.1	177.4	-170	0	0	0	0	111.3	C510 E511 S516 Q517	C510-C513 WeakPolarHBondContact O-CA 3.46Å; C510-C513 WeakPolarHBondContact O-CB 3.46Å; C510-C513 PolarHBondContact O-N 3.27Å; E511-C513 PolarHBondContact O-N 3.43Å; E511-C513 VanDerWaalsContact O-N 3.12Å; C513-S516 PolarHBondContact O-N 3.19Å; C513-S516 PolarHBondContact O-OG 2.77Å; C513-Q517 WeakPolarHBondContact O-CG 3.49Å; C513-Q517 PolarHBondContact O-N 3.17Å; C513-Q517 PolarHBondContact O-NE2 3.05Å; C513-Q517 PolarHBondContact SG-NE2 2.87Å
514	L	89.2	Confident	85.4	Confident	22 Å²	22	91.6 Å²	91.6	12%	0.115	43%	0.428	C	S	.	.	H	α-helix	trans	-64.7	-46.3	178.2	-68.5	174.7	0	0	0	112.1	I440 Y487 L506 C510 E511 S516 Q517 A518	I440-L514 HydrophobicContact CD1-CB 4.06Å; I440-L514 HydrophobicContact CD1-CD2 4.07Å; I440-L514 HydrophobicContact CD1-CG 4.49Å; I440-L514 HydrophobicContact CG1-CB 4.4Å; I440-L514 HydrophobicContact CG2-CB 4.13Å; Y487-L514 HydrophobicContact CD2-CD1 3.38Å; Y487-L514 HydrophobicContact CD2-CD2 4.25Å; Y487-L514 HydrophobicContact CD2-CG 4.48Å; Y487-L514 HydrophobicContact CE2-CD1 4.02Å; Y487-L514 HydrophobicContact CE2-CD2 4.15Å; Y487-L514 HydrophobicContact CG-CD1 3.68Å; Y487-L514 HydrophobicContact CG-CD2 4.47Å; L506-L514 HydrophobicContact CD2-CD1 4.1Å; C510-L514 HydrophobicContact CB-CD1 4.42Å; C510-L514 HydrophobicContact CB-CG 4.49Å; C510-L514 WeakPolarHBondContact O-CG 3.37Å; C510-L514 PolarHBondContact O-N 3.35Å; E511-L514 PolarHBondContact O-N 3.33Å; L514-S516 VanDerWaalsContact C-N 3.29Å; L514-S516 PolarHBondContact O-N 2.83Å; L514-Q517 CarbonylContact O-C 3.51Å; L514-Q517 WeakPolarHBondContact O-CA 3.31Å; L514-Q517 PolarHBondContact O-N 3.42Å; L514-A518 PolarHBondContact O-N 3.42Å
515	V	89.7	Confident	83	Confident	44 Å²	44	95.9 Å²	95.9	27%	0.267	46%	0.459	S	S	.	.	H	α-helix	trans	-59.6	-40.8	176.9	176.5	0	0	0	0	110.8	I440 A444 L506 E511 Q517 A518	I440-V515 HydrophobicContact CG2-CG2 4.26Å; A444-V515 HydrophobicContact CB-CG1 4.37Å; A444-V515 HydrophobicContact CB-CG2 3.83Å; L506-V515 HydrophobicContact CD1-CG2 4.07Å; E511-V515 HydrophobicContact CG-CG2 4.05Å; E511-V515 WeakPolarHBondContact O-CG2 3.19Å; E511-V515 PolarHBondContact O-N 2.89Å; V515-Q517 PolarHBondContact O-N 2.85Å; V515-Q517 VanDerWaalsContact O-N 3.13Å; V515-A518 WeakPolarHBondContact O-CB 3.44Å; V515-A518 PolarHBondContact O-N 2.88Å
516	S	86.8	Confident	80.4	Confident	63 Å²	63	98.3 Å²	98.3	44%	0.441	48%	0.482	S	S	.	.	H	α-helix	trans	-65.6	-13.2	174.5	87.1	0	0	0	0	114.7	T512 C513 L514 R520	T512-S516 WeakPolarHBondContact O-CB 3.45Å; T512-S516 PolarHBondContact O-N 2.88Å; C513-S516 PolarHBondContact O-N 3.19Å; C513-S516 PolarHBondContact O-OG 2.77Å; L514-S516 VanDerWaalsContact C-N 3.29Å; L514-S516 PolarHBondContact O-N 2.83Å; S516-R520 PolarHBondContact O-NE 2.89Å; S516-R520 PolarHBondContact O-NH2 2.9Å
517	Q	86.3	Confident	77.9	Confident	87 Å²	87	103.2 Å²	103.2	41%	0.407	52%	0.516	S	S	.	.	H	α-helix	trans	-107.8	-19.6	177.9	-68.1	-178.3	64.7	0	0	113	Q437 C513 L514 V515 F519 R520	Q437-Q517 PolarHBondContact NE2-O 2.85Å; C513-Q517 WeakPolarHBondContact O-CG 3.49Å; C513-Q517 PolarHBondContact O-N 3.17Å; C513-Q517 PolarHBondContact O-NE2 3.05Å; C513-Q517 PolarHBondContact SG-NE2 2.87Å; L514-Q517 CarbonylContact O-C 3.51Å; L514-Q517 WeakPolarHBondContact O-CA 3.31Å; L514-Q517 PolarHBondContact O-N 3.42Å; V515-Q517 PolarHBondContact O-N 2.85Å; V515-Q517 VanDerWaalsContact O-N 3.13Å; Q517-F519 VanDerWaalsContact C-N 3.3Å; Q517-F519 PolarHBondContact O-N 3.47Å; Q517-R520 WeakPolarHBondContact O-CB 3.46Å; Q517-R520 PolarHBondContact O-N 2.62Å; Q517-R520 VanDerWaalsContact O-N 3.1Å
518	A	85.7	Confident	75.3	Confident	0 Å²	0	110.3 Å²	110.3	0%	0	55%	0.545	C	S	.	.	H	α-helix	trans	-55.7	-42	-176	0	0	0	0	0	112.9	I440 Q441 L514 V515	I440-A518 HydrophobicContact CB-CB 4.01Å; I440-A518 HydrophobicContact CG2-CB 3.58Å; Q441-A518 HydrophobicContact CG-CB 3.91Å; Q441-A518 PolarHBondContact NE2-O 2.87Å; L514-A518 PolarHBondContact O-N 3.42Å; V515-A518 WeakPolarHBondContact O-CB 3.44Å; V515-A518 PolarHBondContact O-N 2.88Å
519	F	86.1	Confident	72.8	Confident	124 Å²	124	111.7 Å²	111.7	54%	0.544	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.7	0.7	-177.8	-58.7	-79.5	0	0	0	114.3	Y433 Q441 Q517 K521	Y433-F519 WeakPolarHBondContact CE1-O 3.33Å; Q441-F519 HydrophobicContact CB-CE1 4.48Å; Q441-F519 HydrophobicContact CG-CD1 4.1Å; Q441-F519 HydrophobicContact CG-CE1 3.75Å; Q441-F519 HydrophobicContact CG-CZ 4.02Å; Q517-F519 VanDerWaalsContact C-N 3.3Å; Q517-F519 PolarHBondContact O-N 3.47Å; F519-K521 PolarHBondContact O-N 2.66Å; F519-K521 VanDerWaalsContact O-N 3.12Å
520	R	84	Confident	70.5	Confident	154 Å²	154	105.7 Å²	105.7	58%	0.581	55%	0.548	S	S	*	.			trans	-75.9	102.6	179.3	-62.4	-175.5	-168.4	-160.9	3.7	109.9	Q437 S516 Q517 R522	Q437-R520 PolarHBondContact NE2-O 2.91Å; S516-R520 PolarHBondContact O-NE 2.89Å; S516-R520 PolarHBondContact O-NH2 2.9Å; Q517-R520 WeakPolarHBondContact O-CB 3.46Å; Q517-R520 PolarHBondContact O-N 2.62Å; Q517-R520 VanDerWaalsContact O-N 3.1Å; R520-R522 PolarHBondContact O-N 2.87Å
521	K	78.6	Confident	68.2	Low	148 Å²	148	109 Å²	109	64%	0.643	57%	0.572	S	S	*	*			trans	-51.1	127.9	174.6	-61.9	-174.7	179.6	179.7	0	109.6	P432 Y433 F519 R523	P432-K521 HydrophobicContact CB-CB 4.31Å; P432-K521 HydrophobicContact CG-CB 4.22Å; P432-K521 HydrophobicContact CG-CD 4.06Å; P432-K521 HydrophobicContact CG-CG 3.91Å; Y433-K521 HydrophobicContact CE1-CG 3.98Å; F519-K521 PolarHBondContact O-N 2.66Å; F519-K521 VanDerWaalsContact O-N 3.12Å; K521-R523 PolarHBondContact O-N 3Å
522	R	71.1	Confident	65.7	Low	167 Å²	167	113 Å²	113	63%	0.63	60%	0.603	S	S	*	*			trans	-59.4	127.2	173.2	-178.6	-175.9	-73.6	177.2	-7.3	108.1	P432 R520 Q524	P432-R522 PolarHBondContact O-N 3.15Å; R520-R522 PolarHBondContact O-N 2.87Å; R522-Q524 PolarHBondContact O-N 3.36Å; R522-Q524 VanDerWaalsContact O-N 3.07Å
523	R	63.6	Low	63.2	Low	234 Å²	234	112.5 Å²	112.5	88%	0.883	61%	0.611	S	S	*	*			trans	-57.8	115.6	166.4	-100.7	-175.3	162.2	-173	-6.1	107.6	K521 T525	K521-R523 PolarHBondContact O-N 3Å; R523-T525 PolarHBondContact O-N 3.37Å; R523-T525 VanDerWaalsContact O-N 3.08Å
524	Q	57.4	Low	60.9	Low	179 Å²	179	116.9 Å²	116.9	84%	0.836	63%	0.629	S	S	*	*			trans	-62.5	110.2	161	-73	178.8	-16.4	0	0	106.5	R522 S526	R522-Q524 PolarHBondContact O-N 3.36Å; R522-Q524 VanDerWaalsContact O-N 3.07Å; Q524-S526 PolarHBondContact O-N 2.97Å; Q524-S526 VanDerWaalsContact O-N 3.14Å
525	T	46.5	Very low	58.7	Low	132 Å²	132	120.3 Å²	120.3	81%	0.81	66%	0.655	S	S	*	*			trans	-66.9	105.2	163	41	0	0	0	0	106.3	R523 S527	R523-T525 PolarHBondContact O-N 3.37Å; R523-T525 VanDerWaalsContact O-N 3.08Å; T525-S527 PolarHBondContact O-N 2.68Å; T525-S527 VanDerWaalsContact O-N 3.1Å
526	S	41.6	Very low	56.3	Low	106 Å²	106	125 Å²	125	74%	0.741	68%	0.678	S	S	*	*			trans	-56.8	118.5	172.8	38.4	0	0	0	0	108.9	Q524 K528	Q524-S526 PolarHBondContact O-N 2.97Å; Q524-S526 VanDerWaalsContact O-N 3.14Å; S526-K528 PolarHBondContact O-N 2.94Å; S526-K528 VanDerWaalsContact O-N 3.13Å
527	S	43.1	Very low	54.2	Low	106 Å²	106	130.1 Å²	130.1	74%	0.741	70%	0.696	S	S	*	*			trans	-56.6	115.3	170	26.9	0	0	0	0	107.7	T525 S529	T525-S527 PolarHBondContact O-N 2.68Å; T525-S527 VanDerWaalsContact O-N 3.1Å; S527-S529 PolarHBondContact O-N 3.2Å
528	K	39.9	Very low	51.7	Low	191 Å²	191	131.2 Å²	131.2	83%	0.83	71%	0.708	S	S	*	*			trans	-77.1	75.6	174.9	-85.9	-166.6	168	-168.6	0	110.1	S526 S530	S526-K528 PolarHBondContact O-N 2.94Å; S526-K528 VanDerWaalsContact O-N 3.13Å; K528-S530 PolarHBondContact O-N 2.74Å
529	S	38	Very low	49.4	Very low	110 Å²	110	138 Å²	138	77%	0.769	75%	0.745	S	S	*	*			trans	-65.9	81.4	156.1	38.7	0	0	0	0	108.9	S527	S527-S529 PolarHBondContact O-N 3.2Å
530	S	41.4	Very low	47.1	Very low	99 Å²	99	139.5 Å²	139.5	69%	0.692	76%	0.758	S	S	*	*			trans	-152.9	67.4	174.2	-43.4	0	0	0	0	109.8	K528	K528-S530 PolarHBondContact O-N 2.74Å
531	S	38.8	Very low	44.9	Very low	106 Å²	106	136 Å²	136	74%	0.741	76%	0.763	S	S	*	*			trans	-60.4	159.8	157.6	47.9	0	0	0	0	110.6
532	S	36.7	Very low	43	Very low	115 Å²	115	135.8 Å²	135.8	80%	0.804	77%	0.768	S	S	*	*			trans	53.3	93.8	162.4	53.3	0	0	0	0	117.6
533	A	36.7	Very low	41.4	Very low	106 Å²	106	134.9 Å²	134.9	88%	0.876	78%	0.776	S	S	*	*			trans	-149.4	55.8	155.2	0	0	0	0	0	110.1
534	D	38.7	Very low	40	Very low	162 Å²	162	130.9 Å²	130.9	87%	0.866	77%	0.772	S	S	*	*			trans	-107.4	96.9	174.8	-177.2	20.3	0	0	0	109.6
535	S	42.3	Very low	39.2	Very low	93 Å²	93	129.1 Å²	129.1	65%	0.65	77%	0.773	S	S	*	*			trans	-173.8	122.5	167.4	50.6	0	0	0	0	112.5
536	N	38.3	Very low	38.8	Very low	142 Å²	142	129.6 Å²	129.6	76%	0.759	77%	0.771	S	S	*	*			trans	44.9	114.8	134.1	-55	-22.2	0	0	0	118.9
537	Q	42.7	Very low	38.6	Very low	172 Å²	172	132.4 Å²	132.4	80%	0.804	78%	0.777	S	S	*	*				60.6	121.8	85.9	-73.6	-167.1	-0.9	0	0	116.2
538	T	35.1	Very low	38.4	Very low	109 Å²	109	134.5 Å²	134.5	67%	0.669	78%	0.78	S	S	*	*			trans	67.2	106.1	150.6	56.8	0	0	0	0	121.3
539	N	37.1	Very low	38.5	Very low	143 Å²	143	131.3 Å²	131.3	77%	0.765	78%	0.782	S	S	*	*				76.5	148.9	123.7	-56.2	-10.4	0	0	0	121.9
540	N	36.6	Very low	38.4	Very low	156 Å²	156	134 Å²	134	83%	0.834	79%	0.788	S	S	*	*			trans	70.1	85.5	160	-66.4	-2.9	0	0	0	120.1
541	A	38.3	Very low	38.1	Very low	81 Å²	81	136.5 Å²	136.5	67%	0.669	79%	0.793	S	S	*	*				60.2	139.7	106.9	0	0	0	0	0	122.3
542	N	38.4	Very low	37.8	Very low	142 Å²	142	138.3 Å²	138.3	76%	0.759	80%	0.795	S	S	*	*			trans	66	112.4	150.3	-60.8	-1.1	0	0	0	117
543	N	38.8	Very low	37.9	Very low	149 Å²	149	140.7 Å²	140.7	80%	0.797	79%	0.793	S	S	*	*			cis	-169.5	164.7	46.3	-88.1	-39.2	0	0	0	112.6
544	N	34.4	Very low	37.8	Very low	150 Å²	150	141.6 Å²	141.6	80%	0.802	78%	0.783	S	S	*	*			trans	-73.5	140.2	165.6	-64.4	-15.5	0	0	0	112
545	V	39.7	Very low	37.6	Very low	141 Å²	141	141.3 Å²	141.3	86%	0.855	78%	0.777	S	S	*	*			trans	-140.7	135.5	139.1	-179.2	0	0	0	0	106.7
546	N	37.4	Very low	37.2	Very low	143 Å²	143	147.4 Å²	147.4	77%	0.765	79%	0.787	S	S	*	*			trans	-90.9	150.5	171.9	-45.3	-40.2	0	0	0	109.1
547	D	39	Very low	37.1	Very low	164 Å²	164	146.1 Å²	146.1	88%	0.877	78%	0.78	S	S	*	*			trans	-151.7	146.7	145.1	-136.8	-22.3	0	0	0	111.3
548	D	37.8	Very low	37.1	Very low	150 Å²	150	145.9 Å²	145.9	80%	0.802	79%	0.785	S	S	*	*			trans	-94.1	138.4	-178.1	-77.5	-59.1	0	0	0	110.9
549	S	42.7	Very low	37.3	Very low	124 Å²	124	147.3 Å²	147.3	87%	0.867	79%	0.788	S	S	*	*			trans	-161.4	121.6	156.1	-85.8	0	0	0	0	112.5
550	N	35.7	Very low	37.7	Very low	168 Å²	168	148.8 Å²	148.8	90%	0.898	80%	0.796	S	S	*	*			trans	-66	142.2	164.5	-70.2	-62.4	0	0	0	110.3
551	N	35.7	Very low	38.1	Very low	150 Å²	150	148 Å²	148	80%	0.802	79%	0.792	S	S	*	*			trans	-149.7	129.7	141.6	-147.9	2.3	0	0	0	111.8
552	N	32.2	Very low	38.2	Very low	145 Å²	145	151.1 Å²	151.1	78%	0.775	80%	0.797	S	S	*	*			trans	-79.8	137.1	168.1	-81.6	-29	0	0	0	108.9
553	Q	38.2	Very low	38.6	Very low	164 Å²	164	150.9 Å²	150.9	77%	0.766	80%	0.801	S	S	*	*			trans	-173.4	139.4	138.6	-106.2	155	32	0	0	112.3
554	N	34.7	Very low	38.6	Very low	125 Å²	125	151.4 Å²	151.4	67%	0.668	80%	0.804	S	S	*	*			trans	59.8	109.9	157.9	-45	-18	0	0	0	115.6
555	Q	34.3	Very low	38.9	Very low	156 Å²	156	151.7 Å²	151.7	73%	0.729	81%	0.805	S	S	*	*				55.4	91.8	51.8	-162.4	-178.5	2.1	0	0	113.3
556	Y	35	Very low	38.8	Very low	222 Å²	222	153 Å²	153	87%	0.871	80%	0.802	S	S	*	*			trans	-137.7	138.1	139.2	-84.5	-73.4	0	0	0	107.4
557	D	34.5	Very low	38.8	Very low	115 Å²	115	155.1 Å²	155.1	62%	0.615	81%	0.807	S	S	*	*			trans	-97.4	126.7	-179.3	-58.7	-83.6	0	0	0	108.6	D559	D557-D559 PolarHBondContact O-N 3.41Å
558	D	42.7	Very low	38.9	Very low	167 Å²	167	156.7 Å²	156.7	89%	0.893	81%	0.809	S	S	*	*			trans	-91.9	88.4	176.5	-81	-42.4	0	0	0	109.8	D560	D558-D560 PolarHBondContact O-N 2.97Å
559	D	41.3	Very low	39	Very low	139 Å²	139	156.2 Å²	156.2	74%	0.743	80%	0.802	S	S	*	*			trans	-77.5	91.6	173.5	-70	-49.2	0	0	0	111.3	D557 D561	D557-D559 PolarHBondContact O-N 3.41Å; D559-D561 PolarHBondContact O-N 3.46Å
560	D	45	Very low	38.7	Very low	173 Å²	173	160.2 Å²	160.2	93%	0.925	80%	0.8	S	S	*	*			trans	-73.3	71.5	163	-94.7	-30	0	0	0	109.7	D558	D558-D560 PolarHBondContact O-N 2.97Å
561	D	44.1	Very low	38.9	Very low	140 Å²	140	161.5 Å²	161.5	75%	0.749	80%	0.8	S	S	*	*			trans	-73.8	149.5	179.2	-124	-13.3	0	0	0	112.4	D559	D559-D561 PolarHBondContact O-N 3.46Å
562	D	41.4	Very low	39.2	Very low	146 Å²	146	163.1 Å²	163.1	78%	0.781	80%	0.803	S	S	*	*			trans	-68.4	131.4	-176.6	-69.7	-57.3	0	0	0	112.4
563	V	46.7	Very low	39.6	Very low	138 Å²	138	164.7 Å²	164.7	84%	0.836	80%	0.803	S	S	*	*			trans	-125	67.7	168.8	-169.4	0	0	0	0	110.6
