A0A077ZBR1_TRITR Loading...

Signal peptide, CUB and EGF

AlphaFold DB , UniProt , Accession A0A077ZBR1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 944 aa.

						>A0A077ZBR1_TRITR|A0A077ZBR1
MNITCDQNAHCVSSYGKHRCVCKPGFVGNGQTCRDIDECARNNGTCVQVCENTIGSFRCSCYPGFTLAKNGKDCIGIPFRDINECENKRGFCHHMCVNTVGSYHCTCNGSYLLAADGYSCLKRRYSRSCDRLGCEHGCVKELGLCYCKTGYRMHSDHRHCTPTCALSKDMEFVLLQIGNGGCQHVCEDAKDKIFCRCHAGYTLSIDNRTCFGEGPFQARSTGIKIFIIQRHVVSTTAVAIMCAKMDPSAPIAVALMDIKDLHRYDFVPRVGQHINNFHKTKRHENVLCYKLSFPIAPQLVFKVTSNINVYTDECVDGKNNCQYGCVNEPGSYRCTCPDGYQLNSDGETCKDINECLEGQNCDHICLNKPGGFACECQPGYHLYSYRHCAGEMLFLLNKYTFSTVADIDECSVFNGGCEQHCHNTPGSYHCSCDPGYVLHYNGKDCVPMEKCTVNEQEPRAGAFFCHKNRCTLTCDSNAAFANYKNKTTVHLSCVTKLNNSVCSLLNEWKQMEISFAVAKCLWVNKTSKALSHAFAEGIGTYVLVVPVSWEVPASANEINTHLLMKQAAEAMQAQGIKLHQKDFFFLKTVTKLSGRVDCNRLHSIKRCSYIGKAYGSKMDDETENIDCSPGSYYDRRHGLCFSCSRGTYQPLKASLACMPCPERIRTNRAIYGASNVQDCAERCKPGYFSETGFEPCQPCLDGYFQNERGRSSCKRCKHQYTTVTYGVRSSVECSAPERCQAGTFYDVTVAACLPCPVATYQPMEGQDFCIKCPGNLTTGSPESRTCRKVDRTSNGLFESPNYPNNYPSNVSCSWYLKAPKGRRILIFVLDLNLADDHCGDYLVIRKNKVRYYYPFCAMRLTTFAEEYHVVVEDFVRDVRLYQTTRSEPIFKNSHSLDLMMDILAEPEKLRNYVRLPAHVMPKKFMELVWEKLHGYFGFGHAAAM
					

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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	49.6	Very low	81.7	Confident	238 Å²	238	92.8 Å²	92.8	100%	1.172	49%	0.493	S	S	*	.				0	124.5	0	-72.2	171.1	172.6	0	0	107.3	I3	M1-I3 PolarHBondContact O-N 3.37Å
2	N	65.2	Low	82.1	Confident	160 Å²	160	89.8 Å²	89.8	86%	0.856	48%	0.481	S	S	*	.			trans	-81.6	107.9	-179.6	-161.7	14.5	0	0	0	108.1
3	I	69.9	Low	81.6	Confident	66 Å²	66	89.5 Å²	89.5	34%	0.338	49%	0.489	S	S	.	.			trans	-87.3	113.1	-177.5	-138.6	170.3	0	0	0	108.6	M1 H18	M1-I3 PolarHBondContact O-N 3.37Å; I3-H18 WeakPolarHBondContact CD1-O 3.49Å; I3-H18 HydrophobicContact CG2-CB 3.94Å
4	T	82.5	Confident	80.1	Confident	104 Å²	104	87.6 Å²	87.6	64%	0.638	49%	0.486	S	S	*	.			trans	-90.3	111.8	174.3	47.8	0	0	0	0	108.7
5	C	87.5	Confident	79.1	Confident	40 Å²	40	97.1 Å²	97.1	27%	0.27	51%	0.514	S	S	.	.			trans	-85.8	157.2	173.6	-57.2	0	0	0	0	111	A9 C20	C5-A9 HydrophobicContact CB-CB 3.99Å; C5-C20 WeakPolarHBondContact CA-SG 3.49Å; C5-C20 HydrophobicContact CB-CB 3.66Å; C5-C20 WeakPolarHBondContact CB-SG 3.08Å; C5-C20 WeakPolarHBondContact SG-CB 3.29Å; C5-C20 CovalentContact SG-SG 2.03Å; C5-C20 PolarHBondContact SG-SG 3.39Å
6	D	91.4	Very high	78.3	Confident	32 Å²	32	95.7 Å²	95.7	17%	0.171	53%	0.53	C	S	.	.			trans	-57.1	150.2	168.8	-165.1	-65	0	0	0	110.6	N8 A9 G30 T32 C33	D6-N8 PolarHBondContact O-N 2.85Å; D6-N8 VanDerWaalsContact O-N 3.12Å; D6-N8 WeakPolarHBondContact OD1-CB 3.43Å; D6-N8 PolarHBondContact OD1-N 3.43Å; D6-A9 HydrophobicContact CB-CB 4.02Å; D6-A9 WeakPolarHBondContact O-CB 3.33Å; D6-A9 PolarHBondContact O-N 3.32Å; D6-G30 PolarHBondContact N-O 2.73Å; D6-T32 VanDerWaalsContact OD2-CA 3.29Å; D6-T32 WeakPolarHBondContact OD2-CA 3.36Å; D6-C33 HydrophobicContact CB-CB 4.03Å; D6-C33 PolarHBondContact OD2-N 2.03Å
7	Q	91.5	Very high	77.7	Confident	160 Å²	160	100.1 Å²	100.1	75%	0.748	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-27	171.7	63.8	179.5	-1	0	0	112.4	K23	Q7-K23 WeakPolarHBondContact O-CE 3.38Å; Q7-K23 PolarHBondContact O-NZ 2.77Å
8	N	91.7	Very high	77.7	Confident	34 Å²	34	100.4 Å²	100.4	18%	0.182	54%	0.539	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	26.9	175.8	-63.3	-33.9	0	0	0	112.9	D6 C22 K23 F26 C33	D6-N8 PolarHBondContact O-N 2.85Å; D6-N8 VanDerWaalsContact O-N 3.12Å; D6-N8 WeakPolarHBondContact OD1-CB 3.43Å; D6-N8 PolarHBondContact OD1-N 3.43Å; N8-C22 WeakPolarHBondContact O-CA 3.23Å; N8-K23 WeakPolarHBondContact O-CB 3.48Å; N8-K23 WeakPolarHBondContact O-CG 3.33Å; N8-K23 PolarHBondContact O-N 3.19Å; N8-F26 HydrophobicContact CB-CD1 3.68Å; N8-F26 HydrophobicContact CB-CD2 4.08Å; N8-F26 HydrophobicContact CB-CE1 3.78Å; N8-F26 HydrophobicContact CB-CE2 4.15Å; N8-F26 HydrophobicContact CB-CG 3.85Å; N8-F26 HydrophobicContact CB-CZ 4.01Å; N8-F26 VanDerWaalsContact CG-CE1 3.42Å; N8-F26 WeakPolarHBondContact ND2-CE1 3.28Å; N8-C33 HydrophobicContact CB-CB 3.92Å
9	A	91.8	Very high	78.2	Confident	11 Å²	11	103.4 Å²	103.4	9%	0.091	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	163.5	172.9	0	0	0	0	0	112.9	C5 D6 C20 V21 G30	C5-A9 HydrophobicContact CB-CB 3.99Å; D6-A9 HydrophobicContact CB-CB 4.02Å; D6-A9 WeakPolarHBondContact O-CB 3.33Å; D6-A9 PolarHBondContact O-N 3.32Å; A9-C20 HydrophobicContact CB-CB 4.44Å; A9-V21 CarbonylContact C-O 3.51Å; A9-V21 VanDerWaalsContact CA-O 3.24Å; A9-V21 WeakPolarHBondContact CA-O 3.29Å; A9-V21 WeakPolarHBondContact CB-O 3.3Å; A9-G30 VanDerWaalsContact CB-O 3.23Å; A9-G30 WeakPolarHBondContact CB-O 3.02Å
10	H	89.9	Confident	78.8	Confident	110 Å²	110	99.1 Å²	99.1	51%	0.509	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	140.5	166.6	-67.8	-60.1	0	0	0	110	C20 V21	H10-C20 WeakPolarHBondContact O-CA 3.18Å; H10-V21 PolarHBondContact N-O 2.94Å; H10-V21 PolarHBondContact O-N 3.29Å
11	C	88.1	Confident	79.4	Confident	66 Å²	66	97.4 Å²	97.4	45%	0.446	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	121	170.3	-172.6	0	0	0	0	109.2
12	V	85.8	Confident	81.5	Confident	57 Å²	57	87.1 Å²	87.1	35%	0.345	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	131.1	174.4	-57.6	0	0	0	0	110.1	R19 V21	V12-R19 HydrophobicContact CG2-CG 3.54Å; V12-R19 PolarHBondContact N-O 3.07Å; V12-R19 PolarHBondContact O-N 3.24Å; V12-V21 HydrophobicContact CG2-CG2 3.71Å
13	S	75.6	Confident	82.8	Confident	85 Å²	85	82.5 Å²	82.5	59%	0.594	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	125.4	178.1	-59.1	0	0	0	0	109.9	H18	S13-H18 PolarHBondContact OG-CE1 3.29Å; S13-H18 VanDerWaalsContact OG-CE1 3.3Å; S13-H18 PolarHBondContact OG-ND1 3.01Å
14	S	60.6	Low	83.8	Confident	63 Å²	63	85 Å²	85	44%	0.441	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	121.7	173.2	-169.1	0	0	0	0	109.2	G16 K17	S14-G16 VanDerWaalsContact C-N 3.28Å; S14-G16 PolarHBondContact O-N 3.45Å; S14-K17 PolarHBondContact N-O 3.07Å; S14-K17 PolarHBondContact O-N 3.38Å
15	Y	66	Low	84.2	Confident	230 Å²	230	80.7 Å²	80.7	90%	0.902	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.7	46.4	-178.5	-57.3	-82.2	0	0	0	114.4	K17	Y15-K17 VanDerWaalsContact C-N 3.26Å; Y15-K17 PolarHBondContact O-N 3.23Å
16	G	65	Low	84.5	Confident	75 Å²	75	80 Å²	80	77%	0.773	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	2.6	179.1	0	0	0	0	0	115.7	S14	S14-G16 VanDerWaalsContact C-N 3.28Å; S14-G16 PolarHBondContact O-N 3.45Å
17	K	69	Low	84.5	Confident	170 Å²	170	81.6 Å²	81.6	74%	0.739	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	129.7	170.5	-66.2	-176.6	-179.5	179	0	110.5	S14 Y15	S14-K17 PolarHBondContact N-O 3.07Å; S14-K17 PolarHBondContact O-N 3.38Å; Y15-K17 VanDerWaalsContact C-N 3.26Å; Y15-K17 PolarHBondContact O-N 3.23Å
18	H	77.7	Confident	84.5	Confident	106 Å²	106	76.5 Å²	76.5	49%	0.491	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	135.4	171.4	-60	-70.2	0	0	0	109.9	I3 S13	I3-H18 WeakPolarHBondContact CD1-O 3.49Å; I3-H18 HydrophobicContact CG2-CB 3.94Å; S13-H18 PolarHBondContact OG-CE1 3.29Å; S13-H18 VanDerWaalsContact OG-CE1 3.3Å; S13-H18 PolarHBondContact OG-ND1 3.01Å
19	R	87	Confident	84.4	Confident	158 Å²	158	80 Å²	80	60%	0.596	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.7	147.1	167	67.5	178.1	-177.2	175.5	0.3	110.3	V12 V21	V12-R19 HydrophobicContact CG2-CG 3.54Å; V12-R19 PolarHBondContact N-O 3.07Å; V12-R19 PolarHBondContact O-N 3.24Å; R19-V21 HydrophobicContact CG-CG2 4.44Å
20	C	90.4	Very high	84.2	Confident	16 Å²	16	79.4 Å²	79.4	11%	0.108	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	140	173.6	-54	0	0	0	0	109.9	C5 A9 H10 G30	C5-C20 WeakPolarHBondContact CA-SG 3.49Å; C5-C20 HydrophobicContact CB-CB 3.66Å; C5-C20 WeakPolarHBondContact CB-SG 3.08Å; C5-C20 WeakPolarHBondContact SG-CB 3.29Å; C5-C20 CovalentContact SG-SG 2.03Å; C5-C20 PolarHBondContact SG-SG 3.39Å; A9-C20 HydrophobicContact CB-CB 4.44Å; H10-C20 WeakPolarHBondContact O-CA 3.18Å; C20-G30 VanDerWaalsContact CB-C 3.43Å; C20-G30 WeakPolarHBondContact CB-O 3.37Å
21	V	91.4	Very high	84.1	Confident	65 Å²	65	79.9 Å²	79.9	39%	0.394	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	129.6	174.9	178.7	0	0	0	0	107.3	A9 H10 V12 R19	A9-V21 CarbonylContact C-O 3.51Å; A9-V21 VanDerWaalsContact CA-O 3.24Å; A9-V21 WeakPolarHBondContact CA-O 3.29Å; A9-V21 WeakPolarHBondContact CB-O 3.3Å; H10-V21 PolarHBondContact N-O 2.94Å; H10-V21 PolarHBondContact O-N 3.29Å; V12-V21 HydrophobicContact CG2-CG2 3.71Å; R19-V21 HydrophobicContact CG-CG2 4.44Å
22	C	93.7	Very high	84.3	Confident	21 Å²	21	81.1 Å²	81.1	14%	0.142	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	147.1	178.4	-61.3	0	0	0	0	111.2	N8 F26 C33	N8-C22 WeakPolarHBondContact O-CA 3.23Å; C22-F26 HydrophobicContact CB-CB 3.96Å; C22-F26 WeakPolarHBondContact CB-O 3.13Å; C22-C33 WeakPolarHBondContact CA-SG 3.06Å; C22-C33 HydrophobicContact CB-CB 3.87Å; C22-C33 WeakPolarHBondContact CB-SG 3.44Å; C22-C33 WeakPolarHBondContact SG-CB 3.26Å; C22-C33 CovalentContact SG-SG 2.04Å; C22-C33 PolarHBondContact SG-SG 3.09Å
23	K	93.4	Very high	84.6	Confident	64 Å²	64	78.9 Å²	78.9	28%	0.278	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-63.7	155.7	173.5	-69.9	175.5	-174.4	168	0	109.8	Q7 N8 F26	Q7-K23 WeakPolarHBondContact O-CE 3.38Å; Q7-K23 PolarHBondContact O-NZ 2.77Å; N8-K23 WeakPolarHBondContact O-CB 3.48Å; N8-K23 WeakPolarHBondContact O-CG 3.33Å; N8-K23 PolarHBondContact O-N 3.19Å; K23-F26 HydrophobicContact CB-CD2 3.91Å; K23-F26 HydrophobicContact CB-CE2 4.42Å; K23-F26 WeakPolarHBondContact O-CB 3.47Å; K23-F26 PolarHBondContact O-N 3Å
24	P	90.1	Very high	85.4	Confident	119 Å²	119	83.9 Å²	83.9	77%	0.773	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	141.6	166.8	-24.7	34.9	0	0	0	111	F26	P24-F26 VanDerWaalsContact C-N 3.32Å; P24-F26 WeakPolarHBondContact O-CD2 3.03Å
25	G	90.1	Very high	87	Confident	13 Å²	13	83.1 Å²	83.1	13%	0.134	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	-5.3	-170.8	0	0	0	0	0	114.9	I36	G25-I36 PolarHBondContact O-N 2.84Å
26	F	94.4	Very high	88.3	Confident	26 Å²	26	75.3 Å²	75.3	11%	0.114	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.7	-179.6	-59.6	-93.8	0	0	0	112.6	N8 C22 K23 P24 C33 R34 I54	N8-F26 HydrophobicContact CB-CD1 3.68Å; N8-F26 HydrophobicContact CB-CD2 4.08Å; N8-F26 HydrophobicContact CB-CE1 3.78Å; N8-F26 HydrophobicContact CB-CE2 4.15Å; N8-F26 HydrophobicContact CB-CG 3.85Å; N8-F26 HydrophobicContact CB-CZ 4.01Å; N8-F26 VanDerWaalsContact CG-CE1 3.42Å; N8-F26 WeakPolarHBondContact ND2-CE1 3.28Å; C22-F26 HydrophobicContact CB-CB 3.96Å; C22-F26 WeakPolarHBondContact CB-O 3.13Å; K23-F26 HydrophobicContact CB-CD2 3.91Å; K23-F26 HydrophobicContact CB-CE2 4.42Å; K23-F26 WeakPolarHBondContact O-CB 3.47Å; K23-F26 PolarHBondContact O-N 3Å; P24-F26 VanDerWaalsContact C-N 3.32Å; P24-F26 WeakPolarHBondContact O-CD2 3.03Å; F26-C33 HydrophobicContact CB-CB 4.11Å; F26-R34 CarbonylContact C-O 3.53Å; F26-R34 VanDerWaalsContact CA-O 3.26Å; F26-R34 WeakPolarHBondContact CA-O 3.5Å; F26-R34 WeakPolarHBondContact CB-O 3.5Å; F26-I54 HydrophobicContact CE1-CG2 3.93Å; F26-I54 HydrophobicContact CZ-CG2 3.77Å
27	V	91.7	Very high	89.5	Confident	65 Å²	65	75.7 Å²	75.7	39%	0.394	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	141.3	175.7	65.3	0	0	0	0	110.7	R34 I36	V27-R34 HydrophobicContact CG1-CG 3.7Å; V27-R34 PolarHBondContact N-O 2.85Å; V27-R34 WeakPolarHBondContact O-CG 3.36Å; V27-R34 PolarHBondContact O-N 2.99Å; V27-I36 HydrophobicContact CB-CD1 4.07Å; V27-I36 HydrophobicContact CB-CG1 3.79Å; V27-I36 HydrophobicContact CG1-CG1 3.82Å
28	G	91.5	Very high	90.6	Very high	52 Å²	52	69.7 Å²	69.7	54%	0.536	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	157.6	-165.5	-179.9	0	0	0	0	0	113.8	T32	G28-T32 VanDerWaalsContact CA-O 3.29Å; G28-T32 WeakPolarHBondContact CA-O 3.49Å
29	N	89.6	Confident	91.3	Very high	107 Å²	107	65.7 Å²	65.7	57%	0.572	35%	0.35	S	S	*	.	S	Bend	trans	-94.5	5.8	-176	65.2	16.9	0	0	0	113.4	Q31 T32	N29-Q31 VanDerWaalsContact C-N 3.26Å; N29-Q31 PolarHBondContact O-N 2.79Å; N29-Q31 WeakPolarHBondContact OD1-CA 3.31Å; N29-Q31 PolarHBondContact OD1-N 2.97Å; N29-T32 PolarHBondContact N-O 3.24Å; N29-T32 PolarHBondContact ND2-OG1 2.93Å; N29-T32 PolarHBondContact OD1-N 2.78Å; N29-T32 PolarHBondContact OD1-O 3.27Å; N29-T32 PolarHBondContact OD1-OG1 2.78Å
30	G	87.2	Confident	91.4	Very high	0 Å²	0	62 Å²	62	0%	0	35%	0.353	C	S	.	.	S	Bend	trans	82.5	-17.7	-176.1	0	0	0	0	0	115.5	D6 A9 C20	D6-G30 PolarHBondContact N-O 2.73Å; A9-G30 VanDerWaalsContact CB-O 3.23Å; A9-G30 WeakPolarHBondContact CB-O 3.02Å; C20-G30 VanDerWaalsContact CB-C 3.43Å; C20-G30 WeakPolarHBondContact CB-O 3.37Å
31	Q	89	Confident	91.1	Very high	120 Å²	120	71.3 Å²	71.3	56%	0.561	39%	0.386	S	S	*	.	S	Bend	trans	-99.9	-17.8	169.2	-61.8	-177.4	33	0	0	112.3	N29	N29-Q31 VanDerWaalsContact C-N 3.26Å; N29-Q31 PolarHBondContact O-N 2.79Å; N29-Q31 WeakPolarHBondContact OD1-CA 3.31Å; N29-Q31 PolarHBondContact OD1-N 2.97Å
32	T	90.9	Very high	90.7	Very high	92 Å²	92	74.6 Å²	74.6	56%	0.564	40%	0.401	S	S	*	.	S	Bend	trans	-140.1	109.2	174.1	-19.3	0	0	0	0	105.9	D6 G28 N29	D6-T32 VanDerWaalsContact OD2-CA 3.29Å; D6-T32 WeakPolarHBondContact OD2-CA 3.36Å; G28-T32 VanDerWaalsContact CA-O 3.29Å; G28-T32 WeakPolarHBondContact CA-O 3.49Å; N29-T32 PolarHBondContact N-O 3.24Å; N29-T32 PolarHBondContact ND2-OG1 2.93Å; N29-T32 PolarHBondContact OD1-N 2.78Å; N29-T32 PolarHBondContact OD1-O 3.27Å; N29-T32 PolarHBondContact OD1-OG1 2.78Å
33	C	93	Very high	90.5	Very high	10 Å²	10	76.5 Å²	76.5	7%	0.068	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	102.4	-177.3	-68.5	0	0	0	0	109	D6 N8 C22 F26	D6-C33 HydrophobicContact CB-CB 4.03Å; D6-C33 PolarHBondContact OD2-N 2.03Å; N8-C33 HydrophobicContact CB-CB 3.92Å; C22-C33 WeakPolarHBondContact CA-SG 3.06Å; C22-C33 HydrophobicContact CB-CB 3.87Å; C22-C33 WeakPolarHBondContact CB-SG 3.44Å; C22-C33 WeakPolarHBondContact SG-CB 3.26Å; C22-C33 CovalentContact SG-SG 2.04Å; C22-C33 PolarHBondContact SG-SG 3.09Å; F26-C33 HydrophobicContact CB-CB 4.11Å
34	R	93	Very high	90.1	Very high	190 Å²	190	73.7 Å²	73.7	72%	0.717	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	151.2	173.7	66.8	173.9	-175.9	-174.9	1.7	109.9	F26 V27	F26-R34 CarbonylContact C-O 3.53Å; F26-R34 VanDerWaalsContact CA-O 3.26Å; F26-R34 WeakPolarHBondContact CA-O 3.5Å; F26-R34 WeakPolarHBondContact CB-O 3.5Å; V27-R34 HydrophobicContact CG1-CG 3.7Å; V27-R34 PolarHBondContact N-O 2.85Å; V27-R34 WeakPolarHBondContact O-CG 3.36Å; V27-R34 PolarHBondContact O-N 2.99Å
35	D	94	Very high	90.1	Very high	46 Å²	46	71.2 Å²	71.2	25%	0.246	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	145.4	169.5	-164.5	47.2	0	0	0	111.3	N52 I54 G55	D35-N52 PolarHBondContact OD2-ND2 2.89Å; D35-I54 WeakPolarHBondContact OD1-CA 3.47Å; D35-G55 PolarHBondContact OD1-N 2.04Å
36	I	91.6	Very high	90	Very high	66 Å²	66	71.1 Å²	71.1	34%	0.338	38%	0.379	S	S	.	.			trans	-94.4	111.6	169.2	-61.9	173.1	0	0	0	106.8	G25 V27 E38 N52	G25-I36 PolarHBondContact O-N 2.84Å; V27-I36 HydrophobicContact CB-CD1 4.07Å; V27-I36 HydrophobicContact CB-CG1 3.79Å; V27-I36 HydrophobicContact CG1-CG1 3.82Å; I36-E38 HydrophobicContact CG2-CG 4.08Å; I36-E38 PolarHBondContact O-N 3.18Å; I36-N52 PolarHBondContact O-OD1 2.98Å
37	D	91.1	Very high	89.7	Confident	83 Å²	83	74 Å²	74	44%	0.444	40%	0.399	S	S	.	.			trans	-69.5	95.7	169.1	-172	-20.2	0	0	0	109.3	C39 A40 N52	D37-C39 VanDerWaalsContact C-N 3.29Å; D37-C39 WeakPolarHBondContact OD1-CA 3.42Å; D37-C39 WeakPolarHBondContact OD1-CB 3.41Å; D37-C39 PolarHBondContact OD1-N 3.3Å; D37-A40 HydrophobicContact CB-CB 3.98Å; D37-A40 PolarHBondContact OD1-N 2.99Å; D37-N52 WeakPolarHBondContact CA-OD1 3.26Å
38	E	92.2	Very high	89.4	Confident	44 Å²	44	72.2 Å²	72.2	21%	0.206	39%	0.386	C	S	.	.	S	Bend	trans	-73	-25	178.4	-69.9	115	175.6	0	0	111.9	I36 A40 R41 G44 N52 S56 F57	I36-E38 HydrophobicContact CG2-CG 4.08Å; I36-E38 PolarHBondContact O-N 3.18Å; E38-A40 VanDerWaalsContact C-N 3.35Å; E38-R41 PolarHBondContact O-N 3.25Å; E38-G44 VanDerWaalsContact O-CA 3.23Å; E38-G44 WeakPolarHBondContact O-CA 3.25Å; E38-G44 PolarHBondContact O-N 2.83Å; E38-N52 PolarHBondContact N-OD1 3.45Å; E38-S56 VanDerWaalsContact OE2-CA 3.31Å; E38-S56 WeakPolarHBondContact OE2-CA 3.48Å; E38-F57 HydrophobicContact CB-CB 4.06Å; E38-F57 HydrophobicContact CB-CD1 3.32Å; E38-F57 HydrophobicContact CB-CE1 3.94Å; E38-F57 HydrophobicContact CB-CG 3.82Å; E38-F57 HydrophobicContact CG-CD1 3.76Å; E38-F57 HydrophobicContact CG-CE1 4.24Å; E38-F57 WeakPolarHBondContact OE2-CD1 3.3Å; E38-F57 PolarHBondContact OE2-N 2.79Å
39	C	92.3	Very high	89.3	Confident	23 Å²	23	71.6 Å²	71.6	16%	0.155	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-31.6	176.5	-61.9	0	0	0	0	112.4	D37 R41 N43 C50 E51 N52	D37-C39 VanDerWaalsContact C-N 3.29Å; D37-C39 WeakPolarHBondContact OD1-CA 3.42Å; D37-C39 WeakPolarHBondContact OD1-CB 3.41Å; D37-C39 PolarHBondContact OD1-N 3.3Å; C39-R41 PolarHBondContact O-N 2.84Å; C39-N43 WeakPolarHBondContact O-CA 3.42Å; C39-N43 PolarHBondContact O-N 2.85Å; C39-C50 WeakPolarHBondContact CA-SG 3.47Å; C39-C50 HydrophobicContact CB-CB 3.72Å; C39-C50 WeakPolarHBondContact CB-SG 3.11Å; C39-C50 WeakPolarHBondContact SG-CB 3.31Å; C39-C50 CovalentContact SG-SG 2.04Å; C39-C50 PolarHBondContact SG-SG 3.38Å; C39-E51 PolarHBondContact SG-N 3.5Å; C39-N52 HydrophobicContact CB-CB 4.4Å; C39-N52 PolarHBondContact SG-N 2.97Å
40	A	89.7	Confident	89.4	Confident	80 Å²	80	67.5 Å²	67.5	66%	0.661	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-9.6	175.5	0	0	0	0	0	114.7	D37 E38	D37-A40 HydrophobicContact CB-CB 3.98Å; D37-A40 PolarHBondContact OD1-N 2.99Å; E38-A40 VanDerWaalsContact C-N 3.35Å
41	R	83.7	Confident	89.6	Confident	212 Å²	212	70.9 Å²	70.9	80%	0.8	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125	113.4	175.5	-173	174.9	-178.2	156.4	2.1	111.6	E38 C39 N43 G44	E38-R41 PolarHBondContact O-N 3.25Å; C39-R41 PolarHBondContact O-N 2.84Å; R41-N43 PolarHBondContact O-N 3.01Å; R41-G44 PolarHBondContact O-N 2.79Å; R41-G44 VanDerWaalsContact O-N 3.15Å
42	N	83.6	Confident	89.7	Confident	133 Å²	133	67.8 Å²	67.8	71%	0.711	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	50.4	40.7	178.9	-162.4	25.8	0	0	0	112.9	G44 T45	N42-G44 PolarHBondContact O-N 3.41Å; N42-G44 VanDerWaalsContact O-N 3.16Å; N42-T45 WeakPolarHBondContact O-CA 3.45Å; N42-T45 PolarHBondContact O-N 3.43Å
43	N	88	Confident	89.7	Confident	61 Å²	61	65.7 Å²	65.7	33%	0.326	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	53.1	34.5	-179.1	-162.5	38.9	0	0	0	113.7	C39 R41 T45 C46 Q48 C50	C39-N43 WeakPolarHBondContact O-CA 3.42Å; C39-N43 PolarHBondContact O-N 2.85Å; R41-N43 PolarHBondContact O-N 3.01Å; N43-T45 PolarHBondContact O-N 3.36Å; N43-C46 PolarHBondContact ND2-O 3.49Å; N43-C46 VanDerWaalsContact O-CB 3.22Å; N43-C46 WeakPolarHBondContact O-CB 3.17Å; N43-C46 PolarHBondContact O-N 2.93Å; N43-C46 PolarHBondContact O-SG 3.29Å; N43-Q48 PolarHBondContact ND2-O 3.17Å; N43-C50 VanDerWaalsContact O-CB 3.29Å; N43-C50 WeakPolarHBondContact O-CB 3.44Å; N43-C50 PolarHBondContact O-SG 2.93Å; N43-C50 WeakPolarHBondContact OD1-CB 3.37Å
44	G	86.5	Confident	89.6	Confident	5 Å²	5	72 Å²	72	5%	0.052	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	62	13.5	-173.5	0	0	0	0	0	114.2	E38 R41 N42 C46 F57	E38-G44 VanDerWaalsContact O-CA 3.23Å; E38-G44 WeakPolarHBondContact O-CA 3.25Å; E38-G44 PolarHBondContact O-N 2.83Å; R41-G44 PolarHBondContact O-N 2.79Å; R41-G44 VanDerWaalsContact O-N 3.15Å; N42-G44 PolarHBondContact O-N 3.41Å; N42-G44 VanDerWaalsContact O-N 3.16Å; G44-C46 PolarHBondContact O-N 3Å; G44-F57 WeakPolarHBondContact O-CE2 3.4Å; G44-F57 WeakPolarHBondContact O-CZ 3.41Å
45	T	88.8	Confident	89.3	Confident	68 Å²	68	64 Å²	64	42%	0.417	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	59.3	25.2	-164	62.7	0	0	0	0	114.5	N42 N43 K72	N42-T45 WeakPolarHBondContact O-CA 3.45Å; N42-T45 PolarHBondContact O-N 3.43Å; N43-T45 PolarHBondContact O-N 3.36Å; T45-K72 VanDerWaalsContact OG1-CE 3.3Å; T45-K72 WeakPolarHBondContact OG1-CE 3.38Å; T45-K72 PolarHBondContact OG1-NZ 2.9Å
46	C	88.8	Confident	89.2	Confident	10 Å²	10	64.7 Å²	64.7	7%	0.068	36%	0.358	C	S	.	.			trans	-78.8	139.6	166.9	-56.4	0	0	0	0	110.6	N43 G44 C50 C59	N43-C46 PolarHBondContact ND2-O 3.49Å; N43-C46 VanDerWaalsContact O-CB 3.22Å; N43-C46 WeakPolarHBondContact O-CB 3.17Å; N43-C46 PolarHBondContact O-N 2.93Å; N43-C46 PolarHBondContact O-SG 3.29Å; G44-C46 PolarHBondContact O-N 3Å; C46-C50 HydrophobicContact CB-CB 4.07Å; C46-C50 VanDerWaalsContact SG-SG 3.69Å; C46-C59 WeakPolarHBondContact CA-SG 3.22Å; C46-C59 HydrophobicContact CB-CB 3.59Å; C46-C59 WeakPolarHBondContact CB-SG 3.29Å; C46-C59 WeakPolarHBondContact SG-CA 3.48Å; C46-C59 WeakPolarHBondContact SG-CB 3.21Å; C46-C59 CovalentContact SG-SG 2.02Å; C46-C59 PolarHBondContact SG-SG 2.78Å
47	V	86.8	Confident	89.2	Confident	88 Å²	88	63.9 Å²	63.9	53%	0.533	35%	0.352	S	S	.	.	S	Bend	trans	-74.1	-25.4	-178.9	170.3	0	0	0	0	113.2	K72 D73 C74	V47-K72 PolarHBondContact N-O 2.99Å; V47-D73 HydrophobicContact CG2-CB 4.17Å; V47-C74 HydrophobicContact CG1-CB 4.43Å
48	Q	86.3	Confident	89.3	Confident	27 Å²	27	67 Å²	67	13%	0.126	36%	0.357	C	S	.	.	S	Bend	trans	-128	-82.1	179.7	-68.4	-179.9	-15.2	0	0	111.9	N43 C61 Y62 C74	N43-Q48 PolarHBondContact ND2-O 3.17Å; Q48-C61 VanDerWaalsContact OE1-CA 3.25Å; Q48-Y62 HydrophobicContact CB-CD2 3.89Å; Q48-Y62 HydrophobicContact CB-CE2 3.81Å; Q48-Y62 VanDerWaalsContact CD-CD2 3.45Å; Q48-Y62 HydrophobicContact CG-CD2 3.78Å; Q48-Y62 HydrophobicContact CG-CE2 3.93Å; Q48-C74 HydrophobicContact CG-CB 4.02Å; Q48-C74 PolarHBondContact OE1-SG 2.92Å; Q48-C74 VanDerWaalsContact OE1-SG 3.37Å
49	V	88.5	Confident	89.3	Confident	39 Å²	39	65.6 Å²	65.6	24%	0.236	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	133.6	-174.6	-178.4	0	0	0	0	109.8	E51 C59 S60 Y62	V49-E51 HydrophobicContact CG1-CG 4.37Å; V49-C59 CarbonylContact O-C 3.49Å; V49-C59 VanDerWaalsContact O-CA 3.27Å; V49-C59 WeakPolarHBondContact O-CA 3.44Å; V49-S60 WeakPolarHBondContact CB-O 3.44Å; V49-S60 WeakPolarHBondContact CB-OG 3.38Å; V49-S60 WeakPolarHBondContact CG1-OG 3.44Å; V49-S60 PolarHBondContact N-O 2.75Å; V49-S60 PolarHBondContact O-N 3.05Å; V49-Y62 HydrophobicContact CG2-CD1 3.97Å; V49-Y62 HydrophobicContact CG2-CE1 3.48Å; V49-Y62 VanDerWaalsContact CG2-CE1 3.48Å
50	C	93	Very high	89.1	Confident	20 Å²	20	66.3 Å²	66.3	14%	0.135	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	129.4	170.7	-171.4	0	0	0	0	109.7	C39 N43 C46	C39-C50 WeakPolarHBondContact CA-SG 3.47Å; C39-C50 HydrophobicContact CB-CB 3.72Å; C39-C50 WeakPolarHBondContact CB-SG 3.11Å; C39-C50 WeakPolarHBondContact SG-CB 3.31Å; C39-C50 CovalentContact SG-SG 2.04Å; C39-C50 PolarHBondContact SG-SG 3.38Å; N43-C50 VanDerWaalsContact O-CB 3.29Å; N43-C50 WeakPolarHBondContact O-CB 3.44Å; N43-C50 PolarHBondContact O-SG 2.93Å; N43-C50 WeakPolarHBondContact OD1-CB 3.37Å; C46-C50 HydrophobicContact CB-CB 4.07Å; C46-C50 VanDerWaalsContact SG-SG 3.69Å
51	E	91.8	Very high	88.8	Confident	72 Å²	72	64 Å²	64	34%	0.336	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	115.7	174.1	-67.3	174.6	-166.7	0	0	109.4	C39 V49 F57 R58	C39-E51 PolarHBondContact SG-N 3.5Å; V49-E51 HydrophobicContact CG1-CG 4.37Å; E51-F57 WeakPolarHBondContact O-CA 3.24Å; E51-R58 HydrophobicContact CB-CG 3.93Å; E51-R58 PolarHBondContact N-O 2.93Å; E51-R58 PolarHBondContact O-N 2.73Å; E51-R58 IonicContact OE2-CZ 3.05Å; E51-R58 IonicContact OE2-NE 3.55Å; E51-R58 PolarHBondContact OE2-NE 3.35Å; E51-R58 IonicContact OE2-NH2 2.67Å; E51-R58 PolarHBondContact OE2-NH2 3.07Å
52	N	90.3	Very high	88.4	Confident	55 Å²	55	59.8 Å²	59.8	29%	0.294	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	137.5	177.2	-168.6	61.5	0	0	0	110.6	D35 I36 D37 E38 C39	D35-N52 PolarHBondContact OD2-ND2 2.89Å; I36-N52 PolarHBondContact O-OD1 2.98Å; D37-N52 WeakPolarHBondContact CA-OD1 3.26Å; E38-N52 PolarHBondContact N-OD1 3.45Å; C39-N52 HydrophobicContact CB-CB 4.4Å; C39-N52 PolarHBondContact SG-N 2.97Å
53	T	91	Very high	87.5	Confident	47 Å²	47	59.6 Å²	59.6	29%	0.288	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	162.8	178.8	71.9	0	0	0	0	109.8	G55 S56	T53-G55 PolarHBondContact O-N 2.77Å; T53-S56 CarbonylContact C-O 3.57Å; T53-S56 WeakPolarHBondContact CA-O 3.41Å; T53-S56 VanDerWaalsContact CB-O 3.32Å; T53-S56 WeakPolarHBondContact CB-O 3.45Å; T53-S56 PolarHBondContact N-O 3.13Å; T53-S56 PolarHBondContact O-N 3.38Å; T53-S56 PolarHBondContact OG1-O 2.71Å
54	I	90.3	Very high	85.9	Confident	143 Å²	143	59.4 Å²	59.4	73%	0.733	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	107	-175.2	-62.6	172.9	0	0	0	109.8	F26 D35	F26-I54 HydrophobicContact CE1-CG2 3.93Å; F26-I54 HydrophobicContact CZ-CG2 3.77Å; D35-I54 WeakPolarHBondContact OD1-CA 3.47Å
55	G	87.8	Confident	84.9	Confident	22 Å²	22	61.6 Å²	61.6	23%	0.227	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.6	9.6	179.9	0	0	0	0	0	115.7	D35 T53	D35-G55 PolarHBondContact OD1-N 2.04Å; T53-G55 PolarHBondContact O-N 2.77Å
56	S	91.1	Very high	84.3	Confident	60 Å²	60	62.7 Å²	62.7	42%	0.42	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.8	167.8	179.9	-174.5	0	0	0	0	110.7	E38 T53	E38-S56 VanDerWaalsContact OE2-CA 3.31Å; E38-S56 WeakPolarHBondContact OE2-CA 3.48Å; T53-S56 CarbonylContact C-O 3.57Å; T53-S56 WeakPolarHBondContact CA-O 3.41Å; T53-S56 VanDerWaalsContact CB-O 3.32Å; T53-S56 WeakPolarHBondContact CB-O 3.45Å; T53-S56 PolarHBondContact N-O 3.13Å; T53-S56 PolarHBondContact O-N 3.38Å; T53-S56 PolarHBondContact OG1-O 2.71Å
57	F	92.6	Very high	84	Confident	50 Å²	50	65.9 Å²	65.9	22%	0.219	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	170.4	164.5	67.7	-74.1	0	0	0	111.5	E38 G44 E51	E38-F57 HydrophobicContact CB-CB 4.06Å; E38-F57 HydrophobicContact CB-CD1 3.32Å; E38-F57 HydrophobicContact CB-CE1 3.94Å; E38-F57 HydrophobicContact CB-CG 3.82Å; E38-F57 HydrophobicContact CG-CD1 3.76Å; E38-F57 HydrophobicContact CG-CE1 4.24Å; E38-F57 WeakPolarHBondContact OE2-CD1 3.3Å; E38-F57 PolarHBondContact OE2-N 2.79Å; G44-F57 WeakPolarHBondContact O-CE2 3.4Å; G44-F57 WeakPolarHBondContact O-CZ 3.41Å; E51-F57 WeakPolarHBondContact O-CA 3.24Å
58	R	92.4	Very high	83.6	Confident	149 Å²	149	62.3 Å²	62.3	56%	0.562	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.6	147.4	167.5	66.4	-177.7	-179.5	-145.3	0.4	111.2	E51	E51-R58 HydrophobicContact CB-CG 3.93Å; E51-R58 PolarHBondContact N-O 2.93Å; E51-R58 PolarHBondContact O-N 2.73Å; E51-R58 IonicContact OE2-CZ 3.05Å; E51-R58 IonicContact OE2-NE 3.55Å; E51-R58 PolarHBondContact OE2-NE 3.35Å; E51-R58 IonicContact OE2-NH2 2.67Å; E51-R58 PolarHBondContact OE2-NH2 3.07Å
59	C	92.2	Very high	83.3	Confident	13 Å²	13	71.7 Å²	71.7	9%	0.088	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	145.2	172.7	-52.1	0	0	0	0	111	C46 V49 L67 G71	C46-C59 WeakPolarHBondContact CA-SG 3.22Å; C46-C59 HydrophobicContact CB-CB 3.59Å; C46-C59 WeakPolarHBondContact CB-SG 3.29Å; C46-C59 WeakPolarHBondContact SG-CA 3.48Å; C46-C59 WeakPolarHBondContact SG-CB 3.21Å; C46-C59 CovalentContact SG-SG 2.02Å; C46-C59 PolarHBondContact SG-SG 2.78Å; V49-C59 CarbonylContact O-C 3.49Å; V49-C59 VanDerWaalsContact O-CA 3.27Å; V49-C59 WeakPolarHBondContact O-CA 3.44Å; C59-L67 HydrophobicContact CB-CD1 3.88Å; C59-L67 WeakPolarHBondContact O-CD2 3.23Å; C59-G71 VanDerWaalsContact CB-O 3.25Å; C59-G71 WeakPolarHBondContact CB-O 3.46Å; C59-G71 PolarHBondContact SG-O 3.38Å
60	S	87.5	Confident	83.1	Confident	38 Å²	38	73.9 Å²	73.9	27%	0.266	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	166.1	168.9	60	0	0	0	0	110.2	V49	V49-S60 WeakPolarHBondContact CB-O 3.44Å; V49-S60 WeakPolarHBondContact CB-OG 3.38Å; V49-S60 WeakPolarHBondContact CG1-OG 3.44Å; V49-S60 PolarHBondContact N-O 2.75Å; V49-S60 PolarHBondContact O-N 3.05Å
61	C	83.7	Confident	82.6	Confident	31 Å²	31	74.4 Å²	74.4	21%	0.209	41%	0.409	C	S	.	.			trans	-121.3	150.2	-175.3	-58.1	0	0	0	0	110.8	Q48 F65 C74	Q48-C61 VanDerWaalsContact OE1-CA 3.25Å; C61-F65 HydrophobicContact CB-CB 3.75Å; C61-C74 VanDerWaalsContact CA-SG 3.56Å; C61-C74 HydrophobicContact CB-CB 3.83Å; C61-C74 WeakPolarHBondContact CB-SG 3.01Å; C61-C74 WeakPolarHBondContact SG-CA 3.45Å; C61-C74 WeakPolarHBondContact SG-CB 3.03Å; C61-C74 CovalentContact SG-SG 2.04Å; C61-C74 PolarHBondContact SG-SG 3.4Å