564	D	39.2	Very low	39.8	Very low	160 Å²	160	166.8 Å²	166.8	86%	0.856	81%	0.809	S	S	*	*			trans	-108.1	40.1	177.6	-109.7	-9.5	0	0	0	111.3
565	D	39.5	Very low	39.6	Very low	156 Å²	156	163.7 Å²	163.7	83%	0.834	81%	0.808	S	S	*	*			trans	-150	62	-169.2	-122.1	-22.1	0	0	0	114.8
566	E	37.1	Very low	39.6	Very low	167 Å²	167	165.3 Å²	165.3	78%	0.78	82%	0.815	S	S	*	*			trans	-161.4	42.6	159	-126.7	-178.5	-138.6	0	0	118.3
567	E	38.8	Very low	39.7	Very low	189 Å²	189	163.9 Å²	163.9	88%	0.883	82%	0.816	S	S	*	*	S	Bend	trans	-107	15.7	174.1	-142.5	-178.6	-168	0	0	115.7
568	Q	40.5	Very low	39.6	Very low	196 Å²	196	166.2 Å²	166.2	92%	0.916	83%	0.826	S	S	*	*	S	Bend	trans	-110.5	1	-178.7	-65.5	-171.7	29.2	0	0	116.1
569	Q	39.4	Very low	39.1	Very low	141 Å²	141	165.8 Å²	165.8	66%	0.659	82%	0.823	S	S	*	*	S	Bend	trans	-112.2	-10.7	175.5	-72.4	-165.1	17.1	0	0	115.5	Q571 E572	Q569-Q571 VanDerWaalsContact C-N 3.28Å; Q569-Q571 PolarHBondContact O-N 3.45Å; Q569-E572 PolarHBondContact O-N 3.42Å
570	Y	37.4	Very low	39.1	Very low	207 Å²	207	164.4 Å²	164.4	81%	0.812	82%	0.819	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	0.1	-172.4	-114.5	-79.3	0	0	0	116
571	Q	39.1	Very low	38.6	Very low	196 Å²	196	163.9 Å²	163.9	92%	0.916	82%	0.816	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-14.7	174.7	-64.3	-166.3	4.7	0	0	114.1	Q569	Q569-Q571 VanDerWaalsContact C-N 3.28Å; Q569-Q571 PolarHBondContact O-N 3.45Å
572	E	42	Very low	37.9	Very low	183 Å²	183	161.6 Å²	161.6	86%	0.855	81%	0.811	S	S	*	*	S	Bend	trans	-105.8	9.9	-167.5	-146.2	172.3	-155.9	0	0	114.6	Q569	Q569-E572 PolarHBondContact O-N 3.42Å
573	K	41.6	Very low	37.7	Very low	179 Å²	179	160.9 Å²	160.9	78%	0.778	81%	0.807	S	S	*	*	S	Bend	trans	-130.9	26.2	-171.2	-120.2	172.5	-171.4	168.6	0	115.8
574	K	40.5	Very low	37.2	Very low	207 Å²	207	161.2 Å²	161.2	90%	0.9	80%	0.804	S	S	*	*	S	Bend	trans	-121.7	12.8	178.2	-133.7	174.5	-174.1	176.4	0	115.5
575	G	30.7	Very low	36.9	Very low	61 Å²	61	160.3 Å²	160.3	63%	0.629	80%	0.798	S	S	*	*	S	Bend	trans	-85.7	165.6	151.4	0	0	0	0	0	110.7
576	E	35.2	Very low	36.5	Very low	190 Å²	190	159.5 Å²	159.5	89%	0.888	79%	0.793	S	S	*	*	S	Bend	trans	64.7	52.6	165.4	-56.5	-174.9	177.1	0	0	118
577	Q	37.2	Very low	36.3	Very low	191 Å²	191	157.2 Å²	157.2	89%	0.893	79%	0.787	S	S	*	*			trans	-158.5	156.4	142.8	-118.5	150.3	96.7	0	0	113.4
578	M	32.7	Very low	36.2	Very low	165 Å²	165	155.4 Å²	155.4	81%	0.813	78%	0.776	S	S	*	*			trans	59.6	56.1	178.7	-59.3	-54.3	-62.7	0	0	116.5
579	N	32.1	Very low	35.9	Very low	157 Å²	157	152.9 Å²	152.9	84%	0.84	77%	0.769	S	S	*	*				-81.2	157.3	128.1	-164	0.1	0	0	0	107.7
580	V	39.8	Very low	35.5	Very low	110 Å²	110	152.2 Å²	152.2	67%	0.667	77%	0.77	S	S	*	*			trans	113.3	127.7	-177.3	174.8	0	0	0	0	114.9
581	L	34.8	Very low	35.7	Very low	162 Å²	162	148.9 Å²	148.9	85%	0.848	76%	0.764	S	S	*	*			trans	68.7	97.8	169.7	-71.7	166.1	0	0	0	119.2
582	S	29.8	Very low	35.5	Very low	93 Å²	93	145 Å²	145	65%	0.65	75%	0.75	S	S	*	*			trans	-76	161.7	140.2	57.5	0	0	0	0	111.3
583	D	37	Very low	35	Very low	131 Å²	131	141.9 Å²	141.9	70%	0.701	74%	0.739	S	S	*	*			trans	148.1	150.5	133.3	-75.1	1.6	0	0	0	113.2
584	N	35.7	Very low	34.8	Very low	145 Å²	145	142.2 Å²	142.2	78%	0.775	74%	0.743	S	S	*	*			trans	63.3	107.3	173.3	-52.4	-56.4	0	0	0	115.9
585	I	34.2	Very low	34.3	Very low	141 Å²	141	137.6 Å²	137.6	72%	0.723	73%	0.733	S	S	*	*			cis	70.3	115.3	35.1	-52.3	-179.9	0	0	0	114.3
586	N	31.6	Very low	34.6	Very low	138 Å²	138	141.9 Å²	141.9	74%	0.738	74%	0.74	S	S	*	*			trans	62.7	129.1	168	-58.8	-26	0	0	0	116.8
587	N	32.5	Very low	34.4	Very low	119 Å²	119	139.5 Å²	139.5	64%	0.636	73%	0.733	S	S	*	*				-170.6	149.7	60.2	-103.6	-69.4	0	0	0	113.8
588	K	37.2	Very low	34.4	Very low	152 Å²	152	134.9 Å²	134.9	66%	0.661	72%	0.718	S	S	*	*			trans	59.1	125.3	135.8	-73	-178.2	177.9	73.6	0	122.9
589	N	34	Very low	34.5	Very low	142 Å²	142	133.3 Å²	133.3	76%	0.759	71%	0.712	S	S	*	*				74.1	159	122.9	-63.5	12.9	0	0	0	119.4
590	N	31.3	Very low	34.6	Very low	128 Å²	128	132.5 Å²	132.5	68%	0.684	71%	0.708	S	S	*	*			cis	-177.5	171.8	-25.1	-173.5	27.3	0	0	0	106.5
591	I	40.3	Very low	34.4	Very low	136 Å²	136	131.7 Å²	131.7	70%	0.697	71%	0.707	S	S	*	*			trans	72.6	142.2	164.4	-54.2	174.6	0	0	0	115.4
592	D	35.1	Very low	34.5	Very low	115 Å²	115	127.7 Å²	127.7	62%	0.615	70%	0.697	S	S	*	*			cis	-166.9	156.6	-33.7	-100.7	-41.2	0	0	0	110.8
593	N	32.5	Very low	34.6	Very low	118 Å²	118	132.9 Å²	132.9	63%	0.631	71%	0.709	S	S	*	*			trans	30.4	121.8	144.1	-52.3	-47.4	0	0	0	122.8
594	H	36.9	Very low	34.8	Very low	185 Å²	185	131.8 Å²	131.8	86%	0.856	71%	0.709	S	S	*	*				175.5	106.4	124.5	-92.7	-62.8	0	0	0	107.3
595	T	29.7	Very low	34.7	Very low	111 Å²	111	131.1 Å²	131.1	68%	0.681	71%	0.71	S	S	*	*			cis	80.8	133.8	46.1	-37.1	0	0	0	0	114.1
596	I	36.5	Very low	34.6	Very low	151 Å²	151	129.8 Å²	129.8	77%	0.774	71%	0.708	S	S	*	*			trans	84.8	108.2	174.1	-50	-171.6	0	0	0	114.6
597	D	31.6	Very low	34.8	Very low	140 Å²	140	128 Å²	128	75%	0.749	71%	0.706	S	S	*	*				83.6	149	68.9	-122.6	3.2	0	0	0	113
598	V	37.6	Very low	34.9	Very low	94 Å²	94	132.1 Å²	132.1	57%	0.57	71%	0.713	S	S	*	*			cis	-153.3	169.1	10.4	-148	0	0	0	0	110.2
599	N	34.3	Very low	34.7	Very low	132 Å²	132	130.6 Å²	130.6	71%	0.706	71%	0.708	S	S	*	*			trans	69.3	152.9	151.2	-66.5	-31.7	0	0	0	118.2
600	N	34	Very low	34.6	Very low	140 Å²	140	130 Å²	130	75%	0.749	70%	0.704	S	S	*	*			cis	-158.7	165.6	-3.5	-117.3	-25.3	0	0	0	107.6
601	S	36.5	Very low	34.3	Very low	92 Å²	92	131.6 Å²	131.6	64%	0.643	71%	0.705	S	S	*	*			cis	-167.7	157.2	2.8	48.7	0	0	0	0	112
602	A	35.5	Very low	33.9	Very low	78 Å²	78	134.4 Å²	134.4	65%	0.645	71%	0.713	S	S	*	*			trans	70.7	140.5	141.4	0	0	0	0	0	122
603	F	32.3	Very low	33.5	Very low	202 Å²	202	134.9 Å²	134.9	89%	0.886	72%	0.715	S	S	*	*			cis	-160.5	143	-25	-109.6	-60.8	0	0	0	109.6
604	P	41.5	Very low	33.4	Very low	108 Å²	108	137.3 Å²	137.3	70%	0.701	73%	0.728	S	S	*	*			trans	-114	176.1	176.7	40.9	-32.1	0	0	0	114
605	V	34.2	Very low	32.9	Very low	132 Å²	132	134.7 Å²	134.7	80%	0.8	72%	0.721	S	S	*	*			trans	-141.1	94	170.3	178.4	0	0	0	0	107.3
606	T	32	Very low	33	Very low	112 Å²	112	134.8 Å²	134.8	69%	0.687	73%	0.726	S	S	*	*				56.7	137.1	100.5	66.1	0	0	0	0	115
607	S	35.3	Very low	32.6	Very low	100 Å²	100	136.1 Å²	136.1	70%	0.699	73%	0.729	S	S	*	*			cis	-144.5	144.2	38.8	-78.9	0	0	0	0	112.5
608	R	33.6	Very low	32.6	Very low	206 Å²	206	138.6 Å²	138.6	78%	0.777	74%	0.736	S	S	*	*				66	134.8	71.6	-100.8	-176.1	139.5	136.6	3	112.9
609	E	33.7	Very low	32.3	Very low	121 Å²	121	141.3 Å²	141.3	57%	0.565	75%	0.747	S	S	*	*			cis	-133.2	178.3	3.2	-82.6	-70.5	22.4	0	0	108.4
610	L	31.6	Very low	32.2	Very low	129 Å²	129	140.7 Å²	140.7	68%	0.675	75%	0.75	S	S	*	*			cis	-147.8	-142.1	6.6	-136.8	-171.9	0	0	0	109.2
611	F	26.2	Very low	32	Very low	161 Å²	161	142.1 Å²	142.1	71%	0.706	76%	0.757	S	S	*	*			trans	-123.8	171.1	177.5	-67.6	-98.1	0	0	0	110.7
612	F	31.1	Very low	31.7	Very low	195 Å²	195	143.6 Å²	143.6	86%	0.855	76%	0.757	S	S	*	*				-145.3	146.6	66.3	-85	-88.9	0	0	0	114.5
613	N	26.2	Very low	31.4	Very low	125 Å²	125	145.4 Å²	145.4	67%	0.668	76%	0.756	S	S	*	*			trans	-81	161.1	161.9	-79.1	-18.7	0	0	0	110.5
614	D	30.9	Very low	31.2	Very low	169 Å²	169	142.2 Å²	142.2	90%	0.904	75%	0.748	S	S	*	*				-143.8	149.5	128.1	-129.9	-28	0	0	0	111.2
615	N	25.8	Very low	30.7	Very low	131 Å²	131	143.5 Å²	143.5	70%	0.701	76%	0.755	S	S	*	*			trans	-126.7	125.2	-168.8	-89.6	-51.9	0	0	0	113
616	S	31.8	Very low	30.4	Very low	112 Å²	112	146.7 Å²	146.7	78%	0.783	75%	0.754	S	S	*	*			trans	-149.9	95.7	156.3	57	0	0	0	0	108.4
617	Q	29.1	Very low	30.1	Very low	179 Å²	179	147.8 Å²	147.8	84%	0.836	75%	0.754	S	S	*	*				43.3	101.4	87.7	-68.5	-158	8.8	0	0	114.5
618	H	31.5	Very low	29.8	Very low	192 Å²	192	148.4 Å²	148.4	89%	0.889	76%	0.759	S	S	*	*				-152.6	152.1	124.1	-121	-86.3	0	0	0	110.9
619	N	30.6	Very low	29.5	Very low	152 Å²	152	145.4 Å²	145.4	81%	0.813	76%	0.758	S	S	*	*			trans	-81.2	154.3	-166.3	-78.6	-26.7	0	0	0	115.2
620	P	32.2	Very low	29.2	Very low	118 Å²	118	147 Å²	147	77%	0.766	77%	0.77	S	S	*	*			trans	-86.5	140.8	170.4	35	-33.8	0	0	0	113.3
621	L	30.4	Very low	29	Very low	170 Å²	170	145.1 Å²	145.1	89%	0.89	77%	0.768	S	S	*	*			trans	-154.9	157.1	164.4	-78.5	170.7	0	0	0	108.1
622	N	31.3	Very low	29.1	Very low	123 Å²	123	144 Å²	144	66%	0.658	77%	0.769	S	S	*	*			cis	-169	148.5	-40.5	-167.3	9.9	0	0	0	107.4
623	N	29.3	Very low	28.9	Very low	116 Å²	116	141 Å²	141	62%	0.62	77%	0.767	S	S	*	*			trans	53.3	112.9	160.9	-72.9	-24.2	0	0	0	122.6
624	N	27.5	Very low	29	Very low	135 Å²	135	140.4 Å²	140.4	72%	0.722	77%	0.773	S	S	*	*				54.7	112.5	115.6	-49.7	-18.5	0	0	0	122.1
625	T	30	Very low	28.8	Very low	136 Å²	136	137.2 Å²	137.2	83%	0.834	77%	0.77	S	S	*	*			trans	172.2	156.9	130.7	28.8	0	0	0	0	109.4
626	Y	28.1	Very low	28.9	Very low	198 Å²	198	136.5 Å²	136.5	78%	0.776	78%	0.775	S	S	*	*			cis	-163.4	146.3	-32	-142.8	-122	0	0	0	106.7
627	I	26.2	Very low	28.6	Very low	135 Å²	135	139.7 Å²	139.7	69%	0.692	78%	0.778	S	S	*	*			trans	32.6	118.9	158.9	-56.6	176.7	0	0	0	120.2
628	S	28.9	Very low	28.4	Very low	114 Å²	114	138.5 Å²	138.5	80%	0.797	77%	0.766	S	S	*	*			trans	-159.4	134	134.1	63.6	0	0	0	0	112.1
629	N	26.7	Very low	28.2	Very low	143 Å²	143	135.1 Å²	135.1	77%	0.765	76%	0.759	S	S	*	*			trans	-80.8	138.9	178.3	-54.9	-50.6	0	0	0	111.8
630	N	28.1	Very low	27.9	Very low	153 Å²	153	136.7 Å²	136.7	82%	0.818	76%	0.759	S	S	*	*				173.5	145.1	116.9	-93.9	-20.9	0	0	0	114.8
631	S	27.6	Very low	27.8	Very low	90 Å²	90	136.8 Å²	136.8	63%	0.629	76%	0.757	S	S	*	*			trans	32.5	141.6	144.3	70	0	0	0	0	123.3
632	N	27.3	Very low	27.5	Very low	137 Å²	137	135.4 Å²	135.4	73%	0.733	75%	0.746	S	S	*	*			trans	89.1	91.6	148.8	-57.7	-14.5	0	0	0	120.1
633	T	27.4	Very low	27.5	Very low	133 Å²	133	133.4 Å²	133.4	82%	0.816	74%	0.742	S	S	*	*				38	105.8	120.5	58.5	0	0	0	0	119.7
634	S	28.3	Very low	27.3	Very low	113 Å²	113	134.8 Å²	134.8	79%	0.79	75%	0.749	S	S	*	*			trans	-150.7	104.1	145.7	-72.3	0	0	0	0	107
635	A	26.6	Very low	27.4	Very low	101 Å²	101	138.4 Å²	138.4	84%	0.835	75%	0.754	S	S	*	*				57.3	88.8	81	0	0	0	0	0	113.1
636	S	28.3	Very low	27.1	Very low	116 Å²	116	137.2 Å²	137.2	81%	0.811	75%	0.75	S	S	*	*			trans	-125.3	134.8	158.7	-73.4	0	0	0	0	109.1
637	Q	24.6	Very low	27.1	Very low	179 Å²	179	135.7 Å²	135.7	84%	0.836	76%	0.755	S	S	*	*			trans	-97.1	127.6	-157.2	-62.5	169.2	-13.8	0	0	111.8
638	Y	25.9	Very low	27.1	Very low	154 Å²	154	138 Å²	138	60%	0.604	76%	0.76	S	S	*	*			trans	-122.1	135.3	159.3	-85.2	-85.6	0	0	0	110.7	S166 H167	S166-Y638 WeakPolarHBondContact CB-OH 3.45Å; S166-Y638 PolarHBondContact OG-OH 2.99Å; S166-Y638 VanDerWaalsContact OG-OH 3.12Å; H167-Y638 PolarHBondContact O-OH 2.91Å
639	V	26.8	Very low	27.2	Very low	122 Å²	122	141.5 Å²	141.5	74%	0.739	76%	0.764	S	S	*	*			trans	-91.4	111	-161.8	179.2	0	0	0	0	110.8	V641	V639-V641 HydrophobicContact CG1-CG2 4.28Å; V639-V641 PolarHBondContact O-N 2.96Å
640	F	25.2	Very low	27.2	Very low	184 Å²	184	139.9 Å²	139.9	81%	0.807	76%	0.761	S	S	*	*			trans	-64	127.3	165	-96.5	-103	0	0	0	110.6
641	V	29.2	Very low	27.1	Very low	120 Å²	120	140.4 Å²	140.4	73%	0.727	76%	0.764	S	S	*	*			trans	-114.2	89.9	170.3	-178.3	0	0	0	0	108.6	V639 S643	V639-V641 HydrophobicContact CG1-CG2 4.28Å; V639-V641 PolarHBondContact O-N 2.96Å; V641-S643 PolarHBondContact O-N 3.3Å
642	Q	25.1	Very low	27.4	Very low	142 Å²	142	144.4 Å²	144.4	66%	0.664	77%	0.772	S	S	*	*			trans	-71.1	92	169.1	-76.6	-178.9	-26.5	0	0	109.9	N644	Q642-N644 PolarHBondContact O-N 3.34Å
643	S	29.9	Very low	27.4	Very low	81 Å²	81	144.5 Å²	144.5	57%	0.566	77%	0.768	S	S	*	*			trans	-76.2	84.2	173.9	57.2	0	0	0	0	111.2	V641 Y645	V641-S643 PolarHBondContact O-N 3.3Å; S643-Y645 PolarHBondContact O-N 3Å
644	N	26.4	Very low	27.6	Very low	145 Å²	145	145.6 Å²	145.6	78%	0.775	77%	0.768	S	S	*	*			trans	-61.5	95.7	170.4	-80.7	-68.4	0	0	0	111.3	Q642 C646	Q642-N644 PolarHBondContact O-N 3.34Å; N644-C646 PolarHBondContact O-N 3.38Å; N644-C646 VanDerWaalsContact O-N 3.12Å
645	Y	28.9	Very low	27.7	Very low	210 Å²	210	146.6 Å²	146.6	82%	0.824	76%	0.76	S	S	*	*			trans	-83	83.6	171.9	-89.4	-83	0	0	0	111.4	S643 L647	S643-Y645 PolarHBondContact O-N 3Å; Y645-L647 PolarHBondContact O-N 3.46Å; Y645-L647 VanDerWaalsContact O-N 3.09Å
646	C	24.2	Very low	27.8	Very low	111 Å²	111	147.9 Å²	147.9	75%	0.75	75%	0.753	S	S	*	*			trans	-69.8	97.6	168.8	-179.1	0	0	0	0	110.4	N644 K648	N644-C646 PolarHBondContact O-N 3.38Å; N644-C646 VanDerWaalsContact O-N 3.12Å; C646-K648 PolarHBondContact O-N 3.33Å
647	L	28	Very low	28.1	Very low	167 Å²	167	150.6 Å²	150.6	87%	0.874	76%	0.756	S	S	*	*			trans	-83.2	106.2	165.5	-98.7	169.2	0	0	0	109.7	Y645	Y645-L647 PolarHBondContact O-N 3.46Å; Y645-L647 VanDerWaalsContact O-N 3.09Å