62	Y	75.9	Confident	82.4	Confident	124 Å²	124	74.4 Å²	74.4	49%	0.486	41%	0.408	S	S	.	.			trans	-62.6	155.4	170.9	-60.2	-52.7	0	0	0	110.9	Q48 V49 G64 F65	Q48-Y62 HydrophobicContact CB-CD2 3.89Å; Q48-Y62 HydrophobicContact CB-CE2 3.81Å; Q48-Y62 VanDerWaalsContact CD-CD2 3.45Å; Q48-Y62 HydrophobicContact CG-CD2 3.78Å; Q48-Y62 HydrophobicContact CG-CE2 3.93Å; V49-Y62 HydrophobicContact CG2-CD1 3.97Å; V49-Y62 HydrophobicContact CG2-CE1 3.48Å; V49-Y62 VanDerWaalsContact CG2-CE1 3.48Å; Y62-G64 PolarHBondContact O-N 3.05Å; Y62-F65 PolarHBondContact O-N 3.26Å; Y62-F65 VanDerWaalsContact O-N 3.15Å
63	P	63.6	Low	81.9	Confident	130 Å²	130	75.2 Å²	75.2	84%	0.844	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	137.5	173.8	-26.6	35.5	0	0	0	112
64	G	54.8	Low	81.2	Confident	57 Å²	57	73.7 Å²	73.7	59%	0.588	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.6	-6.5	-173.6	0	0	0	0	0	114.9	Y62	Y62-G64 PolarHBondContact O-N 3.05Å
65	F	65.9	Low	80.1	Confident	50 Å²	50	71.4 Å²	71.4	22%	0.219	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	154.9	175.3	-61.1	-102.6	0	0	0	112	C61 Y62 C74 I77	C61-F65 HydrophobicContact CB-CB 3.75Å; Y62-F65 PolarHBondContact O-N 3.26Å; Y62-F65 VanDerWaalsContact O-N 3.15Å; F65-C74 HydrophobicContact CB-CB 3.94Å; F65-C74 HydrophobicContact CD1-CB 3.94Å; F65-C74 HydrophobicContact CG-CB 4.22Å; F65-I77 WeakPolarHBondContact CE1-O 3.44Å; F65-I77 WeakPolarHBondContact CE2-O 3.48Å; F65-I77 WeakPolarHBondContact CZ-O 3.41Å
66	T	75.9	Confident	78.8	Confident	92 Å²	92	70.7 Å²	70.7	56%	0.564	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	135.8	176.6	57.7	0	0	0	0	110.6	A68 C74 I75	T66-A68 PolarHBondContact O-N 3.36Å; T66-C74 CarbonylContact O-C 3.45Å; T66-I75 PolarHBondContact N-O 3.14Å; T66-I75 PolarHBondContact O-N 3.27Å; T66-I75 PolarHBondContact OG1-O 3.34Å
67	L	81.7	Confident	76.8	Confident	77 Å²	77	69.2 Å²	69.2	40%	0.403	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	128.1	179.6	-165.9	72.7	0	0	0	110.4	C59 D73	C59-L67 HydrophobicContact CB-CD1 3.88Å; C59-L67 WeakPolarHBondContact O-CD2 3.23Å; L67-D73 CarbonylContact C-O 3.53Å
68	A	78.6	Confident	74.6	Confident	13 Å²	13	70.4 Å²	70.4	11%	0.107	39%	0.385	C	S	.	.			trans	-69.1	165.5	-178.5	0	0	0	0	0	112.4	T66 N70 G71 D73 I75	T66-A68 PolarHBondContact O-N 3.36Å; A68-N70 WeakPolarHBondContact CB-OD1 3.47Å; A68-N70 PolarHBondContact O-N 2.73Å; A68-G71 PolarHBondContact O-N 3.12Å; A68-D73 HydrophobicContact CB-CB 3.74Å; A68-D73 WeakPolarHBondContact CB-O 3.43Å; A68-D73 PolarHBondContact N-O 2.78Å; A68-I75 HydrophobicContact CB-CD1 3.68Å; A68-I75 HydrophobicContact CB-CG1 3.53Å
69	K	81.5	Confident	72.5	Confident	224 Å²	224	72.3 Å²	72.3	97%	0.974	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-17.8	177.9	-70.3	-171.9	178.1	-177.8	0	114.7	G71	K69-G71 VanDerWaalsContact C-N 3.27Å
70	N	83.2	Confident	70.8	Confident	85 Å²	85	81.4 Å²	81.4	46%	0.455	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-4.8	174.1	72.7	-8.9	0	0	0	113.3	A68 K72 D73	A68-N70 WeakPolarHBondContact CB-OD1 3.47Å; A68-N70 PolarHBondContact O-N 2.73Å; N70-K72 VanDerWaalsContact C-N 3.25Å; N70-K72 PolarHBondContact O-N 2.7Å; N70-K72 PolarHBondContact OD1-N 3.18Å; N70-D73 PolarHBondContact ND2-OD1 3.35Å; N70-D73 PolarHBondContact ND2-OD2 2.92Å; N70-D73 PolarHBondContact OD1-N 3.01Å
71	G	83.5	Confident	69.2	Low	30 Å²	30	81.8 Å²	81.8	31%	0.309	43%	0.429	S	S	.	.	S	Bend	trans	70.5	14.8	-178.8	0	0	0	0	0	114.6	C59 A68 K69	C59-G71 VanDerWaalsContact CB-O 3.25Å; C59-G71 WeakPolarHBondContact CB-O 3.46Å; C59-G71 PolarHBondContact SG-O 3.38Å; A68-G71 PolarHBondContact O-N 3.12Å; K69-G71 VanDerWaalsContact C-N 3.27Å
72	K	86.3	Confident	68.2	Low	73 Å²	73	84.2 Å²	84.2	32%	0.317	44%	0.439	S	S	.	.	S	Bend	trans	-133.3	-41.2	-172.8	-70.1	-177.5	175.7	-172.1	0	114.2	T45 V47 N70	T45-K72 VanDerWaalsContact OG1-CE 3.3Å; T45-K72 WeakPolarHBondContact OG1-CE 3.38Å; T45-K72 PolarHBondContact OG1-NZ 2.9Å; V47-K72 PolarHBondContact N-O 2.99Å; N70-K72 VanDerWaalsContact C-N 3.25Å; N70-K72 PolarHBondContact O-N 2.7Å; N70-K72 PolarHBondContact OD1-N 3.18Å
73	D	80.5	Confident	67.8	Low	71 Å²	71	80 Å²	80	38%	0.38	43%	0.425	S	S	.	.			trans	-83.1	151.5	-178.4	-43.7	-19.9	0	0	0	110.8	V47 L67 A68 N70	V47-D73 HydrophobicContact CG2-CB 4.17Å; L67-D73 CarbonylContact C-O 3.53Å; A68-D73 HydrophobicContact CB-CB 3.74Å; A68-D73 WeakPolarHBondContact CB-O 3.43Å; A68-D73 PolarHBondContact N-O 2.78Å; N70-D73 PolarHBondContact ND2-OD1 3.35Å; N70-D73 PolarHBondContact ND2-OD2 2.92Å; N70-D73 PolarHBondContact OD1-N 3.01Å
74	C	76.4	Confident	68.4	Low	16 Å²	16	75.5 Å²	75.5	11%	0.108	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	103.3	174.8	-69	0	0	0	0	108.9	V47 Q48 C61 F65 T66 G76	V47-C74 HydrophobicContact CG1-CB 4.43Å; Q48-C74 HydrophobicContact CG-CB 4.02Å; Q48-C74 PolarHBondContact OE1-SG 2.92Å; Q48-C74 VanDerWaalsContact OE1-SG 3.37Å; C61-C74 VanDerWaalsContact CA-SG 3.56Å; C61-C74 HydrophobicContact CB-CB 3.83Å; C61-C74 WeakPolarHBondContact CB-SG 3.01Å; C61-C74 WeakPolarHBondContact SG-CA 3.45Å; C61-C74 WeakPolarHBondContact SG-CB 3.03Å; C61-C74 CovalentContact SG-SG 2.04Å; C61-C74 PolarHBondContact SG-SG 3.4Å; F65-C74 HydrophobicContact CB-CB 3.94Å; F65-C74 HydrophobicContact CD1-CB 3.94Å; F65-C74 HydrophobicContact CG-CB 4.22Å; T66-C74 CarbonylContact O-C 3.45Å; C74-G76 PolarHBondContact O-N 2.93Å
75	I	67.7	Low	69.6	Low	94 Å²	94	74.9 Å²	74.9	48%	0.482	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	113.6	177.4	-32.4	178	0	0	0	108.5	T66 A68	T66-I75 PolarHBondContact N-O 3.14Å; T66-I75 PolarHBondContact O-N 3.27Å; T66-I75 PolarHBondContact OG1-O 3.34Å; A68-I75 HydrophobicContact CB-CD1 3.68Å; A68-I75 HydrophobicContact CB-CG1 3.53Å
76	G	60.7	Low	69.9	Low	8 Å²	8	80.1 Å²	80.1	8%	0.082	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.6	-170.1	-178.9	0	0	0	0	0	110.6	C74 F79 R80	C74-G76 PolarHBondContact O-N 2.93Å; G76-F79 PolarHBondContact O-N 3.04Å; G76-F79 VanDerWaalsContact O-N 3.16Å; G76-R80 PolarHBondContact O-N 2.79Å
77	I	48.2	Very low	69.1	Low	28 Å²	28	79.3 Å²	79.3	14%	0.144	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	120.6	179.8	-58.6	102.9	0	0	0	108.8	F65 V100 G101	F65-I77 WeakPolarHBondContact CE1-O 3.44Å; F65-I77 WeakPolarHBondContact CE2-O 3.48Å; F65-I77 WeakPolarHBondContact CZ-O 3.41Å; I77-V100 HydrophobicContact CG2-CB 4.34Å; I77-V100 HydrophobicContact CG2-CG1 3.4Å; I77-G101 VanDerWaalsContact CG1-CA 3.45Å; I77-G101 VanDerWaalsContact CG2-CA 3.45Å
78	P	46.9	Very low	67.8	Low	76 Å²	76	85.7 Å²	85.7	49%	0.494	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	cis	-112.6	2.5	38	39	-35.9	0	0	0	116.2	V100	P78-V100 HydrophobicContact CB-CG1 4.31Å
79	F	48.5	Very low	66.7	Low	189 Å²	189	92.1 Å²	92.1	83%	0.829	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-17	-167.9	-72.2	-73.1	0	0	0	115.5	G76	G76-F79 PolarHBondContact O-N 3.04Å; G76-F79 VanDerWaalsContact O-N 3.16Å
80	R	56.4	Low	65.6	Low	203 Å²	203	82.6 Å²	82.6	77%	0.766	41%	0.408	S	S	*	.	S	Bend	trans	-146.6	92.7	155.7	-71	-165.6	-176.6	-161.4	-0.1	108.4	G76 I82	G76-R80 PolarHBondContact O-N 2.79Å; R80-I82 PolarHBondContact O-N 2.81Å
81	D	53.8	Low	65	Low	47 Å²	47	84.1 Å²	84.1	25%	0.251	41%	0.411	S	S	.	.			trans	-55.2	127	167.2	-172.2	60.8	0	0	0	109.9	N83 N98 T99 V100 G101	D81-N83 PolarHBondContact O-N 3.42Å; D81-N98 PolarHBondContact OD2-ND2 3.11Å; D81-T99 VanDerWaalsContact OD1-O 3.14Å; D81-V100 WeakPolarHBondContact OD1-CA 3.29Å; D81-G101 PolarHBondContact OD1-N 3.09Å
82	I	61.9	Low	64.8	Low	81 Å²	81	83.8 Å²	83.8	42%	0.415	40%	0.403	S	S	.	.			trans	-87.3	95.6	179	-61.1	177.6	0	0	0	105.6	R80 E84	R80-I82 PolarHBondContact O-N 2.81Å; I82-E84 HydrophobicContact CG2-CG 4.49Å; I82-E84 WeakPolarHBondContact O-CG 3.28Å; I82-E84 PolarHBondContact O-N 2.88Å
83	N	68.6	Low	64.6	Low	35 Å²	35	85.7 Å²	85.7	19%	0.187	41%	0.413	C	S	.	.			trans	-60.9	98.7	178.8	-173.6	-17.9	0	0	0	110.4	D81 C85 E86 N87 N98	D81-N83 PolarHBondContact O-N 3.42Å; N83-C85 PolarHBondContact O-N 2.79Å; N83-C85 WeakPolarHBondContact OD1-CA 3.32Å; N83-C85 VanDerWaalsContact OD1-CB 3.32Å; N83-C85 WeakPolarHBondContact OD1-CB 3.46Å; N83-C85 PolarHBondContact OD1-N 3.22Å; N83-E86 HydrophobicContact CB-CB 4.04Å; N83-E86 HydrophobicContact CB-CG 4.33Å; N83-E86 VanDerWaalsContact ND2-CG 3.32Å; N83-E86 WeakPolarHBondContact ND2-CG 2.89Å; N83-E86 PolarHBondContact ND2-OE1 3.01Å; N83-E86 PolarHBondContact O-N 3.42Å; N83-E86 PolarHBondContact OD1-N 2.78Å; N83-N87 PolarHBondContact O-N 3.39Å; N83-N87 VanDerWaalsContact O-N 3.16Å; N83-N87 PolarHBondContact O-ND2 3.44Å; N83-N98 VanDerWaalsContact CA-OD1 3.31Å; N83-N98 WeakPolarHBondContact CA-OD1 3.37Å; N83-N98 PolarHBondContact OD1-OD1 3.39Å
84	E	74.8	Confident	64.8	Low	36 Å²	36	85 Å²	85	17%	0.168	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-12.8	-176.8	-68.6	104.1	173.2	0	0	112	I82 G90 N98 Y103	I82-E84 HydrophobicContact CG2-CG 4.49Å; I82-E84 WeakPolarHBondContact O-CG 3.28Å; I82-E84 PolarHBondContact O-N 2.88Å; E84-G90 WeakPolarHBondContact O-CA 3.23Å; E84-G90 PolarHBondContact O-N 2.94Å; E84-N98 PolarHBondContact N-OD1 2.91Å; E84-Y103 HydrophobicContact CB-CD1 3.29Å; E84-Y103 HydrophobicContact CB-CE1 3.78Å; E84-Y103 HydrophobicContact CB-CG 3.79Å; E84-Y103 HydrophobicContact CG-CD1 3.62Å; E84-Y103 HydrophobicContact CG-CE1 3.98Å; E84-Y103 WeakPolarHBondContact OE2-CD1 3.49Å; E84-Y103 PolarHBondContact OE2-N 2.9Å
85	C	80.1	Confident	65	Low	45 Å²	45	88.9 Å²	88.9	30%	0.304	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-27.7	173.6	-50.4	0	0	0	0	113	N83 C96 N98	N83-C85 PolarHBondContact O-N 2.79Å; N83-C85 WeakPolarHBondContact OD1-CA 3.32Å; N83-C85 VanDerWaalsContact OD1-CB 3.32Å; N83-C85 WeakPolarHBondContact OD1-CB 3.46Å; N83-C85 PolarHBondContact OD1-N 3.22Å; C85-C96 WeakPolarHBondContact CA-SG 3.06Å; C85-C96 HydrophobicContact CB-CB 3.65Å; C85-C96 WeakPolarHBondContact CB-SG 3.31Å; C85-C96 WeakPolarHBondContact SG-CB 3.08Å; C85-C96 PolarHBondContact SG-O 2.83Å; C85-C96 CovalentContact SG-SG 2.04Å; C85-C96 PolarHBondContact SG-SG 2.81Å; C85-N98 PolarHBondContact SG-N 3.27Å; C85-N98 VanDerWaalsContact SG-N 3.42Å
86	E	72.4	Confident	65.8	Low	159 Å²	159	86.1 Å²	86.1	74%	0.743	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-36.9	171.2	-87.4	173.3	-145.2	0	0	112.3	N83	N83-E86 HydrophobicContact CB-CB 4.04Å; N83-E86 HydrophobicContact CB-CG 4.33Å; N83-E86 VanDerWaalsContact ND2-CG 3.32Å; N83-E86 WeakPolarHBondContact ND2-CG 2.89Å; N83-E86 PolarHBondContact ND2-OE1 3.01Å; N83-E86 PolarHBondContact O-N 3.42Å; N83-E86 PolarHBondContact OD1-N 2.78Å
87	N	59.9	Low	66.9	Low	75 Å²	75	88.1 Å²	88.1	40%	0.401	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	147.2	165.6	-70.2	-77.5	0	0	0	109.2	N83 R89	N83-N87 PolarHBondContact O-N 3.39Å; N83-N87 VanDerWaalsContact O-N 3.16Å; N83-N87 PolarHBondContact O-ND2 3.44Å; N87-R89 HydrophobicContact CB-CB 4.11Å; N87-R89 HydrophobicContact CB-CG 4.07Å; N87-R89 PolarHBondContact O-N 2.99Å
88	K	54.9	Low	68.1	Low	212 Å²	212	89.1 Å²	89.1	92%	0.922	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	50.2	170.4	-63.4	-175.8	179.1	-178.2	0	111.6
89	R	54.2	Low	69.2	Low	148 Å²	148	88 Å²	88	56%	0.558	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.5	-23.2	-174.2	-74.7	-176.2	174.6	-175.5	-2.2	112.7	N87 F91	N87-R89 HydrophobicContact CB-CB 4.11Å; N87-R89 HydrophobicContact CB-CG 4.07Å; N87-R89 PolarHBondContact O-N 2.99Å; R89-F91 VanDerWaalsContact O-CD2 3.23Å; R89-F91 WeakPolarHBondContact O-CD2 3.24Å; R89-F91 WeakPolarHBondContact O-CE2 3.17Å; R89-F91 PolarHBondContact O-N 3.06Å
90	G	58.6	Low	69.9	Low	24 Å²	24	84.3 Å²	84.3	25%	0.247	41%	0.414	C	S	.	.			trans	-62.9	102.8	171.5	0	0	0	0	0	110.6	E84 C92	E84-G90 WeakPolarHBondContact O-CA 3.23Å; E84-G90 PolarHBondContact O-N 2.94Å; G90-C92 PolarHBondContact O-N 3.34Å
91	F	70.8	Confident	70	Confident	117 Å²	117	76.3 Å²	76.3	51%	0.513	40%	0.395	S	S	.	.			trans	-69.9	19.7	-177.1	-68.2	-74.5	0	0	0	114.8	R89 Y103 Y118	R89-F91 VanDerWaalsContact O-CD2 3.23Å; R89-F91 WeakPolarHBondContact O-CD2 3.24Å; R89-F91 WeakPolarHBondContact O-CE2 3.17Å; R89-F91 PolarHBondContact O-N 3.06Å; F91-Y103 WeakPolarHBondContact CD2-OH 3.45Å; F91-Y103 PolarHBondContact N-OH 2.89Å; F91-Y118 HydrophobicContact CB-CD1 3.79Å; F91-Y118 HydrophobicContact CB-CE1 4.24Å; F91-Y118 HydrophobicContact CB-CG 4.17Å
92	C	79.9	Confident	70.6	Confident	22 Å²	22	77 Å²	77	15%	0.149	40%	0.403	C	S	.	.			trans	-73.1	132.3	-174.3	-55.9	0	0	0	0	112.6	G90 M95 C96 C105	G90-C92 PolarHBondContact O-N 3.34Å; C92-M95 VanDerWaalsContact CB-O 3.32Å; C92-M95 WeakPolarHBondContact CB-O 3.49Å; C92-C96 HydrophobicContact CB-CB 4.11Å; C92-C96 VanDerWaalsContact SG-CA 3.58Å; C92-C96 VanDerWaalsContact SG-CB 3.58Å; C92-C105 WeakPolarHBondContact CA-SG 3.29Å; C92-C105 HydrophobicContact CB-CB 3.55Å; C92-C105 WeakPolarHBondContact CB-SG 3.23Å; C92-C105 WeakPolarHBondContact SG-CA 3.35Å; C92-C105 WeakPolarHBondContact SG-CB 3.39Å; C92-C105 CovalentContact SG-SG 2.03Å; C92-C105 PolarHBondContact SG-SG 2.93Å
93	H	81.3	Confident	71.5	Confident	113 Å²	113	74.6 Å²	74.6	52%	0.523	39%	0.389	S	S	.	.	S	Bend	trans	-66.9	-37.2	176.7	-179.6	-158.6	0	0	0	112.6	Y118 C120	H93-Y118 WeakPolarHBondContact CB-O 3.49Å; H93-Y118 PolarHBondContact N-O 3.38Å; H93-C120 HydrophobicContact CB-CB 4.09Å; H93-C120 VanDerWaalsContact CB-N 3.34Å; H93-C120 PolarHBondContact CE1-O 3.15Å; H93-C120 VanDerWaalsContact CE1-O 3.22Å; H93-C120 WeakPolarHBondContact ND1-CB 3.28Å; H93-C120 PolarHBondContact ND1-N 3.42Å; H93-C120 VanDerWaalsContact ND1-N 3.15Å; H93-C120 PolarHBondContact ND1-O 3.18Å
94	H	84.4	Confident	72.3	Confident	56 Å²	56	77.3 Å²	77.3	26%	0.259	40%	0.4	S	S	.	.	S	Bend	trans	-115	-90.3	178.6	-68.8	-177.5	0	0	0	111.6	T106 N108 Y111 C120	H94-T106 WeakPolarHBondContact CB-O 3.22Å; H94-N108 PolarHBondContact ND1-N 2.94Å; H94-Y111 AromaticContact CE1-CD1 3.5Å; H94-Y111 VanDerWaalsContact CE1-CD1 3.5Å; H94-Y111 WeakPolarHBondContact CE1-CD1 3.39Å; H94-Y111 AromaticContact CE1-CD2 3.74Å; H94-Y111 AromaticContact CE1-CE1 3.9Å; H94-Y111 AromaticContact CE1-CG 3.43Å; H94-Y111 VanDerWaalsContact CE1-CG 3.43Å; H94-Y111 AromaticContact NE2-CD1 3.92Å; H94-C120 HydrophobicContact CB-CB 4.41Å; H94-C120 VanDerWaalsContact CG-SG 3.53Å
95	M	82.2	Confident	72.7	Confident	98 Å²	98	75.8 Å²	75.8	48%	0.483	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	143.4	-177.9	-81.9	173.7	66.2	0	0	111	C92 C105 T106 N108	C92-M95 VanDerWaalsContact CB-O 3.32Å; C92-M95 WeakPolarHBondContact CB-O 3.49Å; M95-C105 CarbonylContact O-C 3.6Å; M95-C105 VanDerWaalsContact O-CA 3.31Å; M95-C105 WeakPolarHBondContact O-CA 3.17Å; M95-T106 VanDerWaalsContact CB-OG1 3.23Å; M95-T106 WeakPolarHBondContact CB-OG1 3.08Å; M95-T106 PolarHBondContact N-O 2.83Å; M95-T106 PolarHBondContact O-N 3.4Å; M95-N108 VanDerWaalsContact CG-OD1 3.23Å; M95-N108 WeakPolarHBondContact CG-OD1 3.34Å; M95-N108 PolarHBondContact SD-OD1 3.44Å
96	C	84.3	Confident	72.9	Confident	36 Å²	36	75.9 Å²	75.9	24%	0.243	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	130.1	170.8	-178.2	0	0	0	0	108	C85 C92 Y103	C85-C96 WeakPolarHBondContact CA-SG 3.06Å; C85-C96 HydrophobicContact CB-CB 3.65Å; C85-C96 WeakPolarHBondContact CB-SG 3.31Å; C85-C96 WeakPolarHBondContact SG-CB 3.08Å; C85-C96 PolarHBondContact SG-O 2.83Å; C85-C96 CovalentContact SG-SG 2.04Å; C85-C96 PolarHBondContact SG-SG 2.81Å; C92-C96 HydrophobicContact CB-CB 4.11Å; C92-C96 VanDerWaalsContact SG-CA 3.58Å; C92-C96 VanDerWaalsContact SG-CB 3.58Å; C96-Y103 VanDerWaalsContact SG-CD2 3.53Å
97	V	83.3	Confident	73.4	Confident	50 Å²	50	69.6 Å²	69.6	30%	0.303	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	113.8	176.7	-176.8	0	0	0	0	108	Y103 H104 T106	V97-Y103 WeakPolarHBondContact O-CA 3.28Å; V97-H104 WeakPolarHBondContact CG1-CE1 3.45Å; V97-H104 PolarHBondContact N-O 2.03Å; V97-H104 PolarHBondContact O-N 3.49Å; V97-T106 HydrophobicContact CG2-CG2 3.76Å
98	N	73.9	Confident	74.4	Confident	50 Å²	50	70.1 Å²	70.1	27%	0.267	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	140.6	-179.2	-166.4	57.6	0	0	0	110.6	D81 N83 E84 C85	D81-N98 PolarHBondContact OD2-ND2 3.11Å; N83-N98 VanDerWaalsContact CA-OD1 3.31Å; N83-N98 WeakPolarHBondContact CA-OD1 3.37Å; N83-N98 PolarHBondContact OD1-OD1 3.39Å; E84-N98 PolarHBondContact N-OD1 2.91Å; C85-N98 PolarHBondContact SG-N 3.27Å; C85-N98 VanDerWaalsContact SG-N 3.42Å
99	T	68.8	Low	75.2	Confident	51 Å²	51	63.8 Å²	63.8	31%	0.313	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	149.9	179.2	52.7	0	0	0	0	109.5	D81 G101 S102 H104	D81-T99 VanDerWaalsContact OD1-O 3.14Å; T99-G101 VanDerWaalsContact C-N 3.33Å; T99-G101 PolarHBondContact O-N 3.43Å; T99-S102 CarbonylContact C-O 3.54Å; T99-S102 WeakPolarHBondContact CA-O 3.13Å; T99-S102 PolarHBondContact N-O 3.11Å; T99-S102 PolarHBondContact O-N 2.9Å; T99-S102 PolarHBondContact OG1-O 3.22Å; T99-H104 WeakPolarHBondContact CG2-ND1 3.41Å
100	V	63.2	Low	75.3	Confident	113 Å²	113	60.8 Å²	60.8	69%	0.685	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	93.4	178.5	-179.7	0	0	0	0	109.1	I77 P78 D81	I77-V100 HydrophobicContact CG2-CB 4.34Å; I77-V100 HydrophobicContact CG2-CG1 3.4Å; P78-V100 HydrophobicContact CB-CG1 4.31Å; D81-V100 WeakPolarHBondContact OD1-CA 3.29Å
101	G	58.7	Low	76	Confident	34 Å²	34	62.7 Å²	62.7	35%	0.351	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	130.3	-19.7	-176.8	0	0	0	0	0	116.2	I77 D81 T99	I77-G101 VanDerWaalsContact CG1-CA 3.45Å; I77-G101 VanDerWaalsContact CG2-CA 3.45Å; D81-G101 PolarHBondContact OD1-N 3.09Å; T99-G101 VanDerWaalsContact C-N 3.33Å; T99-G101 PolarHBondContact O-N 3.43Å
102	S	67.3	Low	75.9	Confident	61 Å²	61	60.7 Å²	60.7	43%	0.427	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.8	-176.4	-161.9	-165.9	0	0	0	0	110.9	T99	T99-S102 CarbonylContact C-O 3.54Å; T99-S102 WeakPolarHBondContact CA-O 3.13Å; T99-S102 PolarHBondContact N-O 3.11Å; T99-S102 PolarHBondContact O-N 2.9Å; T99-S102 PolarHBondContact OG1-O 3.22Å
103	Y	79.4	Confident	75.6	Confident	32 Å²	32	63.3 Å²	63.3	13%	0.125	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	155.8	163	68.9	-76	0	0	0	109.8	E84 F91 C96 V97 Y118	E84-Y103 HydrophobicContact CB-CD1 3.29Å; E84-Y103 HydrophobicContact CB-CE1 3.78Å; E84-Y103 HydrophobicContact CB-CG 3.79Å; E84-Y103 HydrophobicContact CG-CD1 3.62Å; E84-Y103 HydrophobicContact CG-CE1 3.98Å; E84-Y103 WeakPolarHBondContact OE2-CD1 3.49Å; E84-Y103 PolarHBondContact OE2-N 2.9Å; F91-Y103 WeakPolarHBondContact CD2-OH 3.45Å; F91-Y103 PolarHBondContact N-OH 2.89Å; C96-Y103 VanDerWaalsContact SG-CD2 3.53Å; V97-Y103 WeakPolarHBondContact O-CA 3.28Å; Y103-Y118 HydrophobicContact CE2-CD1 4.29Å; Y103-Y118 AromaticContact CE2-CE1 3.82Å; Y103-Y118 HydrophobicContact CE2-CE1 3.82Å; Y103-Y118 AromaticContact CZ-CE1 3.78Å; Y103-Y118 VanDerWaalsContact OH-CE1 3.22Å; Y103-Y118 WeakPolarHBondContact OH-CE1 3.4Å
104	H	85.2	Confident	75.2	Confident	91 Å²	91	58.8 Å²	58.8	42%	0.421	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	153.5	169.9	66.4	-83.9	0	0	0	110.5	V97 T99	V97-H104 WeakPolarHBondContact CG1-CE1 3.45Å; V97-H104 PolarHBondContact N-O 2.03Å; V97-H104 PolarHBondContact O-N 3.49Å; T99-H104 WeakPolarHBondContact CG2-ND1 3.41Å
105	C	84.9	Confident	74.4	Confident	5 Å²	5	61.5 Å²	61.5	3%	0.034	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	139.7	-179.2	-56.7	0	0	0	0	110.9	C92 M95 L113 G117 Y118	C92-C105 WeakPolarHBondContact CA-SG 3.29Å; C92-C105 HydrophobicContact CB-CB 3.55Å; C92-C105 WeakPolarHBondContact CB-SG 3.23Å; C92-C105 WeakPolarHBondContact SG-CA 3.35Å; C92-C105 WeakPolarHBondContact SG-CB 3.39Å; C92-C105 CovalentContact SG-SG 2.03Å; C92-C105 PolarHBondContact SG-SG 2.93Å; M95-C105 CarbonylContact O-C 3.6Å; M95-C105 VanDerWaalsContact O-CA 3.31Å; M95-C105 WeakPolarHBondContact O-CA 3.17Å; C105-L113 HydrophobicContact CB-CD1 3.78Å; C105-L113 WeakPolarHBondContact O-CD2 3.12Å; C105-G117 WeakPolarHBondContact CB-O 3.44Å; C105-G117 PolarHBondContact SG-O 3.2Å; C105-Y118 VanDerWaalsContact SG-CD1 3.56Å
106	T	83.2	Confident	74	Confident	46 Å²	46	60.7 Å²	60.7	28%	0.282	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	156.4	175.6	57.4	0	0	0	0	110.1	H94 M95 V97	H94-T106 WeakPolarHBondContact CB-O 3.22Å; M95-T106 VanDerWaalsContact CB-OG1 3.23Å; M95-T106 WeakPolarHBondContact CB-OG1 3.08Å; M95-T106 PolarHBondContact N-O 2.83Å; M95-T106 PolarHBondContact O-N 3.4Å; V97-T106 HydrophobicContact CG2-CG2 3.76Å
107	C	82.9	Confident	73.5	Confident	28 Å²	28	60.4 Å²	60.4	19%	0.189	39%	0.387	C	S	.	.			trans	-117.8	119.5	-168.2	-65.2	0	0	0	0	112.5	G109 Y111 C120	C107-G109 PolarHBondContact O-N 3.46Å; C107-Y111 WeakPolarHBondContact CB-O 3.17Å; C107-C120 WeakPolarHBondContact CA-SG 3.04Å; C107-C120 HydrophobicContact CB-CB 3.78Å; C107-C120 WeakPolarHBondContact CB-SG 2.97Å; C107-C120 WeakPolarHBondContact SG-CA 3.41Å; C107-C120 WeakPolarHBondContact SG-CB 2.99Å; C107-C120 CovalentContact SG-SG 2.04Å; C107-C120 PolarHBondContact SG-SG 2.78Å
108	N	80.8	Confident	73.4	Confident	85 Å²	85	62.7 Å²	62.7	46%	0.455	39%	0.391	S	S	.	.	S	Bend	trans	-57.3	129.9	175.9	-59.3	11.2	0	0	0	112.2	H94 M95 Y111	H94-N108 PolarHBondContact ND1-N 2.94Å; M95-N108 VanDerWaalsContact CG-OD1 3.23Å; M95-N108 WeakPolarHBondContact CG-OD1 3.34Å; M95-N108 PolarHBondContact SD-OD1 3.44Å; N108-Y111 VanDerWaalsContact O-CD2 3.3Å; N108-Y111 WeakPolarHBondContact O-CD2 2.99Å
109	G	72.2	Confident	73.6	Confident	79 Å²	79	62.4 Å²	62.4	81%	0.814	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	-133.8	172.3	0	0	0	0	0	113.5	C107 Y111	C107-G109 PolarHBondContact O-N 3.46Å; G109-Y111 VanDerWaalsContact C-N 3.33Å; G109-Y111 PolarHBondContact O-N 2.82Å
110	S	54.9	Low	74.2	Confident	86 Å²	86	60.2 Å²	60.2	60%	0.601	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	27	-173.8	55.4	0	0	0	0	114.7
111	Y	73.7	Confident	74.5	Confident	64 Å²	64	59.8 Å²	59.8	25%	0.251	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	138.2	175.4	-67.7	-119	0	0	0	109.1	H94 C107 N108 G109 C120 L121 K122	H94-Y111 AromaticContact CE1-CD1 3.5Å; H94-Y111 VanDerWaalsContact CE1-CD1 3.5Å; H94-Y111 WeakPolarHBondContact CE1-CD1 3.39Å; H94-Y111 AromaticContact CE1-CD2 3.74Å; H94-Y111 AromaticContact CE1-CE1 3.9Å; H94-Y111 AromaticContact CE1-CG 3.43Å; H94-Y111 VanDerWaalsContact CE1-CG 3.43Å; H94-Y111 AromaticContact NE2-CD1 3.92Å; C107-Y111 WeakPolarHBondContact CB-O 3.17Å; N108-Y111 VanDerWaalsContact O-CD2 3.3Å; N108-Y111 WeakPolarHBondContact O-CD2 2.99Å; G109-Y111 VanDerWaalsContact C-N 3.33Å; G109-Y111 PolarHBondContact O-N 2.82Å; Y111-C120 HydrophobicContact CD1-CB 4.5Å; Y111-L121 WeakPolarHBondContact CA-O 3.39Å; Y111-K122 HydrophobicContact CD1-CB 3.65Å; Y111-K122 HydrophobicContact CD1-CG 4.03Å; Y111-K122 HydrophobicContact CE1-CB 3.45Å; Y111-K122 VanDerWaalsContact CE1-CB 3.45Å; Y111-K122 HydrophobicContact CE1-CD 3.73Å; Y111-K122 HydrophobicContact CE1-CG 3.55Å; Y111-K122 HydrophobicContact CE2-CG 4.24Å; Y111-K122 HydrophobicContact CG-CB 4.44Å; Y111-K122 WeakPolarHBondContact OH-CD 3.33Å; Y111-K122 VanDerWaalsContact OH-CE 3.24Å; Y111-K122 WeakPolarHBondContact OH-CE 3.24Å; Y111-K122 PolarHBondContact OH-NZ 3.23Å
112	L	69	Low	74.5	Confident	75 Å²	75	64.7 Å²	64.7	39%	0.393	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	143.9	177.5	-64.2	173	0	0	0	109.9	A114 C120 L121 R123	L112-A114 PolarHBondContact O-N 3.28Å; L112-C120 CarbonylContact O-C 3.32Å; L112-C120 WeakPolarHBondContact O-CA 3.39Å; L112-L121 PolarHBondContact N-O 2.97Å; L112-L121 PolarHBondContact O-N 3.35Å; L112-R123 HydrophobicContact CD1-CG 3.8Å; L112-R123 HydrophobicContact CG-CG 3.92Å
113	L	74.8	Confident	73.7	Confident	76 Å²	76	65.6 Å²	65.6	40%	0.398	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	132.4	169.4	-166	69.3	0	0	0	109.1	C105	C105-L113 HydrophobicContact CB-CD1 3.78Å; C105-L113 WeakPolarHBondContact O-CD2 3.12Å
114	A	72.3	Confident	72.2	Confident	18 Å²	18	75.8 Å²	75.8	15%	0.149	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-74	166	177.5	0	0	0	0	0	111.3	L112 D116 G117 S119 L121	L112-A114 PolarHBondContact O-N 3.28Å; A114-D116 WeakPolarHBondContact CB-OD1 3.26Å; A114-D116 PolarHBondContact O-N 3.1Å; A114-G117 PolarHBondContact O-N 3.46Å; A114-S119 WeakPolarHBondContact CB-O 3.02Å; A114-S119 PolarHBondContact N-O 3.42Å; A114-L121 HydrophobicContact CB-CD1 3.6Å; A114-L121 HydrophobicContact CB-CG 3.89Å
115	A	67.8	Low	70.1	Confident	114 Å²	114	75.1 Å²	75.1	94%	0.942	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-6.3	174.9	0	0	0	0	0	114.6
116	D	72.8	Confident	68	Low	81 Å²	81	80.9 Å²	80.9	43%	0.433	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-11.3	170.8	64.2	13.1	0	0	0	113.3	A114 Y118 S119	A114-D116 WeakPolarHBondContact CB-OD1 3.26Å; A114-D116 PolarHBondContact O-N 3.1Å; D116-Y118 VanDerWaalsContact C-N 3.25Å; D116-Y118 WeakPolarHBondContact O-CD2 3.26Å; D116-Y118 VanDerWaalsContact O-CE2 3.31Å; D116-Y118 WeakPolarHBondContact O-CE2 3.46Å; D116-Y118 PolarHBondContact O-N 3.29Å; D116-Y118 PolarHBondContact OD1-N 3.45Å; D116-S119 WeakPolarHBondContact OD1-CB 3.47Å; D116-S119 PolarHBondContact OD1-N 2.66Å; D116-S119 VanDerWaalsContact OD2-CB 3.23Å; D116-S119 WeakPolarHBondContact OD2-CB 3.31Å; D116-S119 PolarHBondContact OD2-OG 2.94Å
117	G	74.2	Confident	66.3	Low	29 Å²	29	88 Å²	88	30%	0.299	47%	0.473	S	S	.	.	S	Bend	trans	77.4	3.1	-177.5	0	0	0	0	0	115	C105 A114	C105-G117 WeakPolarHBondContact CB-O 3.44Å; C105-G117 PolarHBondContact SG-O 3.2Å; A114-G117 PolarHBondContact O-N 3.46Å
118	Y	81.1	Confident	64.9	Low	99 Å²	99	88.4 Å²	88.4	39%	0.388	48%	0.477	S	S	.	.	S	Bend	trans	-128.3	-39.3	-171.8	-62.2	-63.1	0	0	0	113.4	F91 H93 Y103 C105 D116	F91-Y118 HydrophobicContact CB-CD1 3.79Å; F91-Y118 HydrophobicContact CB-CE1 4.24Å; F91-Y118 HydrophobicContact CB-CG 4.17Å; H93-Y118 WeakPolarHBondContact CB-O 3.49Å; H93-Y118 PolarHBondContact N-O 3.38Å; Y103-Y118 HydrophobicContact CE2-CD1 4.29Å; Y103-Y118 AromaticContact CE2-CE1 3.82Å; Y103-Y118 HydrophobicContact CE2-CE1 3.82Å; Y103-Y118 AromaticContact CZ-CE1 3.78Å; Y103-Y118 VanDerWaalsContact OH-CE1 3.22Å; Y103-Y118 WeakPolarHBondContact OH-CE1 3.4Å; C105-Y118 VanDerWaalsContact SG-CD1 3.56Å; D116-Y118 VanDerWaalsContact C-N 3.25Å; D116-Y118 WeakPolarHBondContact O-CD2 3.26Å; D116-Y118 VanDerWaalsContact O-CE2 3.31Å; D116-Y118 WeakPolarHBondContact O-CE2 3.46Å; D116-Y118 PolarHBondContact O-N 3.29Å; D116-Y118 PolarHBondContact OD1-N 3.45Å
119	S	78.7	Confident	63.9	Low	44 Å²	44	85.9 Å²	85.9	31%	0.308	47%	0.465	S	S	.	.			trans	-88.2	123.7	-171.4	-63.3	0	0	0	0	112.3	A114 D116 L121	A114-S119 WeakPolarHBondContact CB-O 3.02Å; A114-S119 PolarHBondContact N-O 3.42Å; D116-S119 WeakPolarHBondContact OD1-CB 3.47Å; D116-S119 PolarHBondContact OD1-N 2.66Å; D116-S119 VanDerWaalsContact OD2-CB 3.23Å; D116-S119 WeakPolarHBondContact OD2-CB 3.31Å; D116-S119 PolarHBondContact OD2-OG 2.94Å; S119-L121 PolarHBondContact O-N 3.06Å
120	C	80.5	Confident	63.3	Low	4 Å²	4	88.9 Å²	88.9	3%	0.027	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	107.9	171.3	-64.8	0	0	0	0	111.1	H93 H94 C107 Y111 L112	H93-C120 HydrophobicContact CB-CB 4.09Å; H93-C120 VanDerWaalsContact CB-N 3.34Å; H93-C120 PolarHBondContact CE1-O 3.15Å; H93-C120 VanDerWaalsContact CE1-O 3.22Å; H93-C120 WeakPolarHBondContact ND1-CB 3.28Å; H93-C120 PolarHBondContact ND1-N 3.42Å; H93-C120 VanDerWaalsContact ND1-N 3.15Å; H93-C120 PolarHBondContact ND1-O 3.18Å; H94-C120 HydrophobicContact CB-CB 4.41Å; H94-C120 VanDerWaalsContact CG-SG 3.53Å; C107-C120 WeakPolarHBondContact CA-SG 3.04Å; C107-C120 HydrophobicContact CB-CB 3.78Å; C107-C120 WeakPolarHBondContact CB-SG 2.97Å; C107-C120 WeakPolarHBondContact SG-CA 3.41Å; C107-C120 WeakPolarHBondContact SG-CB 2.99Å; C107-C120 CovalentContact SG-SG 2.04Å; C107-C120 PolarHBondContact SG-SG 2.78Å; Y111-C120 HydrophobicContact CD1-CB 4.5Å; L112-C120 CarbonylContact O-C 3.32Å; L112-C120 WeakPolarHBondContact O-CA 3.39Å
121	L	69.9	Low	63.6	Low	104 Å²	104	96.3 Å²	96.3	55%	0.545	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	118.6	177.3	-65.6	173.2	0	0	0	110.2	Y111 L112 A114 S119 R123	Y111-L121 WeakPolarHBondContact CA-O 3.39Å; L112-L121 PolarHBondContact N-O 2.97Å; L112-L121 PolarHBondContact O-N 3.35Å; A114-L121 HydrophobicContact CB-CD1 3.6Å; A114-L121 HydrophobicContact CB-CG 3.89Å; S119-L121 PolarHBondContact O-N 3.06Å; L121-R123 PolarHBondContact O-N 3.26Å