648	K	26.4	Very low	28.3	Very low	183 Å²	183	149.6 Å²	149.6	80%	0.796	75%	0.752	S	S	*	*			trans	-65.3	137.4	174.8	-60.4	175.3	179.2	179	0	110.9	C646	C646-K648 PolarHBondContact O-N 3.33Å
649	Q	29.8	Very low	28.5	Very low	188 Å²	188	147.3 Å²	147.3	88%	0.879	76%	0.758	S	S	*	*			trans	-131.1	153.5	145.8	-74.7	-148.5	14.4	0	0	109.8
650	P	27.9	Very low	28.5	Very low	108 Å²	108	148.8 Å²	148.8	70%	0.701	76%	0.761	S	S	*	*			trans	-89.4	148	-161.3	34.2	-35.5	0	0	0	114.2	H652	P650-H652 PolarHBondContact O-N 2.99Å
651	N	24.9	Very low	28.8	Very low	165 Å²	165	147.1 Å²	147.1	88%	0.882	76%	0.76	S	S	*	*			trans	-81.5	109.9	167.6	-79.9	-37.2	0	0	0	111.1
652	H	34.6	Very low	28.8	Very low	174 Å²	174	150.1 Å²	150.1	81%	0.806	77%	0.766	S	S	*	*			trans	-137.1	103.9	153	-78	-93.4	0	0	0	105.6	P650	P650-H652 PolarHBondContact O-N 2.99Å
653	H	27.3	Very low	29.6	Very low	138 Å²	138	148 Å²	148	64%	0.639	77%	0.765	S	S	*	*				73.6	95	60.4	-170.5	53.5	0	0	0	113.9
654	L	32	Very low	29.6	Very low	156 Å²	156	152.7 Å²	152.7	82%	0.817	78%	0.777	S	S	*	*			trans	173.8	91.4	149.5	-94.9	161.5	0	0	0	105.6
655	Q	29.3	Very low	29.9	Very low	134 Å²	134	150.2 Å²	150.2	63%	0.626	77%	0.771	S	S	*	*				65.9	116	78.2	-75.8	-165.4	-22.9	0	0	116.3
656	N	28.6	Very low	29.7	Very low	129 Å²	129	148.1 Å²	148.1	69%	0.69	77%	0.773	S	S	*	*			trans	67.4	150.5	154.5	-60.2	-8.4	0	0	0	116
657	I	34.3	Very low	29.8	Very low	172 Å²	172	148.3 Å²	148.3	88%	0.882	77%	0.774	S	S	*	*			cis	-122.6	153.2	32.9	-70.7	167.4	0	0	0	113.4
658	Q	29.6	Very low	29.7	Very low	158 Å²	158	148.3 Å²	148.3	74%	0.738	78%	0.775	S	S	*	*			trans	-85.5	152.9	177.7	-64	149.4	-93	0	0	113
659	S	30.4	Very low	29.9	Very low	106 Å²	106	143.6 Å²	143.6	74%	0.741	77%	0.765	S	S	*	*				-167.8	136.5	124	21.3	0	0	0	0	112.7
660	L	27.3	Very low	29.8	Very low	154 Å²	154	141.6 Å²	141.6	81%	0.806	76%	0.76	S	S	*	*			trans	48.1	124.2	140.7	-58.9	170.6	0	0	0	119.2
661	L	30.8	Very low	30	Very low	148 Å²	148	141.3 Å²	141.3	78%	0.775	76%	0.76	S	S	*	*			cis	-141.4	170.3	7.5	-76.2	107.9	0	0	0	112
662	H	29.9	Very low	30.4	Very low	183 Å²	183	141.1 Å²	141.1	85%	0.847	76%	0.759	S	S	*	*			trans	-103.8	-139.9	158.9	-71.3	30.8	0	0	0	110
663	P	40.3	Very low	30.3	Very low	99 Å²	99	137.8 Å²	137.8	64%	0.643	76%	0.755	S	S	*	*			trans	-113.6	-172.8	-131.8	36.5	-15.7	0	0	0	112.8
664	H	31.6	Very low	30.4	Very low	178 Å²	178	136.3 Å²	136.3	82%	0.824	76%	0.76	S	S	*	*				174.8	166.9	119.5	-99.7	-76.2	0	0	0	112.2
665	S	31.6	Very low	30.4	Very low	93 Å²	93	136.2 Å²	136.2	65%	0.65	76%	0.759	S	S	*	*			trans	-97.8	178.7	173.5	51	0	0	0	0	112.1
666	L	25.5	Very low	30.7	Very low	167 Å²	167	134 Å²	134	87%	0.874	76%	0.758	S	S	*	*			trans	102.8	148.5	163.5	-55	176.8	0	0	0	117.9
667	C	26.4	Very low	31	Very low	114 Å²	114	134 Å²	134	77%	0.77	76%	0.763	S	S	*	*			trans	-75.2	160.2	-177.1	-46.1	0	0	0	0	112.5
668	L	26.3	Very low	31.4	Very low	168 Å²	168	130.9 Å²	130.9	88%	0.88	76%	0.755	S	S	*	*				-174.2	156.6	110.1	-97.4	162.5	0	0	0	113.9
669	S	29.3	Very low	31.8	Very low	84 Å²	84	128.2 Å²	128.2	59%	0.587	75%	0.753	S	S	*	*			trans	-51.1	157.6	-179.7	56.8	0	0	0	0	119.6
670	N	28.4	Very low	32.4	Very low	146 Å²	146	128.8 Å²	128.8	78%	0.781	76%	0.757	S	S	*	*				132.6	141.1	111.1	-100.1	-8.4	0	0	0	119.4
671	S	30.8	Very low	33	Very low	101 Å²	101	127.3 Å²	127.3	71%	0.706	76%	0.757	S	S	*	*			trans	71	120.3	153.9	-49	0	0	0	0	118.4
672	L	33.5	Very low	33.2	Very low	162 Å²	162	126 Å²	126	85%	0.848	76%	0.76	S	S	*	*				-168.9	153.4	65.2	-88.8	166.2	0	0	0	113.3
673	S	33	Very low	33.5	Very low	104 Å²	104	122.4 Å²	122.4	73%	0.727	76%	0.755	S	S	*	*			trans	12.4	148.3	153	57	0	0	0	0	122.2
674	S	30.5	Very low	33.3	Very low	106 Å²	106	123.9 Å²	123.9	74%	0.741	76%	0.763	S	S	*	*			cis	-178.1	153.5	-5.3	48.3	0	0	0	0	107.1
675	L	31.7	Very low	33.4	Very low	154 Å²	154	122.6 Å²	122.6	81%	0.806	76%	0.759	S	S	*	*				178.9	153.9	68.5	-162.3	73.2	0	0	0	110.4
676	S	35.1	Very low	33.5	Very low	87 Å²	87	125.2 Å²	125.2	61%	0.608	77%	0.765	S	S	*	*			trans	35.9	116.8	159.5	55	0	0	0	0	121.3
677	T	35.6	Very low	33.6	Very low	129 Å²	129	121.7 Å²	121.7	79%	0.791	75%	0.754	S	S	*	*			cis	74.7	158.6	40.3	80.2	0	0	0	0	115.5
678	P	41.6	Very low	33.9	Very low	108 Å²	108	121.2 Å²	121.2	70%	0.701	75%	0.752	S	S	*	*			cis	-142.5	156.8	5.1	42.7	-23.7	0	0	0	119.9
679	S	38.3	Very low	34	Very low	102 Å²	102	119 Å²	119	71%	0.713	75%	0.751	S	S	*	*			trans	50.2	137.1	135.9	70.1	0	0	0	0	126
680	S	43.6	Very low	34.3	Very low	117 Å²	117	118.7 Å²	118.7	82%	0.818	76%	0.761	S	S	*	*				-160.5	154.9	108.2	-79.6	0	0	0	0	112.4
681	P	39.7	Very low	34.3	Very low	124 Å²	124	118.8 Å²	118.8	81%	0.805	76%	0.761	S	S	*	*			trans	-133	-179.8	-147.6	41.1	-23.1	0	0	0	118.5
682	S	35.6	Very low	34.4	Very low	119 Å²	119	121.9 Å²	121.9	83%	0.832	76%	0.764	S	S	*	*			trans	-81.4	178.4	-179.1	-20	0	0	0	0	115.7
683	S	34.8	Very low	34.1	Very low	108 Å²	108	120.8 Å²	120.8	76%	0.755	76%	0.755	S	S	*	*				162.3	176.5	119	-167.2	0	0	0	0	114.4
684	V	36.7	Very low	33.9	Very low	131 Å²	131	123.6 Å²	123.6	79%	0.794	76%	0.756	S	S	*	*			trans	79.5	133.6	161.4	-175.4	0	0	0	0	117.6
685	M	32.8	Very low	33.6	Very low	150 Å²	150	124.4 Å²	124.4	74%	0.739	75%	0.749	S	S	*	*			cis	-176.3	164.6	-28.6	-119.9	-153.4	-154.6	0	0	111.2
686	L	33.9	Very low	33.6	Very low	148 Å²	148	125.6 Å²	125.6	78%	0.775	74%	0.744	S	S	*	*			trans	64.6	167.2	155	-64.6	158.1	0	0	0	119.2
687	S	27.3	Very low	33.1	Very low	93 Å²	93	127.9 Å²	127.9	65%	0.65	75%	0.745	S	S	*	*			cis	-179	165.3	-47.4	61.1	0	0	0	0	111.3
688	S	32.6	Very low	32.9	Very low	104 Å²	104	127.9 Å²	127.9	73%	0.727	74%	0.74	S	S	*	*			trans	75	114.3	165.3	-162.7	0	0	0	0	115.6
689	S	29.7	Very low	32.5	Very low	123 Å²	123	131.1 Å²	131.1	86%	0.86	75%	0.745	S	S	*	*				74.9	128.1	66.8	-51.7	0	0	0	0	114.6
690	G	34.4	Very low	32.3	Very low	77 Å²	77	131.5 Å²	131.5	79%	0.794	75%	0.748	S	S	*	*			trans	161.6	108.5	171.5	0	0	0	0	0	114.4
691	D	29.2	Very low	31.9	Very low	147 Å²	147	129.6 Å²	129.6	79%	0.786	75%	0.747	S	S	*	*			trans	-74.8	-175.5	178.2	-57.2	-88.6	0	0	0	114.8
692	Q	32.4	Very low	31.7	Very low	166 Å²	166	128 Å²	128	78%	0.776	74%	0.744	S	S	*	*			trans	78.1	151.8	160.5	-68	164.3	77.5	0	0	116.9
693	Q	27.8	Very low	31.8	Very low	140 Å²	140	128.5 Å²	128.5	65%	0.654	74%	0.742	S	S	*	*			cis	-177.7	144.2	-30.3	-116.1	179.4	40.8	0	0	105.2
694	Q	27.8	Very low	31.9	Very low	162 Å²	162	129.9 Å²	129.9	76%	0.757	74%	0.74	S	S	*	*			trans	62.1	172.4	161.5	-71.8	159.4	25.1	0	0	114.6
695	Q	25.5	Very low	32.1	Very low	123 Å²	123	128.4 Å²	128.4	58%	0.575	73%	0.734	S	S	*	*			cis	-169.3	164.3	-34.4	179.8	178.3	-8.4	0	0	105.6
696	Y	30.5	Very low	32.2	Very low	180 Å²	180	131.1 Å²	131.1	71%	0.706	74%	0.737	S	S	*	*			trans	69.6	157.2	174.6	-59.3	-70.7	0	0	0	115.4
697	Q	26.5	Very low	32.2	Very low	134 Å²	134	128.2 Å²	128.2	63%	0.626	73%	0.729	S	S	*	*			cis	-161.6	153.7	-35.6	-135.4	-173.6	-74.4	0	0	108
698	D	30.1	Very low	32.5	Very low	129 Å²	129	131.6 Å²	131.6	69%	0.69	74%	0.74	S	S	*	*			trans	56.9	175.2	162.2	-40.5	-38.2	0	0	0	115.8
699	E	34.4	Very low	32.6	Very low	176 Å²	176	129.6 Å²	129.6	82%	0.822	74%	0.736	S	S	*	*			cis	-125	140.2	-15.5	-82.7	-165.2	146.6	0	0	107.3
700	S	32.4	Very low	32.8	Very low	111 Å²	111	131.4 Å²	131.4	78%	0.776	74%	0.735	S	S	*	*				83.4	133.8	74.2	117.9	0	0	0	0	116.5
701	G	35.5	Very low	32.7	Very low	77 Å²	77	131.7 Å²	131.7	79%	0.794	73%	0.725	S	S	*	*			trans	98.2	144	166.3	0	0	0	0	0	117.6
702	A	36.6	Very low	32.7	Very low	90 Å²	90	130.6 Å²	130.6	74%	0.744	72%	0.724	S	S	*	*			cis	-167.5	171.5	-12.2	0	0	0	0	0	111.9
703	V	37.9	Very low	32.8	Very low	130 Å²	130	128.6 Å²	128.6	79%	0.788	72%	0.723	S	S	*	*			trans	70.2	127.5	147.5	160.3	0	0	0	0	118
704	L	36.5	Very low	32.9	Very low	136 Å²	136	129.2 Å²	129.2	71%	0.712	73%	0.73	S	S	*	*			cis	-154.8	151.7	-3.3	-107.5	173	0	0	0	111.6
705	P	40.4	Very low	33.3	Very low	101 Å²	101	125.1 Å²	125.1	66%	0.656	73%	0.732	S	S	*	*			trans	-117	179.8	171.1	42.4	-32.1	0	0	0	113.4
706	Y	35.3	Very low	33.6	Very low	206 Å²	206	125 Å²	125	81%	0.808	74%	0.735	S	S	*	*			trans	-170.1	129.3	144.6	-85.1	-60.3	0	0	0	107.8
707	S	34	Very low	33.8	Very low	88 Å²	88	126.5 Å²	126.5	62%	0.615	74%	0.74	S	S	*	*				79.9	150.2	61.2	101.2	0	0	0	0	113.9
708	N	32.4	Very low	34.1	Very low	163 Å²	163	128.5 Å²	128.5	87%	0.872	75%	0.746	S	S	*	*			cis	-166.5	161.3	1.7	-130.3	-9.7	0	0	0	112.4
709	G	35.3	Very low	34.2	Very low	63 Å²	63	128.3 Å²	128.3	65%	0.649	75%	0.745	S	S	*	*			trans	89	157	156.4	0	0	0	0	0	118.5
710	L	33.7	Very low	34.1	Very low	161 Å²	161	127.8 Å²	127.8	84%	0.843	74%	0.742	S	S	*	*			cis	-157.3	144.4	-4.3	-150.5	76	0	0	0	113
711	S	32.6	Very low	34	Very low	83 Å²	83	126.7 Å²	126.7	58%	0.58	73%	0.734	S	S	*	*			trans	41.5	110	147.7	60.5	0	0	0	0	122.2
712	T	28.8	Very low	33.9	Very low	123 Å²	123	131.7 Å²	131.7	76%	0.755	74%	0.737	S	S	*	*				37.7	141.2	110.3	62.5	0	0	0	0	119.7
713	V	35.8	Very low	33.9	Very low	124 Å²	124	132.6 Å²	132.6	75%	0.752	74%	0.735	S	S	*	*				-158.7	146.8	67.6	159.2	0	0	0	0	113.6
714	N	30	Very low	34.1	Very low	153 Å²	153	131.1 Å²	131.1	82%	0.818	73%	0.728	S	S	*	*			trans	-17.3	144.7	162.6	-45.3	-19.7	0	0	0	119.2
715	G	35.2	Very low	33.8	Very low	77 Å²	77	130.4 Å²	130.4	79%	0.794	73%	0.729	S	S	*	*			trans	-162.3	21.7	179.1	0	0	0	0	0	119.6
716	D	31.5	Very low	33.2	Very low	119 Å²	119	136.1 Å²	136.1	64%	0.636	74%	0.738	S	S	*	*			trans	38	135.5	149.6	-148	30.7	0	0	0	121.6
717	R	35	Very low	32.9	Very low	213 Å²	213	131.4 Å²	131.4	80%	0.804	73%	0.731	S	S	*	*			trans	74.5	151.2	165.9	-63.5	165.4	-137.5	-178.2	8.6	118.1
718	K	31.9	Very low	32.6	Very low	175 Å²	175	135.6 Å²	135.6	76%	0.761	74%	0.743	S	S	*	*			cis	-171.1	159.4	-27.2	-145.5	-177.7	-176.5	-179.1	0	107.8
719	L	32.3	Very low	32.6	Very low	126 Å²	126	134.9 Å²	134.9	66%	0.66	74%	0.737	S	S	*	*			trans	69.2	134.7	160.1	-58.4	164.5	0	0	0	118.8
720	Q	32.1	Very low	32.3	Very low	164 Å²	164	139 Å²	139	77%	0.766	74%	0.744	S	S	*	*			trans	54.5	151.1	131.4	-67.7	169	-50.2	0	0	121.9
721	S	32	Very low	32.1	Very low	88 Å²	88	136.5 Å²	136.5	62%	0.615	74%	0.74	S	S	*	*			cis	177.9	115.7	-37.9	46	0	0	0	0	109.2
722	H	32.4	Very low	32	Very low	183 Å²	183	140 Å²	140	85%	0.847	75%	0.746	S	S	*	*			trans	59.6	-171.5	163.4	-64.2	-68	0	0	0	115.3
723	P	37.6	Very low	32.2	Very low	109 Å²	109	139.9 Å²	139.9	71%	0.708	74%	0.741	S	S	*	*				-132.1	-128.3	-110.1	37.8	-11.9	0	0	0	109.5
724	P	40.6	Very low	32.1	Very low	99 Å²	99	141 Å²	141	64%	0.643	74%	0.742	S	S	*	*			cis	-128.3	-170.5	-35.2	28.1	-5.7	0	0	0	113.3
725	T	30.9	Very low	32.2	Very low	120 Å²	120	139.8 Å²	139.8	74%	0.736	74%	0.736	S	S	*	*			trans	77	133.6	145	22.7	0	0	0	0	123.3
726	R	28.8	Very low	32.1	Very low	221 Å²	221	141.8 Å²	141.8	83%	0.834	73%	0.733	S	S	*	*			trans	77.4	102.8	135.4	-96.3	-172.6	164.2	161.2	-2	123.4
727	T	28.2	Very low	32	Very low	107 Å²	107	140.5 Å²	140.5	66%	0.656	74%	0.738	S	S	*	*				73.2	144.5	118.2	51.7	0	0	0	0	123.6
728	M	27.9	Very low	31.8	Very low	177 Å²	177	134.7 Å²	134.7	87%	0.872	74%	0.736	S	S	*	*			trans	71.2	147.1	173.1	-49.9	-168.1	-75.6	0	0	113.3
729	I	32.1	Very low	31.9	Very low	147 Å²	147	133.2 Å²	133.2	75%	0.754	74%	0.736	S	S	*	*			cis	-146.2	139.1	33.8	-76.6	174.5	0	0	0	111.9
730	L	28.6	Very low	32	Very low	151 Å²	151	134.6 Å²	134.6	79%	0.791	74%	0.743	S	S	*	*			trans	25.1	150	146.9	-52.6	172.1	0	0	0	124.1
731	S	30.7	Very low	32	Very low	107 Å²	107	130.3 Å²	130.3	75%	0.748	74%	0.736	S	S	*	*			trans	70.9	159.8	146.6	-69.1	0	0	0	0	119
732	H	30.8	Very low	31.9	Very low	156 Å²	156	133 Å²	133	72%	0.722	74%	0.743	S	S	*	*			cis	-173.7	160.6	-37.8	-138.4	-93.3	0	0	0	105.9
733	D	32	Very low	32.1	Very low	121 Å²	121	132.6 Å²	132.6	65%	0.647	74%	0.741	S	S	*	*			trans	67.5	127.3	165.1	-51.4	-31.1	0	0	0	117.1
734	L	33.9	Very low	32	Very low	148 Å²	148	132.3 Å²	132.3	78%	0.775	74%	0.742	S	S	*	*				52.3	139.2	96	-71.1	93.4	0	0	0	114.5
735	D	31.5	Very low	31.3	Very low	128 Å²	128	135.8 Å²	135.8	68%	0.684	76%	0.755	S	S	*	*			cis	-166	167	33.4	-145.3	-39.7	0	0	0	115.1
736	T	33.4	Very low	31.4	Very low	119 Å²	119	135.8 Å²	135.8	73%	0.73	76%	0.76	S	S	*	*			trans	47.9	136.2	149.6	6.4	0	0	0	0	127.3
737	A	29.4	Very low	31.4	Very low	91 Å²	91	132.8 Å²	132.8	75%	0.752	76%	0.76	S	S	*	*				108.3	150.4	122	0	0	0	0	0	123.2
738	A	31.8	Very low	31.5	Very low	91 Å²	91	135.7 Å²	135.7	75%	0.752	77%	0.77	S	S	*	*			trans	74.5	144	159.3	0	0	0	0	0	119.5
739	L	33.9	Very low	31.4	Very low	145 Å²	145	134.4 Å²	134.4	76%	0.759	77%	0.767	S	S	*	*			cis	-164.3	149	-6	-111.3	168.6	0	0	0	111.6
740	L	34.1	Very low	31.6	Very low	155 Å²	155	132.6 Å²	132.6	81%	0.812	77%	0.767	S	S	*	*			trans	68.6	165.4	156.9	-58.6	165.9	0	0	0	121