122	K	58.6	Low	63	Low	138 Å²	138	95.9 Å²	95.9	60%	0.6	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.7	127	166.8	-153.5	164.2	-168	155.8	0	107.6	Y111 R124	Y111-K122 HydrophobicContact CD1-CB 3.65Å; Y111-K122 HydrophobicContact CD1-CG 4.03Å; Y111-K122 HydrophobicContact CE1-CB 3.45Å; Y111-K122 VanDerWaalsContact CE1-CB 3.45Å; Y111-K122 HydrophobicContact CE1-CD 3.73Å; Y111-K122 HydrophobicContact CE1-CG 3.55Å; Y111-K122 HydrophobicContact CE2-CG 4.24Å; Y111-K122 HydrophobicContact CG-CB 4.44Å; Y111-K122 WeakPolarHBondContact OH-CD 3.33Å; Y111-K122 VanDerWaalsContact OH-CE 3.24Å; Y111-K122 WeakPolarHBondContact OH-CE 3.24Å; Y111-K122 PolarHBondContact OH-NZ 3.23Å; K122-R124 PolarHBondContact O-N 3.04Å
123	R	50.3	Low	63.1	Low	80 Å²	80	95 Å²	95	30%	0.302	49%	0.489	S	S	.	.			trans	-53.4	97.2	-178.5	-77.5	-174.4	80.4	164.2	2.6	110.6	L112 L121 Y125 E141	L112-R123 HydrophobicContact CD1-CG 3.8Å; L112-R123 HydrophobicContact CG-CG 3.92Å; L121-R123 PolarHBondContact O-N 3.26Å; R123-Y125 VanDerWaalsContact C-N 3.26Å; R123-Y125 HydrophobicContact CB-CD2 3.93Å; R123-Y125 HydrophobicContact CB-CE2 3.72Å; R123-Y125 HydrophobicContact CG-CE2 4.5Å; R123-Y125 VanDerWaalsContact CZ-CE1 3.48Å; R123-Y125 VanDerWaalsContact CZ-CZ 3.49Å; R123-Y125 VanDerWaalsContact NE-CZ 3.32Å; R123-Y125 PolarHBondContact NE-OH 3.26Å; R123-Y125 PolarHBondContact NH1-OH 3.38Å; R123-Y125 VanDerWaalsContact NH2-CE1 3.34Å; R123-Y125 PolarHBondContact O-N 3.48Å; R123-E141 PolarHBondContact NH1-O 3.21Å; R123-E141 PolarHBondContact NH2-O 3.42Å
124	R	47.8	Very low	63.3	Low	245 Å²	245	92.9 Å²	92.9	93%	0.925	48%	0.48	S	S	*	.			trans	-73.2	91	161	-79.4	-168.5	179.1	-178.8	2	105.9	K122 S126	K122-R124 PolarHBondContact O-N 3.04Å; R124-S126 PolarHBondContact O-N 3.31Å
125	Y	41.2	Very low	63.8	Low	78 Å²	78	96.8 Å²	96.8	31%	0.306	50%	0.495	S	S	.	.			trans	-62	87.2	173.9	-82	-80.2	0	0	0	110.9	R123 R127 S128 K140 E141	R123-Y125 VanDerWaalsContact C-N 3.26Å; R123-Y125 HydrophobicContact CB-CD2 3.93Å; R123-Y125 HydrophobicContact CB-CE2 3.72Å; R123-Y125 HydrophobicContact CG-CE2 4.5Å; R123-Y125 VanDerWaalsContact CZ-CE1 3.48Å; R123-Y125 VanDerWaalsContact CZ-CZ 3.49Å; R123-Y125 VanDerWaalsContact NE-CZ 3.32Å; R123-Y125 PolarHBondContact NE-OH 3.26Å; R123-Y125 PolarHBondContact NH1-OH 3.38Å; R123-Y125 VanDerWaalsContact NH2-CE1 3.34Å; R123-Y125 PolarHBondContact O-N 3.48Å; Y125-R127 PolarHBondContact O-N 3.49Å; Y125-S128 PolarHBondContact O-N 2.04Å; Y125-K140 WeakPolarHBondContact CE1-O 3.39Å; Y125-K140 VanDerWaalsContact CZ-O 3.25Å; Y125-K140 PolarHBondContact OH-O 3.15Å; Y125-E141 VanDerWaalsContact OH-CA 3.32Å; Y125-E141 WeakPolarHBondContact OH-CA 3.15Å
126	S	41.3	Very low	64.5	Low	126 Å²	126	93.2 Å²	93.2	88%	0.881	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	16.3	160	-146.8	0	0	0	0	111.8	R124	R124-S126 PolarHBondContact O-N 3.31Å
127	R	47.5	Very low	64.7	Low	194 Å²	194	90 Å²	90	73%	0.732	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.3	49.1	161.8	-64.2	-170.6	-174.3	-178.2	4.5	109.3	Y125	Y125-R127 PolarHBondContact O-N 3.49Å
128	S	53.3	Low	64.8	Low	37 Å²	37	89.7 Å²	89.7	26%	0.259	44%	0.438	S	S	.	.			trans	-70	143.5	176.3	-162.2	0	0	0	0	110.2	Y125 D130 R131	Y125-S128 PolarHBondContact O-N 2.04Å; S128-D130 WeakPolarHBondContact CB-OD2 3.49Å; S128-D130 PolarHBondContact O-N 3.05Å; S128-D130 PolarHBondContact OG-OD2 3.24Å; S128-R131 PolarHBondContact O-N 2.82Å
129	C	61	Low	64.2	Low	33 Å²	33	87.4 Å²	87.4	22%	0.223	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-54.2	-21.5	175.6	-62.9	0	0	0	0	113.1	R131 L132 C138	C129-R131 PolarHBondContact O-N 3.45Å; C129-L132 PolarHBondContact O-N 2.71Å; C129-L132 VanDerWaalsContact O-N 3.09Å; C129-C138 VanDerWaalsContact CA-SG 3.57Å; C129-C138 HydrophobicContact CB-CB 3.53Å; C129-C138 WeakPolarHBondContact CB-SG 3.11Å; C129-C138 WeakPolarHBondContact SG-CB 3.37Å; C129-C138 CovalentContact SG-SG 2.03Å; C129-C138 PolarHBondContact SG-SG 3.46Å
130	D	59.5	Low	63.2	Low	141 Å²	141	93 Å²	93	75%	0.754	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-52.9	-6.6	175.9	-46.5	-31.5	0	0	0	115.8	S128	S128-D130 WeakPolarHBondContact CB-OD2 3.49Å; S128-D130 PolarHBondContact O-N 3.05Å; S128-D130 PolarHBondContact OG-OD2 3.24Å
131	R	60.6	Low	61.6	Low	242 Å²	242	98.6 Å²	98.6	91%	0.913	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-132	-0.6	175.1	-65.4	-170	-178.5	-174	0.6	115.8	S128 C129	S128-R131 PolarHBondContact O-N 2.82Å; C129-R131 PolarHBondContact O-N 3.45Å
132	L	60.4	Low	60.9	Low	55 Å²	55	96.8 Å²	96.8	29%	0.288	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-18.3	-168.1	-86.8	144.6	0	0	0	114.9	C129 C134 G143 R158	C129-L132 PolarHBondContact O-N 2.71Å; C129-L132 VanDerWaalsContact O-N 3.09Å; L132-C134 PolarHBondContact O-N 3.1Å; L132-G143 WeakPolarHBondContact CD1-O 3.23Å; L132-G143 WeakPolarHBondContact CD2-O 3.29Å; L132-R158 WeakPolarHBondContact O-CD 3.37Å
133	G	70.5	Confident	61.1	Low	58 Å²	58	90.8 Å²	90.8	60%	0.598	45%	0.447	S	S	*	.			trans	66.1	32.9	172.9	0	0	0	0	0	114.6
134	C	79.8	Confident	61.9	Low	30 Å²	30	91.8 Å²	91.8	20%	0.203	46%	0.457	C	S	.	.			trans	-70	136.2	176.2	-53.9	0	0	0	0	111.7	L132 G137 C138 C145	L132-C134 PolarHBondContact O-N 3.1Å; C134-G137 VanDerWaalsContact CB-O 3.28Å; C134-G137 WeakPolarHBondContact CB-O 3.47Å; C134-C138 HydrophobicContact CB-CB 4.3Å; C134-C145 WeakPolarHBondContact CA-SG 3.29Å; C134-C145 HydrophobicContact CB-CB 3.54Å; C134-C145 WeakPolarHBondContact CB-SG 3.48Å; C134-C145 WeakPolarHBondContact SG-CA 3.09Å; C134-C145 WeakPolarHBondContact SG-CB 3.4Å; C134-C145 CovalentContact SG-SG 2.02Å; C134-C145 PolarHBondContact SG-SG 3.33Å
135	E	82.6	Confident	63.4	Low	100 Å²	100	81 Å²	81	47%	0.467	42%	0.42	S	S	.	.	S	Bend	trans	-70.2	-46.4	-177.4	-176.8	175.8	165.1	0	0	113.4	R158 H159 C160	E135-R158 PolarHBondContact N-O 3.22Å; E135-H159 VanDerWaalsContact OE2-CA 3.27Å; E135-H159 WeakPolarHBondContact OE2-CA 3.5Å; E135-H159 WeakPolarHBondContact OE2-CB 3.35Å; E135-H159 IonicContact OE2-CD2 3.71Å; E135-H159 IonicContact OE2-CG 3.69Å; E135-C160 PolarHBondContact OE2-N 2.03Å
136	H	83	Confident	65.3	Low	39 Å²	39	81.6 Å²	81.6	18%	0.181	42%	0.422	C	S	.	.	S	Bend	trans	-101.9	-43.6	-174.6	-88.8	139.2	0	0	0	114.7	Y146 K148 Y151 C160	H136-Y146 VanDerWaalsContact CB-O 3.3Å; H136-Y146 WeakPolarHBondContact CB-O 3.17Å; H136-K148 HydrophobicContact CB-CG 4.13Å; H136-K148 PolarHBondContact ND1-N 3.39Å; H136-Y151 AromaticContact CE1-CD1 3.47Å; H136-Y151 VanDerWaalsContact CE1-CD1 3.47Å; H136-Y151 WeakPolarHBondContact CE1-CD1 3.49Å; H136-Y151 AromaticContact CE1-CD2 3.58Å; H136-Y151 AromaticContact CE1-CE1 3.7Å; H136-Y151 AromaticContact CE1-CE2 3.88Å; H136-Y151 AromaticContact CE1-CG 3.39Å; H136-Y151 AromaticContact CE1-CZ 3.93Å; H136-C160 WeakPolarHBondContact ND1-CB 3.27Å; H136-C160 PolarHBondContact ND1-SG 2.82Å
137	G	76.5	Confident	67	Low	14 Å²	14	76.1 Å²	76.1	14%	0.144	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.9	163.3	-176.3	0	0	0	0	0	111.3	C134 C145 Y146	C134-G137 VanDerWaalsContact CB-O 3.28Å; C134-G137 WeakPolarHBondContact CB-O 3.47Å; G137-C145 CarbonylContact O-C 3.43Å; G137-C145 VanDerWaalsContact O-CA 3.31Å; G137-C145 WeakPolarHBondContact O-CA 3.44Å; G137-Y146 VanDerWaalsContact C-CE1 3.45Å; G137-Y146 PolarHBondContact N-O 3.12Å; G137-Y146 PolarHBondContact O-N 3.07Å
138	C	77.8	Confident	68.5	Low	23 Å²	23	72.6 Å²	72.6	16%	0.155	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	129.5	178.4	169.2	0	0	0	0	108	C129 C134 K140 L144	C129-C138 VanDerWaalsContact CA-SG 3.57Å; C129-C138 HydrophobicContact CB-CB 3.53Å; C129-C138 WeakPolarHBondContact CB-SG 3.11Å; C129-C138 WeakPolarHBondContact SG-CB 3.37Å; C129-C138 CovalentContact SG-SG 2.03Å; C129-C138 PolarHBondContact SG-SG 3.46Å; C134-C138 HydrophobicContact CB-CB 4.3Å; C138-K140 PolarHBondContact O-N 3.16Å; C138-L144 CarbonylContact C-O 3.6Å; C138-L144 WeakPolarHBondContact CA-O 3.49Å
139	V	68.5	Low	68.8	Low	51 Å²	51	74.6 Å²	74.6	31%	0.309	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	102.6	172.2	-175.8	0	0	0	0	106.5	E141 L142 G143 L144 Y146	V139-E141 HydrophobicContact CG1-CB 4.46Å; V139-E141 PolarHBondContact O-N 3.47Å; V139-L142 HydrophobicContact CB-CB 4.23Å; V139-L142 HydrophobicContact CB-CD1 4.38Å; V139-L142 HydrophobicContact CB-CG 4.36Å; V139-L142 HydrophobicContact CG1-CB 4.13Å; V139-L142 HydrophobicContact CG1-CD1 3.86Å; V139-L142 HydrophobicContact CG1-CG 3.76Å; V139-L142 PolarHBondContact O-N 2.86Å; V139-G143 PolarHBondContact O-N 3.04Å; V139-L144 PolarHBondContact N-O 3.45Å; V139-Y146 HydrophobicContact CG2-CD1 3.84Å
140	K	55.8	Low	69	Low	160 Å²	160	73 Å²	73	70%	0.696	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.6	-37	-176.4	-72.5	-178.8	178.6	175.3	0	111.8	Y125 C138	Y125-K140 WeakPolarHBondContact CE1-O 3.39Å; Y125-K140 VanDerWaalsContact CZ-O 3.25Å; Y125-K140 PolarHBondContact OH-O 3.15Å; C138-K140 PolarHBondContact O-N 3.16Å
141	E	48.7	Very low	69.9	Low	122 Å²	122	68.4 Å²	68.4	57%	0.57	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-18.7	-176.2	-61.5	-176.8	163.7	0	0	115.5	R123 Y125 V139	R123-E141 PolarHBondContact NH1-O 3.21Å; R123-E141 PolarHBondContact NH2-O 3.42Å; Y125-E141 VanDerWaalsContact OH-CA 3.32Å; Y125-E141 WeakPolarHBondContact OH-CA 3.15Å; V139-E141 HydrophobicContact CG1-CB 4.46Å; V139-E141 PolarHBondContact O-N 3.47Å
142	L	53.8	Low	70.7	Confident	67 Å²	67	61.6 Å²	61.6	35%	0.351	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.1	-22.1	-172.4	-53.6	179	0	0	0	113.6	V139 L144 M858	V139-L142 HydrophobicContact CB-CB 4.23Å; V139-L142 HydrophobicContact CB-CD1 4.38Å; V139-L142 HydrophobicContact CB-CG 4.36Å; V139-L142 HydrophobicContact CG1-CB 4.13Å; V139-L142 HydrophobicContact CG1-CD1 3.86Å; V139-L142 HydrophobicContact CG1-CG 3.76Å; V139-L142 PolarHBondContact O-N 2.86Å; L142-L144 HydrophobicContact CB-CB 4.23Å; L142-L144 HydrophobicContact CB-CD1 3.96Å; L142-L144 HydrophobicContact CB-CG 3.9Å; L142-L144 HydrophobicContact CD1-CD1 3.92Å; L142-L144 PolarHBondContact O-N 3.24Å; L142-M858 HydrophobicContact CD1-CE 3.6Å; L142-M858 HydrophobicContact CD1-SD 4.14Å; L142-M858 HydrophobicContact CD2-CE 3.63Å; L142-M858 HydrophobicContact CD2-SD 3.51Å; L142-M858 VanDerWaalsContact CD2-SD 3.51Å; L142-M858 HydrophobicContact CG-CE 4.27Å; L142-M858 HydrophobicContact CG-SD 4.43Å
143	G	63.6	Low	71.5	Confident	12 Å²	12	61.6 Å²	61.6	12%	0.124	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	18.4	-169.5	0	0	0	0	0	113.2	L132 V139	L132-G143 WeakPolarHBondContact CD1-O 3.23Å; L132-G143 WeakPolarHBondContact CD2-O 3.29Å; V139-G143 PolarHBondContact O-N 3.04Å
144	L	67.3	Low	71.9	Confident	101 Å²	101	62.7 Å²	62.7	53%	0.529	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	136	175.4	-66	174	0	0	0	109.9	C138 V139 L142	C138-L144 CarbonylContact C-O 3.6Å; C138-L144 WeakPolarHBondContact CA-O 3.49Å; V139-L144 PolarHBondContact N-O 3.45Å; L142-L144 HydrophobicContact CB-CB 4.23Å; L142-L144 HydrophobicContact CB-CD1 3.96Å; L142-L144 HydrophobicContact CB-CG 3.9Å; L142-L144 HydrophobicContact CD1-CD1 3.92Å; L142-L144 PolarHBondContact O-N 3.24Å
145	C	78.6	Confident	71.7	Confident	19 Å²	19	66 Å²	66	13%	0.128	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	150.1	169.2	-54.5	0	0	0	0	110.3	C134 G137 M153 H157	C134-C145 WeakPolarHBondContact CA-SG 3.29Å; C134-C145 HydrophobicContact CB-CB 3.54Å; C134-C145 WeakPolarHBondContact CB-SG 3.48Å; C134-C145 WeakPolarHBondContact SG-CA 3.09Å; C134-C145 WeakPolarHBondContact SG-CB 3.4Å; C134-C145 CovalentContact SG-SG 2.02Å; C134-C145 PolarHBondContact SG-SG 3.33Å; G137-C145 CarbonylContact O-C 3.43Å; G137-C145 VanDerWaalsContact O-CA 3.31Å; G137-C145 WeakPolarHBondContact O-CA 3.44Å; C145-M153 VanDerWaalsContact C-CE 3.47Å; C145-M153 HydrophobicContact CB-CE 3.91Å; C145-M153 HydrophobicContact CB-SD 4.42Å; C145-M153 WeakPolarHBondContact O-CE 3.32Å; C145-H157 VanDerWaalsContact CB-O 3.29Å; C145-H157 WeakPolarHBondContact CB-O 3.35Å; C145-H157 PolarHBondContact SG-O 2.62Å
146	Y	81.1	Confident	71.5	Confident	89 Å²	89	63.6 Å²	63.6	35%	0.349	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	155.6	170	70.1	-94	0	0	0	110.2	H136 G137 V139 M170	H136-Y146 VanDerWaalsContact CB-O 3.3Å; H136-Y146 WeakPolarHBondContact CB-O 3.17Å; G137-Y146 VanDerWaalsContact C-CE1 3.45Å; G137-Y146 PolarHBondContact N-O 3.12Å; G137-Y146 PolarHBondContact O-N 3.07Å; V139-Y146 HydrophobicContact CG2-CD1 3.84Å; Y146-M170 HydrophobicContact CD2-CE 4.49Å
147	C	77.2	Confident	71.1	Confident	12 Å²	12	68.2 Å²	68.2	8%	0.081	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-101.7	146.3	176	-61.6	0	0	0	0	111.2	Y151 M153 C160	C147-Y151 WeakPolarHBondContact CB-O 3.19Å; C147-M153 VanDerWaalsContact SG-CE 3.6Å; C147-C160 WeakPolarHBondContact CA-SG 3.44Å; C147-C160 HydrophobicContact CB-CB 3.86Å; C147-C160 WeakPolarHBondContact CB-SG 3.48Å; C147-C160 VanDerWaalsContact SG-CA 3.51Å; C147-C160 WeakPolarHBondContact SG-CB 3.43Å; C147-C160 CovalentContact SG-SG 2.04Å; C147-C160 PolarHBondContact SG-SG 2.85Å
148	K	78	Confident	71.4	Confident	119 Å²	119	73.3 Å²	73.3	52%	0.517	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-71.1	157	170.7	-68	174.7	-174.6	175.1	0	109.9	H136 G150 Y151	H136-K148 HydrophobicContact CB-CG 4.13Å; H136-K148 PolarHBondContact ND1-N 3.39Å; K148-G150 PolarHBondContact O-N 3.15Å; K148-Y151 WeakPolarHBondContact O-CB 2.95Å; K148-Y151 PolarHBondContact O-N 3.18Å; K148-Y151 VanDerWaalsContact O-N 3.13Å
149	T	61.4	Low	71.6	Confident	80 Å²	80	76.7 Å²	76.7	49%	0.491	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	135.5	177.5	-39.7	0	0	0	0	111.9
150	G	64.9	Low	72.2	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	10.8	-172.5	0	0	0	0	0	114.8	K148 T163	K148-G150 PolarHBondContact O-N 3.15Å; G150-T163 CarbonylContact C-O 3.5Å; G150-T163 PolarHBondContact O-N 2.76Å; G150-T163 VanDerWaalsContact O-O 3.06Å
151	Y	78.2	Confident	73.3	Confident	43 Å²	43	68.6 Å²	68.6	17%	0.169	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	144.7	174.3	-60.7	-106.9	0	0	0	110.7	H136 C147 K148 C160 T161 P162 R208	H136-Y151 AromaticContact CE1-CD1 3.47Å; H136-Y151 VanDerWaalsContact CE1-CD1 3.47Å; H136-Y151 WeakPolarHBondContact CE1-CD1 3.49Å; H136-Y151 AromaticContact CE1-CD2 3.58Å; H136-Y151 AromaticContact CE1-CE1 3.7Å; H136-Y151 AromaticContact CE1-CE2 3.88Å; H136-Y151 AromaticContact CE1-CG 3.39Å; H136-Y151 AromaticContact CE1-CZ 3.93Å; C147-Y151 WeakPolarHBondContact CB-O 3.19Å; K148-Y151 WeakPolarHBondContact O-CB 2.95Å; K148-Y151 PolarHBondContact O-N 3.18Å; K148-Y151 VanDerWaalsContact O-N 3.13Å; Y151-C160 HydrophobicContact CD1-CB 4.44Å; Y151-C160 WeakPolarHBondContact CD1-O 3.31Å; Y151-T161 CarbonylContact C-O 3.58Å; Y151-T161 VanDerWaalsContact CA-O 3.26Å; Y151-T161 WeakPolarHBondContact CA-O 3.42Å; Y151-P162 HydrophobicContact CD1-CB 4.06Å; Y151-P162 HydrophobicContact CD1-CG 3.9Å; Y151-P162 HydrophobicContact CE1-CB 4.12Å; Y151-P162 HydrophobicContact CE1-CG 3.7Å; Y151-R208 PolarHBondContact OH-NH1 2.9Å; Y151-R208 VanDerWaalsContact OH-NH1 3.08Å
152	R	76.9	Confident	74.5	Confident	100 Å²	100	65 Å²	65	38%	0.377	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	149.3	176.1	67.3	-175.4	-174	-171.1	4	110.4	H154 C160 T161 T163 D191	R152-H154 PolarHBondContact O-N 2.01Å; R152-C160 CarbonylContact O-C 3.43Å; R152-C160 WeakPolarHBondContact O-CA 3.43Å; R152-T161 WeakPolarHBondContact CG-OG1 3.49Å; R152-T161 PolarHBondContact N-O 3.49Å; R152-T161 PolarHBondContact NE-OG1 3.04Å; R152-T161 PolarHBondContact O-N 3.13Å; R152-T161 PolarHBondContact O-OG1 2.84Å; R152-T163 HydrophobicContact CB-CG2 3.85Å; R152-T163 HydrophobicContact CG-CG2 4.16Å; R152-D191 IonicContact CZ-OD1 2.66Å; R152-D191 IonicContact NH1-OD1 3.51Å; R152-D191 IonicContact NH2-OD1 3.84Å; R152-D191 PolarHBondContact NH2-OD1 2.86Å
153	M	78.2	Confident	75.4	Confident	55 Å²	55	62.1 Å²	62.1	27%	0.271	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	132.2	177.7	-168.4	58.6	65.7	0	0	111.1	C145 C147 H157 H159	C145-M153 VanDerWaalsContact C-CE 3.47Å; C145-M153 HydrophobicContact CB-CE 3.91Å; C145-M153 HydrophobicContact CB-SD 4.42Å; C145-M153 WeakPolarHBondContact O-CE 3.32Å; C147-M153 VanDerWaalsContact SG-CE 3.6Å; M153-H157 VanDerWaalsContact SD-C 3.54Å; M153-H159 VanDerWaalsContact SD-O 3.39Å
154	H	77.5	Confident	75.8	Confident	80 Å²	80	63 Å²	63	37%	0.37	31%	0.313	S	S	.	.			trans	-76.3	157.7	171.8	-175.7	-103.1	0	0	0	110.5	R152 D156 H157 H159 T161	R152-H154 PolarHBondContact O-N 2.01Å; H154-D156 IonicContact CG-OD1 2.76Å; H154-D156 IonicContact ND1-OD1 3.13Å; H154-D156 PolarHBondContact ND1-OD1 3.29Å; H154-D156 PolarHBondContact O-N 2.98Å; H154-H157 PolarHBondContact O-N 2.81Å; H154-H159 HydrophobicContact CB-CB 3.88Å; H154-H159 VanDerWaalsContact CB-O 3.26Å; H154-H159 WeakPolarHBondContact CB-O 3.36Å; H154-H159 PolarHBondContact N-O 2.83Å; H154-T161 HydrophobicContact CB-CG2 4.43Å
155	S	76.2	Confident	75.6	Confident	100 Å²	100	60.6 Å²	60.6	70%	0.699	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-15.7	-172.1	60.2	0	0	0	0	114.9	H157	S155-H157 VanDerWaalsContact C-N 3.29Å; S155-H157 PolarHBondContact O-ND1 2.94Å
156	D	79.3	Confident	74.4	Confident	50 Å²	50	65 Å²	65	27%	0.267	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	1.7	175.7	77.5	-29.6	0	0	0	114.3	H154 R158 H159	H154-D156 IonicContact CG-OD1 2.76Å; H154-D156 IonicContact ND1-OD1 3.13Å; H154-D156 PolarHBondContact ND1-OD1 3.29Å; H154-D156 PolarHBondContact O-N 2.98Å; D156-R158 PolarHBondContact O-N 2.85Å; D156-R158 PolarHBondContact OD1-N 3.25Å; D156-H159 PolarHBondContact OD1-N 3.37Å; D156-H159 IonicContact OD1-ND1 3.43Å; D156-H159 IonicContact OD2-CE1 3.88Å; D156-H159 PolarHBondContact OD2-CE1 2.78Å; D156-H159 IonicContact OD2-CG 3.43Å; D156-H159 IonicContact OD2-ND1 2.75Å; D156-H159 PolarHBondContact OD2-ND1 3.04Å
157	H	74.5	Confident	72.7	Confident	135 Å²	135	62.3 Å²	62.3	63%	0.625	32%	0.323	S	S	*	.	S	Bend	trans	57.9	26.1	178.1	-60.1	64.2	0	0	0	114.1	C145 M153 H154 S155	C145-H157 VanDerWaalsContact CB-O 3.29Å; C145-H157 WeakPolarHBondContact CB-O 3.35Å; C145-H157 PolarHBondContact SG-O 2.62Å; M153-H157 VanDerWaalsContact SD-C 3.54Å; H154-H157 PolarHBondContact O-N 2.81Å; S155-H157 VanDerWaalsContact C-N 3.29Å; S155-H157 PolarHBondContact O-ND1 2.94Å
158	R	81.1	Confident	71.2	Confident	122 Å²	122	69.4 Å²	69.4	46%	0.46	35%	0.353	S	S	.	.	S	Bend	trans	-133.4	-38.9	179.8	-77.7	178.7	-76.2	-147.2	-4.5	114	L132 E135 D156	L132-R158 WeakPolarHBondContact O-CD 3.37Å; E135-R158 PolarHBondContact N-O 3.22Å; D156-R158 PolarHBondContact O-N 2.85Å; D156-R158 PolarHBondContact OD1-N 3.25Å
159	H	82.6	Confident	69.7	Low	94 Å²	94	69.8 Å²	69.8	44%	0.435	36%	0.36	S	S	.	.			trans	-92.4	159.6	179	-64.5	91.5	0	0	0	112.2	E135 M153 H154 D156	E135-H159 VanDerWaalsContact OE2-CA 3.27Å; E135-H159 WeakPolarHBondContact OE2-CA 3.5Å; E135-H159 WeakPolarHBondContact OE2-CB 3.35Å; E135-H159 IonicContact OE2-CD2 3.71Å; E135-H159 IonicContact OE2-CG 3.69Å; M153-H159 VanDerWaalsContact SD-O 3.39Å; H154-H159 HydrophobicContact CB-CB 3.88Å; H154-H159 VanDerWaalsContact CB-O 3.26Å; H154-H159 WeakPolarHBondContact CB-O 3.36Å; H154-H159 PolarHBondContact N-O 2.83Å; D156-H159 PolarHBondContact OD1-N 3.37Å; D156-H159 IonicContact OD1-ND1 3.43Å; D156-H159 IonicContact OD2-CE1 3.88Å; D156-H159 PolarHBondContact OD2-CE1 2.78Å; D156-H159 IonicContact OD2-CG 3.43Å; D156-H159 IonicContact OD2-ND1 2.75Å; D156-H159 PolarHBondContact OD2-ND1 3.04Å
160	C	82.3	Confident	68.7	Low	4 Å²	4	71.7 Å²	71.7	3%	0.027	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	103.2	-174.4	-72.3	0	0	0	0	110.6	E135 H136 C147 Y151 R152	E135-C160 PolarHBondContact OE2-N 2.03Å; H136-C160 WeakPolarHBondContact ND1-CB 3.27Å; H136-C160 PolarHBondContact ND1-SG 2.82Å; C147-C160 WeakPolarHBondContact CA-SG 3.44Å; C147-C160 HydrophobicContact CB-CB 3.86Å; C147-C160 WeakPolarHBondContact CB-SG 3.48Å; C147-C160 VanDerWaalsContact SG-CA 3.51Å; C147-C160 WeakPolarHBondContact SG-CB 3.43Å; C147-C160 CovalentContact SG-SG 2.04Å; C147-C160 PolarHBondContact SG-SG 2.85Å; Y151-C160 HydrophobicContact CD1-CB 4.44Å; Y151-C160 WeakPolarHBondContact CD1-O 3.31Å; R152-C160 CarbonylContact O-C 3.43Å; R152-C160 WeakPolarHBondContact O-CA 3.43Å
161	T	78.9	Confident	67.3	Low	36 Å²	36	77.4 Å²	77.4	22%	0.221	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	135.9	176.3	52.9	0	0	0	0	110.5	Y151 R152 H154	Y151-T161 CarbonylContact C-O 3.58Å; Y151-T161 VanDerWaalsContact CA-O 3.26Å; Y151-T161 WeakPolarHBondContact CA-O 3.42Å; R152-T161 WeakPolarHBondContact CG-OG1 3.49Å; R152-T161 PolarHBondContact N-O 3.49Å; R152-T161 PolarHBondContact NE-OG1 3.04Å; R152-T161 PolarHBondContact O-N 3.13Å; R152-T161 PolarHBondContact O-OG1 2.84Å; H154-T161 HydrophobicContact CB-CG2 4.43Å
162	P	71.9	Confident	65	Low	46 Å²	46	84.8 Å²	84.8	30%	0.299	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	143.2	173.5	-19	28.8	0	0	0	111.3	Y151 I193	Y151-P162 HydrophobicContact CD1-CB 4.06Å; Y151-P162 HydrophobicContact CD1-CG 3.9Å; Y151-P162 HydrophobicContact CE1-CB 4.12Å; Y151-P162 HydrophobicContact CE1-CG 3.7Å; P162-I193 HydrophobicContact CB-CD1 3.35Å; P162-I193 HydrophobicContact CB-CG1 3.88Å
163	T	73	Confident	62.7	Low	8 Å²	8	85.8 Å²	85.8	5%	0.049	44%	0.442	C	S	.	.			trans	-143.6	147	168.9	-178.5	0	0	0	0	111.6	G150 R152 A165 G180	G150-T163 CarbonylContact C-O 3.5Å; G150-T163 PolarHBondContact O-N 2.76Å; G150-T163 VanDerWaalsContact O-O 3.06Å; R152-T163 HydrophobicContact CB-CG2 3.85Å; R152-T163 HydrophobicContact CG-CG2 4.16Å; T163-A165 HydrophobicContact CG2-CB 4.42Å; T163-A165 WeakPolarHBondContact CG2-O 3.47Å; T163-A165 WeakPolarHBondContact OG1-CB 3.49Å; T163-A165 PolarHBondContact OG1-N 2.95Å; T163-A165 VanDerWaalsContact OG1-N 3.1Å; T163-G180 WeakPolarHBondContact O-CA 3.02Å
164	C	73	Confident	60.5	Low	30 Å²	30	90.4 Å²	90.4	20%	0.203	47%	0.467	C	S	.	.	S	Bend	trans	-76	-12.1	168.4	-56.2	0	0	0	0	113	C186 E187 D188	C164-C186 WeakPolarHBondContact CA-SG 3.02Å; C164-C186 HydrophobicContact CB-CB 3.78Å; C164-C186 WeakPolarHBondContact CB-SG 3.42Å; C164-C186 WeakPolarHBondContact SG-CB 3.39Å; C164-C186 CovalentContact SG-SG 2.03Å; C164-C186 PolarHBondContact SG-SG 3.19Å; C164-E187 PolarHBondContact SG-N 3.16Å; C164-D188 WeakPolarHBondContact CB-OD2 3.01Å; C164-D188 PolarHBondContact N-OD1 2.57Å; C164-D188 PolarHBondContact N-OD2 2.98Å; C164-D188 PolarHBondContact SG-N 2.67Å
165	A	62.7	Low	58.1	Low	50 Å²	50	94.6 Å²	94.6	41%	0.413	49%	0.492	S	S	.	.	S	Bend	trans	-76.3	143.3	175.1	0	0	0	0	0	112	T163 S167	T163-A165 HydrophobicContact CG2-CB 4.42Å; T163-A165 WeakPolarHBondContact CG2-O 3.47Å; T163-A165 WeakPolarHBondContact OG1-CB 3.49Å; T163-A165 PolarHBondContact OG1-N 2.95Å; T163-A165 VanDerWaalsContact OG1-N 3.1Å; A165-S167 PolarHBondContact O-N 3.4Å
166	L	53.3	Low	56.3	Low	112 Å²	112	97.5 Å²	97.5	59%	0.586	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-62.5	128	168.6	-66.5	166.4	0	0	0	109.4	K168 G178	L166-K168 PolarHBondContact O-N 2.9Å; L166-G178 VanDerWaalsContact CD2-N 3.29Å
167	S	45.6	Very low	54.6	Low	33 Å²	33	102.6 Å²	102.6	23%	0.231	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-64.4	119.7	167.5	166.9	0	0	0	0	108.2	A165 D169	A165-S167 PolarHBondContact O-N 3.4Å; S167-D169 PolarHBondContact O-N 3.12Å; S167-D169 WeakPolarHBondContact OG-CB 3.12Å; S167-D169 PolarHBondContact OG-N 3.12Å; S167-D169 PolarHBondContact OG-OD2 3.03Å
168	K	45.5	Very low	53.6	Low	160 Å²	160	96.5 Å²	96.5	70%	0.696	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-5.5	172.6	-70.6	-173.3	172.2	-173.1	0	112.5	L166 M170	L166-K168 PolarHBondContact O-N 2.9Å; K168-M170 VanDerWaalsContact C-N 3.26Å; K168-M170 PolarHBondContact O-N 2.87Å
169	D	45.9	Very low	52.8	Low	127 Å²	127	92.7 Å²	92.7	68%	0.679	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	7.4	-169.1	-41.8	-55.1	0	0	0	113.8	S167	S167-D169 PolarHBondContact O-N 3.12Å; S167-D169 WeakPolarHBondContact OG-CB 3.12Å; S167-D169 PolarHBondContact OG-N 3.12Å; S167-D169 PolarHBondContact OG-OD2 3.03Å
170	M	41.7	Very low	52.1	Low	121 Å²	121	88.2 Å²	88.2	60%	0.596	46%	0.461	S	S	*	.			trans	-136.6	68.8	175.9	-86.8	-164.6	153.8	0	0	112.4	Y146 K168 F172	Y146-M170 HydrophobicContact CD2-CE 4.49Å; K168-M170 VanDerWaalsContact C-N 3.26Å; K168-M170 PolarHBondContact O-N 2.87Å; M170-F172 PolarHBondContact O-N 2.81Å
171	E	33.9	Very low	51.6	Low	119 Å²	119	89.9 Å²	89.9	56%	0.556	48%	0.479	S	S	*	.			trans	-74	61.2	171.8	-167	179.4	-141.9	0	0	112.1	T861	E171-T861 WeakPolarHBondContact OE2-CB 3.33Å; E171-T861 PolarHBondContact OE2-OG1 2.91Å
172	F	31	Very low	51.6	Low	198 Å²	198	88.7 Å²	88.7	87%	0.868	47%	0.472	S	S	*	.			trans	-172.2	53.1	160.2	-124.9	-80.5	0	0	0	115.5	M170	M170-F172 PolarHBondContact O-N 2.81Å
173	V	28.9	Very low	51.9	Low	121 Å²	121	90.9 Å²	90.9	73%	0.733	48%	0.479	S	S	*	.			trans	-137.8	135.4	167.4	-169.7	0	0	0	0	112.6	L175	V173-L175 PolarHBondContact O-N 2.87Å
174	L	31	Very low	52.4	Low	153 Å²	153	92.2 Å²	92.2	80%	0.801	48%	0.484	S	S	*	.	S	Bend	trans	-54.9	124	169.8	-72.9	141.7	0	0	0	112.2	Q176	L174-Q176 PolarHBondContact O-N 3Å
175	L	27.5	Very low	52.7	Low	168 Å²	168	93.2 Å²	93.2	88%	0.88	49%	0.489	S	S	*	.	S	Bend	trans	41.5	72.1	150.4	-70.2	165.4	0	0	0	117.4	V173	V173-L175 PolarHBondContact O-N 2.87Å
176	Q	37.6	Very low	53.6	Low	161 Å²	161	91.8 Å²	91.8	75%	0.752	48%	0.476	S	S	*	.			trans	-137.4	120.6	154.3	-72.4	-159	-11.4	0	0	112.7	L174 G178	L174-Q176 PolarHBondContact O-N 3Å; Q176-G178 PolarHBondContact O-N 3.11Å
177	I	44.8	Very low	54.8	Low	157 Å²	157	89.5 Å²	89.5	81%	0.805	46%	0.462	S	S	*	.			trans	-76	112.7	177	-60.3	171.2	0	0	0	108.8	N179	I177-N179 VanDerWaalsContact C-N 3.29Å; I177-N179 PolarHBondContact O-N 3.21Å
178	G	53.3	Low	56	Low	6 Å²	6	92 Å²	92	6%	0.062	47%	0.473	C	S	.	.			trans	-74.3	72	176.7	0	0	0	0	0	113.4	L166 Q176 G180	L166-G178 VanDerWaalsContact CD2-N 3.29Å; Q176-G178 PolarHBondContact O-N 3.11Å; G178-G180 PolarHBondContact O-N 3.13Å
179	N	64.3	Low	57.1	Low	42 Å²	42	86.5 Å²	86.5	23%	0.225	46%	0.457	C	S	.	.			trans	-73.2	35.4	-179.1	-161.5	33.7	0	0	0	113.7	I177 G181 C182 H184 C186	I177-N179 VanDerWaalsContact C-N 3.29Å; I177-N179 PolarHBondContact O-N 3.21Å; N179-G181 PolarHBondContact O-N 3.3Å; N179-C182 PolarHBondContact ND2-O 3.03Å; N179-C182 VanDerWaalsContact O-CB 3.3Å; N179-C182 WeakPolarHBondContact O-CB 3.36Å; N179-C182 PolarHBondContact O-N 3.29Å; N179-H184 VanDerWaalsContact ND2-C 3.33Å; N179-H184 PolarHBondContact ND2-O 2.89Å; N179-C186 WeakPolarHBondContact O-CB 3.35Å; N179-C186 PolarHBondContact O-SG 2.91Å; N179-C186 VanDerWaalsContact O-SG 3.4Å; N179-C186 WeakPolarHBondContact OD1-CB 3.36Å; N179-C186 PolarHBondContact OD1-N 2.95Å
180	G	67.9	Low	58	Low	0 Å²	0	90.1 Å²	90.1	0%	0	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	13.8	178.4	0	0	0	0	0	117.1	T163 G178 I193	T163-G180 WeakPolarHBondContact O-CA 3.02Å; G178-G180 PolarHBondContact O-N 3.13Å; G180-I193 VanDerWaalsContact O-CD1 3.27Å; G180-I193 WeakPolarHBondContact O-CD1 3.04Å
181	G	71.5	Confident	58.8	Low	40 Å²	40	90.2 Å²	90.2	41%	0.412	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.8	2.7	-171.5	0	0	0	0	0	115	N179 R208	N179-G181 PolarHBondContact O-N 3.3Å; G181-R208 VanDerWaalsContact O-CB 3.31Å; G181-R208 WeakPolarHBondContact O-CB 3.07Å; G181-R208 WeakPolarHBondContact O-CD 3.2Å; G181-R208 WeakPolarHBondContact O-CG 3.39Å
182	C	79.4	Confident	60.4	Low	10 Å²	10	91.3 Å²	91.3	7%	0.068	47%	0.473	C	S	.	.			trans	-78.5	142.4	171.4	-54.1	0	0	0	0	111.6	N179 V185 C186 I193 C195	N179-C182 PolarHBondContact ND2-O 3.03Å; N179-C182 VanDerWaalsContact O-CB 3.3Å; N179-C182 WeakPolarHBondContact O-CB 3.36Å; N179-C182 PolarHBondContact O-N 3.29Å; C182-V185 WeakPolarHBondContact CB-O 3.45Å; C182-C186 HydrophobicContact CB-CB 4.04Å; C182-C186 VanDerWaalsContact SG-CB 3.56Å; C182-C186 VanDerWaalsContact SG-SG 3.65Å; C182-I193 VanDerWaalsContact SG-CG2 3.59Å; C182-C195 WeakPolarHBondContact CA-SG 3.44Å; C182-C195 HydrophobicContact CB-CB 3.59Å; C182-C195 WeakPolarHBondContact CB-SG 3.44Å; C182-C195 WeakPolarHBondContact SG-CA 3.46Å; C182-C195 WeakPolarHBondContact SG-CB 3.2Å; C182-C195 CovalentContact SG-SG 2.02Å; C182-C195 PolarHBondContact SG-SG 2.92Å
183	Q	78.8	Confident	62.3	Low	93 Å²	93	83.5 Å²	83.5	44%	0.435	44%	0.44	S	S	.	.	S	Bend	trans	-74.9	-33.8	176.3	-175.3	-177	-40.7	0	0	113	R208 T209 C210	Q183-R208 WeakPolarHBondContact CB-O 3.19Å; Q183-R208 PolarHBondContact N-O 3.31Å; Q183-T209 VanDerWaalsContact OE1-CG2 3.22Å; Q183-C210 HydrophobicContact CB-CB 4.35Å; Q183-C210 HydrophobicContact CG-CB 4.47Å; Q183-C210 PolarHBondContact NE2-O 3.17Å; Q183-C210 PolarHBondContact OE1-O 2.75Å
184	H	82	Confident	64.9	Low	36 Å²	36	83 Å²	83	17%	0.167	43%	0.428	C	S	.	.	S	Bend	trans	-117	-80.3	-175.7	-74.3	159.9	0	0	0	112.3	N179 R196 H198 Y201 C210	N179-H184 VanDerWaalsContact ND2-C 3.33Å; N179-H184 PolarHBondContact ND2-O 2.89Å; H184-R196 WeakPolarHBondContact CB-O 3.35Å; H184-H198 AromaticContact CD2-CD2 3.44Å; H184-H198 PolarHBondContact CD2-CD2 3.2Å; H184-H198 VanDerWaalsContact CD2-CD2 3.44Å; H184-H198 AromaticContact CD2-NE2 3.93Å; H184-H198 AromaticContact CG-CD2 3.36Å; H184-H198 AromaticContact CG-NE2 3.88Å; H184-H198 AromaticContact ND1-CD2 3.78Å; H184-H198 PolarHBondContact ND1-N 3.05Å; H184-H198 AromaticContact NE2-CD2 3.92Å; H184-Y201 AromaticContact CE1-CD1 3.6Å; H184-Y201 AromaticContact CE1-CD2 3.82Å; H184-Y201 AromaticContact CE1-CE1 3.97Å; H184-Y201 AromaticContact CE1-CG 3.54Å; H184-C210 VanDerWaalsContact CE1-CB 3.49Å; H184-C210 WeakPolarHBondContact CE1-CB 3.44Å; H184-C210 WeakPolarHBondContact ND1-CB 3.3Å; H184-C210 PolarHBondContact ND1-SG 3.34Å
185	V	80.3	Confident	67.4	Low	51 Å²	51	76.4 Å²	76.4	31%	0.309	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	137.3	-177.8	-176.8	0	0	0	0	110	C182 C195 R196	C182-V185 WeakPolarHBondContact CB-O 3.45Å; V185-C195 CarbonylContact O-C 3.48Å; V185-C195 VanDerWaalsContact O-CA 3.23Å; V185-C195 WeakPolarHBondContact O-CA 3.24Å; V185-R196 HydrophobicContact CB-CB 4.21Å; V185-R196 PolarHBondContact N-O 3.06Å; V185-R196 PolarHBondContact O-N 3.11Å
186	C	81.2	Confident	70.2	Confident	19 Å²	19	75.2 Å²	75.2	13%	0.128	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	136.1	175.1	-169.6	0	0	0	0	110.4	C164 N179 C182 I193	C164-C186 WeakPolarHBondContact CA-SG 3.02Å; C164-C186 HydrophobicContact CB-CB 3.78Å; C164-C186 WeakPolarHBondContact CB-SG 3.42Å; C164-C186 WeakPolarHBondContact SG-CB 3.39Å; C164-C186 CovalentContact SG-SG 2.03Å; C164-C186 PolarHBondContact SG-SG 3.19Å; N179-C186 WeakPolarHBondContact O-CB 3.35Å; N179-C186 PolarHBondContact O-SG 2.91Å; N179-C186 VanDerWaalsContact O-SG 3.4Å; N179-C186 WeakPolarHBondContact OD1-CB 3.36Å; N179-C186 PolarHBondContact OD1-N 2.95Å; C182-C186 HydrophobicContact CB-CB 4.04Å; C182-C186 VanDerWaalsContact SG-CB 3.56Å; C182-C186 VanDerWaalsContact SG-SG 3.65Å; C186-I193 WeakPolarHBondContact SG-CG2 3.37Å
187	E	78.6	Confident	72.4	Confident	64 Å²	64	69.1 Å²	69.1	30%	0.299	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	128.4	172.3	-65.6	177.9	-179	0	0	111.8	C164 I193 F194 R196	C164-E187 PolarHBondContact SG-N 3.16Å; E187-I193 WeakPolarHBondContact O-CA 3.31Å; E187-F194 PolarHBondContact N-O 2.72Å; E187-F194 PolarHBondContact O-N 3.43Å; E187-R196 WeakPolarHBondContact OE1-CD 3.46Å; E187-R196 IonicContact OE1-CZ 2.79Å; E187-R196 IonicContact OE1-NE 2.76Å; E187-R196 PolarHBondContact OE1-NE 2.94Å; E187-R196 IonicContact OE1-NH1 2.67Å; E187-R196 PolarHBondContact OE1-NH1 3.4Å; E187-R196 IonicContact OE1-NH2 3.73Å; E187-R196 PolarHBondContact OE1-NH2 3.33Å; E187-R196 IonicContact OE2-CZ 3.74Å; E187-R196 IonicContact OE2-NE 2.75Å; E187-R196 PolarHBondContact OE2-NE 2.76Å; E187-R196 IonicContact OE2-NH1 3.85Å; E187-R196 IonicContact OE2-NH2 3.77Å; E187-R196 PolarHBondContact OE2-NH2 3.3Å
188	D	71.9	Confident	74.3	Confident	86 Å²	86	66.4 Å²	66.4	46%	0.46	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	120.7	172.1	-74	-45.4	0	0	0	110	C164	C164-D188 WeakPolarHBondContact CB-OD2 3.01Å; C164-D188 PolarHBondContact N-OD1 2.57Å; C164-D188 PolarHBondContact N-OD2 2.98Å; C164-D188 PolarHBondContact SG-N 2.67Å
189	A	68.2	Low	75.5	Confident	44 Å²	44	71.1 Å²	71.1	36%	0.364	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	111.7	173.8	0	0	0	0	0	111.8	K192 F194	A189-K192 PolarHBondContact N-O 2.89Å; A189-K192 PolarHBondContact O-N 3.18Å; A189-F194 HydrophobicContact CB-CD2 3.86Å; A189-F194 HydrophobicContact CB-CE2 3.85Å
190	K	63.6	Low	76.1	Confident	203 Å²	203	72 Å²	72	88%	0.883	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	58.1	177	-60	-178.6	178.8	179.5	0	113.1	K192	K190-K192 PolarHBondContact O-N 3.2Å; K190-K192 VanDerWaalsContact O-N 3.16Å
191	D	59.6	Low	76.9	Confident	124 Å²	124	77.4 Å²	77.4	66%	0.663	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	24.5	-178.8	-57.7	-49.1	0	0	0	115	R152	R152-D191 IonicContact CZ-OD1 2.66Å; R152-D191 IonicContact NH1-OD1 3.51Å; R152-D191 IonicContact NH2-OD1 3.84Å; R152-D191 PolarHBondContact NH2-OD1 2.86Å
192	K	66.4	Low	77.3	Confident	142 Å²	142	79.4 Å²	79.4	62%	0.617	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129	146.4	170	-65.8	-177.4	178.6	-178.2	0	110.3	A189 K190 F194	A189-K192 PolarHBondContact N-O 2.89Å; A189-K192 PolarHBondContact O-N 3.18Å; K190-K192 PolarHBondContact O-N 3.2Å; K190-K192 VanDerWaalsContact O-N 3.16Å; K192-F194 HydrophobicContact CB-CE2 4.04Å
193	I	72.3	Confident	77.4	Confident	34 Å²	34	81.9 Å²	81.9	17%	0.174	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	138.4	169.3	-68	-175.3	0	0	0	109.8	P162 G180 C182 C186 E187	P162-I193 HydrophobicContact CB-CD1 3.35Å; P162-I193 HydrophobicContact CB-CG1 3.88Å; G180-I193 VanDerWaalsContact O-CD1 3.27Å; G180-I193 WeakPolarHBondContact O-CD1 3.04Å; C182-I193 VanDerWaalsContact SG-CG2 3.59Å; C186-I193 WeakPolarHBondContact SG-CG2 3.37Å; E187-I193 WeakPolarHBondContact O-CA 3.31Å
194	F	83.5	Confident	77.3	Confident	111 Å²	111	78 Å²	78	49%	0.487	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.5	164.6	-68.4	-94.9	0	0	0	109.3	E187 A189 K192	E187-F194 PolarHBondContact N-O 2.72Å; E187-F194 PolarHBondContact O-N 3.43Å; A189-F194 HydrophobicContact CB-CD2 3.86Å; A189-F194 HydrophobicContact CB-CE2 3.85Å; K192-F194 HydrophobicContact CB-CE2 4.04Å
195	C	83.3	Confident	77.1	Confident	14 Å²	14	83.5 Å²	83.5	10%	0.095	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	143.3	172.3	-55	0	0	0	0	110.8	C182 V185 L203 N207	C182-C195 WeakPolarHBondContact CA-SG 3.44Å; C182-C195 HydrophobicContact CB-CB 3.59Å; C182-C195 WeakPolarHBondContact CB-SG 3.44Å; C182-C195 WeakPolarHBondContact SG-CA 3.46Å; C182-C195 WeakPolarHBondContact SG-CB 3.2Å; C182-C195 CovalentContact SG-SG 2.02Å; C182-C195 PolarHBondContact SG-SG 2.92Å; V185-C195 CarbonylContact O-C 3.48Å; V185-C195 VanDerWaalsContact O-CA 3.23Å; V185-C195 WeakPolarHBondContact O-CA 3.24Å; C195-L203 HydrophobicContact CB-CD1 4.01Å; C195-L203 WeakPolarHBondContact O-CD2 3.4Å; C195-N207 WeakPolarHBondContact CB-O 3.42Å; C195-N207 PolarHBondContact SG-O 2.9Å
196	R	85.6	Confident	76.9	Confident	142 Å²	142	84.7 Å²	84.7	54%	0.536	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	146.3	174.2	-54.9	-179.9	178	-173.3	4.1	109.8	H184 V185 E187	H184-R196 WeakPolarHBondContact CB-O 3.35Å; V185-R196 HydrophobicContact CB-CB 4.21Å; V185-R196 PolarHBondContact N-O 3.06Å; V185-R196 PolarHBondContact O-N 3.11Å; E187-R196 WeakPolarHBondContact OE1-CD 3.46Å; E187-R196 IonicContact OE1-CZ 2.79Å; E187-R196 IonicContact OE1-NE 2.76Å; E187-R196 PolarHBondContact OE1-NE 2.94Å; E187-R196 IonicContact OE1-NH1 2.67Å; E187-R196 PolarHBondContact OE1-NH1 3.4Å; E187-R196 IonicContact OE1-NH2 3.73Å; E187-R196 PolarHBondContact OE1-NH2 3.33Å; E187-R196 IonicContact OE2-CZ 3.74Å; E187-R196 IonicContact OE2-NE 2.75Å; E187-R196 PolarHBondContact OE2-NE 2.76Å; E187-R196 IonicContact OE2-NH1 3.85Å; E187-R196 IonicContact OE2-NH2 3.77Å; E187-R196 PolarHBondContact OE2-NH2 3.3Å
197	C	84.3	Confident	76.9	Confident	34 Å²	34	89 Å²	89	23%	0.23	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-94.9	148.2	176.9	-59.3	0	0	0	0	111.7	Y201 L203 C210	C197-Y201 WeakPolarHBondContact CB-O 3.36Å; C197-L203 WeakPolarHBondContact SG-CA 3.1Å; C197-L203 VanDerWaalsContact SG-CD1 3.56Å; C197-L203 PolarHBondContact SG-N 3.31Å; C197-C210 WeakPolarHBondContact CA-SG 3Å; C197-C210 HydrophobicContact CB-CB 3.88Å; C197-C210 WeakPolarHBondContact CB-SG 3.32Å; C197-C210 WeakPolarHBondContact SG-CB 3.02Å; C197-C210 CovalentContact SG-SG 2.04Å; C197-C210 PolarHBondContact SG-SG 2.84Å
198	H	83.7	Confident	76.9	Confident	100 Å²	100	89.7 Å²	89.7	46%	0.463	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-62.9	158.2	163.4	-57.6	-52.6	0	0	0	110.9	H184 Y201	H184-H198 AromaticContact CD2-CD2 3.44Å; H184-H198 PolarHBondContact CD2-CD2 3.2Å; H184-H198 VanDerWaalsContact CD2-CD2 3.44Å; H184-H198 AromaticContact CD2-NE2 3.93Å; H184-H198 AromaticContact CG-CD2 3.36Å; H184-H198 AromaticContact CG-NE2 3.88Å; H184-H198 AromaticContact ND1-CD2 3.78Å; H184-H198 PolarHBondContact ND1-N 3.05Å; H184-H198 AromaticContact NE2-CD2 3.92Å; H198-Y201 PolarHBondContact O-N 3.1Å
199	A	78.6	Confident	77.3	Confident	104 Å²	104	88.3 Å²	88.3	86%	0.86	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	141.5	-179.8	0	0	0	0	0	112
200	G	77.9	Confident	78	Confident	62 Å²	62	86.4 Å²	86.4	64%	0.639	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.1	-0.1	-174.5	0	0	0	0	0	115.1
201	Y	83.7	Confident	78.7	Confident	112 Å²	112	81.3 Å²	81.3	44%	0.439	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	141.4	176.5	-63.3	-106.9	0	0	0	111.1	H184 C197 H198 C210 F211 G212	H184-Y201 AromaticContact CE1-CD1 3.6Å; H184-Y201 AromaticContact CE1-CD2 3.82Å; H184-Y201 AromaticContact CE1-CE1 3.97Å; H184-Y201 AromaticContact CE1-CG 3.54Å; C197-Y201 WeakPolarHBondContact CB-O 3.36Å; H198-Y201 PolarHBondContact O-N 3.1Å; Y201-C210 HydrophobicContact CD1-CB 4.46Å; Y201-F211 CarbonylContact C-O 3.56Å; Y201-F211 VanDerWaalsContact CA-O 3.27Å; Y201-F211 WeakPolarHBondContact CA-O 3.2Å; Y201-G212 VanDerWaalsContact CD1-CA 3.48Å
202	T	80.4	Confident	78.9	Confident	83 Å²	83	77 Å²	77	51%	0.509	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	143.2	173.1	43.5	0	0	0	0	110.9	C210 F211	T202-C210 CarbonylContact O-C 3.53Å; T202-C210 WeakPolarHBondContact O-CA 3.42Å; T202-F211 PolarHBondContact N-O 3.42Å; T202-F211 VanDerWaalsContact O-CD2 3.28Å; T202-F211 WeakPolarHBondContact O-CD2 3.24Å; T202-F211 PolarHBondContact O-N 3.03Å; T202-F211 WeakPolarHBondContact OG1-CD2 3.26Å; T202-F211 PolarHBondContact OG1-O 3.32Å
203	L	81.6	Confident	78.2	Confident	61 Å²	61	79.8 Å²	79.8	32%	0.319	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	136.7	179.3	-168.5	73.1	0	0	0	110	C195 C197 N207	C195-L203 HydrophobicContact CB-CD1 4.01Å; C195-L203 WeakPolarHBondContact O-CD2 3.4Å; C197-L203 WeakPolarHBondContact SG-CA 3.1Å; C197-L203 VanDerWaalsContact SG-CD1 3.56Å; C197-L203 PolarHBondContact SG-N 3.31Å; L203-N207 HydrophobicContact CD2-CB 4.3Å
204	S	77.6	Confident	76.8	Confident	12 Å²	12	80.4 Å²	80.4	8%	0.084	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-73.1	162.4	-179.6	175.3	0	0	0	0	113.1	D206 N207 T209	S204-D206 WeakPolarHBondContact CB-OD1 3.44Å; S204-D206 PolarHBondContact O-N 2.93Å; S204-D206 VanDerWaalsContact O-N 3.13Å; S204-D206 VanDerWaalsContact OG-CG 3.27Å; S204-D206 PolarHBondContact OG-OD1 3.28Å; S204-D206 PolarHBondContact OG-OD2 3.03Å; S204-N207 WeakPolarHBondContact O-CA 3.18Å; S204-N207 PolarHBondContact O-N 2.99Å; S204-T209 WeakPolarHBondContact CB-O 3.5Å; S204-T209 PolarHBondContact N-O 2.89Å
205	I	76.4	Confident	74.6	Confident	152 Å²	152	81.5 Å²	81.5	78%	0.779	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-17.7	174.8	61.1	170.8	0	0	0	113.5
206	D	76.4	Confident	72.1	Confident	76 Å²	76	90.6 Å²	90.6	41%	0.406	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-3.5	171.6	59.8	28.8	0	0	0	113.4	S204 R208 T209	S204-D206 WeakPolarHBondContact CB-OD1 3.44Å; S204-D206 PolarHBondContact O-N 2.93Å; S204-D206 VanDerWaalsContact O-N 3.13Å; S204-D206 VanDerWaalsContact OG-CG 3.27Å; S204-D206 PolarHBondContact OG-OD1 3.28Å; S204-D206 PolarHBondContact OG-OD2 3.03Å; D206-R208 PolarHBondContact O-N 2.02Å; D206-R208 WeakPolarHBondContact OD1-CA 3.38Å; D206-R208 PolarHBondContact OD1-N 3.27Å; D206-T209 PolarHBondContact OD1-N 3.08Å; D206-T209 VanDerWaalsContact OD2-CB 3.27Å; D206-T209 WeakPolarHBondContact OD2-CB 3.43Å; D206-T209 PolarHBondContact OD2-OG1 2.95Å
207	N	81.2	Confident	69.4	Low	108 Å²	108	93 Å²	93	58%	0.578	52%	0.516	S	S	*	.	S	Bend	trans	51.6	31.1	-172.4	-70.8	-36.2	0	0	0	113.9	C195 L203 S204	C195-N207 WeakPolarHBondContact CB-O 3.42Å; C195-N207 PolarHBondContact SG-O 2.9Å; L203-N207 HydrophobicContact CD2-CB 4.3Å; S204-N207 WeakPolarHBondContact O-CA 3.18Å; S204-N207 PolarHBondContact O-N 2.99Å
208	R	79.7	Confident	66.8	Low	80 Å²	80	96.1 Å²	96.1	30%	0.302	54%	0.544	S	S	.	.	S	Bend	trans	-138.3	-47.3	-175	-76.8	-178.6	-175.7	-142.3	-3	113.1	Y151 G181 Q183 D206	Y151-R208 PolarHBondContact OH-NH1 2.9Å; Y151-R208 VanDerWaalsContact OH-NH1 3.08Å; G181-R208 VanDerWaalsContact O-CB 3.31Å; G181-R208 WeakPolarHBondContact O-CB 3.07Å; G181-R208 WeakPolarHBondContact O-CD 3.2Å; G181-R208 WeakPolarHBondContact O-CG 3.39Å; Q183-R208 WeakPolarHBondContact CB-O 3.19Å; Q183-R208 PolarHBondContact N-O 3.31Å; D206-R208 PolarHBondContact O-N 2.02Å; D206-R208 WeakPolarHBondContact OD1-CA 3.38Å; D206-R208 PolarHBondContact OD1-N 3.27Å
209	T	79.1	Confident	64.2	Low	56 Å²	56	103.2 Å²	103.2	34%	0.344	57%	0.567	S	S	.	*			trans	-81.7	146.5	-177.4	-51.2	0	0	0	0	110.2	Q183 S204 D206	Q183-T209 VanDerWaalsContact OE1-CG2 3.22Å; S204-T209 WeakPolarHBondContact CB-O 3.5Å; S204-T209 PolarHBondContact N-O 2.89Å; D206-T209 PolarHBondContact OD1-N 3.08Å; D206-T209 VanDerWaalsContact OD2-CB 3.27Å; D206-T209 WeakPolarHBondContact OD2-CB 3.43Å; D206-T209 PolarHBondContact OD2-OG1 2.95Å
210	C	83.6	Confident	62.1	Low	4 Å²	4	103.8 Å²	103.8	3%	0.027	57%	0.565	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.8	114.1	179.8	-71.4	0	0	0	0	110	Q183 H184 C197 Y201 T202	Q183-C210 HydrophobicContact CB-CB 4.35Å; Q183-C210 HydrophobicContact CG-CB 4.47Å; Q183-C210 PolarHBondContact NE2-O 3.17Å; Q183-C210 PolarHBondContact OE1-O 2.75Å; H184-C210 VanDerWaalsContact CE1-CB 3.49Å; H184-C210 WeakPolarHBondContact CE1-CB 3.44Å; H184-C210 WeakPolarHBondContact ND1-CB 3.3Å; H184-C210 PolarHBondContact ND1-SG 3.34Å; C197-C210 WeakPolarHBondContact CA-SG 3Å; C197-C210 HydrophobicContact CB-CB 3.88Å; C197-C210 WeakPolarHBondContact CB-SG 3.32Å; C197-C210 WeakPolarHBondContact SG-CB 3.02Å; C197-C210 CovalentContact SG-SG 2.04Å; C197-C210 PolarHBondContact SG-SG 2.84Å; Y201-C210 HydrophobicContact CD1-CB 4.46Å; T202-C210 CarbonylContact O-C 3.53Å; T202-C210 WeakPolarHBondContact O-CA 3.42Å
211	F	78.7	Confident	60	Low	97 Å²	97	107 Å²	107	43%	0.425	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.9	132.2	178.2	13.9	-111.1	0	0	0	111.7	Y201 T202	Y201-F211 CarbonylContact C-O 3.56Å; Y201-F211 VanDerWaalsContact CA-O 3.27Å; Y201-F211 WeakPolarHBondContact CA-O 3.2Å; T202-F211 PolarHBondContact N-O 3.42Å; T202-F211 VanDerWaalsContact O-CD2 3.28Å; T202-F211 WeakPolarHBondContact O-CD2 3.24Å; T202-F211 PolarHBondContact O-N 3.03Å; T202-F211 WeakPolarHBondContact OG1-CD2 3.26Å; T202-F211 PolarHBondContact OG1-O 3.32Å
212	G	62.1	Low	57.5	Low	34 Å²	34	105 Å²	105	35%	0.351	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.8	158.1	173.6	0	0	0	0	0	110.8	Y201 G214	Y201-G212 VanDerWaalsContact CD1-CA 3.48Å; G212-G214 VanDerWaalsContact C-N 3.31Å; G212-G214 PolarHBondContact O-N 2.99Å
213	E	51.9	Low	55.1	Low	199 Å²	199	108.4 Å²	108.4	93%	0.93	60%	0.6	S	S	*	*	S	Bend	trans	-72	85.7	173.8	-64.4	-173.5	163.9	0	0	110.3
214	G	44.5	Very low	52.7	Low	47 Å²	47	114.2 Å²	114.2	49%	0.485	62%	0.622	S	S	.	*			trans	-144.3	152.6	178.2	0	0	0	0	0	112	G212 F216	G212-G214 VanDerWaalsContact C-N 3.31Å; G212-G214 PolarHBondContact O-N 2.99Å; G214-F216 PolarHBondContact O-N 2.84Å
215	P	37.2	Very low	50.4	Low	134 Å²	134	119.9 Å²	119.9	87%	0.87	65%	0.65	S	S	*	*			trans	-68.4	127.6	-170.8	26.1	-33.9	0	0	0	112.9
216	F	29.7	Very low	48.2	Very low	205 Å²	205	121.1 Å²	121.1	90%	0.899	65%	0.65	S	S	*	*			trans	-59.6	132.5	-176.7	-91.6	-112.4	0	0	0	114	G214	G214-F216 PolarHBondContact O-N 2.84Å
217	Q	28.8	Very low	45.9	Very low	193 Å²	193	124.7 Å²	124.7	90%	0.902	67%	0.668	S	S	*	*			trans	-117.4	109.2	154.9	-77	-167.7	-13.5	0	0	109.7
218	A	29.6	Very low	43.6	Very low	99 Å²	99	126.8 Å²	126.8	82%	0.818	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-85.6	119.4	178.1	0	0	0	0	0	111.3
219	R	30.6	Very low	41.2	Very low	249 Å²	249	131.8 Å²	131.8	94%	0.94	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-95	119.2	166	-93.2	-176.2	170.3	-179.1	-2.9	110.1
220	S	32.8	Very low	38.9	Very low	116 Å²	116	140.2 Å²	140.2	81%	0.811	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-68.8	125.5	-179	172	0	0	0	0	112.8
221	T	33.9	Very low	36.3	Very low	129 Å²	129	148.6 Å²	148.6	79%	0.791	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-81.3	117.1	164.2	49.5	0	0	0	0	110	I223	T221-I223 PolarHBondContact O-N 3.04Å
222	G	31.8	Very low	33.9	Very low	72 Å²	72	149.7 Å²	149.7	74%	0.742	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-66.5	122.5	-168.4	0	0	0	0	0	115.8
223	I	30.6	Very low	32.3	Very low	154 Å²	154	154.6 Å²	154.6	79%	0.79	81%	0.805	S	S	*	*			trans	-82.6	115.5	168.8	-61	172.4	0	0	0	108.9	T221 I225	T221-I223 PolarHBondContact O-N 3.04Å; I223-I225 HydrophobicContact CG2-CG1 4.31Å
224	K	30.5	Very low	31.4	Very low	183 Å²	183	149.5 Å²	149.5	80%	0.796	79%	0.792	S	S	*	*			trans	-85.9	114	172.4	-75.9	-171.9	174.6	-176.2	0	111.2	F226	K224-F226 HydrophobicContact CB-CE2 4.23Å
225	I	28.9	Very low	31	Very low	130 Å²	130	154 Å²	154	67%	0.667	81%	0.81	S	S	*	*			trans	-94.6	123.1	173.1	-58.9	175.2	0	0	0	108.7	I223 I227	I223-I225 HydrophobicContact CG2-CG1 4.31Å; I225-I227 HydrophobicContact CG2-CG1 4.42Å
226	F	29.9	Very low	30.9	Very low	179 Å²	179	152.2 Å²	152.2	79%	0.785	80%	0.797	S	S	*	*			trans	-100.1	116.4	173.6	-71	-89.3	0	0	0	110.5	K224	K224-F226 HydrophobicContact CB-CE2 4.23Å
227	I	29.9	Very low	31	Very low	150 Å²	150	146.3 Å²	146.3	77%	0.769	79%	0.786	S	S	*	*			trans	-96.5	112.5	170.1	-59.9	177.6	0	0	0	108.2	I225 Q229	I225-I227 HydrophobicContact CG2-CG1 4.42Å; I227-Q229 PolarHBondContact O-N 2.75Å
228	I	32.2	Very low	31.5	Very low	153 Å²	153	140.4 Å²	140.4	79%	0.785	76%	0.763	S	S	*	*			trans	-80.7	103.7	175.2	-55.7	173.5	0	0	0	108.2	R230	I228-R230 PolarHBondContact O-N 3.38Å
229	Q	28.8	Very low	32	Very low	184 Å²	184	138.3 Å²	138.3	86%	0.86	75%	0.745	S	S	*	*			trans	-72	122.6	166.1	-74.9	-164.2	-10.1	0	0	110.2	I227	I227-Q229 PolarHBondContact O-N 2.75Å
230	R	30.3	Very low	32.6	Very low	234 Å²	234	132 Å²	132	88%	0.883	73%	0.729	S	S	*	*			trans	-129.7	148.7	157.9	-94.1	-168.3	172.4	-168.1	-1.4	110.1	I228	I228-R230 PolarHBondContact O-N 3.38Å
231	H	29.6	Very low	32.9	Very low	179 Å²	179	131.5 Å²	131.5	83%	0.829	72%	0.715	S	S	*	*			trans	-62.7	132.6	-167.6	-84.4	-101.2	0	0	0	115
232	V	28.6	Very low	33.1	Very low	120 Å²	120	128.7 Å²	128.7	73%	0.727	70%	0.7	S	S	*	*			trans	55.3	146.1	134.9	-155.1	0	0	0	0	119.7
233	V	28.3	Very low	33.6	Very low	138 Å²	138	127.9 Å²	127.9	84%	0.836	69%	0.686	S	S	*	*			trans	78.6	71.3	167	-154.8	0	0	0	0	117.5
234	S	32.4	Very low	34	Very low	92 Å²	92	129.2 Å²	129.2	64%	0.643	69%	0.687	S	S	*	*			trans	-173.3	147.1	143.4	179.7	0	0	0	0	111.1	T236	S234-T236 PolarHBondContact O-N 2.74Å; S234-T236 VanDerWaalsContact O-N 3.16Å; S234-T236 PolarHBondContact OG-OG1 3.33Å
235	T	36.1	Very low	34.5	Very low	141 Å²	141	125.8 Å²	125.8	87%	0.865	67%	0.674	S	S	*	*	S	Bend	trans	-78.3	16.4	-179.3	44.6	0	0	0	0	114.8
236	T	34.8	Very low	34.9	Very low	96 Å²	96	124.3 Å²	124.3	59%	0.589	67%	0.668	S	S	*	*			trans	-130.4	100.4	178	51.4	0	0	0	0	111.6	S234 V238	S234-T236 PolarHBondContact O-N 2.74Å; S234-T236 VanDerWaalsContact O-N 3.16Å; S234-T236 PolarHBondContact OG-OG1 3.33Å; T236-V238 PolarHBondContact O-N 2.64Å
237	A	32.6	Very low	35.3	Very low	81 Å²	81	121.4 Å²	121.4	67%	0.669	67%	0.667	S	S	*	*			trans	-75.2	103.7	170.7	0	0	0	0	0	110.2
238	V	39	Very low	35.7	Very low	70 Å²	70	119 Å²	119	42%	0.424	66%	0.664	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.9	110.1	172.5	177.9	0	0	0	0	108.6	T236 I240 K290	T236-V238 PolarHBondContact O-N 2.64Å; V238-I240 HydrophobicContact CG1-CG1 4.26Å; V238-K290 HydrophobicContact CG1-CD 4.15Å; V238-K290 HydrophobicContact CG1-CG 3.77Å
239	A	40.3	Very low	35.9	Very low	54 Å²	54	114.7 Å²	114.7	45%	0.446	65%	0.651	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87	126	171.1	0	0	0	0	0	109.8	L291	A239-L291 HydrophobicContact CB-CB 4.4Å; A239-L291 PolarHBondContact N-O 3.36Å; A239-L291 PolarHBondContact O-N 3.37Å
240	I	43.4	Very low	36.1	Very low	118 Å²	118	110.7 Å²	110.7	61%	0.605	64%	0.641	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-108.3	109.5	170.6	-58.1	175.9	0	0	0	107.4	V238 C288 Y289	V238-I240 HydrophobicContact CG1-CG1 4.26Å; I240-C288 HydrophobicContact CG2-CB 4.19Å; I240-Y289 CarbonylContact C-O 3.57Å; I240-Y289 WeakPolarHBondContact CA-O 3.47Å
241	M	39.5	Very low	36	Very low	104 Å²	104	108.2 Å²	108.2	51%	0.512	64%	0.643	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.3	113.5	173.4	-76	-179	155.8	0	0	109.1	C288 Y289 L291	M241-C288 CarbonylContact O-C 3.55Å; M241-C288 VanDerWaalsContact O-CA 3.25Å; M241-C288 WeakPolarHBondContact O-CA 3.48Å; M241-Y289 PolarHBondContact N-O 2.04Å; M241-Y289 PolarHBondContact O-N 3.33Å; M241-L291 HydrophobicContact CE-CD1 4.41Å; M241-L291 HydrophobicContact SD-CD1 3.92Å
242	C	38.2	Very low	36	Very low	71 Å²	71	103.2 Å²	103.2	48%	0.48	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.3	124.7	175.1	-66	0	0	0	0	110.8	V286 L287 C288	C242-V286 HydrophobicContact CB-CG1 3.77Å; C242-L287 CarbonylContact C-O 3.51Å; C242-L287 WeakPolarHBondContact CA-O 3.03Å; C242-C288 HydrophobicContact CB-CB 4.18Å; C242-C288 WeakPolarHBondContact CB-SG 3.47Å; C242-C288 WeakPolarHBondContact SG-CB 3.25Å; C242-C288 CovalentContact SG-SG 2.05Å; C242-C288 PolarHBondContact SG-SG 3.21Å
243	A	41.5	Very low	36.1	Very low	55 Å²	55	103.4 Å²	103.4	46%	0.455	63%	0.634	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.2	128	172.8	0	0	0	0	0	110	V286 L287	A243-V286 WeakPolarHBondContact O-CA 3.5Å; A243-L287 PolarHBondContact N-O 2.95Å; A243-L287 PolarHBondContact O-N 3.39Å
244	K	38.5	Very low	36	Very low	182 Å²	182	101.1 Å²	101.1	79%	0.791	63%	0.63	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.6	118.2	170.7	-172.5	179	-179.6	-176.9	0	108.3	N285	K244-N285 CarbonylContact C-O 3.44Å; K244-N285 WeakPolarHBondContact CA-O 3.41Å
245	M	40.9	Very low	35.7	Very low	110 Å²	110	103.7 Å²	103.7	54%	0.542	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-79	126	176.8	-76.2	177.1	163.4	0	0	109.8	N285 L287	M245-N285 PolarHBondContact N-O 2.74Å; M245-L287 HydrophobicContact CE-CD1 4.12Å; M245-L287 HydrophobicContact SD-CD1 4.45Å
246	D	37.6	Very low	35.2	Very low	99 Å²	99	105.3 Å²	105.3	53%	0.529	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-79	122.9	167.1	-166.2	-45.7	0	0	0	108.6	S248 A249	D246-S248 VanDerWaalsContact CG-OG 3.31Å; D246-S248 PolarHBondContact O-N 2.04Å; D246-S248 VanDerWaalsContact O-N 3.08Å; D246-S248 WeakPolarHBondContact OD1-CB 3.49Å; D246-S248 PolarHBondContact OD1-N 2.92Å; D246-S248 PolarHBondContact OD1-OG 3Å; D246-A249 PolarHBondContact O-N 3.47Å
247	P	38.9	Very low	34.9	Very low	118 Å²	118	105.6 Å²	105.6	77%	0.766	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-2.9	179.8	29	-35.8	0	0	0	114.2
248	S	37.9	Very low	34.9	Very low	100 Å²	100	109.5 Å²	109.5	70%	0.699	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-3.7	175.6	66.7	0	0	0	0	115	D246	D246-S248 VanDerWaalsContact CG-OG 3.31Å; D246-S248 PolarHBondContact O-N 2.04Å; D246-S248 VanDerWaalsContact O-N 3.08Å; D246-S248 WeakPolarHBondContact OD1-CB 3.49Å; D246-S248 PolarHBondContact OD1-N 2.92Å; D246-S248 PolarHBondContact OD1-OG 3Å
249	A	37.7	Very low	34.5	Very low	63 Å²	63	112.4 Å²	112.4	52%	0.521	65%	0.648	S	S	.	*	S	Bend	trans	-85.8	131.1	176.1	0	0	0	0	0	111.8	D246	D246-A249 PolarHBondContact O-N 3.47Å
250	P	32.6	Very low	34.2	Very low	99 Å²	99	117.2 Å²	117.2	64%	0.643	67%	0.666	S	S	*	*			trans	-65.3	138.8	-179	25.6	-33.5	0	0	0	112.3	A252	P250-A252 PolarHBondContact O-N 2.82Å
251	I	26.9	Very low	33.6	Very low	183 Å²	183	119 Å²	119	94%	0.938	68%	0.677	S	S	*	*	S	Bend	trans	-81.1	67.9	177.7	-55	176.5	0	0	0	109.5
252	A	30.7	Very low	33.2	Very low	74 Å²	74	123 Å²	123	61%	0.612	69%	0.693	S	S	*	*			trans	-162.5	121.8	165.1	0	0	0	0	0	105.6	P250	P250-A252 PolarHBondContact O-N 2.82Å
253	V	30.4	Very low	32.8	Very low	124 Å²	124	130.5 Å²	130.5	75%	0.752	71%	0.711	S	S	*	*			cis	-134.2	125	31.5	171.6	0	0	0	0	110.1	L255	V253-L255 WeakPolarHBondContact CG1-O 3Å
254	A	25.3	Very low	32.3	Very low	90 Å²	90	138.2 Å²	138.2	74%	0.744	73%	0.73	S	S	*	*			trans	-98.8	134.8	156.3	0	0	0	0	0	107.8
255	L	26.4	Very low	31.8	Very low	146 Å²	146	137 Å²	137	76%	0.764	73%	0.733	S	S	*	*	S	Bend	trans	79.7	137.5	-176.6	-50.7	158.5	0	0	0	115	V253	V253-L255 WeakPolarHBondContact CG1-O 3Å
256	M	26.5	Very low	31.3	Very low	175 Å²	175	141.3 Å²	141.3	86%	0.862	75%	0.749	S	S	*	*			trans	76.1	138.3	169.6	-50.7	167.4	-171.8	0	0	115.4
257	D	29	Very low	30.9	Very low	102 Å²	102	142.8 Å²	142.8	55%	0.545	76%	0.761	S	S	.	*			cis	-137.1	131.8	-0.4	-155.7	-11	0	0	0	110.9	K259	D257-K259 VanDerWaalsContact C-N 3.32Å; D257-K259 PolarHBondContact O-N 2.9Å; D257-K259 VanDerWaalsContact O-N 3.13Å; D257-K259 WeakPolarHBondContact OD1-CE 3.39Å; D257-K259 IonicContact OD1-NZ 3.31Å; D257-K259 PolarHBondContact OD1-NZ 3.47Å; D257-K259 WeakPolarHBondContact OD2-CD 3.28Å; D257-K259 WeakPolarHBondContact OD2-CE 3.39Å; D257-K259 IonicContact OD2-NZ 2.63Å; D257-K259 PolarHBondContact OD2-NZ 2.03Å
258	I	31.4	Very low	30.4	Very low	163 Å²	163	142.3 Å²	142.3	84%	0.836	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	72.4	-179.9	-57.1	172.4	0	0	0	107.8
259	K	31.2	Very low	30.1	Very low	131 Å²	131	148.7 Å²	148.7	57%	0.57	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.4	-26.1	-177.9	-73.3	-177.1	-169	142.2	0	116.1	D257 L261	D257-K259 VanDerWaalsContact C-N 3.32Å; D257-K259 PolarHBondContact O-N 2.9Å; D257-K259 VanDerWaalsContact O-N 3.13Å; D257-K259 WeakPolarHBondContact OD1-CE 3.39Å; D257-K259 IonicContact OD1-NZ 3.31Å; D257-K259 PolarHBondContact OD1-NZ 3.47Å; D257-K259 WeakPolarHBondContact OD2-CD 3.28Å; D257-K259 WeakPolarHBondContact OD2-CE 3.39Å; D257-K259 IonicContact OD2-NZ 2.63Å; D257-K259 PolarHBondContact OD2-NZ 2.03Å; K259-L261 VanDerWaalsContact C-N 3.31Å; K259-L261 PolarHBondContact O-N 2.78Å
260	D	32.9	Very low	29.7	Very low	155 Å²	155	152.7 Å²	152.7	83%	0.829	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	13.2	-174.5	-66	-38.3	0	0	0	115.3	H262	D260-H262 PolarHBondContact O-N 3.39Å
261	L	30.9	Very low	29.4	Very low	156 Å²	156	151.8 Å²	151.8	82%	0.817	79%	0.793	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	7.4	173.8	-112.5	107.1	0	0	0	114.3	K259 R263	K259-L261 VanDerWaalsContact C-N 3.31Å; K259-L261 PolarHBondContact O-N 2.78Å; L261-R263 VanDerWaalsContact C-N 3.27Å; L261-R263 PolarHBondContact O-N 3.46Å
262	H	31.1	Very low	29.6	Very low	186 Å²	186	151 Å²	151	86%	0.861	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	24.9	-177	-88.1	-77.4	0	0	0	115.2	D260	D260-H262 PolarHBondContact O-N 3.39Å
263	R	31.3	Very low	29.5	Very low	229 Å²	229	155.8 Å²	155.8	86%	0.864	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.9	7.9	-177.2	-129.9	179.4	-166.2	-179.6	4.7	116.6	L261	L261-R263 VanDerWaalsContact C-N 3.27Å; L261-R263 PolarHBondContact O-N 3.46Å
264	Y	30	Very low	29.6	Very low	217 Å²	217	154.9 Å²	154.9	85%	0.851	79%	0.785	S	S	*	*	S	Bend	trans	-134.5	121.4	167.8	-73.6	-82.5	0	0	0	109.5	F266	Y264-F266 PolarHBondContact O-N 3.47Å
265	D	28.2	Very low	29.8	Very low	158 Å²	158	157.9 Å²	157.9	85%	0.845	79%	0.788	S	S	*	*			trans	-62	121.8	173	-71.8	-57.5	0	0	0	110.2
266	F	30.4	Very low	30.1	Very low	199 Å²	199	157.3 Å²	157.3	87%	0.873	79%	0.786	S	S	*	*			trans	172.7	114.4	132.2	-99.8	-72.8	0	0	0	111.6	Y264	Y264-F266 PolarHBondContact O-N 3.47Å
267	V	30.3	Very low	30.2	Very low	130 Å²	130	155 Å²	155	79%	0.788	77%	0.771	S	S	*	*			trans	71.7	117.3	161.4	-165	0	0	0	0	119
268	P	27.6	Very low	30.6	Very low	109 Å²	109	157.9 Å²	157.9	71%	0.708	78%	0.781	S	S	*	*			trans	-93.7	170.3	173.3	37.6	-34.9	0	0	0	114.2