741	A	31.9	Very low	31.5	Very low	74 Å²	74	132.8 Å²	132.8	61%	0.612	77%	0.769	S	S	*	*				-178.8	157.3	-67.3	0	0	0	0	0	114
742	N	30.3	Very low	31.7	Very low	143 Å²	143	137 Å²	137	77%	0.765	78%	0.779	S	S	*	*			trans	88.9	149.5	153.9	-61.2	-28	0	0	0	122.8
743	H	35.9	Very low	31.4	Very low	176 Å²	176	137 Å²	137	82%	0.815	79%	0.785	S	S	*	*			trans	79	132.7	168.1	-67.1	-75.3	0	0	0	120
744	S	34.6	Very low	31.5	Very low	102 Å²	102	138.9 Å²	138.9	71%	0.713	79%	0.793	S	S	*	*			cis	-171.1	141.8	-33.3	30.8	0	0	0	0	110.6
745	N	26	Very low	31.4	Very low	173 Å²	173	135 Å²	135	93%	0.925	79%	0.789	S	S	*	*			trans	-90	154.2	-174.7	-83.8	-19.3	0	0	0	115.6
746	S	33.9	Very low	31.2	Very low	120 Å²	120	138.3 Å²	138.3	84%	0.839	80%	0.798	S	S	*	*			trans	-154.4	121.4	157.1	61.1	0	0	0	0	112.9
747	N	27.7	Very low	30.8	Very low	157 Å²	157	141.3 Å²	141.3	84%	0.84	80%	0.801	S	S	*	*			trans	-89.1	145.3	178.6	-89.5	-25.2	0	0	0	113.2
748	I	31.8	Very low	30.7	Very low	169 Å²	169	145.4 Å²	145.4	87%	0.867	80%	0.804	S	S	*	*			trans	-140.7	133.2	150.9	-61.3	-174.5	0	0	0	109.4
749	N	26.2	Very low	30.6	Very low	150 Å²	150	148.5 Å²	148.5	80%	0.802	81%	0.807	S	S	*	*			trans	-96.2	144.7	175.7	-70.1	-40.9	0	0	0	111.9
750	S	34.6	Very low	30.3	Very low	108 Å²	108	148.4 Å²	148.4	76%	0.755	81%	0.806	S	S	*	*			trans	-169.7	122.1	138.7	58.8	0	0	0	0	114.5
751	N	27.6	Very low	30	Very low	156 Å²	156	148.6 Å²	148.6	83%	0.834	81%	0.808	S	S	*	*			trans	27.1	129.1	142.5	-55.3	-16.2	0	0	0	121.2
752	M	33.9	Very low	29.8	Very low	196 Å²	196	149.2 Å²	149.2	97%	0.966	82%	0.822	S	S	*	*				-164.6	125.6	111.4	-90.5	-110	-88.5	0	0	111.2
753	N	25.6	Very low	29.6	Very low	156 Å²	156	145.7 Å²	145.7	83%	0.834	82%	0.819	S	S	*	*			trans	-157.1	116.8	171.9	-178.7	1.4	0	0	0	109.5
754	L	32.9	Very low	29.3	Very low	159 Å²	159	144.6 Å²	144.6	83%	0.832	82%	0.819	S	S	*	*			trans	170.2	136.4	176.5	-98.9	155.7	0	0	0	105.7	F756	L754-F756 HydrophobicContact CD2-CE2 4.32Å
755	G	31.5	Very low	28.9	Very low	67 Å²	67	146.8 Å²	146.8	69%	0.691	82%	0.823	S	S	*	*			cis	-156.1	-158.5	-8.7	0	0	0	0	0	107.2
756	F	27.7	Very low	29.1	Very low	198 Å²	198	147 Å²	147	87%	0.868	82%	0.822	S	S	*	*			cis	-152.2	167	4.9	-134.5	-89.5	0	0	0	108.8	L754	L754-F756 HydrophobicContact CD2-CE2 4.32Å
757	K	26.3	Very low	28.8	Very low	182 Å²	182	145.2 Å²	145.2	79%	0.791	81%	0.81	S	S	*	*			trans	-141.3	157	179.5	-155.2	176.1	-172.5	177.7	0	110.3
758	Q	27.1	Very low	28.8	Very low	176 Å²	176	144.7 Å²	144.7	82%	0.822	81%	0.807	S	S	*	*			trans	79.4	136.6	171.9	-53	172.8	-19	0	0	118.3
759	I	29.7	Very low	28.7	Very low	156 Å²	156	141.6 Å²	141.6	80%	0.8	80%	0.8	S	S	*	*			trans	163.1	93.2	151.3	-86.8	156.7	0	0	0	104.1
760	L	27.9	Very low	28.9	Very low	143 Å²	143	141.2 Å²	141.2	75%	0.749	80%	0.797	S	S	*	*				78.8	116.9	83.3	-75.2	171.3	0	0	0	114.8
761	N	26.5	Very low	28.7	Very low	159 Å²	159	142.6 Å²	142.6	85%	0.85	79%	0.791	S	S	*	*			trans	28.3	117.5	149.1	-55.8	-2.7	0	0	0	120.2
762	G	28.4	Very low	28.8	Very low	87 Å²	87	142.2 Å²	142.2	90%	0.897	79%	0.785	S	S	*	*			trans	-178.8	142.8	161	0	0	0	0	0	110.6
763	G	26.5	Very low	28.5	Very low	69 Å²	69	137.6 Å²	137.6	71%	0.711	76%	0.764	S	S	*	*			trans	-137.5	-177.1	-176.7	0	0	0	0	0	113.8
764	N	28.8	Very low	28.6	Very low	153 Å²	153	135.3 Å²	135.3	82%	0.818	76%	0.76	S	S	*	*			trans	75.5	108.1	174	-56.7	-21.7	0	0	0	117.9
765	N	26	Very low	28.5	Very low	149 Å²	149	134.9 Å²	134.9	80%	0.797	75%	0.754	S	S	*	*				39.9	123.5	124.5	-51	-10.1	0	0	0	120.1
766	I	30.7	Very low	28.2	Very low	176 Å²	176	137.3 Å²	137.3	90%	0.903	76%	0.758	S	S	*	*				-156.7	158.6	120.6	-101.3	151.5	0	0	0	108.6
767	S	26.6	Very low	28.2	Very low	83 Å²	83	135.1 Å²	135.1	58%	0.58	76%	0.755	S	S	*	*			trans	-104.4	-179.9	-163.2	49.8	0	0	0	0	114.7
768	D	29.5	Very low	28.1	Very low	147 Å²	147	133 Å²	133	79%	0.786	76%	0.758	S	S	*	*			trans	74.8	132.7	160.4	-47.2	-55.4	0	0	0	116.4
769	S	29.8	Very low	28.2	Very low	103 Å²	103	130.7 Å²	130.7	72%	0.72	76%	0.756	S	S	*	*			cis	-161.3	-176.7	-4.8	55.3	0	0	0	0	108.1
770	I	30.4	Very low	28	Very low	142 Å²	142	132.9 Å²	132.9	73%	0.728	76%	0.759	S	S	*	*			cis	-155.5	-169.7	14.8	-152.9	157.6	0	0	0	111.7
771	Q	28.7	Very low	28	Very low	137 Å²	137	134.4 Å²	134.4	64%	0.64	77%	0.767	S	S	*	*			trans	-50.2	163.6	172.8	-66.5	160.9	-84.6	0	0	116
772	E	30.1	Very low	28	Very low	149 Å²	149	131.7 Å²	131.7	70%	0.696	76%	0.761	S	S	*	*			cis	-163.3	170.9	-0.6	-118.5	156.1	-151.6	0	0	108.5
773	D	28.9	Very low	28	Very low	98 Å²	98	133.9 Å²	133.9	52%	0.524	76%	0.757	S	S	.	*			cis	-143	162.8	-2.6	175.5	43.9	0	0	0	109.7	H775	D773-H775 IonicContact OD1-CD2 2.62Å; D773-H775 PolarHBondContact OD1-CD2 3.48Å; D773-H775 VanDerWaalsContact OD1-CD2 3.23Å; D773-H775 IonicContact OD1-CG 2.66Å; D773-H775 PolarHBondContact OD1-N 3.05Å; D773-H775 IonicContact OD1-NE2 3.57Å; D773-H775 IonicContact OD2-CD2 2.91Å; D773-H775 PolarHBondContact OD2-N 3.45Å
774	S	26.8	Very low	28	Very low	108 Å²	108	136.4 Å²	136.4	76%	0.755	76%	0.76	S	S	*	*			trans	-168	103.4	135	27.1	0	0	0	0	109.6	C776	S774-C776 PolarHBondContact O-N 2.91Å; S774-C776 VanDerWaalsContact O-N 3.12Å
775	H	30.9	Very low	27.9	Very low	151 Å²	151	133.8 Å²	133.8	70%	0.699	75%	0.754	S	S	*	*			trans	-71.2	106.5	-171.8	-82.2	-66.4	0	0	0	116	D773	D773-H775 IonicContact OD1-CD2 2.62Å; D773-H775 PolarHBondContact OD1-CD2 3.48Å; D773-H775 VanDerWaalsContact OD1-CD2 3.23Å; D773-H775 IonicContact OD1-CG 2.66Å; D773-H775 PolarHBondContact OD1-N 3.05Å; D773-H775 IonicContact OD1-NE2 3.57Å; D773-H775 IonicContact OD2-CD2 2.91Å; D773-H775 PolarHBondContact OD2-N 3.45Å
776	C	24.7	Very low	27.9	Very low	117 Å²	117	133.3 Å²	133.3	79%	0.791	75%	0.752	S	S	*	*			trans	-101.1	154.5	141.9	-77.9	0	0	0	0	109.8	S774	S774-C776 PolarHBondContact O-N 2.91Å; S774-C776 VanDerWaalsContact O-N 3.12Å
777	L	27.3	Very low	27.9	Very low	153 Å²	153	135.6 Å²	135.6	80%	0.801	76%	0.755	S	S	*	*			trans	-138.9	119.6	158.2	-86.4	-177.7	0	0	0	112.2
778	T	24.6	Very low	27.9	Very low	137 Å²	137	138.1 Å²	138.1	84%	0.84	76%	0.762	S	S	*	*			trans	-127.4	133.3	160.9	59	0	0	0	0	107.2
779	T	29.1	Very low	27.7	Very low	127 Å²	127	137 Å²	137	78%	0.779	76%	0.756	S	S	*	*			trans	-134.1	127.9	-178.4	-29.2	0	0	0	0	111.1
780	K	26.9	Very low	27.5	Very low	202 Å²	202	139 Å²	139	88%	0.878	76%	0.759	S	S	*	*			trans	-92.3	145.8	171.8	-68.1	178.3	178.4	175.8	0	110.1
781	L	27.4	Very low	27.3	Very low	176 Å²	176	140 Å²	140	92%	0.921	77%	0.765	S	S	*	*			trans	-135.5	164.5	159.1	-89.6	166.4	0	0	0	108.6
782	S	26.4	Very low	27.2	Very low	102 Å²	102	139 Å²	139	71%	0.713	77%	0.77	S	S	*	*			trans	-148.7	166	-156.6	53.2	0	0	0	0	114.3
783	V	27.6	Very low	26.9	Very low	133 Å²	133	137.7 Å²	137.7	81%	0.806	78%	0.777	S	S	*	*			trans	78.4	145.8	169.8	-173.7	0	0	0	0	114.3
784	P	26.9	Very low	26.8	Very low	121 Å²	121	142.6 Å²	142.6	79%	0.786	80%	0.795	S	S	*	*			cis	-114.7	-168.9	-8.1	27.9	-6.6	0	0	0	113.9
785	S	27.8	Very low	26.7	Very low	99 Å²	99	144.7 Å²	144.7	69%	0.692	80%	0.797	S	S	*	*			trans	-88.7	-177.5	174.4	59.7	0	0	0	0	114
786	D	25.6	Very low	26.6	Very low	139 Å²	139	145.6 Å²	145.6	74%	0.743	81%	0.806	S	S	*	*			trans	99.7	92.4	159.8	-56.7	5	0	0	0	117.3
787	F	30.6	Very low	26.7	Very low	224 Å²	224	145.6 Å²	145.6	98%	0.982	80%	0.804	S	S	*	*				-157.8	146.7	119.3	-114.5	-76.7	0	0	0	109.8
788	N	26.2	Very low	26.9	Very low	136 Å²	136	143.4 Å²	143.4	73%	0.727	80%	0.797	S	S	*	*			trans	-116.4	163	-160.7	-152	-3.9	0	0	0	113.6
789	N	25.6	Very low	27.1	Very low	123 Å²	123	141 Å²	141	66%	0.658	79%	0.785	S	S	*	*			trans	87.5	122.5	164.4	-49.2	-42	0	0	0	120
790	N	25.4	Very low	27.4	Very low	146 Å²	146	141.3 Å²	141.3	78%	0.781	79%	0.79	S	S	*	*			trans	69.6	82.3	140.5	-56.6	-15	0	0	0	121
791	L	26.5	Very low	27.8	Very low	163 Å²	163	138.9 Å²	138.9	85%	0.853	79%	0.786	S	S	*	*			trans	-170.9	152	130.4	-100.4	150.7	0	0	0	110.4	S793	L791-S793 PolarHBondContact O-N 3.29Å
792	P	25	Very low	28.4	Very low	115 Å²	115	134.2 Å²	134.2	75%	0.747	76%	0.759	S	S	*	*			trans	-77.2	118.3	-178.3	-14.4	30.6	0	0	0	113.1	F794	P792-F794 PolarHBondContact O-N 2.92Å
793	S	25.4	Very low	28.9	Very low	121 Å²	121	135.2 Å²	135.2	85%	0.846	76%	0.756	S	S	*	*			trans	-79.1	108.4	-177.2	-57	0	0	0	0	113.1	L791	L791-S793 PolarHBondContact O-N 3.29Å
794	F	25.9	Very low	29.4	Very low	202 Å²	202	133.8 Å²	133.8	89%	0.886	74%	0.736	S	S	*	*			trans	-112.4	34.3	174.8	-116.2	-71.6	0	0	0	113.3	P792	P792-F794 PolarHBondContact O-N 2.92Å
795	L	25.8	Very low	29.9	Very low	152 Å²	152	131.5 Å²	131.5	80%	0.796	73%	0.734	S	S	*	*			trans	-133.2	123.3	176.4	-67.7	174.3	0	0	0	110.6
796	L	28.4	Very low	30.4	Very low	170 Å²	170	130.1 Å²	130.1	89%	0.89	73%	0.729	S	S	*	*			trans	-111.2	135.9	163.1	-77	174	0	0	0	108.8
797	P	26.4	Very low	31	Very low	116 Å²	116	124.4 Å²	124.4	75%	0.753	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-74.6	135.2	-178	30	-34.1	0	0	0	111.5	S799	P797-S799 PolarHBondContact O-N 3.31Å
798	V	31.5	Very low	31.5	Very low	107 Å²	107	121.6 Å²	121.6	65%	0.648	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-66.2	124.5	168.6	-177.9	0	0	0	0	108.3	F802	V798-F802 HydrophobicContact CG1-CB 4.19Å; V798-F802 HydrophobicContact CG1-CG 4.48Å
799	S	29.6	Very low	32.5	Very low	86 Å²	86	120.1 Å²	120.1	60%	0.601	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-67.1	147.2	-179.2	-61.5	0	0	0	0	111.9	P797 N801 F802	P797-S799 PolarHBondContact O-N 3.31Å; S799-N801 PolarHBondContact O-N 2.92Å; S799-F802 PolarHBondContact O-N 3.16Å
800	P	35.7	Very low	33.5	Very low	135 Å²	135	118.8 Å²	118.8	88%	0.877	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	-18.2	-178	-26.4	35.3	0	0	0	115.7
801	N	34.2	Very low	34.5	Very low	151 Å²	151	117.8 Å²	117.8	81%	0.807	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	26.8	-173.7	-61.5	-1.6	0	0	0	113.3	S799 N803	S799-N801 PolarHBondContact O-N 2.92Å; N801-N803 PolarHBondContact O-N 3.36Å
802	F	39.3	Very low	35.5	Very low	78 Å²	78	112.4 Å²	112.4	34%	0.342	64%	0.64	S	S	.	*			trans	-68	113.7	179.1	-171.8	-98.9	0	0	0	111.3	V798 S799 W804	V798-F802 HydrophobicContact CG1-CB 4.19Å; V798-F802 HydrophobicContact CG1-CG 4.48Å; S799-F802 PolarHBondContact O-N 3.16Å; F802-W804 AromaticContact CD1-CD2 3.84Å; F802-W804 HydrophobicContact CD1-CD2 3.84Å; F802-W804 AromaticContact CD1-CE3 3.93Å; F802-W804 HydrophobicContact CD1-CE3 3.93Å; F802-W804 HydrophobicContact CD1-CG 4.31Å; F802-W804 HydrophobicContact CD1-CZ2 4.42Å; F802-W804 HydrophobicContact CD1-CZ3 4.29Å; F802-W804 HydrophobicContact CE1-CD2 4.21Å; F802-W804 AromaticContact CE1-CE3 3.86Å; F802-W804 HydrophobicContact CE1-CE3 3.86Å; F802-W804 HydrophobicContact CE1-CZ3 4.19Å; F802-W804 PolarHBondContact O-N 3.09Å; F802-W804 VanDerWaalsContact O-N 3.1Å
803	N	38	Very low	36.7	Very low	122 Å²	122	107.5 Å²	107.5	65%	0.652	61%	0.607	S	S	*	*			trans	-79.7	93.6	-179.1	-175.5	-3.5	0	0	0	111.4	N801 G805 A806	N801-N803 PolarHBondContact O-N 3.36Å; N803-G805 PolarHBondContact O-N 3.03Å; N803-G805 PolarHBondContact OD1-N 3.46Å; N803-G805 VanDerWaalsContact OD1-N 3.08Å; N803-A806 PolarHBondContact O-N 3.42Å
804	W	38.2	Very low	37.9	Very low	104 Å²	104	106.1 Å²	106.1	39%	0.394	59%	0.589	S	S	.	*	G	3₁₀ helix	trans	-55.6	-20.8	178	-61.3	101.8	0	0	0	115	F802 A806 L807 A831 L835	F802-W804 AromaticContact CD1-CD2 3.84Å; F802-W804 HydrophobicContact CD1-CD2 3.84Å; F802-W804 AromaticContact CD1-CE3 3.93Å; F802-W804 HydrophobicContact CD1-CE3 3.93Å; F802-W804 HydrophobicContact CD1-CG 4.31Å; F802-W804 HydrophobicContact CD1-CZ2 4.42Å; F802-W804 HydrophobicContact CD1-CZ3 4.29Å; F802-W804 HydrophobicContact CE1-CD2 4.21Å; F802-W804 AromaticContact CE1-CE3 3.86Å; F802-W804 HydrophobicContact CE1-CE3 3.86Å; F802-W804 HydrophobicContact CE1-CZ3 4.19Å; F802-W804 PolarHBondContact O-N 3.09Å; F802-W804 VanDerWaalsContact O-N 3.1Å; W804-A806 PolarHBondContact O-N 2.89Å; W804-L807 HydrophobicContact CE3-CD1 3.94Å; W804-A831 HydrophobicContact CH2-CB 4.41Å; W804-A831 HydrophobicContact CZ2-CB 4.3Å; W804-L835 HydrophobicContact CD2-CD1 4.07Å; W804-L835 HydrophobicContact CE3-CD1 3.32Å; W804-L835 HydrophobicContact CZ3-CD1 3.76Å
805	G	36.1	Very low	39	Very low	72 Å²	72	104 Å²	104	74%	0.742	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-68.5	-10.6	179.9	0	0	0	0	0	115.3	N803	N803-G805 PolarHBondContact O-N 3.03Å; N803-G805 PolarHBondContact OD1-N 3.46Å; N803-G805 VanDerWaalsContact OD1-N 3.08Å
806	A	39.8	Very low	40.1	Very low	71 Å²	71	98.5 Å²	98.5	59%	0.587	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-89.1	1.9	-176.1	0	0	0	0	0	115.1	N803 W804 N808	N803-A806 PolarHBondContact O-N 3.42Å; W804-A806 PolarHBondContact O-N 2.89Å; A806-N808 PolarHBondContact O-N 3.14Å