269	R	30.4	Very low	30.5	Very low	233 Å²	233	160.1 Å²	160.1	88%	0.879	79%	0.785	S	S	*	*			trans	87.8	70.1	166.9	-50.6	176.9	-179.8	-179.3	0.6	119.3
270	V	30.2	Very low	30.7	Very low	147 Å²	147	159.6 Å²	159.6	89%	0.891	79%	0.793	S	S	*	*			trans	-143.6	88	140	-171.2	0	0	0	0	109.3
271	G	26.2	Very low	30.9	Very low	80 Å²	80	162.4 Å²	162.4	83%	0.825	80%	0.798	S	S	*	*			trans	-119.3	15.5	-174.2	0	0	0	0	0	115.2
272	Q	30.2	Very low	30.9	Very low	166 Å²	166	166.6 Å²	166.6	78%	0.776	80%	0.803	S	S	*	*			trans	-141.3	147.5	-174.9	-70.4	175.6	-22.8	0	0	110.2
273	H	30	Very low	31.1	Very low	176 Å²	176	165.9 Å²	165.9	82%	0.815	80%	0.799	S	S	*	*			trans	80.8	67.2	177.7	-52.8	-80.6	0	0	0	120.1
274	I	31	Very low	31.6	Very low	105 Å²	105	163.2 Å²	163.2	54%	0.538	80%	0.797	S	S	.	*			trans	-140.5	73.4	138.2	-48	-179.4	0	0	0	110.8	F277 F293	I274-F277 HydrophobicContact CG2-CE2 4.47Å; I274-F293 HydrophobicContact CD1-CZ 4.35Å
275	N	29.8	Very low	32.4	Very low	153 Å²	153	157.3 Å²	157.3	82%	0.818	78%	0.78	S	S	*	*			trans	-93.2	106	156.9	-80.8	-18.9	0	0	0	107.4
276	N	33	Very low	33	Very low	134 Å²	134	153.1 Å²	153.1	72%	0.717	76%	0.76	S	S	*	*			trans	164.3	91.4	153.8	-86.1	-24.2	0	0	0	111.3
277	F	28.8	Very low	33.6	Very low	125 Å²	125	147 Å²	147	55%	0.548	74%	0.736	S	S	.	*			trans	-111.3	96.8	170.7	-85.7	-76	0	0	0	111.1	I274 Y289	I274-F277 HydrophobicContact CG2-CE2 4.47Å; F277-Y289 AromaticContact CD1-CD1 3.38Å; F277-Y289 HydrophobicContact CD1-CD1 3.38Å; F277-Y289 AromaticContact CD1-CE1 3.76Å; F277-Y289 HydrophobicContact CD1-CE1 3.76Å; F277-Y289 HydrophobicContact CD1-CG 4.09Å; F277-Y289 AromaticContact CE1-CD1 3.45Å; F277-Y289 HydrophobicContact CE1-CD1 3.45Å; F277-Y289 VanDerWaalsContact CE1-CD1 3.45Å; F277-Y289 HydrophobicContact CE1-CD2 4.41Å; F277-Y289 AromaticContact CE1-CE1 3.93Å; F277-Y289 HydrophobicContact CE1-CE1 3.93Å; F277-Y289 AromaticContact CE1-CG 3.7Å; F277-Y289 HydrophobicContact CE1-CG 3.7Å
278	H	37.3	Very low	34	Very low	164 Å²	164	143.5 Å²	143.5	76%	0.759	72%	0.716	S	S	*	*			trans	-83.1	125.6	171.4	-82.8	-82.9	0	0	0	111.4
279	K	29.8	Very low	34.7	Very low	209 Å²	209	143.1 Å²	143.1	91%	0.909	70%	0.701	S	S	*	*			trans	-80.4	128.5	174	-67.7	174.6	177.4	173.8	0	110.8
280	T	36.2	Very low	35.2	Very low	120 Å²	120	138.7 Å²	138.7	74%	0.736	69%	0.689	S	S	*	*			trans	-132.6	110.3	171.7	50.7	0	0	0	0	113
281	K	35.9	Very low	35.7	Very low	215 Å²	215	133.5 Å²	133.5	94%	0.935	66%	0.655	S	S	*	*			trans	46.6	126	164.5	-71.9	-172.7	173.9	-177.7	0	120.2
282	R	30.6	Very low	36.2	Very low	244 Å²	244	133.3 Å²	133.3	92%	0.921	64%	0.641	S	S	*	*			trans	-64.6	133	170.6	-78.9	175.2	165.6	168.3	-6.6	112.1
283	H	36.5	Very low	36.6	Very low	171 Å²	171	131.8 Å²	131.8	79%	0.792	63%	0.633	S	S	*	*			trans	-128.6	158.4	134.7	-114.7	-94.6	0	0	0	107.3	N285	H283-N285 PolarHBondContact O-N 2.83Å
284	E	40.3	Very low	36.9	Very low	173 Å²	173	129.5 Å²	129.5	81%	0.808	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.7	128.5	-162.9	-66	163.3	159.3	0	0	113.6	V286	E284-V286 PolarHBondContact O-N 2.82Å
285	N	46.8	Very low	37	Very low	92 Å²	92	131.3 Å²	131.3	49%	0.492	64%	0.643	S	S	.	*	T	Hydrogen-bonded Turn	trans	60.3	22.1	173.1	-59.2	-11.6	0	0	0	118.3	K244 M245 H283	K244-N285 CarbonylContact C-O 3.44Å; K244-N285 WeakPolarHBondContact CA-O 3.41Å; M245-N285 PolarHBondContact N-O 2.74Å; H283-N285 PolarHBondContact O-N 2.83Å
286	V	41.6	Very low	37	Very low	70 Å²	70	128.2 Å²	128.2	42%	0.424	64%	0.638	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.9	127.5	172.7	-170.6	0	0	0	0	112.1	C242 A243 E284	C242-V286 HydrophobicContact CB-CG1 3.77Å; A243-V286 WeakPolarHBondContact O-CA 3.5Å; E284-V286 PolarHBondContact O-N 2.82Å
287	L	42.8	Very low	36.9	Very low	72 Å²	72	127 Å²	127	38%	0.377	64%	0.638	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.9	116.2	174.5	-143.4	104.4	0	0	0	109.5	C242 A243 M245 Y289	C242-L287 CarbonylContact C-O 3.51Å; C242-L287 WeakPolarHBondContact CA-O 3.03Å; A243-L287 PolarHBondContact N-O 2.95Å; A243-L287 PolarHBondContact O-N 3.39Å; M245-L287 HydrophobicContact CE-CD1 4.12Å; M245-L287 HydrophobicContact SD-CD1 4.45Å; L287-Y289 HydrophobicContact CD2-CE1 4.11Å; L287-Y289 HydrophobicContact CD2-CE2 4.01Å; L287-Y289 VanDerWaalsContact CD2-OH 3.24Å; L287-Y289 WeakPolarHBondContact CD2-OH 3.04Å
288	C	38.7	Very low	37.1	Very low	55 Å²	55	129.5 Å²	129.5	37%	0.372	65%	0.651	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.9	140	-177	-61	0	0	0	0	113.1	I240 M241 C242	I240-C288 HydrophobicContact CG2-CB 4.19Å; M241-C288 CarbonylContact O-C 3.55Å; M241-C288 VanDerWaalsContact O-CA 3.25Å; M241-C288 WeakPolarHBondContact O-CA 3.48Å; C242-C288 HydrophobicContact CB-CB 4.18Å; C242-C288 WeakPolarHBondContact CB-SG 3.47Å; C242-C288 WeakPolarHBondContact SG-CB 3.25Å; C242-C288 CovalentContact SG-SG 2.05Å; C242-C288 PolarHBondContact SG-SG 3.21Å
289	Y	42.7	Very low	36.6	Very low	101 Å²	101	128.2 Å²	128.2	40%	0.396	65%	0.649	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-123.7	139.8	178.3	-62.7	-60.5	0	0	0	111.1	I240 M241 F277 L287	I240-Y289 CarbonylContact C-O 3.57Å; I240-Y289 WeakPolarHBondContact CA-O 3.47Å; M241-Y289 PolarHBondContact N-O 2.04Å; M241-Y289 PolarHBondContact O-N 3.33Å; F277-Y289 AromaticContact CD1-CD1 3.38Å; F277-Y289 HydrophobicContact CD1-CD1 3.38Å; F277-Y289 AromaticContact CD1-CE1 3.76Å; F277-Y289 HydrophobicContact CD1-CE1 3.76Å; F277-Y289 HydrophobicContact CD1-CG 4.09Å; F277-Y289 AromaticContact CE1-CD1 3.45Å; F277-Y289 HydrophobicContact CE1-CD1 3.45Å; F277-Y289 VanDerWaalsContact CE1-CD1 3.45Å; F277-Y289 HydrophobicContact CE1-CD2 4.41Å; F277-Y289 AromaticContact CE1-CE1 3.93Å; F277-Y289 HydrophobicContact CE1-CE1 3.93Å; F277-Y289 AromaticContact CE1-CG 3.7Å; F277-Y289 HydrophobicContact CE1-CG 3.7Å; L287-Y289 HydrophobicContact CD2-CE1 4.11Å; L287-Y289 HydrophobicContact CD2-CE2 4.01Å; L287-Y289 VanDerWaalsContact CD2-OH 3.24Å; L287-Y289 WeakPolarHBondContact CD2-OH 3.04Å
290	K	40.9	Very low	36.3	Very low	141 Å²	141	124.7 Å²	124.7	61%	0.613	65%	0.645	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.2	121	176.9	-176.9	-176.5	175.2	-178.1	0	110	V238	V238-K290 HydrophobicContact CG1-CD 4.15Å; V238-K290 HydrophobicContact CG1-CG 3.77Å
291	L	41.2	Very low	35.9	Very low	37 Å²	37	126.6 Å²	126.6	19%	0.194	64%	0.643	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.8	148.4	170.9	-70.8	166.6	0	0	0	110.3	A239 M241 F293	A239-L291 HydrophobicContact CB-CB 4.4Å; A239-L291 PolarHBondContact N-O 3.36Å; A239-L291 PolarHBondContact O-N 3.37Å; M241-L291 HydrophobicContact CE-CD1 4.41Å; M241-L291 HydrophobicContact SD-CD1 3.92Å; L291-F293 HydrophobicContact CB-CE2 4.16Å; L291-F293 HydrophobicContact CD2-CE2 4.33Å; L291-F293 HydrophobicContact CD2-CZ 4.4Å
292	S	36.7	Very low	35.4	Very low	76 Å²	76	124.9 Å²	124.9	53%	0.531	64%	0.636	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-150.7	120	-179.7	-62	0	0	0	0	109.3
293	F	38.7	Very low	35.2	Very low	135 Å²	135	117.4 Å²	117.4	59%	0.592	62%	0.617	S	S	*	*			trans	-130.6	137	-179.8	-64.1	-78.6	0	0	0	110.1	I274 L291	I274-F293 HydrophobicContact CD1-CZ 4.35Å; L291-F293 HydrophobicContact CB-CE2 4.16Å; L291-F293 HydrophobicContact CD2-CE2 4.33Å; L291-F293 HydrophobicContact CD2-CZ 4.4Å
294	P	36.7	Very low	34.7	Very low	128 Å²	128	114 Å²	114	83%	0.831	61%	0.608	S	S	*	*			trans	-79.4	141	171.4	32.4	-32.5	0	0	0	111
295	I	31.3	Very low	34.2	Very low	143 Å²	143	110.7 Å²	110.7	73%	0.733	60%	0.604	S	S	*	*			trans	-91.3	130.4	-178.2	-54.9	169.8	0	0	0	110
296	A	31.6	Very low	33.4	Very low	87 Å²	87	113.5 Å²	113.5	72%	0.719	62%	0.619	S	S	*	*			trans	-111.8	137.6	154.9	0	0	0	0	0	108.7
297	P	31	Very low	32.9	Very low	109 Å²	109	115.1 Å²	115.1	71%	0.708	62%	0.624	S	S	*	*			trans	-76.6	178	-178.3	33.2	-35.9	0	0	0	112.2
298	Q	31.5	Very low	32.6	Very low	178 Å²	178	116.6 Å²	116.6	83%	0.832	63%	0.633	S	S	*	*			trans	94.6	9.5	171.7	-49.8	-66.8	3.2	0	0	119.3
299	L	26.4	Very low	32.6	Very low	137 Å²	137	119 Å²	119	72%	0.717	65%	0.646	S	S	*	*			trans	-103.9	82.3	166.3	-97.7	157.8	0	0	0	111.9	F301	L299-F301 HydrophobicContact CB-CD2 4.39Å; L299-F301 HydrophobicContact CB-CE2 4.02Å; L299-F301 HydrophobicContact CD2-CE1 4.47Å; L299-F301 HydrophobicContact CD2-CE2 4.4Å; L299-F301 HydrophobicContact CD2-CZ 4.25Å; L299-F301 PolarHBondContact O-N 3.18Å; L299-F301 VanDerWaalsContact O-N 3.14Å
300	V	25.3	Very low	33	Very low	135 Å²	135	120.5 Å²	120.5	82%	0.818	65%	0.652	S	S	*	*			trans	-71.2	99.2	156.8	177.5	0	0	0	0	106.9	K302	V300-K302 PolarHBondContact O-N 3.07Å
301	F	27.4	Very low	33.7	Very low	160 Å²	160	115.7 Å²	115.7	70%	0.702	63%	0.634	S	S	*	*			trans	-64	101.1	168.2	-75.5	-87.7	0	0	0	108.5	L299 V303	L299-F301 HydrophobicContact CB-CD2 4.39Å; L299-F301 HydrophobicContact CB-CE2 4.02Å; L299-F301 HydrophobicContact CD2-CE1 4.47Å; L299-F301 HydrophobicContact CD2-CE2 4.4Å; L299-F301 HydrophobicContact CD2-CZ 4.25Å; L299-F301 PolarHBondContact O-N 3.18Å; L299-F301 VanDerWaalsContact O-N 3.14Å; F301-V303 PolarHBondContact O-N 3.2Å
302	K	23.8	Very low	35.1	Very low	178 Å²	178	116.4 Å²	116.4	77%	0.774	64%	0.638	S	S	*	*			trans	-69	98.3	171.3	-161.1	-174.7	-177.2	-179	0	107.4	V300 T304	V300-K302 PolarHBondContact O-N 3.07Å; K302-T304 HydrophobicContact CD-CG2 3.78Å; K302-T304 HydrophobicContact CG-CG2 3.84Å; K302-T304 PolarHBondContact O-N 2.87Å
303	V	27.8	Very low	37.3	Very low	88 Å²	88	114.5 Å²	114.5	53%	0.533	62%	0.62	S	S	.	*			trans	-68.4	78.7	171.9	179.3	0	0	0	0	108.4	F301 S305 I307	F301-V303 PolarHBondContact O-N 3.2Å; V303-S305 VanDerWaalsContact C-N 3.28Å; V303-S305 PolarHBondContact O-N 2.97Å; V303-I307 HydrophobicContact CB-CD1 4.25Å; V303-I307 HydrophobicContact CG1-CB 3.67Å; V303-I307 HydrophobicContact CG1-CD1 3.59Å; V303-I307 HydrophobicContact CG1-CG1 3.67Å; V303-I307 HydrophobicContact CG2-CD1 3.63Å
304	T	26.5	Very low	39.3	Very low	98 Å²	98	110 Å²	110	60%	0.601	61%	0.605	S	S	*	*			trans	-79.8	82.3	171.9	49.1	0	0	0	0	109.2	K302 N306	K302-T304 HydrophobicContact CD-CG2 3.78Å; K302-T304 HydrophobicContact CG-CG2 3.84Å; K302-T304 PolarHBondContact O-N 2.87Å; T304-N306 PolarHBondContact O-N 2.96Å; T304-N306 VanDerWaalsContact O-N 3.08Å
305	S	29	Very low	41.4	Very low	104 Å²	104	109.3 Å²	109.3	73%	0.727	60%	0.599	S	S	*	*	S	Bend	trans	44.6	51.1	153.5	63.9	0	0	0	0	116.6	V303	V303-S305 VanDerWaalsContact C-N 3.28Å; V303-S305 PolarHBondContact O-N 2.97Å
306	N	28.9	Very low	43.4	Very low	151 Å²	151	106.6 Å²	106.6	81%	0.807	59%	0.586	S	S	*	*			trans	-153.1	20.1	154.1	-100.3	-15.3	0	0	0	112.3	T304 N308	T304-N306 PolarHBondContact O-N 2.96Å; T304-N306 VanDerWaalsContact O-N 3.08Å; N306-N308 PolarHBondContact O-N 3.38Å
307	I	31.9	Very low	45.1	Very low	104 Å²	104	105.4 Å²	105.4	53%	0.533	58%	0.581	S	S	.	*			trans	-80.1	102.8	148.3	-65.5	-173.9	0	0	0	104.3	V303 V309	V303-I307 HydrophobicContact CB-CD1 4.25Å; V303-I307 HydrophobicContact CG1-CB 3.67Å; V303-I307 HydrophobicContact CG1-CD1 3.59Å; V303-I307 HydrophobicContact CG1-CG1 3.67Å; V303-I307 HydrophobicContact CG2-CD1 3.63Å; I307-V309 HydrophobicContact CG2-CG2 3.89Å; I307-V309 PolarHBondContact O-N 2.91Å
308	N	36	Very low	47.2	Very low	103 Å²	103	106.1 Å²	106.1	55%	0.551	57%	0.574	S	S	*	*			trans	-62.2	92.7	153.3	-78.5	7.4	0	0	0	105.1	N306 Y310	N306-N308 PolarHBondContact O-N 3.38Å; N308-Y310 HydrophobicContact CB-CD2 4.29Å; N308-Y310 HydrophobicContact CB-CE2 4.42Å; N308-Y310 PolarHBondContact O-N 2.88Å
309	V	39.2	Very low	49.5	Very low	106 Å²	106	99.4 Å²	99.4	64%	0.642	54%	0.543	S	S	*	.			trans	-59.4	103.4	154.5	179.4	0	0	0	0	102.2	I307 T311	I307-V309 HydrophobicContact CG2-CG2 3.89Å; I307-V309 PolarHBondContact O-N 2.91Å; V309-T311 PolarHBondContact O-N 2.81Å; V309-T311 PolarHBondContact O-OG1 3.36Å
310	Y	52	Low	52.2	Low	133 Å²	133	97.8 Å²	97.8	52%	0.522	54%	0.536	S	S	.	.			trans	-61.5	82.7	161.9	-88.7	-111.2	0	0	0	105.2	N308 D312 P329	N308-Y310 HydrophobicContact CB-CD2 4.29Å; N308-Y310 HydrophobicContact CB-CE2 4.42Å; N308-Y310 PolarHBondContact O-N 2.88Å; Y310-D312 VanDerWaalsContact C-N 3.35Å; Y310-D312 PolarHBondContact O-N 2.86Å; Y310-D312 VanDerWaalsContact O-N 3.15Å; Y310-P329 HydrophobicContact CE1-CB 4.41Å; Y310-P329 VanDerWaalsContact OH-CA 3.31Å; Y310-P329 WeakPolarHBondContact OH-CA 3.29Å; Y310-P329 VanDerWaalsContact OH-CB 3.3Å; Y310-P329 WeakPolarHBondContact OH-CB 3.45Å
311	T	55.5	Low	55.1	Low	40 Å²	40	92.4 Å²	92.4	25%	0.245	50%	0.503	C	S	.	.			trans	-64.6	106.1	163.1	-52.3	0	0	0	0	101.6	V309 E313 D316 K318	V309-T311 PolarHBondContact O-N 2.81Å; V309-T311 PolarHBondContact O-OG1 3.36Å; T311-E313 VanDerWaalsContact C-N 3.27Å; T311-E313 HydrophobicContact CG2-CG 4.47Å; T311-E313 PolarHBondContact O-N 2.92Å; T311-D316 HydrophobicContact CG2-CB 4.27Å; T311-D316 VanDerWaalsContact CG2-OD2 3.25Å; T311-D316 WeakPolarHBondContact CG2-OD2 3.45Å; T311-K318 HydrophobicContact CG2-CD 4.31Å
312	D	71	Confident	57.9	Low	51 Å²	51	90.1 Å²	90.1	27%	0.273	50%	0.495	S	S	.	.			trans	-74.9	92.1	176.7	-173.7	-41.2	0	0	0	105.6	Y310 C314 V315 D316 N327	Y310-D312 VanDerWaalsContact C-N 3.35Å; Y310-D312 PolarHBondContact O-N 2.86Å; Y310-D312 VanDerWaalsContact O-N 3.15Å; D312-C314 PolarHBondContact O-N 3.27Å; D312-C314 VanDerWaalsContact O-N 3.08Å; D312-C314 VanDerWaalsContact OD1-CB 3.27Å; D312-C314 WeakPolarHBondContact OD1-CB 3.11Å; D312-C314 PolarHBondContact OD1-N 2.83Å; D312-V315 HydrophobicContact CB-CB 4.02Å; D312-V315 HydrophobicContact CB-CG2 4.11Å; D312-V315 CarbonylContact O-C 3.58Å; D312-V315 WeakPolarHBondContact O-CA 3.45Å; D312-V315 PolarHBondContact O-N 2.86Å; D312-V315 WeakPolarHBondContact OD1-CG2 3.44Å; D312-V315 PolarHBondContact OD1-N 2.78Å; D312-V315 VanDerWaalsContact OD1-N 3.11Å; D312-D316 WeakPolarHBondContact O-CB 3.34Å; D312-D316 PolarHBondContact O-N 2.86Å; D312-N327 WeakPolarHBondContact CB-ND2 3.28Å; D312-N327 PolarHBondContact OD2-ND2 2.98Å
313	E	80.9	Confident	60.7	Low	36 Å²	36	89.8 Å²	89.8	17%	0.168	49%	0.49	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-20.4	-173	-60.5	86.9	179.2	0	0	112	T311 G317 K318 N319 Y332	T311-E313 VanDerWaalsContact C-N 3.27Å; T311-E313 HydrophobicContact CG2-CG 4.47Å; T311-E313 PolarHBondContact O-N 2.92Å; E313-G317 PolarHBondContact O-N 3.39Å; E313-K318 HydrophobicContact CB-CB 4.41Å; E313-K318 PolarHBondContact O-N 3.02Å; E313-N319 HydrophobicContact CB-CB 4.43Å; E313-N319 PolarHBondContact O-N 3.29Å; E313-N319 PolarHBondContact O-ND2 2.79Å; E313-Y332 HydrophobicContact CB-CD1 3.44Å; E313-Y332 VanDerWaalsContact CB-CD1 3.44Å; E313-Y332 HydrophobicContact CB-CE1 3.94Å; E313-Y332 HydrophobicContact CB-CG 4.06Å; E313-Y332 HydrophobicContact CG-CD1 3.69Å; E313-Y332 HydrophobicContact CG-CE1 4.11Å
314	C	81.7	Confident	63.4	Low	40 Å²	40	86.4 Å²	86.4	27%	0.27	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-27.7	171.6	-50.2	0	0	0	0	113	D312 C325 N327	D312-C314 PolarHBondContact O-N 3.27Å; D312-C314 VanDerWaalsContact O-N 3.08Å; D312-C314 VanDerWaalsContact OD1-CB 3.27Å; D312-C314 WeakPolarHBondContact OD1-CB 3.11Å; D312-C314 PolarHBondContact OD1-N 2.83Å; C314-C325 WeakPolarHBondContact CA-SG 3.38Å; C314-C325 HydrophobicContact CB-CB 3.68Å; C314-C325 WeakPolarHBondContact CB-SG 3.39Å; C314-C325 WeakPolarHBondContact SG-CB 3.45Å; C314-C325 CovalentContact SG-SG 2.04Å; C314-C325 PolarHBondContact SG-SG 2.94Å; C314-N327 PolarHBondContact SG-N 3.43Å; C314-N327 VanDerWaalsContact SG-N 3.37Å
315	V	81	Confident	66.3	Low	115 Å²	115	83.3 Å²	83.3	70%	0.697	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-37.5	175.7	176.2	0	0	0	0	112.2	D312 G317	D312-V315 HydrophobicContact CB-CB 4.02Å; D312-V315 HydrophobicContact CB-CG2 4.11Å; D312-V315 CarbonylContact O-C 3.58Å; D312-V315 WeakPolarHBondContact O-CA 3.45Å; D312-V315 PolarHBondContact O-N 2.86Å; D312-V315 WeakPolarHBondContact OD1-CG2 3.44Å; D312-V315 PolarHBondContact OD1-N 2.78Å; D312-V315 VanDerWaalsContact OD1-N 3.11Å; V315-G317 PolarHBondContact O-N 3.32Å
316	D	72.3	Confident	69.1	Low	86 Å²	86	80.8 Å²	80.8	46%	0.46	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-9	-179.9	-99.4	33.4	0	0	0	113.3	T311 D312 K318	T311-D316 HydrophobicContact CG2-CB 4.27Å; T311-D316 VanDerWaalsContact CG2-OD2 3.25Å; T311-D316 WeakPolarHBondContact CG2-OD2 3.45Å; D312-D316 WeakPolarHBondContact O-CB 3.34Å; D312-D316 PolarHBondContact O-N 2.86Å; D316-K318 HydrophobicContact CB-CD 4.05Å; D316-K318 HydrophobicContact CB-CG 4.16Å; D316-K318 PolarHBondContact O-N 3.02Å; D316-K318 WeakPolarHBondContact OD2-CE 3.4Å; D316-K318 IonicContact OD2-NZ 2.7Å; D316-K318 PolarHBondContact OD2-NZ 3Å
317	G	68	Low	71.5	Confident	61 Å²	61	76 Å²	76	63%	0.629	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	20.9	-177.3	0	0	0	0	0	113.9	E313 V315	E313-G317 PolarHBondContact O-N 3.39Å; V315-G317 PolarHBondContact O-N 3.32Å
318	K	74.7	Confident	73.8	Confident	125 Å²	125	74.3 Å²	74.3	54%	0.543	40%	0.399	S	S	.	.			trans	-97.1	6.6	-179.5	-68	172.3	-174.2	153.6	0	113.4	T311 E313 D316	T311-K318 HydrophobicContact CG2-CD 4.31Å; E313-K318 HydrophobicContact CB-CB 4.41Å; E313-K318 PolarHBondContact O-N 3.02Å; D316-K318 HydrophobicContact CB-CD 4.05Å; D316-K318 HydrophobicContact CB-CG 4.16Å; D316-K318 PolarHBondContact O-N 3.02Å; D316-K318 WeakPolarHBondContact OD2-CE 3.4Å; D316-K318 IonicContact OD2-NZ 2.7Å; D316-K318 PolarHBondContact OD2-NZ 3Å
319	N	79.4	Confident	75.6	Confident	37 Å²	37	74.7 Å²	74.7	20%	0.198	41%	0.407	C	S	.	.			trans	-89.4	145.8	172.8	71.2	95.3	0	0	0	110.5	E313 C321 Y332	E313-N319 HydrophobicContact CB-CB 4.43Å; E313-N319 PolarHBondContact O-N 3.29Å; E313-N319 PolarHBondContact O-ND2 2.79Å; N319-C321 WeakPolarHBondContact OD1-CB 3.18Å; N319-C321 PolarHBondContact OD1-N 3.14Å; N319-Y332 HydrophobicContact CB-CD1 4.43Å; N319-Y332 HydrophobicContact CB-CD2 3.71Å; N319-Y332 HydrophobicContact CB-CE1 4.22Å; N319-Y332 HydrophobicContact CB-CE2 3.47Å; N319-Y332 VanDerWaalsContact CB-CE2 3.47Å; N319-Y332 HydrophobicContact CB-CG 4.19Å
320	N	83.7	Confident	77	Confident	103 Å²	103	71.9 Å²	71.9	55%	0.551	40%	0.4	S	S	*	.			trans	-95.2	15.2	175	-69.7	-21.2	0	0	0	112.7	Q322 Y332 E347	N320-Q322 PolarHBondContact O-N 3.4Å; N320-Y332 PolarHBondContact N-OH 3Å; N320-E347 HydrophobicContact CB-CB 4.44Å; N320-E347 HydrophobicContact CB-CG 3.94Å; N320-E347 VanDerWaalsContact CB-OE1 3.26Å; N320-E347 WeakPolarHBondContact CB-OE1 3.28Å; N320-E347 WeakPolarHBondContact CB-OE2 3.05Å; N320-E347 PolarHBondContact ND2-OE1 2.76Å
321	C	86	Confident	78.4	Confident	21 Å²	21	68.4 Å²	68.4	14%	0.142	40%	0.396	C	S	.	.			trans	-67.1	128	-170.3	-60.7	0	0	0	0	112.5	N319 Y323 G324 C325 C334	N319-C321 WeakPolarHBondContact OD1-CB 3.18Å; N319-C321 PolarHBondContact OD1-N 3.14Å; C321-Y323 VanDerWaalsContact C-N 3.28Å; C321-Y323 PolarHBondContact O-N 2.91Å; C321-G324 WeakPolarHBondContact CB-O 3.24Å; C321-C325 HydrophobicContact CB-CB 4.23Å; C321-C334 WeakPolarHBondContact CA-SG 2.77Å; C321-C334 HydrophobicContact CB-CB 3.67Å; C321-C334 WeakPolarHBondContact CB-SG 3.11Å; C321-C334 WeakPolarHBondContact SG-CA 3.38Å; C321-C334 WeakPolarHBondContact SG-CB 3.29Å; C321-C334 CovalentContact SG-SG 2.04Å; C321-C334 PolarHBondContact SG-SG 2.84Å
322	Q	86.2	Confident	79.8	Confident	113 Å²	113	69 Å²	69	53%	0.528	39%	0.394	S	S	.	.	S	Bend	trans	-64.3	-29.2	178.8	179.8	-179.3	-27.5	0	0	113.7	N320 E347 T348	N320-Q322 PolarHBondContact O-N 3.4Å; Q322-E347 WeakPolarHBondContact CB-O 3.37Å; Q322-E347 PolarHBondContact N-O 3.15Å; Q322-T348 VanDerWaalsContact OE1-CA 3.3Å; Q322-T348 VanDerWaalsContact OE1-CB 3.25Å
323	Y	84.2	Confident	80.7	Confident	170 Å²	170	72.1 Å²	72.1	67%	0.667	40%	0.402	S	S	*	.	S	Bend	trans	-135.4	-71.8	-172.9	-164.9	-90.1	0	0	0	114.1	C321 P337	C321-Y323 VanDerWaalsContact C-N 3.28Å; C321-Y323 PolarHBondContact O-N 2.91Å; Y323-P337 HydrophobicContact CD1-CG 3.75Å; Y323-P337 HydrophobicContact CD2-CG 3.78Å; Y323-P337 HydrophobicContact CE1-CB 4.25Å; Y323-P337 HydrophobicContact CE1-CG 3.74Å; Y323-P337 HydrophobicContact CE2-CG 3.76Å; Y323-P337 HydrophobicContact CG-CG 3.76Å
324	G	83.6	Confident	81.1	Confident	17 Å²	17	70.9 Å²	70.9	18%	0.175	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	147.3	179.4	0	0	0	0	0	111.8	C321 C334 T335	C321-G324 WeakPolarHBondContact CB-O 3.24Å; G324-C334 CarbonylContact O-C 3.59Å; G324-C334 VanDerWaalsContact O-CA 3.29Å; G324-C334 WeakPolarHBondContact O-CA 3.28Å; G324-T335 WeakPolarHBondContact CA-O 3.43Å; G324-T335 WeakPolarHBondContact CA-OG1 3.02Å; G324-T335 PolarHBondContact N-O 2.85Å; G324-T335 PolarHBondContact O-N 2.03Å
325	C	88.1	Confident	81.5	Confident	34 Å²	34	71.3 Å²	71.3	23%	0.23	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	130.8	175.2	-179.1	0	0	0	0	108.5	C314 C321	C314-C325 WeakPolarHBondContact CA-SG 3.38Å; C314-C325 HydrophobicContact CB-CB 3.68Å; C314-C325 WeakPolarHBondContact CB-SG 3.39Å; C314-C325 WeakPolarHBondContact SG-CB 3.45Å; C314-C325 CovalentContact SG-SG 2.04Å; C314-C325 PolarHBondContact SG-SG 2.94Å; C321-C325 HydrophobicContact CB-CB 4.23Å
326	V	86.3	Confident	81.8	Confident	51 Å²	51	67.3 Å²	67.3	31%	0.309	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	114.6	172.8	-177.9	0	0	0	0	108.5	Y332 R333 T335	V326-Y332 WeakPolarHBondContact O-CA 3.48Å; V326-R333 HydrophobicContact CB-CG 4.12Å; V326-R333 PolarHBondContact N-O 2.99Å; V326-R333 PolarHBondContact O-N 3.13Å; V326-T335 HydrophobicContact CG2-CG2 3.66Å
327	N	80.8	Confident	82.3	Confident	50 Å²	50	64.9 Å²	64.9	27%	0.267	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	133	176	-175.8	6.5	0	0	0	110.2	D312 C314	D312-N327 WeakPolarHBondContact CB-ND2 3.28Å; D312-N327 PolarHBondContact OD2-ND2 2.98Å; C314-N327 PolarHBondContact SG-N 3.43Å; C314-N327 VanDerWaalsContact SG-N 3.37Å
328	E	80.4	Confident	82.9	Confident	68 Å²	68	69.8 Å²	69.8	32%	0.318	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	166	-179.3	-63.2	-157.1	135.2	0	0	111.4	G330 S331 R333	E328-G330 PolarHBondContact O-N 3.02Å; E328-S331 CarbonylContact C-O 3.53Å; E328-S331 VanDerWaalsContact CA-O 3.29Å; E328-S331 WeakPolarHBondContact CA-O 3.33Å; E328-S331 WeakPolarHBondContact CB-O 3.44Å; E328-S331 PolarHBondContact N-O 3.13Å; E328-S331 PolarHBondContact O-N 3.29Å; E328-R333 HydrophobicContact CG-CG 4.23Å; E328-R333 WeakPolarHBondContact OE1-CD 3.25Å; E328-R333 IonicContact OE1-CZ 3.63Å; E328-R333 IonicContact OE1-NE 3.69Å; E328-R333 IonicContact OE1-NH1 3.01Å; E328-R333 PolarHBondContact OE1-NH1 2.78Å
329	P	72.8	Confident	83.2	Confident	111 Å²	111	64.6 Å²	64.6	72%	0.721	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	84.8	171.2	-33.5	41.2	0	0	0	116.7	Y310	Y310-P329 HydrophobicContact CE1-CB 4.41Å; Y310-P329 VanDerWaalsContact OH-CA 3.31Å; Y310-P329 WeakPolarHBondContact OH-CA 3.29Å; Y310-P329 VanDerWaalsContact OH-CB 3.3Å; Y310-P329 WeakPolarHBondContact OH-CB 3.45Å
330	G	69.2	Low	83.6	Confident	48 Å²	48	66 Å²	66	50%	0.495	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	19.7	178	0	0	0	0	0	114.9	E328	E328-G330 PolarHBondContact O-N 3.02Å
331	S	80.6	Confident	83.8	Confident	60 Å²	60	65.4 Å²	65.4	42%	0.42	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	178.7	176.6	-168.4	0	0	0	0	109.1	E328	E328-S331 CarbonylContact C-O 3.53Å; E328-S331 VanDerWaalsContact CA-O 3.29Å; E328-S331 WeakPolarHBondContact CA-O 3.33Å; E328-S331 WeakPolarHBondContact CB-O 3.44Å; E328-S331 PolarHBondContact N-O 3.13Å; E328-S331 PolarHBondContact O-N 3.29Å
332	Y	85.5	Confident	83.9	Confident	53 Å²	53	67.7 Å²	67.7	21%	0.208	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	160.2	161.1	65	-81.9	0	0	0	109.8	E313 N319 N320 V326	E313-Y332 HydrophobicContact CB-CD1 3.44Å; E313-Y332 VanDerWaalsContact CB-CD1 3.44Å; E313-Y332 HydrophobicContact CB-CE1 3.94Å; E313-Y332 HydrophobicContact CB-CG 4.06Å; E313-Y332 HydrophobicContact CG-CD1 3.69Å; E313-Y332 HydrophobicContact CG-CE1 4.11Å; N319-Y332 HydrophobicContact CB-CD1 4.43Å; N319-Y332 HydrophobicContact CB-CD2 3.71Å; N319-Y332 HydrophobicContact CB-CE1 4.22Å; N319-Y332 HydrophobicContact CB-CE2 3.47Å; N319-Y332 VanDerWaalsContact CB-CE2 3.47Å; N319-Y332 HydrophobicContact CB-CG 4.19Å; N320-Y332 PolarHBondContact N-OH 3Å; V326-Y332 WeakPolarHBondContact O-CA 3.48Å
333	R	89.4	Confident	84	Confident	116 Å²	116	64.9 Å²	64.9	44%	0.438	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	142.7	165.2	71.3	173.8	-167.6	-76.9	-9.4	110.5	V326 E328	V326-R333 HydrophobicContact CB-CG 4.12Å; V326-R333 PolarHBondContact N-O 2.99Å; V326-R333 PolarHBondContact O-N 3.13Å; E328-R333 HydrophobicContact CG-CG 4.23Å; E328-R333 WeakPolarHBondContact OE1-CD 3.25Å; E328-R333 IonicContact OE1-CZ 3.63Å; E328-R333 IonicContact OE1-NE 3.69Å; E328-R333 IonicContact OE1-NH1 3.01Å; E328-R333 PolarHBondContact OE1-NH1 2.78Å
334	C	90	Very high	84	Confident	10 Å²	10	63.2 Å²	63.2	7%	0.068	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	150.7	172.8	-54.5	0	0	0	0	111.1	C321 G324 L342 G346	C321-C334 WeakPolarHBondContact CA-SG 2.77Å; C321-C334 HydrophobicContact CB-CB 3.67Å; C321-C334 WeakPolarHBondContact CB-SG 3.11Å; C321-C334 WeakPolarHBondContact SG-CA 3.38Å; C321-C334 WeakPolarHBondContact SG-CB 3.29Å; C321-C334 CovalentContact SG-SG 2.04Å; C321-C334 PolarHBondContact SG-SG 2.84Å; G324-C334 CarbonylContact O-C 3.59Å; G324-C334 VanDerWaalsContact O-CA 3.29Å; G324-C334 WeakPolarHBondContact O-CA 3.28Å; C334-L342 HydrophobicContact CB-CD1 3.91Å; C334-G346 VanDerWaalsContact CB-O 3.29Å; C334-G346 WeakPolarHBondContact CB-O 3.36Å; C334-G346 PolarHBondContact SG-O 3.16Å; C334-G346 VanDerWaalsContact SG-O 3.36Å
335	T	89.9	Confident	84.2	Confident	48 Å²	48	66.1 Å²	66.1	29%	0.294	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	135.6	178.8	56.2	0	0	0	0	110.2	G324 V326	G324-T335 WeakPolarHBondContact CA-O 3.43Å; G324-T335 WeakPolarHBondContact CA-OG1 3.02Å; G324-T335 PolarHBondContact N-O 2.85Å; G324-T335 PolarHBondContact O-N 2.03Å; V326-T335 HydrophobicContact CG2-CG2 3.66Å
336	C	87.1	Confident	84	Confident	32 Å²	32	66 Å²	66	22%	0.216	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-93.6	158.6	177.1	-62.5	0	0	0	0	112	C349	C336-C349 WeakPolarHBondContact CA-SG 3.32Å; C336-C349 HydrophobicContact CB-CB 3.86Å; C336-C349 WeakPolarHBondContact CB-SG 3.22Å; C336-C349 WeakPolarHBondContact SG-CA 3.35Å; C336-C349 WeakPolarHBondContact SG-CB 3.44Å; C336-C349 CovalentContact SG-SG 2.04Å; C336-C349 PolarHBondContact SG-SG 3.42Å
337	P	83	Confident	84	Confident	34 Å²	34	66.7 Å²	66.7	22%	0.221	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-64.1	161.6	167.2	-4.9	16.8	0	0	0	111.3	Y323 Y340	Y323-P337 HydrophobicContact CD1-CG 3.75Å; Y323-P337 HydrophobicContact CD2-CG 3.78Å; Y323-P337 HydrophobicContact CE1-CB 4.25Å; Y323-P337 HydrophobicContact CE1-CG 3.74Å; Y323-P337 HydrophobicContact CE2-CG 3.76Å; Y323-P337 HydrophobicContact CG-CG 3.76Å; P337-Y340 HydrophobicContact CB-CD2 4.06Å; P337-Y340 HydrophobicContact CG-CD2 3.83Å; P337-Y340 HydrophobicContact CG-CE2 4.28Å; P337-Y340 PolarHBondContact O-N 2.83Å; P337-Y340 VanDerWaalsContact O-N 3.09Å
338	D	80.7	Confident	84.3	Confident	164 Å²	164	66.4 Å²	66.4	88%	0.877	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	140.7	164.2	-59.3	-42.5	0	0	0	110.1	Y340	D338-Y340 VanDerWaalsContact C-N 3.34Å
339	G	80.8	Confident	84.6	Confident	17 Å²	17	63.8 Å²	63.8	18%	0.175	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.9	-1.7	-171.5	0	0	0	0	0	114.9	I352	G339-I352 PolarHBondContact O-N 3.48Å
340	Y	88.3	Confident	85.3	Confident	66 Å²	66	63.9 Å²	63.9	26%	0.259	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	141.8	175.7	-66.2	-97.2	0	0	0	111.9	P337 D338 C349 K350 D351 P369 G370	P337-Y340 HydrophobicContact CB-CD2 4.06Å; P337-Y340 HydrophobicContact CG-CD2 3.83Å; P337-Y340 HydrophobicContact CG-CE2 4.28Å; P337-Y340 PolarHBondContact O-N 2.83Å; P337-Y340 VanDerWaalsContact O-N 3.09Å; D338-Y340 VanDerWaalsContact C-N 3.34Å; Y340-C349 HydrophobicContact CD1-CB 4.22Å; Y340-C349 HydrophobicContact CG-CB 4.44Å; Y340-K350 CarbonylContact C-O 3.4Å; Y340-K350 WeakPolarHBondContact CA-O 3.28Å; Y340-D351 HydrophobicContact CD1-CB 4.44Å; Y340-D351 HydrophobicContact CE1-CB 4.29Å; Y340-P369 WeakPolarHBondContact OH-CB 3.22Å; Y340-P369 PolarHBondContact OH-O 2.72Å; Y340-G370 PolarHBondContact OH-N 3.43Å