807	L	38	Very low	41.1	Very low	18 Å²	18	90.9 Å²	90.9	9%	0.094	51%	0.508	C	S	.	.			trans	-75.9	38.4	-168.6	-72.5	175.4	0	0	0	116.1	W804 N809 E812 W813 L816 L835	W804-L807 HydrophobicContact CE3-CD1 3.94Å; L807-N809 VanDerWaalsContact C-N 3.28Å; L807-N809 PolarHBondContact O-N 3.43Å; L807-E812 HydrophobicContact CD2-CB 3.5Å; L807-E812 VanDerWaalsContact CD2-CB 3.5Å; L807-E812 HydrophobicContact CD2-CG 4.21Å; L807-W813 PolarHBondContact O-NE1 3.07Å; L807-L816 HydrophobicContact CD1-CD1 4.39Å; L807-L816 HydrophobicContact CD2-CD1 4.37Å; L807-L835 HydrophobicContact CD1-CD1 3.84Å; L807-L835 HydrophobicContact CD1-CD2 4.37Å
808	N	40.6	Very low	42	Very low	165 Å²	165	91.7 Å²	91.7	88%	0.882	51%	0.506	S	S	*	.			trans	-88.4	16	-179.7	-135.2	12.9	0	0	0	113.7	A806	A806-N808 PolarHBondContact O-N 3.14Å
809	N	46.5	Very low	43	Very low	105 Å²	105	90.8 Å²	90.8	56%	0.561	50%	0.496	S	S	*	.	S	Bend	trans	-132.1	126.1	-171.4	-120.5	-39.2	0	0	0	111.8	L807 Q811 E812	L807-N809 VanDerWaalsContact C-N 3.28Å; L807-N809 PolarHBondContact O-N 3.43Å; N809-Q811 PolarHBondContact O-N 3.48Å; N809-E812 PolarHBondContact O-N 3.3Å; N809-E812 VanDerWaalsContact O-N 3.1Å
810	N	47.6	Very low	43.6	Very low	96 Å²	96	87.5 Å²	87.5	51%	0.513	48%	0.477	S	S	.	.	H	α-helix	trans	-58	-24.2	-176.4	-72.8	-31.9	0	0	0	114	L814 F843	N810-L814 WeakPolarHBondContact O-CG 3.34Å; N810-L814 PolarHBondContact O-N 2.86Å; N810-L814 VanDerWaalsContact O-N 3.08Å; N810-F843 WeakPolarHBondContact OD1-CE2 3.47Å
811	Q	46.2	Very low	44.2	Very low	124 Å²	124	81.9 Å²	81.9	58%	0.579	44%	0.44	S	S	*	.	H	α-helix	trans	-71.1	-31.8	178.3	-64.9	-163.9	22.3	0	0	113.6	N809 L814 R815	N809-Q811 PolarHBondContact O-N 3.48Å; Q811-L814 PolarHBondContact O-N 2.91Å; Q811-R815 WeakPolarHBondContact O-CG 3.43Å; Q811-R815 PolarHBondContact O-N 3.42Å
812	E	46.7	Very low	44.9	Very low	50 Å²	50	80.6 Å²	80.6	23%	0.234	43%	0.433	C	S	.	.	H	α-helix	trans	-72.5	-39.2	176.6	-69.7	-60.7	107.5	0	0	111.1	L807 N809 L814 R815 L816	L807-E812 HydrophobicContact CD2-CB 3.5Å; L807-E812 VanDerWaalsContact CD2-CB 3.5Å; L807-E812 HydrophobicContact CD2-CG 4.21Å; N809-E812 PolarHBondContact O-N 3.3Å; N809-E812 VanDerWaalsContact O-N 3.1Å; E812-L814 VanDerWaalsContact C-N 3.32Å; E812-L814 PolarHBondContact O-N 3.05Å; E812-R815 WeakPolarHBondContact O-CB 3.42Å; E812-R815 PolarHBondContact O-N 3.27Å; E812-R815 VanDerWaalsContact O-N 3.15Å; E812-R815 WeakPolarHBondContact OE1-CD 3.08Å; E812-R815 IonicContact OE1-CZ 2.68Å; E812-R815 IonicContact OE1-NE 3.13Å; E812-R815 IonicContact OE1-NH1 2.7Å; E812-R815 PolarHBondContact OE1-NH1 3.12Å; E812-L816 PolarHBondContact O-N 3.16Å
813	W	51.6	Low	45.4	Very low	13 Å²	13	83.2 Å²	83.2	5%	0.049	45%	0.451	C	S	.	.	H	α-helix	trans	-63.6	-36.6	172.1	-74.5	96.9	0	0	0	112.6	L807 L816 A817 F832 L835 F843 L850	L807-W813 PolarHBondContact O-NE1 3.07Å; W813-L816 PolarHBondContact O-N 2.97Å; W813-A817 WeakPolarHBondContact O-CB 3.47Å; W813-A817 PolarHBondContact O-N 3.42Å; W813-F832 AromaticContact CE3-CE2 3.81Å; W813-F832 HydrophobicContact CE3-CE2 3.81Å; W813-F832 HydrophobicContact CE3-CZ 4.15Å; W813-F832 HydrophobicContact CZ3-CD2 4.17Å; W813-F832 AromaticContact CZ3-CE2 3.52Å; W813-F832 HydrophobicContact CZ3-CE2 3.52Å; W813-F832 AromaticContact CZ3-CZ 3.88Å; W813-F832 HydrophobicContact CZ3-CZ 3.88Å; W813-L835 HydrophobicContact CH2-CB 3.94Å; W813-L835 HydrophobicContact CZ2-CB 4.43Å; W813-F843 HydrophobicContact CB-CZ 4Å; W813-F843 AromaticContact CD1-CE2 3.92Å; W813-F843 AromaticContact CD1-CZ 3.7Å; W813-F843 AromaticContact CD2-CE1 3.99Å; W813-F843 HydrophobicContact CD2-CE1 3.99Å; W813-F843 HydrophobicContact CD2-CE2 4.44Å; W813-F843 AromaticContact CD2-CZ 3.49Å; W813-F843 HydrophobicContact CD2-CZ 3.49Å; W813-F843 VanDerWaalsContact CD2-CZ 3.49Å; W813-F843 AromaticContact CE2-CZ 3.74Å; W813-F843 HydrophobicContact CE3-CE1 4.2Å; W813-F843 HydrophobicContact CE3-CZ 4.05Å; W813-F843 HydrophobicContact CG-CE1 4.41Å; W813-F843 HydrophobicContact CG-CE2 4.07Å; W813-F843 AromaticContact CG-CZ 3.47Å; W813-F843 HydrophobicContact CG-CZ 3.47Å; W813-F843 VanDerWaalsContact CG-CZ 3.47Å; W813-F843 HydrophobicContact CH2-CE1 4.47Å; W813-F843 HydrophobicContact CZ2-CE1 4.29Å; W813-F843 HydrophobicContact CZ2-CZ 4.44Å; W813-F843 HydrophobicContact CZ3-CE1 4.44Å; W813-F843 AromaticContact NE1-CZ 3.86Å; W813-L850 HydrophobicContact CB-CD1 4.14Å; W813-L850 HydrophobicContact CD2-CD1 4.34Å; W813-L850 HydrophobicContact CE3-CD1 3.84Å
814	L	50.7	Low	46.3	Very low	91 Å²	91	79.8 Å²	79.8	48%	0.476	43%	0.432	S	S	.	.	H	α-helix	trans	-68.5	-34	171.3	-76.4	165.6	0	0	0	112.8	N810 Q811 E812 A817 N818	N810-L814 WeakPolarHBondContact O-CG 3.34Å; N810-L814 PolarHBondContact O-N 2.86Å; N810-L814 VanDerWaalsContact O-N 3.08Å; Q811-L814 PolarHBondContact O-N 2.91Å; E812-L814 VanDerWaalsContact C-N 3.32Å; E812-L814 PolarHBondContact O-N 3.05Å; L814-A817 PolarHBondContact O-N 3.33Å; L814-N818 WeakPolarHBondContact O-CB 3.41Å; L814-N818 VanDerWaalsContact O-CG 3.28Å; L814-N818 PolarHBondContact O-N 3.09Å
815	R	47.9	Very low	47.5	Very low	157 Å²	157	77.6 Å²	77.6	59%	0.592	43%	0.433	S	S	*	.	H	α-helix	trans	-63.1	-47.8	171.5	-78	164.4	164.3	-169.2	-6.6	111.1	Q811 E812 A817 N818 I819	Q811-R815 WeakPolarHBondContact O-CG 3.43Å; Q811-R815 PolarHBondContact O-N 3.42Å; E812-R815 WeakPolarHBondContact O-CB 3.42Å; E812-R815 PolarHBondContact O-N 3.27Å; E812-R815 VanDerWaalsContact O-N 3.15Å; E812-R815 WeakPolarHBondContact OE1-CD 3.08Å; E812-R815 IonicContact OE1-CZ 2.68Å; E812-R815 IonicContact OE1-NE 3.13Å; E812-R815 IonicContact OE1-NH1 2.7Å; E812-R815 PolarHBondContact OE1-NH1 3.12Å; R815-A817 VanDerWaalsContact C-N 3.32Å; R815-A817 PolarHBondContact O-N 3.2Å; R815-N818 PolarHBondContact O-N 3.28Å; R815-I819 PolarHBondContact O-N 3.36Å
816	L	48.9	Very low	48.4	Very low	38 Å²	38	77.8 Å²	77.8	20%	0.199	42%	0.423	C	S	.	.	H	α-helix	trans	-59.5	-40.6	174.5	-71.9	167.8	0	0	0	112.2	L807 E812 W813 N818 I819 F832	L807-L816 HydrophobicContact CD1-CD1 4.39Å; L807-L816 HydrophobicContact CD2-CD1 4.37Å; E812-L816 PolarHBondContact O-N 3.16Å; W813-L816 PolarHBondContact O-N 2.97Å; L816-N818 PolarHBondContact O-N 2.7Å; L816-I819 PolarHBondContact O-N 2.7Å; L816-F832 HydrophobicContact CB-CE2 4.07Å; L816-F832 HydrophobicContact CD1-CD2 4.36Å; L816-F832 HydrophobicContact CD1-CE2 4.12Å
817	A	49.1	Very low	49	Very low	10 Å²	10	78.5 Å²	78.5	8%	0.083	42%	0.424	C	S	.	.	H	α-helix	trans	-66.7	-34.2	178.5	0	0	0	0	0	113.7	W813 L814 R815 I819 F849 L850	W813-A817 WeakPolarHBondContact O-CB 3.47Å; W813-A817 PolarHBondContact O-N 3.42Å; L814-A817 PolarHBondContact O-N 3.33Å; R815-A817 VanDerWaalsContact C-N 3.32Å; R815-A817 PolarHBondContact O-N 3.2Å; A817-I819 VanDerWaalsContact C-N 3.33Å; A817-F849 HydrophobicContact CB-CD1 4.36Å; A817-F849 HydrophobicContact CB-CE1 3.92Å; A817-L850 HydrophobicContact CB-CD2 3.6Å
818	N	46.7	Very low	49.9	Very low	132 Å²	132	79.8 Å²	79.8	71%	0.706	43%	0.434	S	S	*	.	H	α-helix	trans	-77.7	-12.2	-178.2	-78.5	-6	0	0	0	114.3	L814 R815 L816 G820	L814-N818 WeakPolarHBondContact O-CB 3.41Å; L814-N818 VanDerWaalsContact O-CG 3.28Å; L814-N818 PolarHBondContact O-N 3.09Å; R815-N818 PolarHBondContact O-N 3.28Å; L816-N818 PolarHBondContact O-N 2.7Å; N818-G820 PolarHBondContact O-N 3.48Å
819	I	50.9	Low	50.9	Low	88 Å²	88	72.7 Å²	72.7	45%	0.451	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-24.4	174.9	-69.7	168.2	0	0	0	111.5	R815 L816 A817 L824	R815-I819 PolarHBondContact O-N 3.36Å; L816-I819 PolarHBondContact O-N 2.7Å; A817-I819 VanDerWaalsContact C-N 3.33Å; I819-L824 HydrophobicContact CG2-CD2 4.28Å
820	G	43	Very low	51.7	Low	18 Å²	18	71.5 Å²	71.5	19%	0.186	39%	0.392	C	S	.	.			trans	78.5	136	-174	0	0	0	0	0	111.9	N818 D822	N818-G820 PolarHBondContact O-N 3.48Å; G820-D822 PolarHBondContact O-N 2.76Å
821	C	49	Very low	52.2	Low	17 Å²	17	67.9 Å²	67.9	12%	0.115	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-73.8	-5.1	-177.6	-65	0	0	0	0	113.9	N823 A857	C821-N823 VanDerWaalsContact C-N 3.35Å; C821-A857 HydrophobicContact CB-CB 3.88Å
822	D	48.7	Very low	52.8	Low	124 Å²	124	62.8 Å²	62.8	66%	0.663	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-83.8	-11.2	-173.3	-46.9	-61.6	0	0	0	112.9	G820 N860	G820-D822 PolarHBondContact O-N 2.76Å; D822-N860 PolarHBondContact OD1-ND2 3.42Å
823	N	48.9	Very low	53.5	Low	132 Å²	132	63.5 Å²	63.5	71%	0.706	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-118.4	9.4	-179.5	-68.1	-49.3	0	0	0	114.1	C821	C821-N823 VanDerWaalsContact C-N 3.35Å
824	L	56.4	Low	53.9	Low	51 Å²	51	68.6 Å²	68.6	27%	0.267	38%	0.38	S	S	.	.			trans	-88.1	136.1	-177.7	-70.3	172.8	0	0	0	112.1	I819 L829	I819-L824 HydrophobicContact CG2-CD2 4.28Å; L824-L829 HydrophobicContact CB-CD1 4.32Å; L824-L829 HydrophobicContact CB-CD2 4.32Å; L824-L829 HydrophobicContact CB-CG 3.93Å; L824-L829 HydrophobicContact CD1-CD2 3.89Å; L824-L829 HydrophobicContact CD1-CG 4.37Å
825	S	63.2	Low	54.4	Low	58 Å²	58	65.7 Å²	65.7	41%	0.406	36%	0.364	S	S	.	.			trans	-66.1	156.8	171	80.4	0	0	0	0	111.5	S827 S828 L829	S825-S827 VanDerWaalsContact C-N 3.26Å; S825-S827 PolarHBondContact O-N 2.92Å; S825-S828 WeakPolarHBondContact O-CB 3.39Å; S825-S828 PolarHBondContact O-N 3.45Å; S825-S828 PolarHBondContact OG-N 2.68Å; S825-S828 VanDerWaalsContact OG-N 3.07Å; S825-S828 PolarHBondContact OG-OG 3.37Å; S825-L829 PolarHBondContact O-N 2.98Å
826	S	55.6	Low	55.4	Low	75 Å²	75	60.1 Å²	60.1	52%	0.524	34%	0.343	S	S	.	.	H	α-helix	trans	-57.2	-40.8	174.8	54.7	0	0	0	0	111.8	S828 L829 T830	S826-S828 VanDerWaalsContact C-N 3.33Å; S826-S828 PolarHBondContact O-N 2.82Å; S826-L829 PolarHBondContact O-N 2.98Å; S826-L829 VanDerWaalsContact O-N 3.16Å; S826-T830 PolarHBondContact O-N 2.98Å; S826-T830 PolarHBondContact O-OG1 3.49Å; S826-T830 VanDerWaalsContact O-OG1 3.09Å
827	S	53.4	Low	56.1	Low	87 Å²	87	63.9 Å²	63.9	61%	0.608	36%	0.36	S	S	*	.	H	α-helix	trans	-57.6	-43.3	173.4	-46.6	0	0	0	0	112.6	S825 L829 T830 A831	S825-S827 VanDerWaalsContact C-N 3.26Å; S825-S827 PolarHBondContact O-N 2.92Å; S827-L829 VanDerWaalsContact C-N 3.34Å; S827-T830 PolarHBondContact O-N 2.9Å; S827-A831 PolarHBondContact O-N 3.05Å; S827-A831 VanDerWaalsContact O-N 3.09Å
828	S	56.4	Low	56.4	Low	44 Å²	44	70.2 Å²	70.2	31%	0.308	39%	0.392	S	S	.	.	H	α-helix	trans	-65.7	-36.6	176.7	-51.6	0	0	0	0	112	S825 S826 F832	S825-S828 WeakPolarHBondContact O-CB 3.39Å; S825-S828 PolarHBondContact O-N 3.45Å; S825-S828 PolarHBondContact OG-N 2.68Å; S825-S828 VanDerWaalsContact OG-N 3.07Å; S825-S828 PolarHBondContact OG-OG 3.37Å; S826-S828 VanDerWaalsContact C-N 3.33Å; S826-S828 PolarHBondContact O-N 2.82Å; S828-F832 WeakPolarHBondContact O-CB 3.27Å; S828-F832 PolarHBondContact O-N 3.11Å
829	L	61.1	Low	56.9	Low	16 Å²	16	64.7 Å²	64.7	8%	0.084	36%	0.363	C	S	.	.	H	α-helix	trans	-72.6	-37.5	177	-78.7	170	0	0	0	112.8	L824 S825 S826 S827 F832 H833 A857 L861	L824-L829 HydrophobicContact CB-CD1 4.32Å; L824-L829 HydrophobicContact CB-CD2 4.32Å; L824-L829 HydrophobicContact CB-CG 3.93Å; L824-L829 HydrophobicContact CD1-CD2 3.89Å; L824-L829 HydrophobicContact CD1-CG 4.37Å; S825-L829 PolarHBondContact O-N 2.98Å; S826-L829 PolarHBondContact O-N 2.98Å; S826-L829 VanDerWaalsContact O-N 3.16Å; S827-L829 VanDerWaalsContact C-N 3.34Å; L829-F832 PolarHBondContact O-N 3.05Å; L829-H833 WeakPolarHBondContact O-CB 3.48Å; L829-H833 PolarHBondContact O-N 3.36Å; L829-A857 HydrophobicContact CD1-CB 4.36Å; L829-A857 HydrophobicContact CD2-CB 3.56Å; L829-L861 HydrophobicContact CB-CD1 4.13Å; L829-L861 HydrophobicContact CD1-CD1 3.89Å; L829-L861 HydrophobicContact CD1-CD2 4.35Å; L829-L861 HydrophobicContact CD1-CG 4.02Å
830	T	62.9	Low	57.7	Low	80 Å²	80	65.6 Å²	65.6	49%	0.491	37%	0.369	S	S	.	.	H	α-helix	trans	-61.9	-47.5	172.7	-56.2	0	0	0	0	110.9	S826 S827 F832 H833 E834	S826-T830 PolarHBondContact O-N 2.98Å; S826-T830 PolarHBondContact O-OG1 3.49Å; S826-T830 VanDerWaalsContact O-OG1 3.09Å; S827-T830 PolarHBondContact O-N 2.9Å; T830-F832 VanDerWaalsContact C-N 3.34Å; T830-F832 PolarHBondContact O-N 2.96Å; T830-H833 WeakPolarHBondContact O-CB 3.38Å; T830-H833 PolarHBondContact O-N 2.84Å; T830-H833 VanDerWaalsContact O-N 3.16Å; T830-E834 PolarHBondContact O-N 3.38Å
831	A	59.5	Low	58.5	Low	20 Å²	20	74.3 Å²	74.3	17%	0.165	40%	0.396	C	S	.	.	H	α-helix	trans	-60.5	-41.4	175.7	0	0	0	0	0	112.3	W804 S827 H833 E834 L835	W804-A831 HydrophobicContact CH2-CB 4.41Å; W804-A831 HydrophobicContact CZ2-CB 4.3Å; S827-A831 PolarHBondContact O-N 3.05Å; S827-A831 VanDerWaalsContact O-N 3.09Å; A831-H833 VanDerWaalsContact C-N 3.33Å; A831-H833 PolarHBondContact O-N 2.79Å; A831-E834 PolarHBondContact O-N 3.04Å; A831-L835 WeakPolarHBondContact O-CB 3.33Å; A831-L835 WeakPolarHBondContact O-CD1 3.45Å; A831-L835 WeakPolarHBondContact O-CG 3.44Å; A831-L835 PolarHBondContact O-N 2.93Å
832	F	59.2	Low	58.7	Low	17 Å²	17	79.4 Å²	79.4	8%	0.075	42%	0.419	C	S	.	.	H	α-helix	trans	-64.6	-36.1	176	-165.4	-107.5	0	0	0	112.5	W813 L816 S828 L829 T830 W836 L854	W813-F832 AromaticContact CE3-CE2 3.81Å; W813-F832 HydrophobicContact CE3-CE2 3.81Å; W813-F832 HydrophobicContact CE3-CZ 4.15Å; W813-F832 HydrophobicContact CZ3-CD2 4.17Å; W813-F832 AromaticContact CZ3-CE2 3.52Å; W813-F832 HydrophobicContact CZ3-CE2 3.52Å; W813-F832 AromaticContact CZ3-CZ 3.88Å; W813-F832 HydrophobicContact CZ3-CZ 3.88Å; L816-F832 HydrophobicContact CB-CE2 4.07Å; L816-F832 HydrophobicContact CD1-CD2 4.36Å; L816-F832 HydrophobicContact CD1-CE2 4.12Å; S828-F832 WeakPolarHBondContact O-CB 3.27Å; S828-F832 PolarHBondContact O-N 3.11Å; L829-F832 PolarHBondContact O-N 3.05Å; T830-F832 VanDerWaalsContact C-N 3.34Å; T830-F832 PolarHBondContact O-N 2.96Å; F832-W836 VanDerWaalsContact O-CB 3.31Å; F832-W836 WeakPolarHBondContact O-CB 3.34Å; F832-W836 PolarHBondContact O-N 2.82Å; F832-L854 HydrophobicContact CD1-CD1 3.93Å; F832-L854 HydrophobicContact CD1-CD2 4.24Å; F832-L854 HydrophobicContact CD1-CG 3.81Å; F832-L854 HydrophobicContact CE1-CD1 3.67Å; F832-L854 HydrophobicContact CE1-CG 3.72Å
833	H	59.6	Low	59.3	Low	65 Å²	65	75.1 Å²	75.1	30%	0.301	39%	0.394	S	S	.	.	H	α-helix	trans	-68.3	-42.7	174.6	173.1	-106.3	0	0	0	112.4	L829 T830 A831 W836 Q837	L829-H833 WeakPolarHBondContact O-CB 3.48Å; L829-H833 PolarHBondContact O-N 3.36Å; T830-H833 WeakPolarHBondContact O-CB 3.38Å; T830-H833 PolarHBondContact O-N 2.84Å; T830-H833 VanDerWaalsContact O-N 3.16Å; A831-H833 VanDerWaalsContact C-N 3.33Å; A831-H833 PolarHBondContact O-N 2.79Å; H833-W836 WeakPolarHBondContact O-CB 3.39Å; H833-W836 PolarHBondContact O-N 3.48Å; H833-Q837 PolarHBondContact CE1-NE2 3.41Å; H833-Q837 PolarHBondContact NE2-NE2 2.87Å; H833-Q837 WeakPolarHBondContact O-CG 3.12Å; H833-Q837 PolarHBondContact O-N 3.36Å
834	E	61.4	Low	60.1	Low	121 Å²	121	73 Å²	73	57%	0.565	38%	0.376	S	S	*	.	H	α-helix	trans	-61.8	-47.7	174.6	-71.1	-175.6	152.5	0	0	111.7	T830 A831 W836 Q837 L838	T830-E834 PolarHBondContact O-N 3.38Å; A831-E834 PolarHBondContact O-N 3.04Å; E834-W836 VanDerWaalsContact C-N 3.28Å; E834-W836 PolarHBondContact O-N 3.47Å; E834-Q837 PolarHBondContact O-N 3.03Å; E834-L838 WeakPolarHBondContact O-CG 3.49Å; E834-L838 PolarHBondContact O-N 3.43Å
835	L	59.8	Low	60.3	Low	30 Å²	30	77.3 Å²	77.3	16%	0.157	39%	0.392	C	S	.	.	H	α-helix	trans	-62.1	-34.6	176.2	-70.8	162.8	0	0	0	112.4	W804 L807 W813 A831 L838 S839	W804-L835 HydrophobicContact CD2-CD1 4.07Å; W804-L835 HydrophobicContact CE3-CD1 3.32Å; W804-L835 HydrophobicContact CZ3-CD1 3.76Å; L807-L835 HydrophobicContact CD1-CD1 3.84Å; L807-L835 HydrophobicContact CD1-CD2 4.37Å; W813-L835 HydrophobicContact CH2-CB 3.94Å; W813-L835 HydrophobicContact CZ2-CB 4.43Å; A831-L835 WeakPolarHBondContact O-CB 3.33Å; A831-L835 WeakPolarHBondContact O-CD1 3.45Å; A831-L835 WeakPolarHBondContact O-CG 3.44Å; A831-L835 PolarHBondContact O-N 2.93Å; L835-L838 PolarHBondContact O-N 2.92Å; L835-S839 WeakPolarHBondContact O-CB 3.5Å; L835-S839 PolarHBondContact O-N 3.33Å
836	W	69.8	Low	59.7	Low	39 Å²	39	80.5 Å²	80.5	15%	0.148	41%	0.405	C	S	.	.	H	α-helix	trans	-65.9	-39	171.8	-179.5	-102	0	0	0	112.5	F832 H833 E834 L838 S839 F843 R844 L850 A851 L854	F832-W836 VanDerWaalsContact O-CB 3.31Å; F832-W836 WeakPolarHBondContact O-CB 3.34Å; F832-W836 PolarHBondContact O-N 2.82Å; H833-W836 WeakPolarHBondContact O-CB 3.39Å; H833-W836 PolarHBondContact O-N 3.48Å; E834-W836 VanDerWaalsContact C-N 3.28Å; E834-W836 PolarHBondContact O-N 3.47Å; W836-L838 VanDerWaalsContact C-N 3.34Å; W836-S839 PolarHBondContact O-N 3.06Å; W836-S839 PolarHBondContact O-OG 3.33Å; W836-F843 HydrophobicContact CZ3-CE1 4.26Å; W836-R844 HydrophobicContact CD2-CG 4.17Å; W836-R844 HydrophobicContact CE3-CG 4.26Å; W836-R844 HydrophobicContact CH2-CB 4.14Å; W836-R844 HydrophobicContact CH2-CG 3.9Å; W836-R844 HydrophobicContact CZ2-CB 4.08Å; W836-R844 HydrophobicContact CZ2-CG 3.79Å; W836-R844 HydrophobicContact CZ3-CG 4.13Å; W836-R844 WeakPolarHBondContact O-CD 3.3Å; W836-R844 PolarHBondContact O-NE 2.9Å; W836-R844 PolarHBondContact O-NH1 3.2Å; W836-L850 HydrophobicContact CH2-CB 4.28Å; W836-L850 HydrophobicContact CZ3-CB 3.71Å; W836-L850 HydrophobicContact CZ3-CD1 4.33Å; W836-A851 HydrophobicContact CH2-CB 3.84Å; W836-A851 HydrophobicContact CZ2-CB 3.79Å; W836-L854 HydrophobicContact CB-CD1 3.69Å; W836-L854 HydrophobicContact CD2-CD1 3.42Å; W836-L854 VanDerWaalsContact CD2-CD1 3.42Å; W836-L854 HydrophobicContact CE3-CD1 3.82Å; W836-L854 HydrophobicContact CG-CD1 3.37Å
837	Q	64.1	Low	60.1	Low	118 Å²	118	78.7 Å²	78.7	55%	0.551	39%	0.39	S	S	*	.	H	α-helix	trans	-66.2	-37.1	175	-63	-137.8	8.6	0	0	112.4	H833 E834 R844	H833-Q837 PolarHBondContact CE1-NE2 3.41Å; H833-Q837 PolarHBondContact NE2-NE2 2.87Å; H833-Q837 WeakPolarHBondContact O-CG 3.12Å; H833-Q837 PolarHBondContact O-N 3.36Å; E834-Q837 PolarHBondContact O-N 3.03Å; Q837-R844 PolarHBondContact O-NH1 3.32Å; Q837-R844 PolarHBondContact O-NH2 2.9Å
838	L	53.9	Low	60.6	Low	143 Å²	143	79.4 Å²	79.4	75%	0.749	39%	0.386	S	S	*	.	H	α-helix	trans	-73.7	-23.4	176.9	-67.1	169	0	0	0	114	E834 L835 W836	E834-L838 WeakPolarHBondContact O-CG 3.49Å; E834-L838 PolarHBondContact O-N 3.43Å; L835-L838 PolarHBondContact O-N 2.92Å; W836-L838 VanDerWaalsContact C-N 3.34Å
839	S	57.9	Low	60.8	Low	15 Å²	15	82.7 Å²	82.7	11%	0.105	40%	0.395	C	S	.	.	S	Bend	trans	-66.6	152.1	-176.5	70	0	0	0	0	114.3	L835 W836 R844	L835-S839 WeakPolarHBondContact O-CB 3.5Å; L835-S839 PolarHBondContact O-N 3.33Å; W836-S839 PolarHBondContact O-N 3.06Å; W836-S839 PolarHBondContact O-OG 3.33Å; S839-R844 PolarHBondContact O-NE 3.36Å; S839-R844 PolarHBondContact O-NH2 2.81Å; S839-R844 WeakPolarHBondContact OG-CD 3.41Å; S839-R844 WeakPolarHBondContact OG-CG 3.41Å
840	D	67	Low	60.8	Low	108 Å²	108	82.1 Å²	82.1	58%	0.578	39%	0.392	S	S	*	.			trans	-58	149.1	-177.1	-159.4	-50.6	0	0	0	112.7	E842 F843 R844	D840-E842 PolarHBondContact O-N 3.46Å; D840-E842 PolarHBondContact OD1-N 3.33Å; D840-F843 HydrophobicContact CB-CB 4.01Å; D840-F843 PolarHBondContact O-N 2.95Å; D840-R844 WeakPolarHBondContact O-CG 3.35Å; D840-R844 PolarHBondContact O-N 2.88Å
841	R	60.5	Low	60.8	Low	200 Å²	200	79.6 Å²	79.6	76%	0.755	38%	0.379	S	S	*	.	H	α-helix	trans	-61.4	-29.2	172.1	-155.3	177.5	-166.7	-171	5	112	K845	R841-K845 VanDerWaalsContact O-CG 3.28Å; R841-K845 WeakPolarHBondContact O-CG 3.48Å; R841-K845 PolarHBondContact O-N 2.89Å
842	E	53.6	Low	60.9	Low	125 Å²	125	81.4 Å²	81.4	58%	0.584	39%	0.391	S	S	*	.	H	α-helix	trans	-74.8	-43.7	170.7	-61.9	-136.8	135.5	0	0	112.2	D840 R844 K845 N846	D840-E842 PolarHBondContact O-N 3.46Å; D840-E842 PolarHBondContact OD1-N 3.33Å; E842-R844 VanDerWaalsContact C-N 3.28Å; E842-R844 PolarHBondContact O-N 3.37Å; E842-K845 PolarHBondContact O-N 3.06Å; E842-K845 VanDerWaalsContact O-N 3.14Å; E842-N846 PolarHBondContact O-N 3.22Å; E842-N846 PolarHBondContact O-ND2 3.39Å
843	F	60.7	Low	61	Low	33 Å²	33	81.8 Å²	81.8	15%	0.145	39%	0.393	C	S	.	.	H	α-helix	trans	-56.7	-43.2	176.6	-180	-90.6	0	0	0	111.7	N810 W813 W836 D840 N846 N847 L850	N810-F843 WeakPolarHBondContact OD1-CE2 3.47Å; W813-F843 HydrophobicContact CB-CZ 4Å; W813-F843 AromaticContact CD1-CE2 3.92Å; W813-F843 AromaticContact CD1-CZ 3.7Å; W813-F843 AromaticContact CD2-CE1 3.99Å; W813-F843 HydrophobicContact CD2-CE1 3.99Å; W813-F843 HydrophobicContact CD2-CE2 4.44Å; W813-F843 AromaticContact CD2-CZ 3.49Å; W813-F843 HydrophobicContact CD2-CZ 3.49Å; W813-F843 VanDerWaalsContact CD2-CZ 3.49Å; W813-F843 AromaticContact CE2-CZ 3.74Å; W813-F843 HydrophobicContact CE3-CE1 4.2Å; W813-F843 HydrophobicContact CE3-CZ 4.05Å; W813-F843 HydrophobicContact CG-CE1 4.41Å; W813-F843 HydrophobicContact CG-CE2 4.07Å; W813-F843 AromaticContact CG-CZ 3.47Å; W813-F843 HydrophobicContact CG-CZ 3.47Å; W813-F843 VanDerWaalsContact CG-CZ 3.47Å; W813-F843 HydrophobicContact CH2-CE1 4.47Å; W813-F843 HydrophobicContact CZ2-CE1 4.29Å; W813-F843 HydrophobicContact CZ2-CZ 4.44Å; W813-F843 HydrophobicContact CZ3-CE1 4.44Å; W813-F843 AromaticContact NE1-CZ 3.86Å; W836-F843 HydrophobicContact CZ3-CE1 4.26Å; D840-F843 HydrophobicContact CB-CB 4.01Å; D840-F843 PolarHBondContact O-N 2.95Å; F843-N846 PolarHBondContact O-N 3.5Å; F843-N847 WeakPolarHBondContact CD2-ND2 3.33Å; F843-N847 WeakPolarHBondContact CE2-ND2 3.4Å; F843-N847 WeakPolarHBondContact O-CB 3.49Å; F843-N847 PolarHBondContact O-N 3.3Å; F843-N847 VanDerWaalsContact O-N 3.07Å; F843-N847 PolarHBondContact O-ND2 3.19Å; F843-L850 HydrophobicContact CE1-CD1 3.77Å; F843-L850 HydrophobicContact CZ-CD1 3.58Å
844	R	66.2	Low	61.1	Low	89 Å²	89	79.5 Å²	79.5	34%	0.336	38%	0.383	S	S	.	.	H	α-helix	trans	-68.9	-31.8	177.4	-71.3	-174.7	-95.4	-170.3	-10.4	114.2	W836 Q837 S839 D840 E842	W836-R844 HydrophobicContact CD2-CG 4.17Å; W836-R844 HydrophobicContact CE3-CG 4.26Å; W836-R844 HydrophobicContact CH2-CB 4.14Å; W836-R844 HydrophobicContact CH2-CG 3.9Å; W836-R844 HydrophobicContact CZ2-CB 4.08Å; W836-R844 HydrophobicContact CZ2-CG 3.79Å; W836-R844 HydrophobicContact CZ3-CG 4.13Å; W836-R844 WeakPolarHBondContact O-CD 3.3Å; W836-R844 PolarHBondContact O-NE 2.9Å; W836-R844 PolarHBondContact O-NH1 3.2Å; Q837-R844 PolarHBondContact O-NH1 3.32Å; Q837-R844 PolarHBondContact O-NH2 2.9Å; S839-R844 PolarHBondContact O-NE 3.36Å; S839-R844 PolarHBondContact O-NH2 2.81Å; S839-R844 WeakPolarHBondContact OG-CD 3.41Å; S839-R844 WeakPolarHBondContact OG-CG 3.41Å; D840-R844 WeakPolarHBondContact O-CG 3.35Å; D840-R844 PolarHBondContact O-N 2.88Å; E842-R844 VanDerWaalsContact C-N 3.28Å; E842-R844 PolarHBondContact O-N 3.37Å
845	K	60.8	Low	61.3	Low	140 Å²	140	77.7 Å²	77.7	61%	0.609	38%	0.379	S	S	*	.	H	α-helix	trans	-68.3	-46.7	172.1	-75.6	169	179.1	-179.7	0	111.4	R841 E842	R841-K845 VanDerWaalsContact O-CG 3.28Å; R841-K845 WeakPolarHBondContact O-CG 3.48Å; R841-K845 PolarHBondContact O-N 2.89Å; E842-K845 PolarHBondContact O-N 3.06Å; E842-K845 VanDerWaalsContact O-N 3.14Å
846	N	50.5	Low	61.2	Low	125 Å²	125	81 Å²	81	67%	0.668	39%	0.392	S	S	*	.	H	α-helix	trans	-77.8	-24.9	-170.6	-66.2	-21.7	0	0	0	113	E842 F843	E842-N846 PolarHBondContact O-N 3.22Å; E842-N846 PolarHBondContact O-ND2 3.39Å; F843-N846 PolarHBondContact O-N 3.5Å
847	N	63.2	Low	60.5	Low	38 Å²	38	79.2 Å²	79.2	20%	0.203	39%	0.386	C	S	.	.			trans	-102.5	56.9	-179.2	-69	-74.8	0	0	0	113.5	F843 F849 L850 A851	F843-N847 WeakPolarHBondContact CD2-ND2 3.33Å; F843-N847 WeakPolarHBondContact CE2-ND2 3.4Å; F843-N847 WeakPolarHBondContact O-CB 3.49Å; F843-N847 PolarHBondContact O-N 3.3Å; F843-N847 VanDerWaalsContact O-N 3.07Å; F843-N847 PolarHBondContact O-ND2 3.19Å; N847-F849 PolarHBondContact O-N 3.24Å; N847-F849 VanDerWaalsContact O-N 3.1Å; N847-L850 HydrophobicContact CB-CB 4.16Å; N847-L850 HydrophobicContact CB-CD1 3.64Å; N847-L850 HydrophobicContact CB-CG 3.9Å; N847-L850 WeakPolarHBondContact O-CB 3.35Å; N847-L850 PolarHBondContact O-N 3.34Å; N847-A851 PolarHBondContact O-N 3.4Å
848	L	64.7	Low	60.1	Low	102 Å²	102	78 Å²	78	53%	0.534	38%	0.38	S	S	.	.	H	α-helix	trans	-57.7	-26	178.5	-150.4	76.3	0	0	0	113.4	F232 A851 S852	F232-L848 HydrophobicContact CD2-CD2 4.44Å; L848-A851 PolarHBondContact O-N 2.94Å; L848-S852 PolarHBondContact O-N 3.2Å
849	F	60.7	Low	60.1	Low	113 Å²	113	75.8 Å²	75.8	50%	0.496	37%	0.366	S	S	.	.	H	α-helix	trans	-64.5	-45.5	172.6	-179	-111.4	0	0	0	112.6	A817 N847 A851 S852 Q853	A817-F849 HydrophobicContact CB-CD1 4.36Å; A817-F849 HydrophobicContact CB-CE1 3.92Å; N847-F849 PolarHBondContact O-N 3.24Å; N847-F849 VanDerWaalsContact O-N 3.1Å; F849-A851 VanDerWaalsContact C-N 3.31Å; F849-A851 PolarHBondContact O-N 3.17Å; F849-S852 WeakPolarHBondContact O-CB 3.22Å; F849-S852 PolarHBondContact O-N 3.14Å; F849-Q853 HydrophobicContact CE1-CG 4.29Å; F849-Q853 HydrophobicContact CE2-CG 4.32Å; F849-Q853 HydrophobicContact CZ-CG 4.15Å; F849-Q853 WeakPolarHBondContact O-CG 3.45Å; F849-Q853 PolarHBondContact O-N 3.29Å
850	L	61.2	Low	59.7	Low	4 Å²	4	77.9 Å²	77.9	2%	0.021	38%	0.376	C	S	.	.	H	α-helix	trans	-62	-41.8	175.8	-63.5	179.3	0	0	0	110.8	W813 A817 W836 F843 N847 S852 Q853 L854	W813-L850 HydrophobicContact CB-CD1 4.14Å; W813-L850 HydrophobicContact CD2-CD1 4.34Å; W813-L850 HydrophobicContact CE3-CD1 3.84Å; A817-L850 HydrophobicContact CB-CD2 3.6Å; W836-L850 HydrophobicContact CH2-CB 4.28Å; W836-L850 HydrophobicContact CZ3-CB 3.71Å; W836-L850 HydrophobicContact CZ3-CD1 4.33Å; F843-L850 HydrophobicContact CE1-CD1 3.77Å; F843-L850 HydrophobicContact CZ-CD1 3.58Å; N847-L850 HydrophobicContact CB-CB 4.16Å; N847-L850 HydrophobicContact CB-CD1 3.64Å; N847-L850 HydrophobicContact CB-CG 3.9Å; N847-L850 WeakPolarHBondContact O-CB 3.35Å; N847-L850 PolarHBondContact O-N 3.34Å; L850-S852 VanDerWaalsContact C-N 3.33Å; L850-S852 PolarHBondContact O-N 2.88Å; L850-Q853 PolarHBondContact O-N 3.3Å; L850-L854 WeakPolarHBondContact O-CB 3.37Å; L850-L854 PolarHBondContact O-N 3.21Å