341	Q	87.8	Confident	86.3	Confident	91 Å²	91	63.5 Å²	63.5	43%	0.425	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	145.9	171.1	56.6	170.5	56.1	0	0	110.7	K350 I352	Q341-K350 HydrophobicContact CG-CB 4.25Å; Q341-K350 WeakPolarHBondContact CG-O 3.03Å; Q341-K350 PolarHBondContact N-O 3.49Å; Q341-K350 PolarHBondContact O-N 3.45Å; Q341-I352 HydrophobicContact CB-CD1 4.21Å; Q341-I352 HydrophobicContact CB-CG1 3.95Å; Q341-I352 HydrophobicContact CG-CG1 3.93Å
342	L	87.2	Confident	86.5	Confident	68 Å²	68	62.6 Å²	62.6	36%	0.356	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	133	172.8	-162.8	69.5	0	0	0	109.3	C334	C334-L342 HydrophobicContact CB-CD1 3.91Å
343	N	87.9	Confident	86.5	Confident	54 Å²	54	62.8 Å²	62.8	29%	0.289	34%	0.343	S	S	.	.			trans	-70.8	169.9	176.4	-92.8	-31.4	0	0	0	111.6	D345 G346 T348 K350	N343-D345 VanDerWaalsContact CB-OD1 3.31Å; N343-D345 WeakPolarHBondContact CB-OD1 3.34Å; N343-D345 PolarHBondContact O-N 3.13Å; N343-D345 VanDerWaalsContact O-N 3.1Å; N343-G346 PolarHBondContact O-N 3.27Å; N343-T348 WeakPolarHBondContact CB-O 3.3Å; N343-T348 WeakPolarHBondContact CB-OG1 3.11Å; N343-T348 PolarHBondContact N-O 2.81Å; N343-T348 PolarHBondContact ND2-OG1 3.42Å; N343-K350 WeakPolarHBondContact OD1-CB 3.41Å; N343-K350 WeakPolarHBondContact OD1-CD 3.31Å
344	S	85.9	Confident	86.3	Confident	135 Å²	135	58.6 Å²	58.6	94%	0.944	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-9.3	175.7	55.2	0	0	0	0	114.7
345	D	86.4	Confident	86.1	Confident	79 Å²	79	59.7 Å²	59.7	42%	0.422	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-17.5	171.4	56.1	20.6	0	0	0	112.9	N343 E347 T348	N343-D345 VanDerWaalsContact CB-OD1 3.31Å; N343-D345 WeakPolarHBondContact CB-OD1 3.34Å; N343-D345 PolarHBondContact O-N 3.13Å; N343-D345 VanDerWaalsContact O-N 3.1Å; D345-E347 PolarHBondContact O-N 2.81Å; D345-E347 PolarHBondContact OD1-N 3.43Å; D345-T348 PolarHBondContact OD1-N 3.34Å; D345-T348 PolarHBondContact OD1-OG1 2.77Å; D345-T348 WeakPolarHBondContact OD2-CB 3.07Å; D345-T348 WeakPolarHBondContact OD2-CG2 3.07Å; D345-T348 PolarHBondContact OD2-OG1 3.23Å
346	G	84.7	Confident	85.8	Confident	32 Å²	32	64.1 Å²	64.1	33%	0.33	36%	0.357	S	S	.	.	S	Bend	trans	74.4	5.3	-175.2	0	0	0	0	0	114.5	C334 N343	C334-G346 VanDerWaalsContact CB-O 3.29Å; C334-G346 WeakPolarHBondContact CB-O 3.36Å; C334-G346 PolarHBondContact SG-O 3.16Å; C334-G346 VanDerWaalsContact SG-O 3.36Å; N343-G346 PolarHBondContact O-N 3.27Å
347	E	86.1	Confident	84.9	Confident	65 Å²	65	70 Å²	70	30%	0.304	38%	0.381	S	S	.	.	S	Bend	trans	-123.9	-39.9	-169.9	-67	-178.3	166.9	0	0	112.6	N320 Q322 D345	N320-E347 HydrophobicContact CB-CB 4.44Å; N320-E347 HydrophobicContact CB-CG 3.94Å; N320-E347 VanDerWaalsContact CB-OE1 3.26Å; N320-E347 WeakPolarHBondContact CB-OE1 3.28Å; N320-E347 WeakPolarHBondContact CB-OE2 3.05Å; N320-E347 PolarHBondContact ND2-OE1 2.76Å; Q322-E347 WeakPolarHBondContact CB-O 3.37Å; Q322-E347 PolarHBondContact N-O 3.15Å; D345-E347 PolarHBondContact O-N 2.81Å; D345-E347 PolarHBondContact OD1-N 3.43Å
348	T	86.7	Confident	84	Confident	44 Å²	44	70.6 Å²	70.6	27%	0.27	39%	0.393	S	S	.	.			trans	-101.3	152.5	-174.8	68.9	0	0	0	0	112.8	Q322 N343 D345	Q322-T348 VanDerWaalsContact OE1-CA 3.3Å; Q322-T348 VanDerWaalsContact OE1-CB 3.25Å; N343-T348 WeakPolarHBondContact CB-O 3.3Å; N343-T348 WeakPolarHBondContact CB-OG1 3.11Å; N343-T348 PolarHBondContact N-O 2.81Å; N343-T348 PolarHBondContact ND2-OG1 3.42Å; D345-T348 PolarHBondContact OD1-N 3.34Å; D345-T348 PolarHBondContact OD1-OG1 2.77Å; D345-T348 WeakPolarHBondContact OD2-CB 3.07Å; D345-T348 WeakPolarHBondContact OD2-CG2 3.07Å; D345-T348 PolarHBondContact OD2-OG1 3.23Å
349	C	87.7	Confident	83.1	Confident	13 Å²	13	72 Å²	72	9%	0.088	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	116.8	-177.9	-66.8	0	0	0	0	110.1	C336 Y340	C336-C349 WeakPolarHBondContact CA-SG 3.32Å; C336-C349 HydrophobicContact CB-CB 3.86Å; C336-C349 WeakPolarHBondContact CB-SG 3.22Å; C336-C349 WeakPolarHBondContact SG-CA 3.35Å; C336-C349 WeakPolarHBondContact SG-CB 3.44Å; C336-C349 CovalentContact SG-SG 2.04Å; C336-C349 PolarHBondContact SG-SG 3.42Å; Y340-C349 HydrophobicContact CD1-CB 4.22Å; Y340-C349 HydrophobicContact CG-CB 4.44Å
350	K	87.6	Confident	82.7	Confident	112 Å²	112	72.8 Å²	72.8	49%	0.487	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	133.4	174.8	172.6	177.9	174.9	-169.1	0	110.1	Y340 Q341 N343 I352	Y340-K350 CarbonylContact C-O 3.4Å; Y340-K350 WeakPolarHBondContact CA-O 3.28Å; Q341-K350 HydrophobicContact CG-CB 4.25Å; Q341-K350 WeakPolarHBondContact CG-O 3.03Å; Q341-K350 PolarHBondContact N-O 3.49Å; Q341-K350 PolarHBondContact O-N 3.45Å; N343-K350 WeakPolarHBondContact OD1-CB 3.41Å; N343-K350 WeakPolarHBondContact OD1-CD 3.31Å; K350-I352 PolarHBondContact O-N 3.05Å
351	D	88.5	Confident	82.3	Confident	41 Å²	41	70.6 Å²	70.6	22%	0.219	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.8	129.6	172.6	-171.7	51.8	0	0	0	111.9	Y340 N367 P369 G370	Y340-D351 HydrophobicContact CD1-CB 4.44Å; Y340-D351 HydrophobicContact CE1-CB 4.29Å; D351-N367 PolarHBondContact OD2-ND2 3.16Å; D351-P369 VanDerWaalsContact OD1-CA 3.26Å; D351-P369 WeakPolarHBondContact OD1-CA 3.44Å; D351-G370 PolarHBondContact OD1-N 3.05Å
352	I	85.8	Confident	82	Confident	41 Å²	41	69.3 Å²	69.3	21%	0.21	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-83.4	118.9	172	-61	172.4	0	0	0	106.9	G339 Q341 K350 E354	G339-I352 PolarHBondContact O-N 3.48Å; Q341-I352 HydrophobicContact CB-CD1 4.21Å; Q341-I352 HydrophobicContact CB-CG1 3.95Å; Q341-I352 HydrophobicContact CG-CG1 3.93Å; K350-I352 PolarHBondContact O-N 3.05Å; I352-E354 HydrophobicContact CG2-CG 4.17Å; I352-E354 VanDerWaalsContact O-CD 3.29Å; I352-E354 PolarHBondContact O-N 3.05Å; I352-E354 VanDerWaalsContact O-N 3.12Å
353	N	84.8	Confident	81.8	Confident	57 Å²	57	69 Å²	69	31%	0.305	38%	0.381	S	S	.	.			trans	-84.8	86.9	177.3	-174.7	-18.2	0	0	0	110.2	C355 L356 N367	N353-C355 PolarHBondContact O-N 2.95Å; N353-C355 VanDerWaalsContact O-N 3.14Å; N353-C355 WeakPolarHBondContact OD1-CB 3.31Å; N353-C355 PolarHBondContact OD1-N 2.84Å; N353-L356 HydrophobicContact CB-CD1 4.02Å; N353-L356 HydrophobicContact CB-CG 4.21Å; N353-L356 WeakPolarHBondContact O-CB 3.35Å; N353-L356 PolarHBondContact O-N 3.37Å; N353-N367 WeakPolarHBondContact CA-OD1 3.41Å; N353-N367 VanDerWaalsContact CG-CG 3.49Å; N353-N367 WeakPolarHBondContact OD1-CB 3.17Å
354	E	85.1	Confident	81.6	Confident	27 Å²	27	69.3 Å²	69.3	13%	0.126	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-65.9	-18.7	-175.1	-53.3	96	167.4	0	0	112.7	I352 L356 E357 N360 G371 F372	I352-E354 HydrophobicContact CG2-CG 4.17Å; I352-E354 VanDerWaalsContact O-CD 3.29Å; I352-E354 PolarHBondContact O-N 3.05Å; I352-E354 VanDerWaalsContact O-N 3.12Å; E354-L356 PolarHBondContact O-N 3.11Å; E354-E357 PolarHBondContact O-N 2.81Å; E354-N360 PolarHBondContact O-ND2 3.3Å; E354-G371 WeakPolarHBondContact OE1-CA 3.3Å; E354-G371 WeakPolarHBondContact OE2-CA 3.43Å; E354-F372 HydrophobicContact CB-CB 4.39Å; E354-F372 HydrophobicContact CB-CD1 3.61Å; E354-F372 HydrophobicContact CB-CE1 4.25Å; E354-F372 HydrophobicContact CB-CG 4.27Å; E354-F372 HydrophobicContact CG-CD1 3.96Å; E354-F372 PolarHBondContact OE2-N 2.04Å
355	C	85.7	Confident	81.6	Confident	34 Å²	34	64.9 Å²	64.9	23%	0.23	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-68.3	-10.5	172.8	-58.3	0	0	0	0	113.6	N353 C365 L366 N367	N353-C355 PolarHBondContact O-N 2.95Å; N353-C355 VanDerWaalsContact O-N 3.14Å; N353-C355 WeakPolarHBondContact OD1-CB 3.31Å; N353-C355 PolarHBondContact OD1-N 2.84Å; C355-C365 WeakPolarHBondContact CA-SG 3.34Å; C355-C365 HydrophobicContact CB-CB 3.75Å; C355-C365 WeakPolarHBondContact CB-SG 3.48Å; C355-C365 WeakPolarHBondContact SG-CB 3.37Å; C355-C365 CovalentContact SG-SG 2.04Å; C355-C365 PolarHBondContact SG-SG 3.03Å; C355-L366 VanDerWaalsContact SG-C 3.57Å; C355-N367 PolarHBondContact SG-N 2.05Å; C355-N367 VanDerWaalsContact SG-N 3.45Å
356	L	83.6	Confident	81.6	Confident	141 Å²	141	64 Å²	64	74%	0.738	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-94.9	-12.5	173.6	-62	178.5	0	0	0	113.7	N353 E354	N353-L356 HydrophobicContact CB-CD1 4.02Å; N353-L356 HydrophobicContact CB-CG 4.21Å; N353-L356 WeakPolarHBondContact O-CB 3.35Å; N353-L356 PolarHBondContact O-N 3.37Å; E354-L356 PolarHBondContact O-N 3.11Å
357	E	69.2	Low	81.6	Confident	155 Å²	155	65.2 Å²	65.2	72%	0.724	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-8.7	-173.8	-67.7	-164.5	149.3	0	0	114.9	E354	E354-E357 PolarHBondContact O-N 2.81Å
358	G	62.5	Low	81.5	Confident	46 Å²	46	67.3 Å²	67.3	47%	0.474	35%	0.353	S	S	.	.	S	Bend	trans	155.2	-164.7	172.5	0	0	0	0	0	115.7	N360	G358-N360 PolarHBondContact O-N 2.85Å
359	Q	63.4	Low	81.2	Confident	194 Å²	194	70.4 Å²	70.4	91%	0.907	37%	0.374	S	S	*	.			trans	-69.7	72.8	178.1	-71.4	-177.8	-10.1	0	0	111.9
360	N	72.7	Confident	80.7	Confident	34 Å²	34	71.2 Å²	71.2	18%	0.182	39%	0.385	C	S	.	.			trans	-86.2	-14.5	178.9	-85.3	-38.6	0	0	0	114	E354 G358 F372 R386	E354-N360 PolarHBondContact O-ND2 3.3Å; G358-N360 PolarHBondContact O-N 2.85Å; N360-F372 HydrophobicContact CB-CD2 4.18Å; N360-F372 HydrophobicContact CB-CE1 4.31Å; N360-F372 HydrophobicContact CB-CE2 3.79Å; N360-F372 HydrophobicContact CB-CZ 3.85Å; N360-F372 VanDerWaalsContact O-CE2 3.29Å; N360-F372 WeakPolarHBondContact O-CE2 3.47Å; N360-R386 WeakPolarHBondContact O-CB 3.37Å; N360-R386 WeakPolarHBondContact O-CD 3.06Å; N360-R386 VanDerWaalsContact O-CG 3.29Å; N360-R386 WeakPolarHBondContact O-CG 3.1Å
361	C	79.5	Confident	80.4	Confident	19 Å²	19	66.9 Å²	66.9	13%	0.128	37%	0.371	C	S	.	.	S	Bend	trans	-137.4	148.2	176.1	-59.1	0	0	0	0	111	H363 C365 C374 R386	C361-H363 VanDerWaalsContact C-N 3.35Å; C361-H363 PolarHBondContact O-N 3.44Å; C361-C365 HydrophobicContact CB-CB 4.08Å; C361-C365 VanDerWaalsContact SG-CA 3.55Å; C361-C365 VanDerWaalsContact SG-CB 3.55Å; C361-C365 VanDerWaalsContact SG-SG 3.69Å; C361-C374 VanDerWaalsContact CA-SG 3.56Å; C361-C374 HydrophobicContact CB-CB 3.68Å; C361-C374 WeakPolarHBondContact CB-SG 3.35Å; C361-C374 WeakPolarHBondContact SG-CA 3.17Å; C361-C374 WeakPolarHBondContact SG-CB 3.49Å; C361-C374 CovalentContact SG-SG 2.02Å; C361-C374 PolarHBondContact SG-SG 2.94Å; C361-R386 CarbonylContact C-O 3.58Å; C361-R386 WeakPolarHBondContact CA-O 3.22Å
362	D	80.4	Confident	80.2	Confident	65 Å²	65	67.5 Å²	67.5	35%	0.348	37%	0.372	S	S	.	.	S	Bend	trans	-62.9	-38.2	174.9	-75	2.4	0	0	0	112.9	R386 H387 C388	D362-R386 PolarHBondContact N-O 2.63Å; D362-H387 IonicContact OD1-CE1 3.45Å; D362-H387 IonicContact OD1-CG 3.43Å; D362-H387 IonicContact OD1-ND1 3.16Å; D362-H387 PolarHBondContact OD1-ND1 2.8Å; D362-H387 WeakPolarHBondContact OD2-CA 3.37Å; D362-H387 VanDerWaalsContact OD2-CB 3.22Å; D362-H387 WeakPolarHBondContact OD2-CB 3.03Å; D362-H387 IonicContact OD2-CG 2.72Å; D362-H387 IonicContact OD2-ND1 3.99Å; D362-H387 PolarHBondContact OD2-ND1 3.1Å; D362-C388 HydrophobicContact CB-CB 4.21Å; D362-C388 PolarHBondContact OD2-N 2.96Å
363	H	82.6	Confident	79.9	Confident	60 Å²	60	66.7 Å²	66.7	28%	0.278	37%	0.372	S	S	.	.	S	Bend	trans	-121.9	-75.7	-171.3	-74.2	161.3	0	0	0	113.3	C361 E375 Q377 Y380 C388	C361-H363 VanDerWaalsContact C-N 3.35Å; C361-H363 PolarHBondContact O-N 3.44Å; H363-E375 WeakPolarHBondContact CB-O 3.39Å; H363-Q377 HydrophobicContact CB-CG 4.24Å; H363-Q377 PolarHBondContact ND1-N 2.81Å; H363-Y380 AromaticContact CE1-CD1 3.63Å; H363-Y380 AromaticContact CE1-CD2 3.76Å; H363-Y380 AromaticContact CE1-CG 3.5Å; H363-C388 VanDerWaalsContact CE1-CB 3.5Å; H363-C388 WeakPolarHBondContact CE1-CB 3.48Å; H363-C388 WeakPolarHBondContact ND1-CB 3.5Å; H363-C388 PolarHBondContact ND1-SG 3.04Å; H363-C388 VanDerWaalsContact ND1-SG 3.43Å
364	I	84.2	Confident	79.9	Confident	61 Å²	61	64.6 Å²	64.6	31%	0.313	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	126.4	-174.2	-59	166.1	0	0	0	107.9	L366 C374 E375 Q377	I364-L366 HydrophobicContact CG2-CD2 4Å; I364-L366 HydrophobicContact CG2-CG 4.34Å; I364-C374 CarbonylContact O-C 3.53Å; I364-C374 VanDerWaalsContact O-CA 3.28Å; I364-C374 WeakPolarHBondContact O-CA 3.35Å; I364-E375 HydrophobicContact CB-CB 3.97Å; I364-E375 WeakPolarHBondContact CB-O 3.39Å; I364-E375 HydrophobicContact CD1-CB 4.39Å; I364-E375 HydrophobicContact CG2-CB 4.2Å; I364-E375 PolarHBondContact N-O 3.26Å; I364-E375 PolarHBondContact O-N 3.26Å; I364-Q377 HydrophobicContact CD1-CG 4.43Å
365	C	86.9	Confident	79.7	Confident	42 Å²	42	68.2 Å²	68.2	28%	0.284	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	126.4	172.8	-169.5	0	0	0	0	109.8	C355 C361	C355-C365 WeakPolarHBondContact CA-SG 3.34Å; C355-C365 HydrophobicContact CB-CB 3.75Å; C355-C365 WeakPolarHBondContact CB-SG 3.48Å; C355-C365 WeakPolarHBondContact SG-CB 3.37Å; C355-C365 CovalentContact SG-SG 2.04Å; C355-C365 PolarHBondContact SG-SG 3.03Å; C361-C365 HydrophobicContact CB-CB 4.08Å; C361-C365 VanDerWaalsContact SG-CA 3.55Å; C361-C365 VanDerWaalsContact SG-CB 3.55Å; C361-C365 VanDerWaalsContact SG-SG 3.69Å
366	L	85.6	Confident	79.4	Confident	62 Å²	62	68 Å²	68	33%	0.325	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	115.8	175.2	-61.7	-172.4	0	0	0	109.7	C355 I364 F372 A373 E375	C355-L366 VanDerWaalsContact SG-C 3.57Å; I364-L366 HydrophobicContact CG2-CD2 4Å; I364-L366 HydrophobicContact CG2-CG 4.34Å; L366-F372 CarbonylContact O-C 3.54Å; L366-F372 WeakPolarHBondContact O-CA 3.01Å; L366-A373 PolarHBondContact N-O 3.43Å; L366-A373 PolarHBondContact O-N 3.35Å; L366-E375 HydrophobicContact CD1-CG 3.87Å; L366-E375 VanDerWaalsContact CD1-OE1 3.27Å; L366-E375 WeakPolarHBondContact CD1-OE1 3.38Å; L366-E375 HydrophobicContact CG-CG 4.42Å
367	N	84.5	Confident	79.2	Confident	57 Å²	57	66.2 Å²	66.2	31%	0.305	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	134.5	174.5	-168.5	50.8	0	0	0	111.1	D351 N353 C355	D351-N367 PolarHBondContact OD2-ND2 3.16Å; N353-N367 WeakPolarHBondContact CA-OD1 3.41Å; N353-N367 VanDerWaalsContact CG-CG 3.49Å; N353-N367 WeakPolarHBondContact OD1-CB 3.17Å; C355-N367 PolarHBondContact SG-N 2.05Å; C355-N367 VanDerWaalsContact SG-N 3.45Å
368	K	83.5	Confident	79.4	Confident	109 Å²	109	65.1 Å²	65.1	47%	0.474	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	156.2	172.3	-55.5	178.5	174.1	171.2	0	109.6	G370 G371 A373	K368-G370 PolarHBondContact O-N 3.15Å; K368-G371 CarbonylContact C-O 3.4Å; K368-G371 WeakPolarHBondContact CA-O 3.35Å; K368-G371 VanDerWaalsContact CB-O 3.24Å; K368-G371 WeakPolarHBondContact CB-O 3.01Å; K368-G371 PolarHBondContact N-O 3.39Å; K368-G371 CarbonylContact O-C 3.53Å; K368-G371 PolarHBondContact O-N 3.37Å; K368-A373 HydrophobicContact CD-CB 3.88Å; K368-A373 VanDerWaalsContact CE-CB 3.5Å
369	P	81.1	Confident	79.1	Confident	108 Å²	108	65.7 Å²	65.7	70%	0.701	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	111.7	178.3	-26.7	36.3	0	0	0	112.7	Y340 D351	Y340-P369 WeakPolarHBondContact OH-CB 3.22Å; Y340-P369 PolarHBondContact OH-O 2.72Å; D351-P369 VanDerWaalsContact OD1-CA 3.26Å; D351-P369 WeakPolarHBondContact OD1-CA 3.44Å
370	G	77	Confident	79.4	Confident	31 Å²	31	61.7 Å²	61.7	32%	0.32	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.7	20.2	-179.3	0	0	0	0	0	115.2	Y340 D351 K368	Y340-G370 PolarHBondContact OH-N 3.43Å; D351-G370 PolarHBondContact OD1-N 3.05Å; K368-G370 PolarHBondContact O-N 3.15Å
371	G	81.4	Confident	78.9	Confident	20 Å²	20	64.1 Å²	64.1	21%	0.206	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	149	151.6	172.5	0	0	0	0	0	114.3	E354 K368	E354-G371 WeakPolarHBondContact OE1-CA 3.3Å; E354-G371 WeakPolarHBondContact OE2-CA 3.43Å; K368-G371 CarbonylContact C-O 3.4Å; K368-G371 WeakPolarHBondContact CA-O 3.35Å; K368-G371 VanDerWaalsContact CB-O 3.24Å; K368-G371 WeakPolarHBondContact CB-O 3.01Å; K368-G371 PolarHBondContact N-O 3.39Å; K368-G371 CarbonylContact O-C 3.53Å; K368-G371 PolarHBondContact O-N 3.37Å
372	F	84.8	Confident	78.3	Confident	54 Å²	54	67 Å²	67	24%	0.237	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	162.1	175.7	70	-78	0	0	0	114.8	E354 N360 L366 R386	E354-F372 HydrophobicContact CB-CB 4.39Å; E354-F372 HydrophobicContact CB-CD1 3.61Å; E354-F372 HydrophobicContact CB-CE1 4.25Å; E354-F372 HydrophobicContact CB-CG 4.27Å; E354-F372 HydrophobicContact CG-CD1 3.96Å; E354-F372 PolarHBondContact OE2-N 2.04Å; N360-F372 HydrophobicContact CB-CD2 4.18Å; N360-F372 HydrophobicContact CB-CE1 4.31Å; N360-F372 HydrophobicContact CB-CE2 3.79Å; N360-F372 HydrophobicContact CB-CZ 3.85Å; N360-F372 VanDerWaalsContact O-CE2 3.29Å; N360-F372 WeakPolarHBondContact O-CE2 3.47Å; L366-F372 CarbonylContact O-C 3.54Å; L366-F372 WeakPolarHBondContact O-CA 3.01Å; F372-R386 HydrophobicContact CE2-CG 4.28Å; F372-R386 HydrophobicContact CZ-CG 4.31Å
373	A	80.1	Confident	77.2	Confident	24 Å²	24	66.4 Å²	66.4	20%	0.198	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	147.7	165.8	0	0	0	0	0	110.4	L366 K368	L366-A373 PolarHBondContact N-O 3.43Å; L366-A373 PolarHBondContact O-N 3.35Å; K368-A373 HydrophobicContact CD-CB 3.88Å; K368-A373 VanDerWaalsContact CE-CB 3.5Å
374	C	83.4	Confident	75.9	Confident	13 Å²	13	65.9 Å²	65.9	9%	0.088	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	140.9	177.3	-56.9	0	0	0	0	111.7	C361 I364 L382 Y385	C361-C374 VanDerWaalsContact CA-SG 3.56Å; C361-C374 HydrophobicContact CB-CB 3.68Å; C361-C374 WeakPolarHBondContact CB-SG 3.35Å; C361-C374 WeakPolarHBondContact SG-CA 3.17Å; C361-C374 WeakPolarHBondContact SG-CB 3.49Å; C361-C374 CovalentContact SG-SG 2.02Å; C361-C374 PolarHBondContact SG-SG 2.94Å; I364-C374 CarbonylContact O-C 3.53Å; I364-C374 VanDerWaalsContact O-CA 3.28Å; I364-C374 WeakPolarHBondContact O-CA 3.35Å; C374-L382 HydrophobicContact CB-CD1 3.83Å; C374-Y385 PolarHBondContact SG-O 3.31Å
375	E	81.3	Confident	75	Confident	103 Å²	103	72.8 Å²	72.8	48%	0.481	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	154.3	169.4	-75.2	-174.5	173.9	0	0	110.2	H363 I364 L366	H363-E375 WeakPolarHBondContact CB-O 3.39Å; I364-E375 HydrophobicContact CB-CB 3.97Å; I364-E375 WeakPolarHBondContact CB-O 3.39Å; I364-E375 HydrophobicContact CD1-CB 4.39Å; I364-E375 HydrophobicContact CG2-CB 4.2Å; I364-E375 PolarHBondContact N-O 3.26Å; I364-E375 PolarHBondContact O-N 3.26Å; L366-E375 HydrophobicContact CD1-CG 3.87Å; L366-E375 VanDerWaalsContact CD1-OE1 3.27Å; L366-E375 WeakPolarHBondContact CD1-OE1 3.38Å; L366-E375 HydrophobicContact CG-CG 4.42Å
376	C	79	Confident	74.5	Confident	30 Å²	30	77 Å²	77	20%	0.203	41%	0.408	C	S	.	.			trans	-106.8	146.6	-179.7	-60.1	0	0	0	0	111	Y380 H381 C388	C376-Y380 WeakPolarHBondContact CB-O 3.46Å; C376-H381 VanDerWaalsContact SG-C 3.55Å; C376-C388 WeakPolarHBondContact CA-SG 3.41Å; C376-C388 HydrophobicContact CB-CB 3.86Å; C376-C388 WeakPolarHBondContact CB-SG 3.47Å; C376-C388 VanDerWaalsContact SG-CA 3.59Å; C376-C388 WeakPolarHBondContact SG-CB 3.14Å; C376-C388 CovalentContact SG-SG 2.04Å; C376-C388 PolarHBondContact SG-SG 2.89Å
377	Q	80.7	Confident	73.8	Confident	104 Å²	104	76.6 Å²	76.6	49%	0.486	40%	0.404	S	S	.	.			trans	-64.7	152.1	168.8	-63.3	-175.6	9.8	0	0	110.3	H363 I364 G379 Y380	H363-Q377 HydrophobicContact CB-CG 4.24Å; H363-Q377 PolarHBondContact ND1-N 2.81Å; I364-Q377 HydrophobicContact CD1-CG 4.43Å; Q377-G379 PolarHBondContact O-N 2.88Å; Q377-Y380 PolarHBondContact O-N 3.47Å; Q377-Y380 VanDerWaalsContact O-N 3.09Å
378	P	71.7	Confident	73.2	Confident	131 Å²	131	74.4 Å²	74.4	85%	0.851	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	136.1	178.8	-27.5	35.4	0	0	0	112.7
379	G	57.6	Low	72	Confident	58 Å²	58	69.4 Å²	69.4	60%	0.598	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.1	-4.9	-172.7	0	0	0	0	0	114.6	Q377 G390	Q377-G379 PolarHBondContact O-N 2.88Å; G379-G390 WeakPolarHBondContact O-CA 3.39Å
380	Y	68.9	Low	70.7	Confident	111 Å²	111	65.2 Å²	65.2	44%	0.435	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	142.8	175.6	-60.3	-104.5	0	0	0	111.5	H363 C376 Q377 A389	H363-Y380 AromaticContact CE1-CD1 3.63Å; H363-Y380 AromaticContact CE1-CD2 3.76Å; H363-Y380 AromaticContact CE1-CG 3.5Å; C376-Y380 WeakPolarHBondContact CB-O 3.46Å; Q377-Y380 PolarHBondContact O-N 3.47Å; Q377-Y380 VanDerWaalsContact O-N 3.09Å; Y380-A389 CarbonylContact C-O 3.48Å; Y380-A389 WeakPolarHBondContact CA-O 2.99Å
381	H	63.4	Low	69.6	Low	84 Å²	84	70.8 Å²	70.8	39%	0.389	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	151.5	176.3	-68.8	-74.8	0	0	0	111.5	C376 Y383 C388 A389 E391 F394	C376-H381 VanDerWaalsContact SG-C 3.55Å; H381-Y383 PolarHBondContact O-N 2.55Å; H381-C388 CarbonylContact O-C 3.38Å; H381-C388 WeakPolarHBondContact O-CA 3.36Å; H381-A389 PolarHBondContact N-O 3.27Å; H381-A389 PolarHBondContact O-N 3.31Å; H381-E391 WeakPolarHBondContact CD2-CG 3.35Å; H381-E391 IonicContact CD2-OE1 3.46Å; H381-E391 IonicContact CE1-OE1 3.61Å; H381-E391 WeakPolarHBondContact NE2-CG 3.44Å; H381-E391 IonicContact NE2-OE1 2.78Å; H381-E391 PolarHBondContact NE2-OE1 2.99Å; H381-F394 HydrophobicContact CB-CE2 3.84Å; H381-F394 HydrophobicContact CB-CZ 4.4Å
382	L	65	Low	68.1	Low	80 Å²	80	72.7 Å²	72.7	42%	0.419	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	100.7	-178.6	-162	81.8	0	0	0	110.5	C374 S384 H387	C374-L382 HydrophobicContact CB-CD1 3.83Å; L382-S384 VanDerWaalsContact CG-O 3.32Å; L382-S384 WeakPolarHBondContact CG-O 3.38Å; L382-H387 CarbonylContact C-O 3.39Å; L382-H387 WeakPolarHBondContact CA-O 3.31Å; L382-H387 WeakPolarHBondContact CD1-O 3.17Å
383	Y	58.4	Low	66.3	Low	53 Å²	53	73.8 Å²	73.8	21%	0.208	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-15.2	-177.3	75.9	-93.8	0	0	0	113.8	H381 H387 C388 A389 K398	H381-Y383 PolarHBondContact O-N 2.55Å; Y383-H387 HydrophobicContact CD1-CB 3.77Å; Y383-H387 WeakPolarHBondContact CD1-O 3.37Å; Y383-H387 HydrophobicContact CD2-CB 4.34Å; Y383-H387 HydrophobicContact CE1-CB 3.19Å; Y383-H387 HydrophobicContact CE2-CB 3.8Å; Y383-H387 HydrophobicContact CG-CB 4.34Å; Y383-H387 AromaticContact CZ-CG 3.83Å; Y383-H387 PolarHBondContact N-O 2.99Å; Y383-H387 WeakPolarHBondContact OH-CB 3.41Å; Y383-C388 VanDerWaalsContact CD1-C 3.49Å; Y383-A389 HydrophobicContact CD1-CB 3.31Å; Y383-A389 HydrophobicContact CE1-CB 3.88Å; Y383-A389 HydrophobicContact CG-CB 4Å; Y383-K398 HydrophobicContact CD2-CD 4.22Å; Y383-K398 HydrophobicContact CD2-CG 3.93Å; Y383-K398 HydrophobicContact CE2-CG 4.18Å; Y383-K398 WeakPolarHBondContact O-CE 3.4Å; Y383-K398 PolarHBondContact O-NZ 2.79Å
384	S	55.1	Low	64.4	Low	48 Å²	48	78.5 Å²	78.5	34%	0.336	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	160.6	176.1	-172.9	0	0	0	0	108.7	L382 R386 H387	L382-S384 VanDerWaalsContact CG-O 3.32Å; L382-S384 WeakPolarHBondContact CG-O 3.38Å; S384-R386 PolarHBondContact O-N 3.36Å; S384-H387 PolarHBondContact O-N 3.01Å
385	Y	66.3	Low	62.3	Low	207 Å²	207	85.7 Å²	85.7	81%	0.812	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	-24.3	-176.5	-87.7	-87.2	0	0	0	115.7	C374	C374-Y385 PolarHBondContact SG-O 3.31Å
386	R	76.3	Confident	60.3	Low	130 Å²	130	85.1 Å²	85.1	49%	0.491	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-9.8	-180	-56.2	-173.2	-158.8	-173.5	4.5	114.6	N360 C361 D362 F372 S384	N360-R386 WeakPolarHBondContact O-CB 3.37Å; N360-R386 WeakPolarHBondContact O-CD 3.06Å; N360-R386 VanDerWaalsContact O-CG 3.29Å; N360-R386 WeakPolarHBondContact O-CG 3.1Å; C361-R386 CarbonylContact C-O 3.58Å; C361-R386 WeakPolarHBondContact CA-O 3.22Å; D362-R386 PolarHBondContact N-O 2.63Å; F372-R386 HydrophobicContact CE2-CG 4.28Å; F372-R386 HydrophobicContact CZ-CG 4.31Å; S384-R386 PolarHBondContact O-N 3.36Å
387	H	70.9	Confident	58.3	Low	53 Å²	53	89.7 Å²	89.7	25%	0.245	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145.3	-158.3	-55.6	-60.8	0	0	0	115.4	D362 L382 Y383 S384	D362-H387 IonicContact OD1-CE1 3.45Å; D362-H387 IonicContact OD1-CG 3.43Å; D362-H387 IonicContact OD1-ND1 3.16Å; D362-H387 PolarHBondContact OD1-ND1 2.8Å; D362-H387 WeakPolarHBondContact OD2-CA 3.37Å; D362-H387 VanDerWaalsContact OD2-CB 3.22Å; D362-H387 WeakPolarHBondContact OD2-CB 3.03Å; D362-H387 IonicContact OD2-CG 2.72Å; D362-H387 IonicContact OD2-ND1 3.99Å; D362-H387 PolarHBondContact OD2-ND1 3.1Å; L382-H387 CarbonylContact C-O 3.39Å; L382-H387 WeakPolarHBondContact CA-O 3.31Å; L382-H387 WeakPolarHBondContact CD1-O 3.17Å; Y383-H387 HydrophobicContact CD1-CB 3.77Å; Y383-H387 WeakPolarHBondContact CD1-O 3.37Å; Y383-H387 HydrophobicContact CD2-CB 4.34Å; Y383-H387 HydrophobicContact CE1-CB 3.19Å; Y383-H387 HydrophobicContact CE2-CB 3.8Å; Y383-H387 HydrophobicContact CG-CB 4.34Å; Y383-H387 AromaticContact CZ-CG 3.83Å; Y383-H387 PolarHBondContact N-O 2.99Å; Y383-H387 WeakPolarHBondContact OH-CB 3.41Å; S384-H387 PolarHBondContact O-N 3.01Å
388	C	70.3	Confident	56.5	Low	12 Å²	12	90 Å²	90	8%	0.081	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	134.8	-173.5	-69.3	0	0	0	0	112	D362 H363 C376 H381 Y383	D362-C388 HydrophobicContact CB-CB 4.21Å; D362-C388 PolarHBondContact OD2-N 2.96Å; H363-C388 VanDerWaalsContact CE1-CB 3.5Å; H363-C388 WeakPolarHBondContact CE1-CB 3.48Å; H363-C388 WeakPolarHBondContact ND1-CB 3.5Å; H363-C388 PolarHBondContact ND1-SG 3.04Å; H363-C388 VanDerWaalsContact ND1-SG 3.43Å; C376-C388 WeakPolarHBondContact CA-SG 3.41Å; C376-C388 HydrophobicContact CB-CB 3.86Å; C376-C388 WeakPolarHBondContact CB-SG 3.47Å; C376-C388 VanDerWaalsContact SG-CA 3.59Å; C376-C388 WeakPolarHBondContact SG-CB 3.14Å; C376-C388 CovalentContact SG-SG 2.04Å; C376-C388 PolarHBondContact SG-SG 2.89Å; H381-C388 CarbonylContact O-C 3.38Å; H381-C388 WeakPolarHBondContact O-CA 3.36Å; Y383-C388 VanDerWaalsContact CD1-C 3.49Å
389	A	58.8	Low	55.1	Low	4 Å²	4	92.5 Å²	92.5	3%	0.033	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	141	-176.3	0	0	0	0	0	110.9	Y380 H381 Y383 L393	Y380-A389 CarbonylContact C-O 3.48Å; Y380-A389 WeakPolarHBondContact CA-O 2.99Å; H381-A389 PolarHBondContact N-O 3.27Å; H381-A389 PolarHBondContact O-N 3.31Å; Y383-A389 HydrophobicContact CD1-CB 3.31Å; Y383-A389 HydrophobicContact CE1-CB 3.88Å; Y383-A389 HydrophobicContact CG-CB 4Å; A389-L393 HydrophobicContact CB-CB 3.72Å; A389-L393 HydrophobicContact CB-CD2 3.83Å; A389-L393 HydrophobicContact CB-CG 4.39Å
390	G	54.1	Low	54.2	Low	19 Å²	19	95.9 Å²	95.9	20%	0.196	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	161.4	173.6	0	0	0	0	0	112.2	G379 M392 L393	G379-G390 WeakPolarHBondContact O-CA 3.39Å; G390-M392 PolarHBondContact O-N 2.75Å; G390-L393 PolarHBondContact O-N 3.33Å
391	E	53.3	Low	52.6	Low	148 Å²	148	99.1 Å²	99.1	69%	0.692	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-55.6	-25.1	177.9	-75.3	-177.7	150.9	0	0	113.3	H381	H381-E391 WeakPolarHBondContact CD2-CG 3.35Å; H381-E391 IonicContact CD2-OE1 3.46Å; H381-E391 IonicContact CE1-OE1 3.61Å; H381-E391 WeakPolarHBondContact NE2-CG 3.44Å; H381-E391 IonicContact NE2-OE1 2.78Å; H381-E391 PolarHBondContact NE2-OE1 2.99Å
392	M	49.9	Very low	51.4	Low	61 Å²	61	99.7 Å²	99.7	30%	0.3	49%	0.486	S	S	.	.	G	3₁₀ helix	trans	-72.4	-25.3	175.9	-139.5	77.6	179.3	0	0	114.3	G390 F394 E409 G426 S427 Y428	G390-M392 PolarHBondContact O-N 2.75Å; M392-F394 VanDerWaalsContact C-N 3.31Å; M392-F394 PolarHBondContact O-N 3.05Å; M392-E409 HydrophobicContact CE-CG 4.25Å; M392-E409 WeakPolarHBondContact CE-OE1 3.37Å; M392-E409 VanDerWaalsContact CG-OE1 3.29Å; M392-E409 WeakPolarHBondContact CG-OE1 3.5Å; M392-G426 WeakPolarHBondContact CB-O 3.38Å; M392-G426 WeakPolarHBondContact CG-O 3.45Å; M392-S427 PolarHBondContact SD-OG 2.84Å; M392-S427 VanDerWaalsContact SD-OG 3.36Å; M392-Y428 HydrophobicContact CE-CD1 3.42Å; M392-Y428 VanDerWaalsContact CE-CD1 3.42Å; M392-Y428 HydrophobicContact CE-CE1 3.4Å; M392-Y428 VanDerWaalsContact CE-CE1 3.4Å
393	L	47.5	Very low	50.3	Low	76 Å²	76	102 Å²	102	40%	0.398	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-80.6	-8.4	-176	-124.2	89.2	0	0	0	113.7	A389 G390 L395	A389-L393 HydrophobicContact CB-CB 3.72Å; A389-L393 HydrophobicContact CB-CD2 3.83Å; A389-L393 HydrophobicContact CB-CG 4.39Å; G390-L393 PolarHBondContact O-N 3.33Å; L393-L395 PolarHBondContact O-N 3.48Å
394	F	40.1	Very low	49.7	Very low	123 Å²	123	106.9 Å²	106.9	54%	0.539	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-71.7	-9.5	-176.5	-100	-99.4	0	0	0	114.4	H381 M392	H381-F394 HydrophobicContact CB-CE2 3.84Å; H381-F394 HydrophobicContact CB-CZ 4.4Å; M392-F394 VanDerWaalsContact C-N 3.31Å; M392-F394 PolarHBondContact O-N 3.05Å
395	L	39.1	Very low	49.7	Very low	165 Å²	165	108.4 Å²	108.4	86%	0.864	55%	0.554	S	S	*	*	S	Bend	trans	-118.7	-5.5	178.2	-65.5	174.3	0	0	0	114.2	L393	L393-L395 PolarHBondContact O-N 3.48Å