851	A	62.1	Low	58.9	Low	26 Å²	26	75.3 Å²	75.3	22%	0.215	36%	0.362	C	S	.	.	H	α-helix	trans	-59.7	-41.7	174.8	0	0	0	0	0	112.2	W836 N847 L848 F849 L854 V855	W836-A851 HydrophobicContact CH2-CB 3.84Å; W836-A851 HydrophobicContact CZ2-CB 3.79Å; N847-A851 PolarHBondContact O-N 3.4Å; L848-A851 PolarHBondContact O-N 2.94Å; F849-A851 VanDerWaalsContact C-N 3.31Å; F849-A851 PolarHBondContact O-N 3.17Å; A851-L854 PolarHBondContact O-N 2.86Å; A851-V855 WeakPolarHBondContact O-CG2 3.27Å; A851-V855 PolarHBondContact O-N 2.96Å
852	S	62.1	Low	58.3	Low	59 Å²	59	69.8 Å²	69.8	41%	0.413	35%	0.348	S	S	.	.	H	α-helix	trans	-64.5	-41.9	176.3	-175.6	0	0	0	0	112.6	L848 F849 L850 V855 K856	L848-S852 PolarHBondContact O-N 3.2Å; F849-S852 WeakPolarHBondContact O-CB 3.22Å; F849-S852 PolarHBondContact O-N 3.14Å; L850-S852 VanDerWaalsContact C-N 3.33Å; L850-S852 PolarHBondContact O-N 2.88Å; S852-V855 PolarHBondContact O-N 2.9Å; S852-K856 PolarHBondContact O-N 3.18Å
853	Q	60.8	Low	57.8	Low	25 Å²	25	68.6 Å²	68.6	12%	0.117	35%	0.345	C	S	.	.	H	α-helix	trans	-67.7	-39.5	177.6	-64.5	-70.9	86.2	0	0	111.4	F849 L850 V855 K856 A857	F849-Q853 HydrophobicContact CE1-CG 4.29Å; F849-Q853 HydrophobicContact CE2-CG 4.32Å; F849-Q853 HydrophobicContact CZ-CG 4.15Å; F849-Q853 WeakPolarHBondContact O-CG 3.45Å; F849-Q853 PolarHBondContact O-N 3.29Å; L850-Q853 PolarHBondContact O-N 3.3Å; Q853-V855 PolarHBondContact O-N 2.97Å; Q853-K856 PolarHBondContact O-N 3.11Å; Q853-A857 WeakPolarHBondContact O-CB 3.33Å; Q853-A857 PolarHBondContact O-N 2.9Å
854	L	62.3	Low	56.5	Low	17 Å²	17	72 Å²	72	9%	0.089	37%	0.365	C	S	.	.	H	α-helix	trans	-58.9	-44.2	170.9	-111.2	154.1	0	0	0	112.5	F832 W836 L850 A851 A857 H858	F832-L854 HydrophobicContact CD1-CD1 3.93Å; F832-L854 HydrophobicContact CD1-CD2 4.24Å; F832-L854 HydrophobicContact CD1-CG 3.81Å; F832-L854 HydrophobicContact CE1-CD1 3.67Å; F832-L854 HydrophobicContact CE1-CG 3.72Å; W836-L854 HydrophobicContact CB-CD1 3.69Å; W836-L854 HydrophobicContact CD2-CD1 3.42Å; W836-L854 VanDerWaalsContact CD2-CD1 3.42Å; W836-L854 HydrophobicContact CE3-CD1 3.82Å; W836-L854 HydrophobicContact CG-CD1 3.37Å; L850-L854 WeakPolarHBondContact O-CB 3.37Å; L850-L854 PolarHBondContact O-N 3.21Å; A851-L854 PolarHBondContact O-N 2.86Å; L854-A857 PolarHBondContact O-N 2.94Å; L854-H858 WeakPolarHBondContact O-CB 3.32Å; L854-H858 PolarHBondContact O-N 3.42Å
855	V	64.5	Low	55.1	Low	82 Å²	82	72 Å²	72	50%	0.497	37%	0.374	S	S	.	.	H	α-helix	trans	-63	-42.2	177.3	168	0	0	0	0	111.6	A851 S852 Q853 H858 Q859	A851-V855 WeakPolarHBondContact O-CG2 3.27Å; A851-V855 PolarHBondContact O-N 2.96Å; S852-V855 PolarHBondContact O-N 2.9Å; Q853-V855 PolarHBondContact O-N 2.97Å; V855-H858 PolarHBondContact O-N 3.14Å; V855-Q859 VanDerWaalsContact O-CG 3.3Å; V855-Q859 WeakPolarHBondContact O-CG 3.27Å; V855-Q859 PolarHBondContact O-N 3.34Å
856	K	58.2	Low	53.7	Low	99 Å²	99	71.6 Å²	71.6	43%	0.43	38%	0.378	S	S	.	.	H	α-helix	trans	-62.4	-44.5	173.4	-69.2	177.6	-169.2	166.5	0	112	S852 Q853 H858 Q859 N860	S852-K856 PolarHBondContact O-N 3.18Å; Q853-K856 PolarHBondContact O-N 3.11Å; K856-H858 VanDerWaalsContact C-N 3.32Å; K856-H858 PolarHBondContact O-N 2.76Å; K856-Q859 WeakPolarHBondContact O-CB 3.47Å; K856-Q859 PolarHBondContact O-N 3.4Å; K856-Q859 VanDerWaalsContact O-N 3.14Å; K856-N860 PolarHBondContact O-N 2.86Å
857	A	56	Low	52.7	Low	2 Å²	2	69 Å²	69	2%	0.017	37%	0.37	C	S	.	.	H	α-helix	trans	-62.8	-39.6	178.9	0	0	0	0	0	112.2	C821 L829 Q853 L854 Q859 N860 L861	C821-A857 HydrophobicContact CB-CB 3.88Å; L829-A857 HydrophobicContact CD1-CB 4.36Å; L829-A857 HydrophobicContact CD2-CB 3.56Å; Q853-A857 WeakPolarHBondContact O-CB 3.33Å; Q853-A857 PolarHBondContact O-N 2.9Å; L854-A857 PolarHBondContact O-N 2.94Å; A857-Q859 VanDerWaalsContact C-N 3.31Å; A857-Q859 PolarHBondContact O-N 2.97Å; A857-N860 PolarHBondContact O-N 3.49Å; A857-L861 PolarHBondContact O-N 3.43Å
858	H	54.6	Low	51.1	Low	92 Å²	92	72 Å²	72	43%	0.426	39%	0.39	S	S	.	.	H	α-helix	trans	-66.8	-32.6	174.7	-132.4	-50.9	0	0	0	112.6	L854 V855 K856 N862	L854-H858 WeakPolarHBondContact O-CB 3.32Å; L854-H858 PolarHBondContact O-N 3.42Å; V855-H858 PolarHBondContact O-N 3.14Å; K856-H858 VanDerWaalsContact C-N 3.32Å; K856-H858 PolarHBondContact O-N 2.76Å; H858-N862 WeakPolarHBondContact O-CB 3.29Å; H858-N862 PolarHBondContact O-N 3.47Å; H858-N862 PolarHBondContact O-OD1 3.44Å
859	Q	55.2	Low	49.4	Very low	98 Å²	98	73.6 Å²	73.6	46%	0.458	40%	0.399	S	S	.	.	H	α-helix	trans	-69.8	-42.5	171.8	-73	170.2	-20.4	0	0	111.5	V855 K856 A857 N862 N863	V855-Q859 VanDerWaalsContact O-CG 3.3Å; V855-Q859 WeakPolarHBondContact O-CG 3.27Å; V855-Q859 PolarHBondContact O-N 3.34Å; K856-Q859 WeakPolarHBondContact O-CB 3.47Å; K856-Q859 PolarHBondContact O-N 3.4Å; K856-Q859 VanDerWaalsContact O-N 3.14Å; A857-Q859 VanDerWaalsContact C-N 3.31Å; A857-Q859 PolarHBondContact O-N 2.97Å; Q859-N862 PolarHBondContact O-N 3.24Å; Q859-N863 WeakPolarHBondContact O-CB 3.24Å; Q859-N863 PolarHBondContact O-N 3Å; Q859-N863 PolarHBondContact O-ND2 3.25Å
860	N	49.9	Very low	47.8	Very low	59 Å²	59	75 Å²	75	32%	0.316	41%	0.412	S	S	.	.	H	α-helix	trans	-62.2	-43.7	174.8	-73.9	-3.6	0	0	0	111.7	D822 K856 A857 N863 L864	D822-N860 PolarHBondContact OD1-ND2 3.42Å; K856-N860 PolarHBondContact O-N 2.86Å; A857-N860 PolarHBondContact O-N 3.49Å; N860-N863 PolarHBondContact O-N 2.75Å; N860-L864 WeakPolarHBondContact O-CB 3.49Å; N860-L864 WeakPolarHBondContact O-CG 3.39Å; N860-L864 PolarHBondContact O-N 3.11Å
861	L	50.2	Low	46.2	Very low	54 Å²	54	82.5 Å²	82.5	28%	0.283	45%	0.452	S	S	.	.	H	α-helix	trans	-59.5	-47.4	173.7	-80.1	167.5	0	0	0	112.1	L829 A857 N863 L864 T865	L829-L861 HydrophobicContact CB-CD1 4.13Å; L829-L861 HydrophobicContact CD1-CD1 3.89Å; L829-L861 HydrophobicContact CD1-CD2 4.35Å; L829-L861 HydrophobicContact CD1-CG 4.02Å; A857-L861 PolarHBondContact O-N 3.43Å; L861-N863 VanDerWaalsContact C-N 3.34Å; L861-N863 PolarHBondContact O-N 2.81Å; L861-L864 PolarHBondContact O-N 3.08Å; L861-T865 PolarHBondContact O-N 2.95Å; L861-T865 PolarHBondContact O-OG1 3.24Å; L861-T865 VanDerWaalsContact O-OG1 3.06Å
862	N	47.5	Very low	44.5	Very low	84 Å²	84	84.5 Å²	84.5	45%	0.449	48%	0.475	S	S	.	.	H	α-helix	trans	-64.8	-38.1	179.1	-71.7	1.7	0	0	0	112.2	H858 Q859 T865 L866	H858-N862 WeakPolarHBondContact O-CB 3.29Å; H858-N862 PolarHBondContact O-N 3.47Å; H858-N862 PolarHBondContact O-OD1 3.44Å; Q859-N862 PolarHBondContact O-N 3.24Å; N862-T865 WeakPolarHBondContact CA-OG1 3.27Å; N862-T865 PolarHBondContact O-OG1 3.22Å; N862-L866 PolarHBondContact O-N 2.8Å; N862-L866 VanDerWaalsContact O-N 3.14Å
863	N	41.6	Very low	42.9	Very low	100 Å²	100	90 Å²	90	54%	0.535	50%	0.498	S	S	.	.	H	α-helix	trans	-66.7	-42.6	175.6	-70	-16.4	0	0	0	111.5	Q859 N860 L861 L866 S867	Q859-N863 WeakPolarHBondContact O-CB 3.24Å; Q859-N863 PolarHBondContact O-N 3Å; Q859-N863 PolarHBondContact O-ND2 3.25Å; N860-N863 PolarHBondContact O-N 2.75Å; L861-N863 VanDerWaalsContact C-N 3.34Å; L861-N863 PolarHBondContact O-N 2.81Å; N863-L866 PolarHBondContact O-N 3.01Å; N863-S867 PolarHBondContact O-N 3.38Å; N863-S867 PolarHBondContact O-OG 2.68Å
864	L	34.9	Very low	41.2	Very low	104 Å²	104	95.8 Å²	95.8	55%	0.545	53%	0.528	S	S	.	.	H	α-helix	trans	-63.3	-43.1	175.8	-76.7	164.2	0	0	0	111.8	N860 L861 L866 S867 T868	N860-L864 WeakPolarHBondContact O-CB 3.49Å; N860-L864 WeakPolarHBondContact O-CG 3.39Å; N860-L864 PolarHBondContact O-N 3.11Å; L861-L864 PolarHBondContact O-N 3.08Å; L864-L866 PolarHBondContact O-N 3.05Å; L864-S867 PolarHBondContact O-N 3.12Å; L864-S867 VanDerWaalsContact O-N 3.14Å; L864-S867 PolarHBondContact O-OG 3.07Å; L864-T868 VanDerWaalsContact O-CG2 3.27Å; L864-T868 WeakPolarHBondContact O-CG2 3.4Å; L864-T868 PolarHBondContact O-N 3.09Å; L864-T868 PolarHBondContact O-OG1 3.45Å
865	T	36.1	Very low	39.5	Very low	88 Å²	88	100.5 Å²	100.5	54%	0.54	56%	0.558	S	S	.	*	H	α-helix	trans	-68.9	-16.9	175.8	51.8	0	0	0	0	114.2	L861 N862	L861-T865 PolarHBondContact O-N 2.95Å; L861-T865 PolarHBondContact O-OG1 3.24Å; L861-T865 VanDerWaalsContact O-OG1 3.06Å; N862-T865 WeakPolarHBondContact CA-OG1 3.27Å; N862-T865 PolarHBondContact O-OG1 3.22Å
866	L	31.4	Very low	37.8	Very low	132 Å²	132	106 Å²	106	69%	0.691	58%	0.575	S	S	*	*	H	α-helix	trans	-91.3	-22	171	-78.7	166.5	0	0	0	112.8	N862 N863 L864	N862-L866 PolarHBondContact O-N 2.8Å; N862-L866 VanDerWaalsContact O-N 3.14Å; N863-L866 PolarHBondContact O-N 3.01Å; L864-L866 PolarHBondContact O-N 3.05Å
867	S	29.1	Very low	36.3	Very low	72 Å²	72	109.2 Å²	109.2	50%	0.503	60%	0.597	S	S	.	*	H	α-helix	trans	-91	-11.8	178.6	69.8	0	0	0	0	114.7	N863 L864 N869	N863-S867 PolarHBondContact O-N 3.38Å; N863-S867 PolarHBondContact O-OG 2.68Å; L864-S867 PolarHBondContact O-N 3.12Å; L864-S867 VanDerWaalsContact O-N 3.14Å; L864-S867 PolarHBondContact O-OG 3.07Å; S867-N869 PolarHBondContact O-N 2.7Å
868	T	29.5	Very low	35	Very low	101 Å²	101	117.4 Å²	117.4	62%	0.62	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	5.3	-176	49.8	0	0	0	0	115.7	L864	L864-T868 VanDerWaalsContact O-CG2 3.27Å; L864-T868 WeakPolarHBondContact O-CG2 3.4Å; L864-T868 PolarHBondContact O-N 3.09Å; L864-T868 PolarHBondContact O-OG1 3.45Å
869	N	29.1	Very low	33.9	Very low	135 Å²	135	119.2 Å²	119.2	72%	0.722	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.4	13.9	-171.8	-74.4	-23.4	0	0	0	115.2	S867	S867-N869 PolarHBondContact O-N 2.7Å
870	N	27.8	Very low	32.7	Very low	142 Å²	142	120.9 Å²	120.9	76%	0.759	66%	0.658	S	S	*	*	S	Bend	trans	-124.9	-3.7	-171.6	-84.2	-41.8	0	0	0	117
871	D	27	Very low	31.5	Very low	162 Å²	162	128.2 Å²	128.2	87%	0.866	68%	0.681	S	S	*	*	S	Bend	trans	-117.2	116	-176	-79.4	-60.4	0	0	0	114
872	G	27	Very low	30.4	Very low	67 Å²	67	132.7 Å²	132.7	69%	0.691	71%	0.706	S	S	*	*			trans	94.9	63.3	141	0	0	0	0	0	120.3
873	I	27.7	Very low	29.3	Very low	176 Å²	176	133.3 Å²	133.3	90%	0.903	72%	0.716	S	S	*	*			trans	-125	114.3	143.5	-60.7	-176.8	0	0	0	109.1
874	I	25.8	Very low	28.6	Very low	145 Å²	145	134.2 Å²	134.2	74%	0.744	73%	0.726	S	S	*	*			trans	-120.7	148.7	178.8	-48	179.6	0	0	0	109.2
875	T	27.4	Very low	28.2	Very low	117 Å²	117	137 Å²	137	72%	0.718	74%	0.736	S	S	*	*			trans	96.7	138.4	164.8	76.8	0	0	0	0	118.7
876	K	28.8	Very low	27.6	Very low	196 Å²	196	140.3 Å²	140.3	85%	0.852	75%	0.745	S	S	*	*			trans	74.2	78	158.3	-68.1	163.1	-175.6	175.1	0	117.8
877	N	24.9	Very low	27.4	Very low	167 Å²	167	142.9 Å²	142.9	89%	0.893	75%	0.754	S	S	*	*			trans	-118.4	103.8	140.3	-133.9	-5.5	0	0	0	108.5
878	E	29.7	Very low	27.3	Very low	174 Å²	174	143.2 Å²	143.2	81%	0.813	76%	0.756	S	S	*	*			trans	-143.8	103.5	164.1	-83.2	-160.6	147	0	0	108.8
879	N	30.8	Very low	27.2	Very low	130 Å²	130	147.9 Å²	147.9	70%	0.695	77%	0.768	S	S	*	*				179.4	141.1	106.6	-96.9	-68.4	0	0	0	113.3
880	I	30.1	Very low	27.2	Very low	133 Å²	133	146.1 Å²	146.1	68%	0.682	77%	0.766	S	S	*	*			trans	54.8	94	141.5	-59.2	166.2	0	0	0	116
881	R	25.9	Very low	27.4	Very low	213 Å²	213	145.3 Å²	145.3	80%	0.804	77%	0.766	S	S	*	*				78.2	124.6	76.4	-80.1	178.6	174	164	-1.1	115
882	N	26.5	Very low	27.8	Very low	149 Å²	149	141.9 Å²	141.9	80%	0.797	76%	0.755	S	S	*	*			trans	67.4	153	149.4	-56.3	8.5	0	0	0	116.3
883	S	25.1	Very low	28.3	Very low	96 Å²	96	145 Å²	145	67%	0.671	76%	0.756	S	S	*	*			cis	-170.7	151.3	-17.2	45.4	0	0	0	0	109.6
884	T	25.3	Very low	28.7	Very low	119 Å²	119	142.6 Å²	142.6	73%	0.73	75%	0.749	S	S	*	*			trans	33.3	105.9	151.6	55.3	0	0	0	0	120.2
885	H	26.5	Very low	29.1	Very low	163 Å²	163	141.3 Å²	141.3	76%	0.755	75%	0.75	S	S	*	*			trans	168.8	131.1	139.3	-92.6	-72.5	0	0	0	105
886	E	24.8	Very low	29.6	Very low	157 Å²	157	141.5 Å²	141.5	73%	0.734	75%	0.752	S	S	*	*				65.4	139.5	75.5	-67.2	-167.7	137.2	0	0	114.7
887	E	27.3	Very low	29.8	Very low	187 Å²	187	139 Å²	139	87%	0.874	75%	0.747	S	S	*	*			trans	65.1	153.6	174.7	-60.6	-171.6	160.7	0	0	117.5
888	S	27.3	Very low	30.1	Very low	79 Å²	79	137.7 Å²	137.7	55%	0.552	74%	0.739	S	S	*	*			cis	-168.9	159.7	-31.3	55.6	0	0	0	0	110.3
889	F	27.4	Very low	30	Very low	199 Å²	199	134.2 Å²	134.2	87%	0.873	73%	0.734	S	S	*	*			trans	61.1	166.7	168	-62	-70.1	0	0	0	117.3
890	S	29.2	Very low	30	Very low	97 Å²	97	132.7 Å²	132.7	68%	0.678	74%	0.74	S	S	*	*			cis	-165.3	153.3	-27.9	45.8	0	0	0	0	108.1