396	L	39.2	Very low	49.4	Very low	90 Å²	90	101.5 Å²	101.5	47%	0.471	53%	0.531	S	S	.	.	S	Bend	trans	-139.4	102.8	-178	-69.1	173.3	0	0	0	111.9	I407	L396-I407 HydrophobicContact CB-CD1 4.33Å; L396-I407 HydrophobicContact CD1-CD1 4.47Å; L396-I407 HydrophobicContact CD1-CG2 4.5Å
397	N	38.2	Very low	48.9	Very low	126 Å²	126	98.7 Å²	98.7	67%	0.674	53%	0.525	S	S	*	.			trans	61.2	97.9	167.3	-71.4	-27.3	0	0	0	119.1	Y399	N397-Y399 PolarHBondContact O-N 2.75Å
398	K	41.6	Very low	49.2	Very low	111 Å²	111	98.6 Å²	98.6	48%	0.483	53%	0.526	S	S	.	.	S	Bend	trans	-74.8	3.9	166.4	-175.8	157.1	171.2	163.3	0	115	Y383	Y383-K398 HydrophobicContact CD2-CD 4.22Å; Y383-K398 HydrophobicContact CD2-CG 3.93Å; Y383-K398 HydrophobicContact CE2-CG 4.18Å; Y383-K398 WeakPolarHBondContact O-CE 3.4Å; Y383-K398 PolarHBondContact O-NZ 2.79Å
399	Y	43.4	Very low	49.7	Very low	184 Å²	184	98.9 Å²	98.9	72%	0.722	53%	0.527	S	S	*	.			trans	-149	79.5	-173.1	-71.2	-80	0	0	0	115.1	N397	N397-Y399 PolarHBondContact O-N 2.75Å
400	T	37.9	Very low	50.9	Low	128 Å²	128	99.8 Å²	99.8	79%	0.785	53%	0.533	S	S	*	.			trans	-155.6	112.7	139.6	28.9	0	0	0	0	109.9	S402	T400-S402 PolarHBondContact O-N 3.09Å
401	F	35.6	Very low	52.1	Low	180 Å²	180	102.3 Å²	102.3	79%	0.789	55%	0.547	S	S	*	.			trans	-90.4	96.2	175.9	-173.2	-86.6	0	0	0	109.4
402	S	39.4	Very low	52.5	Low	95 Å²	95	99.7 Å²	99.7	66%	0.664	54%	0.541	S	S	*	.	S	Bend	trans	-177.6	121.8	155.2	-172.3	0	0	0	0	110.6	T400	T400-S402 PolarHBondContact O-N 3.09Å
403	T	41	Very low	53.3	Low	128 Å²	128	103.8 Å²	103.8	79%	0.785	56%	0.557	S	S	*	*			trans	52.9	114.1	174.9	57.8	0	0	0	0	116.3	A405	T403-A405 VanDerWaalsContact C-N 3.32Å; T403-A405 PolarHBondContact O-N 3.42Å
404	V	45	Very low	55.1	Low	156 Å²	156	102.8 Å²	102.8	95%	0.945	55%	0.553	S	S	*	*			trans	-67.7	87.8	177.1	-174.8	0	0	0	0	110.1
405	A	56.1	Low	56.9	Low	81 Å²	81	97.3 Å²	97.3	67%	0.669	53%	0.531	S	S	*	.			trans	-84.2	130.8	161.5	0	0	0	0	0	108.3	T403	T403-A405 VanDerWaalsContact C-N 3.32Å; T403-A405 PolarHBondContact O-N 3.42Å
406	D	60.6	Low	58.9	Low	61 Å²	61	90.1 Å²	90.1	33%	0.326	50%	0.497	S	S	.	.			trans	-57.2	135	171.2	-174.4	36.5	0	0	0	110.9	D408 N423 P425 G426	D406-D408 PolarHBondContact O-N 3.34Å; D406-N423 PolarHBondContact OD2-ND2 3.48Å; D406-P425 WeakPolarHBondContact OD1-CA 3.41Å; D406-G426 PolarHBondContact OD1-N 3.16Å
407	I	64.3	Low	61.1	Low	71 Å²	71	86.3 Å²	86.3	36%	0.364	48%	0.477	S	S	.	.			trans	-84.5	103.3	173.2	-60.4	177.7	0	0	0	106.2	L396 E409	L396-I407 HydrophobicContact CB-CD1 4.33Å; L396-I407 HydrophobicContact CD1-CD1 4.47Å; L396-I407 HydrophobicContact CD1-CG2 4.5Å; I407-E409 VanDerWaalsContact C-N 3.33Å; I407-E409 HydrophobicContact CG2-CG 4.3Å; I407-E409 PolarHBondContact O-N 3.23Å
408	D	77.4	Confident	63.5	Low	51 Å²	51	85.3 Å²	85.3	27%	0.273	47%	0.469	S	S	.	.			trans	-66.6	93.7	174	179	2.5	0	0	0	110.3	D406 C410 S411 N423	D406-D408 PolarHBondContact O-N 3.34Å; D408-C410 PolarHBondContact O-N 3.03Å; D408-C410 WeakPolarHBondContact OD1-CA 3Å; D408-C410 VanDerWaalsContact OD1-CB 3.28Å; D408-C410 WeakPolarHBondContact OD1-CB 3.03Å; D408-C410 PolarHBondContact OD1-N 3.42Å; D408-S411 VanDerWaalsContact CG-OG 3.24Å; D408-S411 VanDerWaalsContact O-CB 3.31Å; D408-S411 WeakPolarHBondContact O-CB 3.23Å; D408-S411 PolarHBondContact O-N 2.61Å; D408-S411 PolarHBondContact OD1-N 2.93Å; D408-S411 WeakPolarHBondContact OD2-CB 3.48Å; D408-S411 PolarHBondContact OD2-OG 2.67Å; D408-N423 WeakPolarHBondContact CA-OD1 3.31Å; D408-N423 WeakPolarHBondContact OD1-CB 2.99Å
409	E	80.4	Confident	65.8	Low	18 Å²	18	81.9 Å²	81.9	8%	0.084	45%	0.454	C	S	.	.	S	Bend	trans	-72.3	-19.9	178.5	-62.8	106.1	174.4	0	0	111.9	M392 I407 S411 V412 G415 S427 Y428	M392-E409 HydrophobicContact CE-CG 4.25Å; M392-E409 WeakPolarHBondContact CE-OE1 3.37Å; M392-E409 VanDerWaalsContact CG-OE1 3.29Å; M392-E409 WeakPolarHBondContact CG-OE1 3.5Å; I407-E409 VanDerWaalsContact C-N 3.33Å; I407-E409 HydrophobicContact CG2-CG 4.3Å; I407-E409 PolarHBondContact O-N 3.23Å; E409-S411 VanDerWaalsContact C-N 3.32Å; E409-V412 CarbonylContact O-C 3.49Å; E409-V412 WeakPolarHBondContact O-CA 3.23Å; E409-V412 PolarHBondContact O-N 3.46Å; E409-G415 PolarHBondContact O-N 2.74Å; E409-G415 VanDerWaalsContact O-N 3.12Å; E409-S427 WeakPolarHBondContact OE2-CA 3.33Å; E409-Y428 HydrophobicContact CB-CD1 3.23Å; E409-Y428 HydrophobicContact CB-CE1 3.72Å; E409-Y428 HydrophobicContact CB-CG 3.85Å; E409-Y428 HydrophobicContact CG-CD1 3.68Å; E409-Y428 HydrophobicContact CG-CE1 4.04Å; E409-Y428 WeakPolarHBondContact OE2-CD1 3.34Å; E409-Y428 PolarHBondContact OE2-N 2.95Å
410	C	83.8	Confident	67.9	Low	24 Å²	24	76.6 Å²	76.6	16%	0.162	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-29.7	172.3	-58.2	0	0	0	0	112.1	D408 V412 N414 C421 H422 N423	D408-C410 PolarHBondContact O-N 3.03Å; D408-C410 WeakPolarHBondContact OD1-CA 3Å; D408-C410 VanDerWaalsContact OD1-CB 3.28Å; D408-C410 WeakPolarHBondContact OD1-CB 3.03Å; D408-C410 PolarHBondContact OD1-N 3.42Å; C410-V412 PolarHBondContact O-N 2.04Å; C410-N414 WeakPolarHBondContact O-CA 3.31Å; C410-N414 PolarHBondContact O-N 3.42Å; C410-C421 WeakPolarHBondContact CA-SG 3.29Å; C410-C421 HydrophobicContact CB-CB 3.57Å; C410-C421 WeakPolarHBondContact CB-SG 3.22Å; C410-C421 WeakPolarHBondContact SG-CB 3.44Å; C410-C421 CovalentContact SG-SG 2.03Å; C410-C421 PolarHBondContact SG-SG 2.65Å; C410-H422 PolarHBondContact SG-N 2.88Å; C410-H422 VanDerWaalsContact SG-N 3.37Å; C410-N423 HydrophobicContact CB-CB 4.24Å; C410-N423 PolarHBondContact SG-N 3.1Å
411	S	80	Confident	70.4	Confident	72 Å²	72	71.3 Å²	71.3	50%	0.503	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-13.6	165.2	-77.7	0	0	0	0	113.3	D408 E409	D408-S411 VanDerWaalsContact CG-OG 3.24Å; D408-S411 VanDerWaalsContact O-CB 3.31Å; D408-S411 WeakPolarHBondContact O-CB 3.23Å; D408-S411 PolarHBondContact O-N 2.61Å; D408-S411 PolarHBondContact OD1-N 2.93Å; D408-S411 WeakPolarHBondContact OD2-CB 3.48Å; D408-S411 PolarHBondContact OD2-OG 2.67Å; E409-S411 VanDerWaalsContact C-N 3.32Å
412	V	61.3	Low	72.9	Confident	93 Å²	93	66.6 Å²	66.6	56%	0.564	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.9	101.7	-179.5	-174.3	0	0	0	0	111	E409 C410 N414 G415	E409-V412 CarbonylContact O-C 3.49Å; E409-V412 WeakPolarHBondContact O-CA 3.23Å; E409-V412 PolarHBondContact O-N 3.46Å; C410-V412 PolarHBondContact O-N 2.04Å; V412-N414 PolarHBondContact O-N 3.38Å; V412-N414 VanDerWaalsContact O-N 3.15Å; V412-G415 PolarHBondContact O-N 3.17Å
413	F	66.5	Low	74.8	Confident	146 Å²	146	64.7 Å²	64.7	64%	0.64	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	55.1	30.5	178.6	-169.7	-112.7	0	0	0	113.4	G415 G416 T883	F413-G415 PolarHBondContact O-N 2.82Å; F413-G416 WeakPolarHBondContact O-CA 3.41Å; F413-G416 PolarHBondContact O-N 2.73Å; F413-T883 WeakPolarHBondContact CE2-OG1 3.32Å
414	N	86.1	Confident	76.5	Confident	56 Å²	56	60.9 Å²	60.9	30%	0.299	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	56.1	33	-176.8	-162.3	42.5	0	0	0	111.9	C410 V412 G416 C417 Q419 C421	C410-N414 WeakPolarHBondContact O-CA 3.31Å; C410-N414 PolarHBondContact O-N 3.42Å; V412-N414 PolarHBondContact O-N 3.38Å; V412-N414 VanDerWaalsContact O-N 3.15Å; N414-G416 PolarHBondContact O-N 3.44Å; N414-C417 PolarHBondContact ND2-O 2.7Å; N414-C417 WeakPolarHBondContact O-CB 3.32Å; N414-C417 PolarHBondContact O-N 2.95Å; N414-C417 PolarHBondContact O-SG 2.85Å; N414-Q419 PolarHBondContact ND2-O 2.88Å; N414-C421 HydrophobicContact CB-CB 4.46Å; N414-C421 VanDerWaalsContact O-CB 3.26Å; N414-C421 WeakPolarHBondContact O-CB 3.06Å; N414-C421 WeakPolarHBondContact OD1-CB 3.4Å; N414-C421 PolarHBondContact OD1-N 3.28Å
415	G	77.3	Confident	77.9	Confident	7 Å²	7	59.5 Å²	59.5	7%	0.072	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	63	3	-170.3	0	0	0	0	0	115	E409 V412 F413 C417 Y428 K443	E409-G415 PolarHBondContact O-N 2.74Å; E409-G415 VanDerWaalsContact O-N 3.12Å; V412-G415 PolarHBondContact O-N 3.17Å; F413-G415 PolarHBondContact O-N 2.82Å; G415-C417 VanDerWaalsContact C-N 3.32Å; G415-Y428 WeakPolarHBondContact O-CE2 3.07Å; G415-Y428 VanDerWaalsContact O-CZ 3.24Å; G415-Y428 PolarHBondContact O-OH 2.99Å; G415-K443 WeakPolarHBondContact O-CE 3.04Å; G415-K443 PolarHBondContact O-NZ 2.9Å
416	G	81.4	Confident	78	Confident	15 Å²	15	57.8 Å²	57.8	16%	0.155	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	76.2	14.8	-163.6	0	0	0	0	0	114.4	F413 N414 K443	F413-G416 WeakPolarHBondContact O-CA 3.41Å; F413-G416 PolarHBondContact O-N 2.73Å; N414-G416 PolarHBondContact O-N 3.44Å; G416-K443 WeakPolarHBondContact O-CB 3.39Å; G416-K443 WeakPolarHBondContact O-CD 3.44Å; G416-K443 WeakPolarHBondContact O-CG 3.32Å
417	C	86.9	Confident	78.5	Confident	9 Å²	9	57.1 Å²	57.1	6%	0.061	33%	0.328	C	S	.	.			trans	-70.3	137.8	168.8	-51.4	0	0	0	0	110.6	N414 G415 H420 C421 C430	N414-C417 PolarHBondContact ND2-O 2.7Å; N414-C417 WeakPolarHBondContact O-CB 3.32Å; N414-C417 PolarHBondContact O-N 2.95Å; N414-C417 PolarHBondContact O-SG 2.85Å; G415-C417 VanDerWaalsContact C-N 3.32Å; C417-H420 WeakPolarHBondContact CB-O 3.44Å; C417-C421 HydrophobicContact CB-CB 4.18Å; C417-C421 VanDerWaalsContact SG-CB 3.55Å; C417-C430 WeakPolarHBondContact CA-SG 3.32Å; C417-C430 HydrophobicContact CB-CB 3.54Å; C417-C430 WeakPolarHBondContact CB-SG 3.29Å; C417-C430 WeakPolarHBondContact SG-CA 3.34Å; C417-C430 WeakPolarHBondContact SG-CB 3.34Å; C417-C430 CovalentContact SG-SG 2.01Å; C417-C430 PolarHBondContact SG-SG 3.43Å
418	E	87.5	Confident	79.5	Confident	106 Å²	106	56.5 Å²	56.5	50%	0.495	32%	0.322	S	S	.	.	S	Bend	trans	-65.8	-39.3	177.1	-174.6	-167.8	128.8	0	0	112.1	K443 C445	E418-K443 PolarHBondContact N-O 3.16Å; E418-C445 HydrophobicContact CB-CB 4.34Å; E418-C445 PolarHBondContact OE2-N 2.76Å
419	Q	89.2	Confident	79.9	Confident	39 Å²	39	58.3 Å²	58.3	18%	0.182	33%	0.328	C	S	.	.	S	Bend	trans	-116.8	-82.5	-173.8	-63.5	176.6	-0.7	0	0	111.3	N414 C432 C445	N414-Q419 PolarHBondContact ND2-O 2.88Å; Q419-C432 VanDerWaalsContact OE1-CA 3.24Å; Q419-C445 VanDerWaalsContact CD-SG 3.58Å; Q419-C445 HydrophobicContact CG-CB 3.82Å; Q419-C445 VanDerWaalsContact NE2-CB 3.26Å; Q419-C445 PolarHBondContact OE1-SG 2.02Å
420	H	88.6	Confident	80.3	Confident	72 Å²	72	58.1 Å²	58.1	33%	0.333	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	140.2	-177.7	-52.2	81.5	0	0	0	111.7	C417 C430 S431 D433	C417-H420 WeakPolarHBondContact CB-O 3.44Å; H420-C430 CarbonylContact O-C 3.16Å; H420-C430 VanDerWaalsContact O-CA 3.24Å; H420-C430 WeakPolarHBondContact O-CA 3.06Å; H420-S431 VanDerWaalsContact CB-O 3.32Å; H420-S431 WeakPolarHBondContact CB-O 3.02Å; H420-S431 WeakPolarHBondContact CB-OG 3.29Å; H420-S431 PolarHBondContact N-O 2.04Å; H420-S431 PolarHBondContact ND1-O 3.26Å; H420-S431 PolarHBondContact O-N 3.43Å; H420-D433 IonicContact CE1-OD1 3.27Å; H420-D433 PolarHBondContact CE1-OD1 2.9Å; H420-D433 IonicContact CE1-OD2 3.03Å
421	C	90	Very high	80.5	Confident	18 Å²	18	58.5 Å²	58.5	12%	0.122	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	136	167.1	-174.5	0	0	0	0	109.9	C410 N414 C417 Y428	C410-C421 WeakPolarHBondContact CA-SG 3.29Å; C410-C421 HydrophobicContact CB-CB 3.57Å; C410-C421 WeakPolarHBondContact CB-SG 3.22Å; C410-C421 WeakPolarHBondContact SG-CB 3.44Å; C410-C421 CovalentContact SG-SG 2.03Å; C410-C421 PolarHBondContact SG-SG 2.65Å; N414-C421 HydrophobicContact CB-CB 4.46Å; N414-C421 VanDerWaalsContact O-CB 3.26Å; N414-C421 WeakPolarHBondContact O-CB 3.06Å; N414-C421 WeakPolarHBondContact OD1-CB 3.4Å; N414-C421 PolarHBondContact OD1-N 3.28Å; C417-C421 HydrophobicContact CB-CB 4.18Å; C417-C421 VanDerWaalsContact SG-CB 3.55Å; C421-Y428 VanDerWaalsContact SG-CD2 3.56Å
422	H	88.4	Confident	81	Confident	81 Å²	81	56.4 Å²	56.4	38%	0.375	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	110.6	175.9	-63.7	-72.8	0	0	0	109.7	C410 Y428 H429 S431	C410-H422 PolarHBondContact SG-N 2.88Å; C410-H422 VanDerWaalsContact SG-N 3.37Å; H422-Y428 WeakPolarHBondContact O-CA 3.26Å; H422-H429 WeakPolarHBondContact CB-CE1 3.28Å; H422-H429 AromaticContact CD2-NE2 3.78Å; H422-H429 AromaticContact CG-NE2 3.86Å; H422-H429 PolarHBondContact N-O 2.87Å; H422-H429 PolarHBondContact O-N 3.43Å; H422-H429 PolarHBondContact O-ND1 3.2Å; H422-S431 PolarHBondContact CD2-OG 3.44Å; H422-S431 PolarHBondContact NE2-OG 2.03Å
423	N	79.6	Confident	82.2	Confident	55 Å²	55	55.5 Å²	55.5	29%	0.294	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	140.5	179.4	-172.6	49.9	0	0	0	110.7	D406 D408 C410	D406-N423 PolarHBondContact OD2-ND2 3.48Å; D408-N423 WeakPolarHBondContact CA-OD1 3.31Å; D408-N423 WeakPolarHBondContact OD1-CB 2.99Å; C410-N423 HydrophobicContact CB-CB 4.24Å; C410-N423 PolarHBondContact SG-N 3.1Å
424	T	77.2	Confident	82.8	Confident	48 Å²	48	54.7 Å²	54.7	29%	0.294	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	149	-179.4	59	0	0	0	0	109.6	G426 S427	T424-G426 PolarHBondContact O-N 2.82Å; T424-S427 CarbonylContact C-O 3.47Å; T424-S427 VanDerWaalsContact CA-O 3.31Å; T424-S427 WeakPolarHBondContact CA-O 3.45Å; T424-S427 WeakPolarHBondContact CB-O 3.2Å; T424-S427 PolarHBondContact N-O 3.45Å; T424-S427 CarbonylContact O-C 3.46Å; T424-S427 PolarHBondContact O-N 3Å; T424-S427 PolarHBondContact OG1-O 2.83Å
425	P	72.6	Confident	82.2	Confident	127 Å²	127	53.9 Å²	53.9	83%	0.825	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	104.2	-178.3	-30	37.7	0	0	0	113.7	D406	D406-P425 WeakPolarHBondContact OD1-CA 3.41Å
426	G	59.3	Low	82.3	Confident	45 Å²	45	58.3 Å²	58.3	46%	0.464	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.7	15.4	-177	0	0	0	0	0	116	M392 D406 T424	M392-G426 WeakPolarHBondContact CB-O 3.38Å; M392-G426 WeakPolarHBondContact CG-O 3.45Å; D406-G426 PolarHBondContact OD1-N 3.16Å; T424-G426 PolarHBondContact O-N 2.82Å
427	S	70	Confident	82.2	Confident	47 Å²	47	60.2 Å²	60.2	33%	0.329	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.7	175	173.3	-151.9	0	0	0	0	113.9	M392 E409 T424	M392-S427 PolarHBondContact SD-OG 2.84Å; M392-S427 VanDerWaalsContact SD-OG 3.36Å; E409-S427 WeakPolarHBondContact OE2-CA 3.33Å; T424-S427 CarbonylContact C-O 3.47Å; T424-S427 VanDerWaalsContact CA-O 3.31Å; T424-S427 WeakPolarHBondContact CA-O 3.45Å; T424-S427 WeakPolarHBondContact CB-O 3.2Å; T424-S427 PolarHBondContact N-O 3.45Å; T424-S427 CarbonylContact O-C 3.46Å; T424-S427 PolarHBondContact O-N 3Å; T424-S427 PolarHBondContact OG1-O 2.83Å
428	Y	86	Confident	81.7	Confident	58 Å²	58	63.1 Å²	63.1	23%	0.227	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	162.8	168.9	68.2	-79	0	0	0	111.5	M392 E409 G415 C421 H422 K443	M392-Y428 HydrophobicContact CE-CD1 3.42Å; M392-Y428 VanDerWaalsContact CE-CD1 3.42Å; M392-Y428 HydrophobicContact CE-CE1 3.4Å; M392-Y428 VanDerWaalsContact CE-CE1 3.4Å; E409-Y428 HydrophobicContact CB-CD1 3.23Å; E409-Y428 HydrophobicContact CB-CE1 3.72Å; E409-Y428 HydrophobicContact CB-CG 3.85Å; E409-Y428 HydrophobicContact CG-CD1 3.68Å; E409-Y428 HydrophobicContact CG-CE1 4.04Å; E409-Y428 WeakPolarHBondContact OE2-CD1 3.34Å; E409-Y428 PolarHBondContact OE2-N 2.95Å; G415-Y428 WeakPolarHBondContact O-CE2 3.07Å; G415-Y428 VanDerWaalsContact O-CZ 3.24Å; G415-Y428 PolarHBondContact O-OH 2.99Å; C421-Y428 VanDerWaalsContact SG-CD2 3.56Å; H422-Y428 WeakPolarHBondContact O-CA 3.26Å; Y428-K443 PolarHBondContact OH-NZ 2.82Å
429	H	86.5	Confident	81.2	Confident	89 Å²	89	60.4 Å²	60.4	41%	0.412	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	150.4	171.6	63.8	-77.3	0	0	0	112	H422	H422-H429 WeakPolarHBondContact CB-CE1 3.28Å; H422-H429 AromaticContact CD2-NE2 3.78Å; H422-H429 AromaticContact CG-NE2 3.86Å; H422-H429 PolarHBondContact N-O 2.87Å; H422-H429 PolarHBondContact O-N 3.43Å; H422-H429 PolarHBondContact O-ND1 3.2Å
430	C	87.4	Confident	80.3	Confident	13 Å²	13	68.2 Å²	68.2	9%	0.088	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	151.7	179.9	-55.6	0	0	0	0	112	C417 H420 L438 G442	C417-C430 WeakPolarHBondContact CA-SG 3.32Å; C417-C430 HydrophobicContact CB-CB 3.54Å; C417-C430 WeakPolarHBondContact CB-SG 3.29Å; C417-C430 WeakPolarHBondContact SG-CA 3.34Å; C417-C430 WeakPolarHBondContact SG-CB 3.34Å; C417-C430 CovalentContact SG-SG 2.01Å; C417-C430 PolarHBondContact SG-SG 3.43Å; H420-C430 CarbonylContact O-C 3.16Å; H420-C430 VanDerWaalsContact O-CA 3.24Å; H420-C430 WeakPolarHBondContact O-CA 3.06Å; C430-L438 HydrophobicContact CB-CD1 3.51Å; C430-L438 HydrophobicContact CB-CD2 4.1Å; C430-L438 HydrophobicContact CB-CG 4.47Å; C430-L438 WeakPolarHBondContact O-CD2 3.29Å; C430-G442 WeakPolarHBondContact CB-O 3.12Å; C430-G442 PolarHBondContact SG-O 3.34Å
431	S	89.7	Confident	79.3	Confident	33 Å²	33	68.1 Å²	68.1	23%	0.231	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	161.5	168.3	78.2	0	0	0	0	112.2	H420 H422	H420-S431 VanDerWaalsContact CB-O 3.32Å; H420-S431 WeakPolarHBondContact CB-O 3.02Å; H420-S431 WeakPolarHBondContact CB-OG 3.29Å; H420-S431 PolarHBondContact N-O 2.04Å; H420-S431 PolarHBondContact ND1-O 3.26Å; H420-S431 PolarHBondContact O-N 3.43Å; H422-S431 PolarHBondContact CD2-OG 3.44Å; H422-S431 PolarHBondContact NE2-OG 2.03Å
432	C	88.8	Confident	78.6	Confident	27 Å²	27	68.7 Å²	68.7	18%	0.182	39%	0.389	C	S	.	.			trans	-113.4	156.2	-173.9	-52.6	0	0	0	0	112.8	Q419 L438 C445	Q419-C432 VanDerWaalsContact OE1-CA 3.24Å; C432-L438 WeakPolarHBondContact SG-CA 3.09Å; C432-L438 PolarHBondContact SG-N 3.36Å; C432-C445 VanDerWaalsContact CA-SG 3.5Å; C432-C445 HydrophobicContact CB-CB 3.75Å; C432-C445 WeakPolarHBondContact CB-SG 3.5Å; C432-C445 VanDerWaalsContact SG-CA 3.5Å; C432-C445 WeakPolarHBondContact SG-CB 3.39Å; C432-C445 CovalentContact SG-SG 2.03Å; C432-C445 PolarHBondContact SG-SG 2.81Å
433	D	87.2	Confident	78.3	Confident	74 Å²	74	68.3 Å²	68.3	40%	0.396	39%	0.386	S	S	.	.			trans	-56.7	152.6	169.5	-87.9	-56.3	0	0	0	111.9	H420 G435 Y436	H420-D433 IonicContact CE1-OD1 3.27Å; H420-D433 PolarHBondContact CE1-OD1 2.9Å; H420-D433 IonicContact CE1-OD2 3.03Å; D433-G435 PolarHBondContact O-N 2.88Å; D433-Y436 HydrophobicContact CB-CD2 4.11Å; D433-Y436 PolarHBondContact O-N 2.83Å
434	P	78.6	Confident	78.3	Confident	130 Å²	130	68.8 Å²	68.8	84%	0.844	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	122.4	171.3	-25.1	34.7	0	0	0	111.9
435	G	74.2	Confident	78.7	Confident	39 Å²	39	66.7 Å²	66.7	40%	0.402	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.5	6.2	-174	0	0	0	0	0	114.5	D433 M448	D433-G435 PolarHBondContact O-N 2.88Å; G435-M448 WeakPolarHBondContact O-CB 3.26Å; G435-M448 PolarHBondContact O-N 3.35Å
436	Y	80.4	Confident	78.9	Confident	100 Å²	100	63.5 Å²	63.5	39%	0.392	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	157.4	169.9	-66.9	-99.7	0	0	0	110.4	D433 C445 V446 P447	D433-Y436 HydrophobicContact CB-CD2 4.11Å; D433-Y436 PolarHBondContact O-N 2.83Å; Y436-C445 HydrophobicContact CD1-CB 4.45Å; Y436-C445 VanDerWaalsContact CD1-O 3.31Å; Y436-C445 WeakPolarHBondContact CD1-O 3.29Å; Y436-V446 CarbonylContact C-O 3.58Å; Y436-V446 VanDerWaalsContact CA-O 3.28Å; Y436-V446 WeakPolarHBondContact CA-O 3.24Å; Y436-P447 HydrophobicContact CD1-CB 4.35Å; Y436-P447 HydrophobicContact CD1-CG 4.14Å; Y436-P447 HydrophobicContact CE1-CB 4.24Å; Y436-P447 HydrophobicContact CE1-CG 3.76Å
437	V	78.4	Confident	79.4	Confident	55 Å²	55	65.3 Å²	65.3	33%	0.333	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	146.2	169.8	-71.8	0	0	0	0	110.7	H439 C445 V446 M448	V437-H439 PolarHBondContact O-N 2.04Å; V437-C445 CarbonylContact O-C 3.53Å; V437-C445 WeakPolarHBondContact O-CA 3.38Å; V437-V446 HydrophobicContact CG2-CG2 3.6Å; V437-V446 PolarHBondContact N-O 2.87Å; V437-V446 PolarHBondContact O-N 3Å; V437-M448 HydrophobicContact CG1-CE 3.39Å; V437-M448 HydrophobicContact CG1-CG 3.69Å; V437-M448 HydrophobicContact CG1-SD 4.35Å
438	L	76.3	Confident	78.5	Confident	70 Å²	70	68 Å²	68	37%	0.366	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	127.7	176.3	-164.4	75.4	0	0	0	109.6	C430 C432 D444	C430-L438 HydrophobicContact CB-CD1 3.51Å; C430-L438 HydrophobicContact CB-CD2 4.1Å; C430-L438 HydrophobicContact CB-CG 4.47Å; C430-L438 WeakPolarHBondContact O-CD2 3.29Å; C432-L438 WeakPolarHBondContact SG-CA 3.09Å; C432-L438 PolarHBondContact SG-N 3.36Å; L438-D444 CarbonylContact C-O 3.51Å; L438-D444 WeakPolarHBondContact CA-O 3.44Å; L438-D444 WeakPolarHBondContact CD1-O 3.21Å
439	H	77.8	Confident	76.8	Confident	49 Å²	49	73.5 Å²	73.5	23%	0.227	39%	0.394	C	S	.	.			trans	-69.2	160.7	178.3	-174.8	-121.2	0	0	0	111.3	V437 N441 G442 D444 V446	V437-H439 PolarHBondContact O-N 2.04Å; H439-N441 VanDerWaalsContact ND1-CG 3.27Å; H439-N441 PolarHBondContact ND1-ND2 2.78Å; H439-N441 PolarHBondContact ND1-OD1 3Å; H439-N441 VanDerWaalsContact ND1-OD1 3.1Å; H439-N441 PolarHBondContact O-N 3.5Å; H439-N441 VanDerWaalsContact O-N 3.08Å; H439-G442 PolarHBondContact O-N 3Å; H439-D444 HydrophobicContact CB-CB 3.74Å; H439-D444 VanDerWaalsContact CB-O 3.26Å; H439-D444 WeakPolarHBondContact CB-O 3.34Å; H439-D444 PolarHBondContact N-O 2.85Å; H439-D444 IonicContact ND1-OD2 2.74Å; H439-D444 PolarHBondContact ND1-OD2 2.87Å; H439-V446 HydrophobicContact CB-CG1 4.37Å
440	Y	69.7	Low	74.3	Confident	203 Å²	203	79.2 Å²	79.2	80%	0.796	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-18.4	-172.8	68.2	-99.9	0	0	0	114.2	G442	Y440-G442 PolarHBondContact O-N 3.33Å
441	N	67.3	Low	71.6	Confident	69 Å²	69	84.3 Å²	84.3	37%	0.369	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	0.8	172.6	66.9	-3.7	0	0	0	113.3	H439 K443 D444	H439-N441 VanDerWaalsContact ND1-CG 3.27Å; H439-N441 PolarHBondContact ND1-ND2 2.78Å; H439-N441 PolarHBondContact ND1-OD1 3Å; H439-N441 VanDerWaalsContact ND1-OD1 3.1Å; H439-N441 PolarHBondContact O-N 3.5Å; H439-N441 VanDerWaalsContact O-N 3.08Å; N441-K443 PolarHBondContact O-N 2.99Å; N441-K443 PolarHBondContact OD1-N 3.02Å; N441-K443 VanDerWaalsContact OD1-N 3.1Å; N441-D444 VanDerWaalsContact ND2-CG 3.27Å; N441-D444 PolarHBondContact ND2-OD2 3.26Å; N441-D444 PolarHBondContact OD1-N 3.33Å
442	G	75.4	Confident	68.8	Low	31 Å²	31	89 Å²	89	32%	0.32	48%	0.479	S	S	.	.	S	Bend	trans	69	14.3	179.3	0	0	0	0	0	113.8	C430 H439 Y440	C430-G442 WeakPolarHBondContact CB-O 3.12Å; C430-G442 PolarHBondContact SG-O 3.34Å; H439-G442 PolarHBondContact O-N 3Å; Y440-G442 PolarHBondContact O-N 3.33Å
443	K	82	Confident	66.1	Low	73 Å²	73	94.2 Å²	94.2	32%	0.317	51%	0.51	S	S	.	.	S	Bend	trans	-132.7	-49	-169.7	-75.2	-171.6	176.1	-151.7	0	114.1	G415 G416 E418 Y428 N441	G415-K443 WeakPolarHBondContact O-CE 3.04Å; G415-K443 PolarHBondContact O-NZ 2.9Å; G416-K443 WeakPolarHBondContact O-CB 3.39Å; G416-K443 WeakPolarHBondContact O-CD 3.44Å; G416-K443 WeakPolarHBondContact O-CG 3.32Å; E418-K443 PolarHBondContact N-O 3.16Å; Y428-K443 PolarHBondContact OH-NZ 2.82Å; N441-K443 PolarHBondContact O-N 2.99Å; N441-K443 PolarHBondContact OD1-N 3.02Å; N441-K443 VanDerWaalsContact OD1-N 3.1Å
444	D	80	Confident	63.4	Low	64 Å²	64	97.3 Å²	97.3	34%	0.342	53%	0.527	S	S	.	.			trans	-80	158.5	-177.2	-49.5	-29.8	0	0	0	111.5	L438 H439 N441	L438-D444 CarbonylContact C-O 3.51Å; L438-D444 WeakPolarHBondContact CA-O 3.44Å; L438-D444 WeakPolarHBondContact CD1-O 3.21Å; H439-D444 HydrophobicContact CB-CB 3.74Å; H439-D444 VanDerWaalsContact CB-O 3.26Å; H439-D444 WeakPolarHBondContact CB-O 3.34Å; H439-D444 PolarHBondContact N-O 2.85Å; H439-D444 IonicContact ND1-OD2 2.74Å; H439-D444 PolarHBondContact ND1-OD2 2.87Å; N441-D444 VanDerWaalsContact ND2-CG 3.27Å; N441-D444 PolarHBondContact ND2-OD2 3.26Å; N441-D444 PolarHBondContact OD1-N 3.33Å
445	C	84.9	Confident	61.6	Low	4 Å²	4	98.7 Å²	98.7	3%	0.027	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	99.3	-180	-74.9	0	0	0	0	109.8	E418 Q419 C432 Y436 V437	E418-C445 HydrophobicContact CB-CB 4.34Å; E418-C445 PolarHBondContact OE2-N 2.76Å; Q419-C445 VanDerWaalsContact CD-SG 3.58Å; Q419-C445 HydrophobicContact CG-CB 3.82Å; Q419-C445 VanDerWaalsContact NE2-CB 3.26Å; Q419-C445 PolarHBondContact OE1-SG 2.02Å; C432-C445 VanDerWaalsContact CA-SG 3.5Å; C432-C445 HydrophobicContact CB-CB 3.75Å; C432-C445 WeakPolarHBondContact CB-SG 3.5Å; C432-C445 VanDerWaalsContact SG-CA 3.5Å; C432-C445 WeakPolarHBondContact SG-CB 3.39Å; C432-C445 CovalentContact SG-SG 2.03Å; C432-C445 PolarHBondContact SG-SG 2.81Å; Y436-C445 HydrophobicContact CD1-CB 4.45Å; Y436-C445 VanDerWaalsContact CD1-O 3.31Å; Y436-C445 WeakPolarHBondContact CD1-O 3.29Å; V437-C445 CarbonylContact O-C 3.53Å; V437-C445 WeakPolarHBondContact O-CA 3.38Å
446	V	76.5	Confident	59.8	Low	60 Å²	60	102.4 Å²	102.4	36%	0.364	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	142.2	179.1	-62.8	0	0	0	0	110.5	Y436 V437 H439 M448	Y436-V446 CarbonylContact C-O 3.58Å; Y436-V446 VanDerWaalsContact CA-O 3.28Å; Y436-V446 WeakPolarHBondContact CA-O 3.24Å; V437-V446 HydrophobicContact CG2-CG2 3.6Å; V437-V446 PolarHBondContact N-O 2.87Å; V437-V446 PolarHBondContact O-N 3Å; H439-V446 HydrophobicContact CB-CG1 4.37Å; V446-M448 PolarHBondContact O-N 3.05Å
447	P	71.1	Confident	57.9	Low	83 Å²	83	106.3 Å²	106.3	54%	0.539	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-54.9	136.5	177.6	-25.1	32.6	0	0	0	111.9	Y436 E449	Y436-P447 HydrophobicContact CD1-CB 4.35Å; Y436-P447 HydrophobicContact CD1-CG 4.14Å; Y436-P447 HydrophobicContact CE1-CB 4.24Å; Y436-P447 HydrophobicContact CE1-CG 3.76Å; P447-E449 PolarHBondContact O-N 3.12Å
448	M	51	Low	56.3	Low	104 Å²	104	108.5 Å²	108.5	51%	0.512	57%	0.566	S	S	.	*			trans	-65.6	102.1	160.1	-80.8	-168.2	155.3	0	0	107.8	G435 V437 V446	G435-M448 WeakPolarHBondContact O-CB 3.26Å; G435-M448 PolarHBondContact O-N 3.35Å; V437-M448 HydrophobicContact CG1-CE 3.39Å; V437-M448 HydrophobicContact CG1-CG 3.69Å; V437-M448 HydrophobicContact CG1-SD 4.35Å; V446-M448 PolarHBondContact O-N 3.05Å
449	E	49	Very low	55	Low	173 Å²	173	109.6 Å²	109.6	81%	0.808	57%	0.565	S	S	*	*			trans	-54.4	142.7	160.2	-64.5	-160.5	152.7	0	0	109	P447 C451	P447-E449 PolarHBondContact O-N 3.12Å; E449-C451 VanDerWaalsContact C-N 3.29Å; E449-C451 PolarHBondContact O-N 3.17Å
450	K	33.8	Very low	53.5	Low	209 Å²	209	111.7 Å²	111.7	91%	0.909	59%	0.591	S	S	*	*			trans	-69.2	85.9	-173.5	-71.6	178.7	178.3	175.2	0	110.5	T452	K450-T452 PolarHBondContact O-N 3.48Å
451	C	31.6	Very low	52.7	Low	120 Å²	120	103.6 Å²	103.6	81%	0.811	57%	0.569	S	S	*	*			trans	-59.5	104.7	175.6	-67.5	0	0	0	0	110.2	E449 V453	E449-C451 VanDerWaalsContact C-N 3.29Å; E449-C451 PolarHBondContact O-N 3.17Å; C451-V453 PolarHBondContact O-N 2.82Å
452	T	31.8	Very low	51.8	Low	132 Å²	132	102.6 Å²	102.6	81%	0.81	57%	0.57	S	S	*	*			trans	-56	126.7	160.1	47.6	0	0	0	0	108.4	K450 N454	K450-T452 PolarHBondContact O-N 3.48Å; T452-N454 PolarHBondContact O-N 3.16Å
453	V	30.6	Very low	50.6	Low	136 Å²	136	105 Å²	105	82%	0.824	57%	0.572	S	S	*	*	S	Bend	trans	-47.7	109.5	-172.4	-172	0	0	0	0	112.3	C451	C451-V453 PolarHBondContact O-N 2.82Å
454	N	31.9	Very low	48.9	Very low	139 Å²	139	107.8 Å²	107.8	74%	0.743	58%	0.584	S	S	*	*			trans	-177.9	139.5	138.9	-91.5	-12.2	0	0	0	111.8	T452	T452-N454 PolarHBondContact O-N 3.16Å
455	E	39.7	Very low	47.2	Very low	160 Å²	160	108.1 Å²	108.1	75%	0.748	59%	0.591	S	S	*	*			trans	72.2	118.5	166.7	-65.1	168.6	-150.3	0	0	117.7	W508	E455-W508 HydrophobicContact CB-CH2 4.43Å; E455-W508 HydrophobicContact CG-CH2 4.12Å; E455-W508 HydrophobicContact CG-CZ2 4.33Å
456	Q	37.3	Very low	45	Very low	117 Å²	117	114.5 Å²	114.5	55%	0.547	62%	0.62	S	S	.	*			trans	-117.4	125.4	-175.5	-67.7	170.9	-36.6	0	0	110	T495	Q456-T495 PolarHBondContact NE2-OG1 2.03Å
457	E	41.1	Very low	44	Very low	182 Å²	182	120.2 Å²	120.2	85%	0.85	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-77.6	149.3	172.4	-69.3	-171.7	146.6	0	0	112.2	R459	E457-R459 PolarHBondContact O-N 2.7Å
458	P	43.4	Very low	42.6	Very low	100 Å²	100	123.8 Å²	123.8	65%	0.649	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-68	130.3	178	28.3	-34.4	0	0	0	111.3
459	R	48.8	Very low	41.9	Very low	94 Å²	94	128.3 Å²	128.3	36%	0.355	67%	0.666	S	S	.	*	P	Polyproline II helix	trans	-75.5	151.7	174.7	-72.8	-170.2	173.8	-167.8	1	111.2	E457 G461 D475 N477 C493	E457-R459 PolarHBondContact O-N 2.7Å; R459-G461 PolarHBondContact O-N 3.01Å; R459-D475 IonicContact NH1-OD2 3.88Å; R459-N477 VanDerWaalsContact NH1-CB 3.31Å; R459-C493 HydrophobicContact CB-CB 4.49Å; R459-C493 PolarHBondContact N-O 3.22Å
460	A	47.4	Very low	42.1	Very low	92 Å²	92	122.7 Å²	122.7	76%	0.76	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-57.5	136.6	175.1	0	0	0	0	0	111.3