891	T	31.3	Very low	29.9	Very low	125 Å²	125	132.9 Å²	132.9	77%	0.767	75%	0.747	S	S	*	*			cis	-134.3	-126.2	-22.4	26.2	0	0	0	0	105.3
892	S	35.9	Very low	30.2	Very low	90 Å²	90	128.8 Å²	128.8	63%	0.629	75%	0.747	S	S	*	*			cis	-165.7	156	-16.1	7.6	0	0	0	0	105.4
893	D	36.5	Very low	30.2	Very low	134 Å²	134	128.4 Å²	128.4	72%	0.717	75%	0.745	S	S	*	*			cis	-156.8	124.3	-4.8	-98.1	-22.7	0	0	0	106.4
894	V	36.3	Very low	30.4	Very low	125 Å²	125	130.9 Å²	130.9	76%	0.758	75%	0.749	S	S	*	*				88.3	131.2	88.9	157.8	0	0	0	0	114.3
895	P	35.1	Very low	30.4	Very low	117 Å²	117	131.7 Å²	131.7	76%	0.76	75%	0.748	S	S	*	*			cis	-141.4	-175.7	-33.3	43.7	-26.1	0	0	0	114.4
896	T	36.9	Very low	30.7	Very low	122 Å²	122	131.5 Å²	131.5	75%	0.748	75%	0.753	S	S	*	*			trans	-73.5	162	164.7	-37.9	0	0	0	0	112.7
897	D	33.2	Very low	30.8	Very low	142 Å²	142	132.8 Å²	132.8	76%	0.759	76%	0.756	S	S	*	*			trans	-178.3	150.5	137.5	-100.6	3.1	0	0	0	110.6
898	L	30.8	Very low	31.2	Very low	140 Å²	140	128.8 Å²	128.8	73%	0.733	75%	0.747	S	S	*	*			cis	-155.9	167.7	-21.6	-131.7	174.3	0	0	0	109
899	S	27.3	Very low	31.1	Very low	101 Å²	101	130.7 Å²	130.7	71%	0.706	75%	0.75	S	S	*	*			trans	-83.2	148.1	-175.8	57.9	0	0	0	0	114.8
900	A	31.7	Very low	31.2	Very low	99 Å²	99	128.7 Å²	128.7	82%	0.818	75%	0.749	S	S	*	*			trans	-145.6	127.5	158.1	0	0	0	0	0	111.7
901	T	27.2	Very low	31.1	Very low	136 Å²	136	132.4 Å²	132.4	83%	0.834	75%	0.748	S	S	*	*			trans	-126.5	107.9	-179.6	52.8	0	0	0	0	112.3
902	T	32	Very low	31	Very low	128 Å²	128	134.3 Å²	134.3	79%	0.785	75%	0.745	S	S	*	*			trans	-152	127.5	163.5	33.9	0	0	0	0	106
903	N	26.8	Very low	30.7	Very low	141 Å²	141	137.7 Å²	137.7	75%	0.754	75%	0.751	S	S	*	*			cis	59.3	90.7	22.7	-161.3	15.5	0	0	0	114.1
904	I	29.1	Very low	30.2	Very low	148 Å²	148	140 Å²	140	76%	0.759	75%	0.749	S	S	*	*			trans	-166.1	147.9	140.7	-99.6	151.6	0	0	0	107.7
905	N	26.6	Very low	29.8	Very low	135 Å²	135	140.8 Å²	140.8	72%	0.722	75%	0.745	S	S	*	*			trans	-80.4	140.9	178	-48.6	-86	0	0	0	110.2
906	D	31.9	Very low	29.4	Very low	160 Å²	160	139.7 Å²	139.7	86%	0.856	74%	0.736	S	S	*	*			trans	-136.1	128.8	153.4	-108.3	-40.9	0	0	0	112.7
907	F	27	Very low	28.9	Very low	183 Å²	183	139.6 Å²	139.6	80%	0.803	73%	0.731	S	S	*	*			trans	-84.2	-171.8	165.9	-91.3	-102.5	0	0	0	108
908	P	34.7	Very low	28.5	Very low	104 Å²	104	140.7 Å²	140.7	68%	0.675	73%	0.731	S	S	*	*			cis	-132.7	176.2	-2.3	17.9	8.7	0	0	0	115.6
909	L	26.4	Very low	28.5	Very low	119 Å²	119	141.7 Å²	141.7	62%	0.623	74%	0.737	S	S	*	*			trans	6.6	120.6	136.9	-54.2	157	0	0	0	118.1
910	N	29.9	Very low	28.4	Very low	156 Å²	156	141.4 Å²	141.4	83%	0.834	74%	0.735	S	S	*	*				-150.1	115.1	110	-94.3	-41.8	0	0	0	108.4
911	R	26.8	Very low	28.6	Very low	176 Å²	176	144.8 Å²	144.8	66%	0.664	74%	0.737	S	S	*	*				54.3	115.9	67	-75.5	-173.4	167	177.1	-0	113.8
912	K	28.3	Very low	28.6	Very low	165 Å²	165	142.6 Å²	142.6	72%	0.717	73%	0.728	S	S	*	*			trans	48.3	117.4	134.5	-55.2	176.6	-179.9	-175.6	0	116.5
913	H	29.7	Very low	28.5	Very low	160 Å²	160	142.6 Å²	142.6	74%	0.741	73%	0.73	S	S	*	*				-140.3	142.2	100.8	-105.3	-101.9	0	0	0	105.9
914	R	26.1	Very low	28.8	Very low	182 Å²	182	142.7 Å²	142.7	69%	0.687	73%	0.729	S	S	*	*				57.8	137.6	58.7	-83.9	174.7	164.6	-172.4	-8.2	110.7
915	H	28.3	Very low	28.6	Very low	142 Å²	142	141.5 Å²	141.5	66%	0.657	73%	0.734	S	S	*	*			cis	-135.8	168.2	8.2	-108.9	-73.3	0	0	0	108.2
916	T	26.1	Very low	28.8	Very low	94 Å²	94	141.7 Å²	141.7	58%	0.577	73%	0.733	S	S	*	*				27	134.2	94	86.8	0	0	0	0	114.2
917	D	26.2	Very low	28.5	Very low	121 Å²	121	138.8 Å²	138.8	65%	0.647	73%	0.725	S	S	*	*			cis	-146.8	177	38	-106	-71.1	0	0	0	116.6
918	Q	25.9	Very low	28.4	Very low	164 Å²	164	134.8 Å²	134.8	77%	0.766	72%	0.72	S	S	*	*			trans	-39.1	150.1	164.1	-54.1	150.8	77.8	0	0	114.8
919	L	30.2	Very low	28.1	Very low	162 Å²	162	133.8 Å²	133.8	85%	0.848	72%	0.721	S	S	*	*			trans	176.9	84.9	139.2	-94.3	168.7	0	0	0	106.4
920	S	25.2	Very low	28.2	Very low	94 Å²	94	135.9 Å²	135.9	66%	0.657	73%	0.731	S	S	*	*				56.3	90.5	84.1	79.8	0	0	0	0	114.8
921	I	35.3	Very low	28.2	Very low	170 Å²	170	133.1 Å²	133.1	87%	0.872	72%	0.724	S	S	*	*			trans	-170.6	131.6	150.8	-92.8	143.5	0	0	0	105.3
922	S	29	Very low	28.5	Very low	91 Å²	91	129.5 Å²	129.5	64%	0.636	72%	0.724	S	S	*	*			cis	-168.9	147.3	-41.3	38.8	0	0	0	0	106.4
923	P	29.2	Very low	29.1	Very low	128 Å²	128	127.9 Å²	127.9	83%	0.831	73%	0.73	S	S	*	*			trans	-83.4	141	-169.9	33.3	-34.8	0	0	0	112.5
924	I	31.9	Very low	29.2	Very low	142 Å²	142	128.6 Å²	128.6	73%	0.728	73%	0.732	S	S	*	*			trans	-133.4	116.1	169	-64.9	-176.1	0	0	0	109.9	I926	I924-I926 HydrophobicContact CG2-CD1 3.92Å; I924-I926 HydrophobicContact CG2-CG1 3.79Å
925	S	24.8	Very low	29.4	Very low	124 Å²	124	132.5 Å²	132.5	87%	0.867	75%	0.747	S	S	*	*			trans	-96.8	108.2	168.5	-58.9	0	0	0	0	109.8
926	I	31.5	Very low	29.5	Very low	138 Å²	138	128.8 Å²	128.8	71%	0.708	74%	0.74	S	S	*	*			trans	-143	100.5	162.9	-48.8	175.5	0	0	0	103.9	I924	I924-I926 HydrophobicContact CG2-CD1 3.92Å; I924-I926 HydrophobicContact CG2-CG1 3.79Å
927	S	25.7	Very low	29.9	Very low	99 Å²	99	129.3 Å²	129.3	69%	0.692	75%	0.748	S	S	*	*				63.9	132.8	75.2	-172.1	0	0	0	0	113.5
928	S	25.9	Very low	30.2	Very low	100 Å²	100	132.6 Å²	132.6	70%	0.699	76%	0.756	S	S	*	*			trans	53	117	147.3	60.4	0	0	0	0	120.6
929	A	26.9	Very low	30.3	Very low	82 Å²	82	130 Å²	130	68%	0.678	76%	0.755	S	S	*	*				115.3	136.4	119.1	0	0	0	0	0	118.8
930	L	29.8	Very low	30.3	Very low	163 Å²	163	127.5 Å²	127.5	85%	0.853	75%	0.751	S	S	*	*			trans	65.4	146.1	153.9	-58.6	153.5	0	0	0	117.2
931	S	28.8	Very low	30.5	Very low	98 Å²	98	134.4 Å²	134.4	69%	0.685	76%	0.762	S	S	*	*			cis	-171.6	164.2	-24.2	-108.6	0	0	0	0	107.4
932	P	32.7	Very low	30.4	Very low	100 Å²	100	130.3 Å²	130.3	65%	0.649	75%	0.749	S	S	*	*			trans	-81.9	158.7	-169	33	-36.9	0	0	0	114.5	F934	P932-F934 PolarHBondContact O-N 3.15Å
933	P	41.7	Very low	30.8	Very low	132 Å²	132	131.2 Å²	131.2	86%	0.857	75%	0.753	S	S	*	*			trans	-72.3	108.1	169	30.1	-32.9	0	0	0	111
934	F	31.3	Very low	31.1	Very low	175 Å²	175	132.3 Å²	132.3	77%	0.768	75%	0.747	S	S	*	*			trans	-71.4	145.6	165.2	-116.8	-90.5	0	0	0	110.7	P932 A936	P932-F934 PolarHBondContact O-N 3.15Å; F934-A936 HydrophobicContact CD1-CB 3.86Å; F934-A936 HydrophobicContact CE1-CB 4.04Å
935	W	31.4	Very low	31.3	Very low	264 Å²	264	134.6 Å²	134.6	100%	1	75%	0.754	S	S	*	*			trans	-132.3	123.8	136.8	-118.1	-35.7	0	0	0	109.1
936	A	30.2	Very low	31.6	Very low	64 Å²	64	137.3 Å²	137.3	53%	0.529	75%	0.753	S	S	.	*			trans	-110	157.7	-176.3	0	0	0	0	0	111.5	F934	F934-A936 HydrophobicContact CD1-CB 3.86Å; F934-A936 HydrophobicContact CE1-CB 4.04Å
937	S	33.5	Very low	31.9	Very low	104 Å²	104	135.8 Å²	135.8	73%	0.727	75%	0.75	S	S	*	*			trans	-164.5	111.1	136.3	-89	0	0	0	0	113.8
938	K	32.9	Very low	32.2	Very low	191 Å²	191	138.4 Å²	138.4	83%	0.83	75%	0.752	S	S	*	*			trans	67.3	149	144.1	-56.5	178.1	-179.2	175.5	0	118.2
939	C	28.6	Very low	32.5	Very low	108 Å²	108	141.3 Å²	141.3	73%	0.73	75%	0.754	S	S	*	*			cis	-166.6	160.3	-17.2	-106.9	0	0	0	0	110
940	S	30.8	Very low	32.6	Very low	110 Å²	110	144 Å²	144	77%	0.769	75%	0.753	S	S	*	*			trans	69.9	130.9	164.7	-56.8	0	0	0	0	116.5
941	R	29.2	Very low	32.7	Very low	239 Å²	239	144.1 Å²	144.1	90%	0.902	75%	0.749	S	S	*	*				66.5	134.9	63.9	-76.8	-175.9	170.6	177.1	-4.6	113.2
942	S	31.7	Very low	32.8	Very low	85 Å²	85	144.1 Å²	144.1	59%	0.594	76%	0.755	S	S	*	*			cis	-148.2	175.5	6.6	-130.3	0	0	0	0	111.8
943	P	38.3	Very low	32.7	Very low	109 Å²	109	146.9 Å²	146.9	71%	0.708	76%	0.764	S	S	*	*			trans	-121	148.3	-176.3	40.2	-27.3	0	0	0	115.9
944	E	35.8	Very low	32.4	Very low	152 Å²	152	149.7 Å²	149.7	71%	0.71	76%	0.763	S	S	*	*			trans	-151.1	141.8	176.5	-58.4	77.9	-154.2	0	0	107.1
945	E	35.3	Very low	32.5	Very low	189 Å²	189	150.6 Å²	150.6	88%	0.883	77%	0.769	S	S	*	*			cis	-149.4	-130.9	-0.8	-144.4	162.8	-129	0	0	111
946	E	31.3	Very low	32.6	Very low	181 Å²	181	147.6 Å²	147.6	85%	0.846	76%	0.763	S	S	*	*			trans	-119.8	-175.4	-170.2	-56.5	179	123	0	0	113.1
947	V	37.4	Very low	32.6	Very low	107 Å²	107	153 Å²	153	65%	0.648	78%	0.777	S	S	*	*			cis	-162.4	157.8	18.1	79.2	0	0	0	0	112.8
948	E	33.6	Very low	32.5	Very low	154 Å²	154	154.1 Å²	154.1	72%	0.72	78%	0.78	S	S	*	*			trans	45.9	120.2	157.4	-77	165.8	178.8	0	0	121.8
949	Q	30.9	Very low	32.3	Very low	160 Å²	160	151.7 Å²	151.7	75%	0.748	78%	0.781	S	S	*	*				71.7	139.8	86.8	-90.2	159.8	-94	0	0	115.9
950	E	29.4	Very low	32.4	Very low	139 Å²	139	155.9 Å²	155.9	65%	0.65	79%	0.793	S	S	*	*			cis	-156.1	-178.5	2.7	-153.1	-178.6	95.7	0	0	111
951	Q	32.9	Very low	32.4	Very low	166 Å²	166	160 Å²	160	78%	0.776	80%	0.796	S	S	*	*			trans	75.6	108.4	159.6	-72.4	160.9	31.2	0	0	118.4
952	A	31.1	Very low	32.5	Very low	97 Å²	97	155.8 Å²	155.8	80%	0.802	79%	0.792	S	S	*	*			trans	-79.2	144.4	169.1	0	0	0	0	0	111.4
953	D	30.6	Very low	32.6	Very low	159 Å²	159	159.8 Å²	159.8	85%	0.85	80%	0.801	S	S	*	*				-158.5	166.7	109.4	-127.6	-31.9	0	0	0	111.8
954	K	34.3	Very low	32.4	Very low	191 Å²	191	162.9 Å²	162.9	83%	0.83	80%	0.804	S	S	*	*			trans	68.7	89.1	-177.9	-50.2	177.5	-174	-178.7	0	116.6
955	H	33.3	Very low	32.1	Very low	193 Å²	193	165.3 Å²	165.3	89%	0.894	81%	0.812	S	S	*	*			trans	-160.4	98.7	137.4	-110	-66.3	0	0	0	113.3
956	K	33.1	Very low	32.1	Very low	201 Å²	201	164.4 Å²	164.4	87%	0.874	81%	0.813	S	S	*	*			trans	-138.3	143	152.3	-65.6	-174.7	-176.9	178.8	0	104.6
957	E	30.5	Very low	32.1	Very low	179 Å²	179	161.7 Å²	161.7	84%	0.836	80%	0.804	S	S	*	*	S	Bend	cis	-153.4	107.4	16.7	-175.1	174.3	154.3	0	0	109.4
958	T	31.2	Very low	31.9	Very low	126 Å²	126	162.5 Å²	162.5	77%	0.773	81%	0.811	S	S	*	*			trans	-154.7	42	-176.9	-34.4	0	0	0	0	115.4
959	T	30.3	Very low	32	Very low	141 Å²	141	160.8 Å²	160.8	87%	0.865	81%	0.812	S	S	*	*			trans	-147.3	60.5	178.2	-4.5	0	0	0	0	115.7
960	M	30.2	Very low	32.2	Very low	196 Å²	196	158.9 Å²	158.9	97%	0.966	81%	0.811	S	S	*	*			trans	-137.8	91.8	153.3	-78.7	-157.3	-179.9	0	0	111.6
961	K	31.1	Very low	32.4	Very low	195 Å²	195	161.7 Å²	161.7	85%	0.848	82%	0.821	S	S	*	*			trans	-127.6	145.6	156.7	-88.2	-178.3	176.6	171.5	0	108.1
962	N	30	Very low	32.3	Very low	151 Å²	151	164.6 Å²	164.6	81%	0.807	83%	0.827	S	S	*	*			trans	64.6	94.6	178.8	-50.8	-14.9	0	0	0	114.6
963	H	33.9	Very low	32.4	Very low	169 Å²	169	166.9 Å²	166.9	78%	0.782	83%	0.83	S	S	*	*				-155.3	124.5	121.2	-118.5	-131.9	0	0	0	111
964	F	33.6	Very low	32.1	Very low	175 Å²	175	167.8 Å²	167.8	77%	0.768	83%	0.832	S	S	*	*			trans	56	104.5	160.8	-72.2	-97.9	0	0	0	120.8
965	F	30.2	Very low	31.9	Very low	202 Å²	202	167.8 Å²	167.8	89%	0.886	84%	0.835	S	S	*	*			trans	-54.2	146.4	146.7	-80.3	-122.9	0	0	0	111.2
966	L	35.3	Very low	31.9	Very low	171 Å²	171	164.4 Å²	164.4	90%	0.895	83%	0.832	S	S	*	*			trans	-159.9	165.1	140.3	-107	161.7	0	0	0	109.9
967	N	30.8	Very low	31.9	Very low	123 Å²	123	162.6 Å²	162.6	66%	0.658	83%	0.83	S	S	*	*			trans	-79.1	148.6	-162.9	-99.4	-37.5	0	0	0	114.8	T969	N967-T969 PolarHBondContact O-N 3.32Å
968	P	33.4	Very low	32	Very low	124 Å²	124	161.7 Å²	161.7	81%	0.805	83%	0.83	S	S	*	*	S	Bend	trans	-70.5	-8.7	170.4	-16.4	31.3	0	0	0	114.9	T970	P968-T970 PolarHBondContact O-N 3.42Å
969	T	35.8	Very low	32	Very low	119 Å²	119	163.7 Å²	163.7	73%	0.73	83%	0.833	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	21.3	-159	-24.8	0	0	0	0	114.9	N967	N967-T969 PolarHBondContact O-N 3.32Å
970	T	35.2	Very low	32.1	Very low	120 Å²	120	165 Å²	165	74%	0.736	83%	0.831	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.2	21.8	-167.8	-38.4	0	0	0	0	113.9	P968	P968-T970 PolarHBondContact O-N 3.42Å
971	F	33.4	Very low	32.2	Very low	198 Å²	198	163.1 Å²	163.1	87%	0.868	82%	0.823	S	S	*	*	S	Bend	trans	-128	27.3	-173.4	-128.7	-85.7	0	0	0	115.2
972	Y	32.1	Very low	32.3	Very low	227 Å²	227	160.9 Å²	160.9	89%	0.89	82%	0.821	S	S	*	*	S	Bend	trans	-131.9	25.7	-175.7	-114.9	-74.9	0	0	0	114.5
973	V	32.3	Very low	32.5	Very low	144 Å²	144	161.6 Å²	161.6	87%	0.873	82%	0.822	S	S	*	*	S	Bend	trans	-126	1.9	-177.5	-178.5	0	0	0	0	112.7
974	M	25.1	Very low	32.3	Very low	179 Å²	179	161.1 Å²	161.1	88%	0.882	83%	0.825	S	S	*	*	S	Bend	trans	-134.9	137.1	169.2	-74.7	-171.2	169	0	0	110.9
975	Q	29.6	Very low	32.2	Very low	191 Å²	191	159.9 Å²	159.9	89%	0.893	83%	0.83	S	S	*	*			trans	82.8	114.5	167.5	-145.8	157.7	4.2	0	0	117.8
976	S	33.9	Very low	32.4	Very low	121 Å²	121	156.1 Å²	156.1	85%	0.846	83%	0.825	S	S	*	*			trans	51.5	0	161.5	67	0	0	0	0	120.8	N179	N179-S976 PolarHBondContact ND2-O 3.46Å; N179-S976 PolarHBondContact ND2-OXT 3.48Å

Retrieved 976 of 976 residues in 1255.6 ms (Link to these results)

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