461	G	51.3	Low	43	Very low	34 Å²	34	116 Å²	116	35%	0.351	62%	0.623	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-147.9	136.5	171.1	0	0	0	0	0	109.2	R459 T473	R459-G461 PolarHBondContact O-N 3.01Å; G461-T473 CarbonylContact C-O 3.4Å; G461-T473 WeakPolarHBondContact CA-O 3.21Å
462	A	49.3	Very low	44.4	Very low	47 Å²	47	112.2 Å²	112.2	39%	0.388	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.3	137	179.6	0	0	0	0	0	110.4	F464 T473	A462-F464 HydrophobicContact CB-CD2 4.19Å; A462-F464 HydrophobicContact CB-CE2 3.41Å; A462-F464 VanDerWaalsContact CB-CE2 3.41Å; A462-F464 HydrophobicContact CB-CZ 3.76Å; A462-T473 PolarHBondContact N-O 2.84Å; A462-T473 PolarHBondContact O-N 2.04Å; A462-T473 PolarHBondContact O-OG1 2.85Å
463	F	51.3	Low	45.8	Very low	82 Å²	82	109 Å²	109	36%	0.36	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.8	103	-175.9	-170.7	-108.3	0	0	0	110.7	C465 C470 T471 L472 L491	F463-C465 WeakPolarHBondContact CE1-SG 3.46Å; F463-C470 HydrophobicContact CE1-CB 4.03Å; F463-C470 HydrophobicContact CE2-CB 3.86Å; F463-C470 HydrophobicContact CZ-CB 3.45Å; F463-C470 VanDerWaalsContact CZ-CB 3.45Å; F463-T471 CarbonylContact C-O 3.53Å; F463-T471 WeakPolarHBondContact CA-O 3.38Å; F463-L472 HydrophobicContact CB-CD1 4.32Å; F463-L472 HydrophobicContact CD2-CB 4.02Å; F463-L472 HydrophobicContact CD2-CD1 4.12Å; F463-L491 HydrophobicContact CE2-CD1 4.01Å
464	F	45.4	Very low	47.2	Very low	131 Å²	131	104.3 Å²	104.3	58%	0.575	55%	0.547	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	112.1	-175.2	-61.9	-78.5	0	0	0	111.3	A462 C470 T471	A462-F464 HydrophobicContact CB-CD2 4.19Å; A462-F464 HydrophobicContact CB-CE2 3.41Å; A462-F464 VanDerWaalsContact CB-CE2 3.41Å; A462-F464 HydrophobicContact CB-CZ 3.76Å; F464-C470 CarbonylContact O-C 3.37Å; F464-C470 WeakPolarHBondContact O-CA 3.42Å; F464-T471 PolarHBondContact N-O 3.15Å; F464-T471 PolarHBondContact O-N 3.07Å
465	C	43.5	Very low	48.5	Very low	72 Å²	72	101.1 Å²	101.1	49%	0.486	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	120.5	171.9	-64.9	0	0	0	0	111.5	F463 R469 C470	F463-C465 WeakPolarHBondContact CE1-SG 3.46Å; C465-R469 WeakPolarHBondContact CA-O 3.11Å; C465-C470 HydrophobicContact CB-CB 4.14Å; C465-C470 WeakPolarHBondContact CB-SG 3.48Å; C465-C470 WeakPolarHBondContact SG-CB 3.05Å; C465-C470 CovalentContact SG-SG 2.05Å; C465-C470 PolarHBondContact SG-SG 2.96Å
466	H	39.2	Very low	49.4	Very low	137 Å²	137	97.6 Å²	97.6	63%	0.634	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.5	111.8	166.6	-172.6	84.6	0	0	0	109.7	N468 R469	H466-N468 PolarHBondContact O-N 3.23Å; H466-R469 PolarHBondContact N-O 3.21Å; H466-R469 PolarHBondContact O-N 2.93Å
467	K	56	Low	50.1	Low	180 Å²	180	96.4 Å²	96.4	78%	0.783	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	-119.7	-171.7	-56.7	173.9	-176.6	174.7	0	110.4	R469	K467-R469 VanDerWaalsContact C-N 3.35Å
468	N	41.2	Very low	50.7	Low	159 Å²	159	88.4 Å²	88.4	85%	0.85	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	9.4	-179.2	-62.1	-6	0	0	0	113.5	H466	H466-N468 PolarHBondContact O-N 3.23Å
469	R	37.1	Very low	51.2	Low	198 Å²	198	84.9 Å²	84.9	75%	0.747	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.1	109.8	-177.2	-165.3	-175.3	-63.8	-170.6	1.3	109.6	C465 H466 K467	C465-R469 WeakPolarHBondContact CA-O 3.11Å; H466-R469 PolarHBondContact N-O 3.21Å; H466-R469 PolarHBondContact O-N 2.93Å; K467-R469 VanDerWaalsContact C-N 3.35Å
470	C	52	Low	51.4	Low	56 Å²	56	85.6 Å²	85.6	38%	0.378	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	136	173.4	-60.3	0	0	0	0	110.7	F463 F464 C465	F463-C470 HydrophobicContact CE1-CB 4.03Å; F463-C470 HydrophobicContact CE2-CB 3.86Å; F463-C470 HydrophobicContact CZ-CB 3.45Å; F463-C470 VanDerWaalsContact CZ-CB 3.45Å; F464-C470 CarbonylContact O-C 3.37Å; F464-C470 WeakPolarHBondContact O-CA 3.42Å; C465-C470 HydrophobicContact CB-CB 4.14Å; C465-C470 WeakPolarHBondContact CB-SG 3.48Å; C465-C470 WeakPolarHBondContact SG-CB 3.05Å; C465-C470 CovalentContact SG-SG 2.05Å; C465-C470 PolarHBondContact SG-SG 2.96Å
471	T	53.1	Low	51.8	Low	69 Å²	69	82.4 Å²	82.4	42%	0.423	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	117.6	-176.3	-52	0	0	0	0	108.3	F463 F464 T473	F463-T471 CarbonylContact C-O 3.53Å; F463-T471 WeakPolarHBondContact CA-O 3.38Å; F464-T471 PolarHBondContact N-O 3.15Å; F464-T471 PolarHBondContact O-N 3.07Å; T471-T473 HydrophobicContact CG2-CG2 4.28Å
472	L	61.1	Low	51.8	Low	39 Å²	39	85.8 Å²	85.8	20%	0.204	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	107.4	166.4	-177	66	0	0	0	108.2	F463 L491	F463-L472 HydrophobicContact CB-CD1 4.32Å; F463-L472 HydrophobicContact CD2-CB 4.02Å; F463-L472 HydrophobicContact CD2-CD1 4.12Å; L472-L491 HydrophobicContact CD2-CB 3.88Å
473	T	61.5	Low	51.8	Low	65 Å²	65	91.5 Å²	91.5	40%	0.399	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	109.9	169.3	34.6	0	0	0	0	109	G461 A462 T471	G461-T473 CarbonylContact C-O 3.4Å; G461-T473 WeakPolarHBondContact CA-O 3.21Å; A462-T473 PolarHBondContact N-O 2.84Å; A462-T473 PolarHBondContact O-N 2.04Å; A462-T473 PolarHBondContact O-OG1 2.85Å; T471-T473 HydrophobicContact CG2-CG2 4.28Å
474	C	60	Low	51.4	Low	37 Å²	37	92.5 Å²	92.5	25%	0.25	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	151.5	171.9	-63.8	0	0	0	0	111	A478 C493	C474-A478 HydrophobicContact CB-CB 3.99Å; C474-C493 WeakPolarHBondContact CA-SG 3.03Å; C474-C493 HydrophobicContact CB-CB 3.7Å; C474-C493 WeakPolarHBondContact CB-SG 3.37Å; C474-C493 WeakPolarHBondContact SG-CA 3.23Å; C474-C493 WeakPolarHBondContact SG-CB 3.5Å; C474-C493 CovalentContact SG-SG 2.04Å; C474-C493 PolarHBondContact SG-SG 3.3Å
475	D	59.6	Low	51.5	Low	72 Å²	72	89.4 Å²	89.4	39%	0.385	46%	0.46	S	S	.	.			trans	-54.6	149.6	167.1	173.1	29.3	0	0	0	111.4	R459 N477 A478	R459-D475 IonicContact NH1-OD2 3.88Å; D475-N477 PolarHBondContact O-N 3.18Å; D475-A478 WeakPolarHBondContact O-CB 3.47Å; D475-A478 PolarHBondContact O-N 3Å
476	S	58.1	Low	51.6	Low	86 Å²	86	93.4 Å²	93.4	60%	0.601	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.9	-36.1	177.4	59.7	0	0	0	0	115.2
477	N	52.4	Low	51.6	Low	93 Å²	93	93.1 Å²	93.1	50%	0.497	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	5	-178.9	-71	-52.9	0	0	0	114.2	R459 D475 K496	R459-N477 VanDerWaalsContact NH1-CB 3.31Å; D475-N477 PolarHBondContact O-N 3.18Å; N477-K496 WeakPolarHBondContact O-CB 3.32Å; N477-K496 PolarHBondContact O-N 2.93Å; N477-K496 VanDerWaalsContact O-N 3.1Å
478	A	53.8	Low	50.5	Low	13 Å²	13	87 Å²	87	11%	0.107	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	141.6	177.3	0	0	0	0	0	112.2	C474 D475 C493 V494	C474-A478 HydrophobicContact CB-CB 3.99Å; D475-A478 WeakPolarHBondContact O-CB 3.47Å; D475-A478 PolarHBondContact O-N 3Å; A478-C493 HydrophobicContact CB-CB 3.88Å; A478-V494 CarbonylContact C-O 3.43Å; A478-V494 WeakPolarHBondContact CA-O 3.29Å; A478-V494 WeakPolarHBondContact CB-O 3.46Å
479	A	53.6	Low	50.7	Low	26 Å²	26	83.8 Å²	83.8	22%	0.215	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	150.1	167.2	0	0	0	0	0	110	A481 V494 K496	A479-A481 PolarHBondContact O-N 3.4Å; A479-V494 HydrophobicContact CB-CG2 4.17Å; A479-V494 PolarHBondContact N-O 2.94Å; A479-V494 WeakPolarHBondContact O-CG2 3.46Å; A479-V494 PolarHBondContact O-N 3.49Å; A479-K496 HydrophobicContact CB-CB 4.33Å; A479-K496 HydrophobicContact CB-CG 4.31Å
480	F	53	Low	51.5	Low	110 Å²	110	79.2 Å²	79.2	48%	0.482	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	121.5	167.9	172.9	-92.9	0	0	0	109.8	N482 L491	F480-N482 HydrophobicContact CE1-CB 3.73Å; F480-N482 HydrophobicContact CZ-CB 3.84Å; F480-L491 HydrophobicContact CE2-CB 4.49Å; F480-L491 HydrophobicContact CE2-CD2 3.76Å; F480-L491 HydrophobicContact CZ-CD2 3.65Å
481	A	55	Low	51.6	Low	24 Å²	24	80.2 Å²	80.2	20%	0.198	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	133.1	163.5	0	0	0	0	0	109.8	A479 S492 V494	A479-A481 PolarHBondContact O-N 3.4Å; A481-S492 PolarHBondContact N-O 2.84Å; A481-S492 PolarHBondContact O-N 2.88Å; A481-V494 HydrophobicContact CB-CB 4.3Å; A481-V494 HydrophobicContact CB-CG1 3.58Å; A481-V494 HydrophobicContact CB-CG2 3.72Å
482	N	51.6	Low	51.8	Low	106 Å²	106	78.9 Å²	78.9	57%	0.567	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113	140.9	161.5	61.6	-7.3	0	0	0	110.8	F480 H490 L491	F480-N482 HydrophobicContact CE1-CB 3.73Å; F480-N482 HydrophobicContact CZ-CB 3.84Å; N482-H490 VanDerWaalsContact CA-O 3.24Å; N482-H490 WeakPolarHBondContact CA-O 3.21Å; N482-L491 HydrophobicContact CB-CD2 4.14Å
483	Y	50.1	Low	51.6	Low	167 Å²	167	77.2 Å²	77.2	66%	0.655	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.3	132.4	167.7	-176.6	-99.6	0	0	0	109.7	N485 H490	Y483-N485 HydrophobicContact CE1-CB 4.29Å; Y483-H490 PolarHBondContact N-O 3.03Å; Y483-H490 PolarHBondContact O-N 2.93Å
484	K	42.5	Very low	51.3	Low	102 Å²	102	76.5 Å²	76.5	44%	0.443	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	112.5	-176.9	-175	177.6	-179.7	-174.8	0	109.3	V489 Y541	K484-V489 HydrophobicContact CG-CG2 4.47Å; K484-Y541 WeakPolarHBondContact CD-OH 3.49Å
485	N	46.8	Very low	50.9	Low	66 Å²	66	76.9 Å²	76.9	35%	0.353	41%	0.411	S	S	.	.			trans	-90.6	176.2	162.6	106	13.3	0	0	0	109.2	Y483 T487 T488	Y483-N485 HydrophobicContact CE1-CB 4.29Å; N485-T487 PolarHBondContact O-N 2.91Å; N485-T487 VanDerWaalsContact O-N 3.14Å; N485-T487 PolarHBondContact OD1-N 2.94Å; N485-T487 PolarHBondContact OD1-OG1 2.95Å; N485-T488 PolarHBondContact N-O 3.44Å; N485-T488 PolarHBondContact ND2-OG1 2.63Å; N485-T488 PolarHBondContact OD1-N 3.02Å; N485-T488 PolarHBondContact OD1-OG1 3.31Å
486	K	45.3	Very low	50.2	Low	157 Å²	157	80.1 Å²	80.1	68%	0.683	42%	0.421	S	S	*	.	S	Bend	trans	-59.4	-21.4	-177	-65.9	-174.9	-176.9	175	0	115.1	E536	K486-E536 VanDerWaalsContact NZ-N 3.15Å; K486-E536 PolarHBondContact NZ-O 3.44Å
487	T	39.9	Very low	49.5	Very low	131 Å²	131	80.3 Å²	80.3	80%	0.804	42%	0.415	S	S	*	.	S	Bend	trans	-132.3	-14.3	-177.7	53.8	0	0	0	0	114.7	N485	N485-T487 PolarHBondContact O-N 2.91Å; N485-T487 VanDerWaalsContact O-N 3.14Å; N485-T487 PolarHBondContact OD1-N 2.94Å; N485-T487 PolarHBondContact OD1-OG1 2.95Å
488	T	33.5	Very low	49	Very low	51 Å²	51	83 Å²	83	31%	0.313	43%	0.43	S	S	.	.			trans	-126.9	146.7	179.8	59.7	0	0	0	0	113.4	N485 H490	N485-T488 PolarHBondContact N-O 3.44Å; N485-T488 PolarHBondContact ND2-OG1 2.63Å; N485-T488 PolarHBondContact OD1-N 3.02Å; N485-T488 PolarHBondContact OD1-OG1 3.31Å; T488-H490 PolarHBondContact OG1-CD2 3.47Å; T488-H490 PolarHBondContact OG1-NE2 2.88Å
489	V	45.7	Very low	48.2	Very low	91 Å²	91	90.5 Å²	90.5	55%	0.552	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.3	113.4	164.4	179.5	0	0	0	0	107.2	K484 L491	K484-V489 HydrophobicContact CG-CG2 4.47Å; V489-L491 HydrophobicContact CG1-CD2 3.83Å; V489-L491 HydrophobicContact CG1-CG 4.42Å
490	H	52.3	Low	47.3	Very low	103 Å²	103	93 Å²	93	48%	0.477	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	133.1	170.6	-66.9	-100.2	0	0	0	108.4	N482 Y483 T488	N482-H490 VanDerWaalsContact CA-O 3.24Å; N482-H490 WeakPolarHBondContact CA-O 3.21Å; Y483-H490 PolarHBondContact N-O 3.03Å; Y483-H490 PolarHBondContact O-N 2.93Å; T488-H490 PolarHBondContact OG1-CD2 3.47Å; T488-H490 PolarHBondContact OG1-NE2 2.88Å
491	L	55.3	Low	46.3	Very low	77 Å²	77	93 Å²	93	40%	0.403	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	126.8	173.5	-53.1	172.6	0	0	0	106.3	F463 L472 F480 N482 V489	F463-L491 HydrophobicContact CE2-CD1 4.01Å; L472-L491 HydrophobicContact CD2-CB 3.88Å; F480-L491 HydrophobicContact CE2-CB 4.49Å; F480-L491 HydrophobicContact CE2-CD2 3.76Å; F480-L491 HydrophobicContact CZ-CD2 3.65Å; N482-L491 HydrophobicContact CB-CD2 4.14Å; V489-L491 HydrophobicContact CG1-CD2 3.83Å; V489-L491 HydrophobicContact CG1-CG 4.42Å
492	S	56.9	Low	45.2	Very low	41 Å²	41	97 Å²	97	29%	0.287	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	154.2	-177.4	-169.8	0	0	0	0	111.8	A481	A481-S492 PolarHBondContact N-O 2.84Å; A481-S492 PolarHBondContact O-N 2.88Å
493	C	56.6	Low	44.1	Very low	4 Å²	4	96.4 Å²	96.4	3%	0.027	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	102.5	173.3	-59.1	0	0	0	0	108.8	R459 C474 A478	R459-C493 HydrophobicContact CB-CB 4.49Å; R459-C493 PolarHBondContact N-O 3.22Å; C474-C493 WeakPolarHBondContact CA-SG 3.03Å; C474-C493 HydrophobicContact CB-CB 3.7Å; C474-C493 WeakPolarHBondContact CB-SG 3.37Å; C474-C493 WeakPolarHBondContact SG-CA 3.23Å; C474-C493 WeakPolarHBondContact SG-CB 3.5Å; C474-C493 CovalentContact SG-SG 2.04Å; C474-C493 PolarHBondContact SG-SG 3.3Å; A478-C493 HydrophobicContact CB-CB 3.88Å
494	V	55.3	Low	43.1	Very low	49 Å²	49	95.7 Å²	95.7	30%	0.297	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	154.6	179.7	-63.8	0	0	0	0	110.8	A478 A479 A481 K496	A478-V494 CarbonylContact C-O 3.43Å; A478-V494 WeakPolarHBondContact CA-O 3.29Å; A478-V494 WeakPolarHBondContact CB-O 3.46Å; A479-V494 HydrophobicContact CB-CG2 4.17Å; A479-V494 PolarHBondContact N-O 2.94Å; A479-V494 WeakPolarHBondContact O-CG2 3.46Å; A479-V494 PolarHBondContact O-N 3.49Å; A481-V494 HydrophobicContact CB-CB 4.3Å; A481-V494 HydrophobicContact CB-CG1 3.58Å; A481-V494 HydrophobicContact CB-CG2 3.72Å; V494-K496 PolarHBondContact O-N 3.18Å
495	T	51.2	Low	42.4	Very low	45 Å²	45	97.2 Å²	97.2	28%	0.276	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	133.6	179.7	17.2	0	0	0	0	112.2	Q456 L497	Q456-T495 PolarHBondContact NE2-OG1 2.03Å; T495-L497 PolarHBondContact O-N 3.1Å
496	K	45.1	Very low	41.4	Very low	140 Å²	140	100 Å²	100	61%	0.609	56%	0.556	S	S	*	*			trans	-84.4	90.5	-178.2	-166.1	178.2	-175	-176.8	0	111	N477 A479 V494	N477-K496 WeakPolarHBondContact O-CB 3.32Å; N477-K496 PolarHBondContact O-N 2.93Å; N477-K496 VanDerWaalsContact O-N 3.1Å; A479-K496 HydrophobicContact CB-CB 4.33Å; A479-K496 HydrophobicContact CB-CG 4.31Å; V494-K496 PolarHBondContact O-N 3.18Å
497	L	44.6	Very low	40.5	Very low	91 Å²	91	101.6 Å²	101.6	48%	0.476	57%	0.566	S	S	.	*			trans	-92.7	117.7	174.8	-82.1	157.8	0	0	0	111.4	T495 N499 S500	T495-L497 PolarHBondContact O-N 3.1Å; L497-N499 PolarHBondContact O-N 3.33Å; L497-N499 VanDerWaalsContact O-N 3.07Å; L497-S500 PolarHBondContact O-N 2.96Å; L497-S500 VanDerWaalsContact O-N 3.13Å
498	N	41.5	Very low	40	Very low	150 Å²	150	105.2 Å²	105.2	80%	0.802	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	30.6	63.8	163.3	-67.9	-8.6	0	0	0	116.5	S500	N498-S500 PolarHBondContact O-N 2.75Å
499	N	37.5	Very low	39.6	Very low	170 Å²	170	112.5 Å²	112.5	91%	0.909	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	54.3	18.1	173.3	-74.7	-14.2	0	0	0	116.7	L497	L497-N499 PolarHBondContact O-N 3.33Å; L497-N499 VanDerWaalsContact O-N 3.07Å
500	S	34.1	Very low	38.6	Very low	79 Å²	79	116.8 Å²	116.8	55%	0.552	61%	0.606	S	S	*	*			trans	-132.1	132.5	176.9	55.4	0	0	0	0	112.5	L497 N498	L497-S500 PolarHBondContact O-N 2.96Å; L497-S500 VanDerWaalsContact O-N 3.13Å; N498-S500 PolarHBondContact O-N 2.75Å
501	V	32.1	Very low	37.4	Very low	108 Å²	108	120.3 Å²	120.3	66%	0.655	63%	0.625	S	S	*	*			trans	-87.7	114.3	173.2	178.4	0	0	0	0	107.8	S503	V501-S503 PolarHBondContact O-N 3.23Å
502	C	31.5	Very low	35.9	Very low	109 Å²	109	124.7 Å²	124.7	74%	0.736	64%	0.643	S	S	*	*			trans	-64.9	132	173.1	-71	0	0	0	0	110.5
503	S	27.9	Very low	34.5	Very low	93 Å²	93	129.1 Å²	129.1	65%	0.65	66%	0.663	S	S	*	*			trans	-131.7	152.1	177.7	59.4	0	0	0	0	109.5	V501	V501-S503 PolarHBondContact O-N 3.23Å
504	L	28.9	Very low	33	Very low	153 Å²	153	134.2 Å²	134.2	80%	0.801	70%	0.698	S	S	*	*			trans	73.5	146.4	173.2	-49.2	174.2	0	0	0	114
505	L	27.8	Very low	31.5	Very low	133 Å²	133	139.1 Å²	139.1	70%	0.696	72%	0.716	S	S	*	*			cis	-159	152	-4.9	-114.8	161.3	0	0	0	108.9
506	N	26.6	Very low	30.3	Very low	126 Å²	126	141.9 Å²	141.9	67%	0.674	74%	0.743	S	S	*	*			trans	81.3	138.3	161.8	-56.2	-25.6	0	0	0	121.1
507	E	26.8	Very low	29.3	Very low	190 Å²	190	140.5 Å²	140.5	89%	0.888	75%	0.746	S	S	*	*			trans	59.1	75.1	158.2	-63.5	-171.2	-157.4	0	0	121.1
508	W	28.3	Very low	28.4	Very low	206 Å²	206	140.3 Å²	140.3	78%	0.78	76%	0.758	S	S	*	*			trans	-105.7	122.2	160.4	-70.7	78	0	0	0	111.5	E455	E455-W508 HydrophobicContact CB-CH2 4.43Å; E455-W508 HydrophobicContact CG-CH2 4.12Å; E455-W508 HydrophobicContact CG-CZ2 4.33Å
509	K	26	Very low	27.6	Very low	205 Å²	205	141.9 Å²	141.9	89%	0.891	76%	0.758	S	S	*	*			trans	-88.1	124.5	177.5	-88.2	177.3	176.9	168.1	0	111.9
510	Q	24.7	Very low	26.9	Very low	180 Å²	180	139.5 Å²	139.5	84%	0.841	75%	0.753	S	S	*	*			trans	-3.7	115.9	168.8	-68.3	172.4	-71.1	0	0	118.7
511	M	25.9	Very low	26.5	Very low	177 Å²	177	142.4 Å²	142.4	87%	0.872	76%	0.761	S	S	*	*			trans	-131.8	119.7	143.4	-146.6	-179.6	-71.5	0	0	107.7	I513	M511-I513 PolarHBondContact O-N 3.29Å
512	E	24.9	Very low	26.1	Very low	169 Å²	169	148 Å²	148	79%	0.79	77%	0.771	S	S	*	*			trans	-79.1	105.4	-172.7	-72.8	-173.6	136.2	0	0	112
513	I	26.7	Very low	25.7	Very low	135 Å²	135	148.6 Å²	148.6	69%	0.692	77%	0.771	S	S	*	*			trans	-117.6	94.3	162.3	-56.1	-179.3	0	0	0	108.5	M511 F515	M511-I513 PolarHBondContact O-N 3.29Å; I513-F515 HydrophobicContact CG2-CD2 3.88Å; I513-F515 HydrophobicContact CG2-CE2 3.85Å; I513-F515 PolarHBondContact O-N 2.75Å; I513-F515 VanDerWaalsContact O-N 3.11Å
514	S	24.8	Very low	25.5	Very low	110 Å²	110	148.5 Å²	148.5	77%	0.769	76%	0.763	S	S	*	*			trans	-80.6	84.9	-175	-60.4	0	0	0	0	112.6	A516	S514-A516 PolarHBondContact O-N 2.76Å
515	F	25.8	Very low	25.4	Very low	153 Å²	153	146 Å²	146	67%	0.671	75%	0.746	S	S	*	*			trans	-78.8	103	164	-86.9	-84.5	0	0	0	111.1	I513 V517	I513-F515 HydrophobicContact CG2-CD2 3.88Å; I513-F515 HydrophobicContact CG2-CE2 3.85Å; I513-F515 PolarHBondContact O-N 2.75Å; I513-F515 VanDerWaalsContact O-N 3.11Å; F515-V517 PolarHBondContact O-N 3.5Å
516	A	25.2	Very low	25.3	Very low	103 Å²	103	142.8 Å²	142.8	85%	0.851	73%	0.732	S	S	*	*			trans	-91.1	82.2	172.4	0	0	0	0	0	111.5	S514	S514-A516 PolarHBondContact O-N 2.76Å
517	V	24.6	Very low	25.3	Very low	111 Å²	111	141.9 Å²	141.9	67%	0.673	74%	0.735	S	S	*	*			trans	-93	89.2	167.1	-176.4	0	0	0	0	109.5	F515	F515-V517 PolarHBondContact O-N 3.5Å
518	A	24.9	Very low	25.4	Very low	87 Å²	87	142.6 Å²	142.6	72%	0.719	74%	0.735	S	S	*	*			trans	-169	136.6	158.3	0	0	0	0	0	114.1
519	K	25.4	Very low	25.3	Very low	183 Å²	183	136.9 Å²	136.9	80%	0.796	73%	0.732	S	S	*	*			trans	87.6	79.1	161	-59.9	-176.9	179	179.8	0	119.3	L521	K519-L521 PolarHBondContact O-N 3.4Å; K519-L521 VanDerWaalsContact O-N 3.16Å
520	C	22.7	Very low	25.3	Very low	120 Å²	120	134.8 Å²	134.8	81%	0.811	73%	0.73	S	S	*	*				-63.7	92.4	121.3	-66.3	0	0	0	0	108.9
521	L	24.4	Very low	25.3	Very low	139 Å²	139	130.4 Å²	130.4	73%	0.728	72%	0.719	S	S	*	*			trans	-168.1	113.9	158.6	-111.2	162	0	0	0	110.2	K519 V523	K519-L521 PolarHBondContact O-N 3.4Å; K519-L521 VanDerWaalsContact O-N 3.16Å; L521-V523 PolarHBondContact O-N 2.63Å; L521-V523 VanDerWaalsContact O-N 3.12Å
522	W	23.9	Very low	25.2	Very low	225 Å²	225	131 Å²	131	85%	0.852	72%	0.719	S	S	*	*			trans	-62.2	101.1	171.2	-97.4	48.7	0	0	0	111.4
523	V	24.5	Very low	25.3	Very low	123 Å²	123	127 Å²	127	75%	0.745	72%	0.716	S	S	*	*			trans	-149.2	102.9	156.9	-173.3	0	0	0	0	110.8	L521	L521-V523 PolarHBondContact O-N 2.63Å; L521-V523 VanDerWaalsContact O-N 3.12Å
524	N	23.5	Very low	25.2	Very low	90 Å²	90	130.7 Å²	130.7	48%	0.481	73%	0.727	S	S	.	*			trans	44.1	132.6	135.4	-111.6	-9.2	0	0	0	122.4	L562 Q566	N524-L562 VanDerWaalsContact OD1-CD2 3.29Å; N524-L562 WeakPolarHBondContact OD1-CD2 3.4Å; N524-L562 WeakPolarHBondContact OD1-CG 3.19Å; N524-Q566 PolarHBondContact OD1-NE2 2.79Å
525	K	25.5	Very low	25.2	Very low	102 Å²	102	128.8 Å²	128.8	44%	0.443	72%	0.718	S	S	.	*			trans	70.1	115.7	149.5	-66	-162.6	167.3	-131.5	0	117.2	Q566 E569	K525-Q566 VanDerWaalsContact CA-OE1 3.24Å; K525-Q566 VanDerWaalsContact CG-CD 3.4Å; K525-Q566 HydrophobicContact CG-CG 3.79Å; K525-E569 IonicContact NZ-OE2 3.78Å; K525-E569 PolarHBondContact NZ-OE2 2.87Å
526	T	26.1	Very low	25.3	Very low	65 Å²	65	129.3 Å²	129.3	40%	0.399	72%	0.722	S	S	.	*				41.2	121.5	84.7	65	0	0	0	0	112.9	Q566	T526-Q566 HydrophobicContact CG2-CB 3.78Å; T526-Q566 HydrophobicContact CG2-CG 3.97Å
527	S	27.6	Very low	25.4	Very low	107 Å²	107	127 Å²	127	75%	0.748	71%	0.708	S	S	*	*			cis	-164.7	170.7	16.7	48.6	0	0	0	0	111.5
528	K	27.5	Very low	25.6	Very low	205 Å²	205	130.3 Å²	130.3	89%	0.891	72%	0.721	S	S	*	*			trans	-49.5	139.6	165	-70.8	173.4	170.5	177.2	0	112.1
529	A	26.2	Very low	25.8	Very low	86 Å²	86	129 Å²	129	71%	0.711	72%	0.715	S	S	*	*				175.9	162.9	125.3	0	0	0	0	0	111.2
530	L	26.3	Very low	26	Very low	160 Å²	160	126.3 Å²	126.3	84%	0.838	71%	0.714	S	S	*	*			trans	70.3	112	171.4	-51.7	164.3	0	0	0	114.2
531	S	25.1	Very low	26.2	Very low	89 Å²	89	128.9 Å²	128.9	62%	0.622	71%	0.708	S	S	*	*			cis	73.6	122.6	46.1	87.3	0	0	0	0	114.4
532	H	24.7	Very low	26.3	Very low	188 Å²	188	128.5 Å²	128.5	87%	0.87	71%	0.711	S	S	*	*			trans	81	131.9	165.4	-74.4	-130.7	0	0	0	120.2
533	A	25.2	Very low	26.3	Very low	87 Å²	87	124.7 Å²	124.7	72%	0.719	71%	0.707	S	S	*	*			trans	81.2	107.3	143.9	0	0	0	0	0	122.5
534	F	24.5	Very low	26.4	Very low	212 Å²	212	124.8 Å²	124.8	93%	0.93	71%	0.708	S	S	*	*				59.6	142.9	124.3	-86.4	-94	0	0	0	124.4
535	A	26.5	Very low	26.5	Very low	69 Å²	69	126.9 Å²	126.9	57%	0.57	72%	0.723	S	S	*	*			trans	63.1	103.2	154.3	0	0	0	0	0	118.9
536	E	27.2	Very low	27	Very low	164 Å²	164	127.3 Å²	127.3	77%	0.766	74%	0.736	S	S	*	*				95.5	178.5	111.4	-75.7	165.7	-105.5	0	0	111.3	K486	K486-E536 VanDerWaalsContact NZ-N 3.15Å; K486-E536 PolarHBondContact NZ-O 3.44Å
537	G	27.6	Very low	27.1	Very low	54 Å²	54	131.1 Å²	131.1	56%	0.557	76%	0.759	S	S	*	*			cis	-159	151.7	-21.7	0	0	0	0	0	111.9
538	I	29.3	Very low	27	Very low	182 Å²	182	130 Å²	130	93%	0.933	75%	0.751	S	S	*	*			trans	54.3	131.6	155.4	-54.1	165.3	0	0	0	120.6
539	G	27.4	Very low	26.9	Very low	59 Å²	59	131.1 Å²	131.1	61%	0.608	75%	0.75	S	S	*	*			trans	97.1	161.2	155.5	0	0	0	0	0	117.9
540	T	30.1	Very low	26.9	Very low	126 Å²	126	134.2 Å²	134.2	77%	0.773	75%	0.75	S	S	*	*			cis	-152.8	-152.6	-28	-19.6	0	0	0	0	111
541	Y	27.9	Very low	27	Very low	175 Å²	175	132.5 Å²	132.5	69%	0.686	75%	0.746	S	S	*	*			trans	-146.9	160	-177.1	-77.5	-96.7	0	0	0	113.6	K484	K484-Y541 WeakPolarHBondContact CD-OH 3.49Å
542	V	26.6	Very low	27.4	Very low	131 Å²	131	133.5 Å²	133.5	79%	0.794	75%	0.75	S	S	*	*				175.1	140.5	128.1	147.7	0	0	0	0	113.8
543	L	24.2	Very low	27.4	Very low	145 Å²	145	128.8 Å²	128.8	76%	0.759	74%	0.743	S	S	*	*			trans	21.6	137.4	164.3	-81	62.2	0	0	0	122.1
544	V	25.5	Very low	27.5	Very low	125 Å²	125	130.4 Å²	130.4	76%	0.758	75%	0.75	S	S	*	*			cis	69.3	128.9	50	-168.9	0	0	0	0	111.4
545	V	25.6	Very low	27.6	Very low	134 Å²	134	125.3 Å²	125.3	81%	0.812	75%	0.747	S	S	*	*				-157	166.3	50.9	-138.3	0	0	0	0	111.6
546	P	36.1	Very low	27.7	Very low	110 Å²	110	129.1 Å²	129.1	71%	0.714	76%	0.758	S	S	*	*			trans	-121.7	157.4	-172.2	40.5	-27.6	0	0	0	117.7
547	V	27.3	Very low	27.9	Very low	145 Å²	145	129.9 Å²	129.9	88%	0.879	76%	0.761	S	S	*	*			trans	-177.3	162.8	158	-92.6	0	0	0	0	110.2
548	S	26.6	Very low	28.2	Very low	84 Å²	84	134.3 Å²	134.3	59%	0.587	77%	0.77	S	S	*	*			cis	-175.5	154	-32.3	60	0	0	0	0	111.4
549	W	26	Very low	28.7	Very low	229 Å²	229	130.5 Å²	130.5	87%	0.867	75%	0.752	S	S	*	*			trans	69.2	159	170.2	-55.3	15.9	0	0	0	115.7
550	E	25.3	Very low	29.2	Very low	151 Å²	151	133.2 Å²	133.2	71%	0.706	76%	0.757	S	S	*	*			cis	-160.4	141.7	-29.1	-106.1	-167.6	160.9	0	0	108.7
551	V	28	Very low	29.5	Very low	124 Å²	124	133.7 Å²	133.7	75%	0.752	75%	0.75	S	S	*	*			trans	60.7	145.1	137.4	179	0	0	0	0	120.1
552	P	32.8	Very low	30.2	Very low	110 Å²	110	129.2 Å²	129.2	71%	0.714	74%	0.737	S	S	*	*			cis	-139	-173.4	-37.6	41.1	-21.3	0	0	0	114.8
553	A	26.5	Very low	30.8	Very low	88 Å²	88	128.3 Å²	128.3	73%	0.727	73%	0.728	S	S	*	*			trans	58.9	127	144.6	0	0	0	0	0	123
554	S	26.4	Very low	31.7	Very low	121 Å²	121	126.6 Å²	126.6	85%	0.846	72%	0.717	S	S	*	*			trans	71.7	106.8	157.7	72.2	0	0	0	0	119.7
555	A	26.8	Very low	32.8	Very low	105 Å²	105	126.8 Å²	126.8	87%	0.868	71%	0.708	S	S	*	*			trans	-166.3	146.2	142.1	0	0	0	0	0	109.8
556	N	29.2	Very low	34	Very low	150 Å²	150	121.6 Å²	121.6	80%	0.802	68%	0.675	S	S	*	*			trans	-104.1	156.6	-171.3	-96.7	-8.9	0	0	0	113.9
557	E	30.6	Very low	34.6	Very low	180 Å²	180	118.9 Å²	118.9	84%	0.841	66%	0.661	S	S	*	*			trans	70	172.6	149	-73.7	-179.5	153.8	0	0	120.8
558	I	33.8	Very low	35.6	Very low	146 Å²	146	114 Å²	114	75%	0.749	64%	0.637	S	S	*	*			trans	90.7	120.8	-174.2	-55.8	167.6	0	0	0	112.9
559	N	40.7	Very low	37	Very low	103 Å²	103	113.6 Å²	113.6	55%	0.551	63%	0.625	S	S	*	*			cis	-152.9	116.3	0.9	-133.6	-23.8	0	0	0	111.3	H561	N559-H561 VanDerWaalsContact C-N 3.3Å; N559-H561 PolarHBondContact O-N 3.48Å
560	T	36.3	Very low	38.1	Very low	115 Å²	115	104.7 Å²	104.7	71%	0.706	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-15.3	-178.4	43.6	0	0	0	0	114.5	L562	T560-L562 VanDerWaalsContact C-N 3.29Å; T560-L562 PolarHBondContact O-N 2.88Å
561	H	37.7	Very low	39.1	Very low	137 Å²	137	101.1 Å²	101.1	63%	0.634	58%	0.584	S	S	*	*	H	α-helix	trans	-72.9	-14.5	-168.5	-139	-62.9	0	0	0	115.3	N559	N559-H561 VanDerWaalsContact C-N 3.3Å; N559-H561 PolarHBondContact O-N 3.48Å
562	L	42.1	Very low	40.3	Very low	80 Å²	80	102 Å²	102	42%	0.419	58%	0.58	S	S	.	*	H	α-helix	trans	-94.7	-26.6	-173.1	-172.1	52.7	0	0	0	113.2	N524 T560 Q566	N524-L562 VanDerWaalsContact OD1-CD2 3.29Å; N524-L562 WeakPolarHBondContact OD1-CD2 3.4Å; N524-L562 WeakPolarHBondContact OD1-CG 3.19Å; T560-L562 VanDerWaalsContact C-N 3.29Å; T560-L562 PolarHBondContact O-N 2.88Å; L562-Q566 PolarHBondContact O-NE2 2.04Å
563	L	40.1	Very low	41	Very low	113 Å²	113	100.7 Å²	100.7	59%	0.592	58%	0.579	S	S	*	*	H	α-helix	trans	-71.2	-39.9	174.4	-87	126.3	0	0	0	112.4	K565 Q566 A567	L563-K565 VanDerWaalsContact C-N 3.31Å; L563-K565 PolarHBondContact O-N 2.88Å; L563-Q566 WeakPolarHBondContact O-CB 3.14Å; L563-Q566 PolarHBondContact O-N 2.84Å; L563-A567 PolarHBondContact O-N 3.15Å
564	M	41.5	Very low	41.9	Very low	108 Å²	108	103.8 Å²	103.8	53%	0.532	58%	0.578	S	S	.	*	H	α-helix	trans	-66.2	-32.5	-178.8	-68.4	-167.7	173.1	0	0	113.1	A567 A568 L586	M564-A567 PolarHBondContact O-N 2.88Å; M564-A568 PolarHBondContact O-N 3.09Å; M564-A568 VanDerWaalsContact O-N 3.09Å; M564-L586 HydrophobicContact CE-CD2 4.34Å; M564-L586 HydrophobicContact SD-CD1 3.65Å; M564-L586 HydrophobicContact SD-CD2 3.67Å; M564-L586 HydrophobicContact SD-CG 4.34Å
565	K	49.9	Very low	42.4	Very low	130 Å²	130	101.2 Å²	101.2	57%	0.565	57%	0.571	S	S	*	*	H	α-helix	trans	-69.1	-37.8	175.3	-161.6	177.5	-179.8	-179.4	0	111.9	L563 A568 E569	L563-K565 VanDerWaalsContact C-N 3.31Å; L563-K565 PolarHBondContact O-N 2.88Å; K565-A568 PolarHBondContact O-N 3.39Å; K565-E569 VanDerWaalsContact CE-OE1 3.29Å; K565-E569 WeakPolarHBondContact CE-OE1 3.01Å; K565-E569 WeakPolarHBondContact O-CB 3.04Å; K565-E569 VanDerWaalsContact O-CG 3.28Å; K565-E569 WeakPolarHBondContact O-CG 3.4Å; K565-E569 PolarHBondContact O-N 2.92Å
566	Q	49.7	Very low	43	Very low	25 Å²	25	99.9 Å²	99.9	12%	0.117	55%	0.548	C	S	.	.	H	α-helix	trans	-67.8	-37.4	174.8	-76.4	165.1	59.8	0	0	112.5	N524 K525 T526 L562 L563 A570	N524-Q566 PolarHBondContact OD1-NE2 2.79Å; K525-Q566 VanDerWaalsContact CA-OE1 3.24Å; K525-Q566 VanDerWaalsContact CG-CD 3.4Å; K525-Q566 HydrophobicContact CG-CG 3.79Å; T526-Q566 HydrophobicContact CG2-CB 3.78Å; T526-Q566 HydrophobicContact CG2-CG 3.97Å; L562-Q566 PolarHBondContact O-NE2 2.04Å; L563-Q566 WeakPolarHBondContact O-CB 3.14Å; L563-Q566 PolarHBondContact O-N 2.84Å; Q566-A570 WeakPolarHBondContact O-CB 3.45Å; Q566-A570 PolarHBondContact O-N 3.37Å
567	A	48.5	Very low	43.5	Very low	52 Å²	52	102.5 Å²	102.5	43%	0.43	55%	0.552	S	S	.	*	H	α-helix	trans	-62.2	-46.2	172.5	0	0	0	0	0	111.5	L563 M564 A570 M571	L563-A567 PolarHBondContact O-N 3.15Å; M564-A567 PolarHBondContact O-N 2.88Å; A567-A570 PolarHBondContact O-N 3.34Å; A567-M571 WeakPolarHBondContact O-CB 3.44Å; A567-M571 VanDerWaalsContact O-CG 3.22Å; A567-M571 WeakPolarHBondContact O-CG 3.49Å; A567-M571 PolarHBondContact O-N 2.81Å
568	A	49.1	Very low	44.1	Very low	44 Å²	44	98.5 Å²	98.5	36%	0.364	54%	0.536	S	S	.	.	H	α-helix	trans	-62.9	-44.6	177.3	0	0	0	0	0	112.9	M564 K565 A570 M571 Q572	M564-A568 PolarHBondContact O-N 3.09Å; M564-A568 VanDerWaalsContact O-N 3.09Å; K565-A568 PolarHBondContact O-N 3.39Å; A568-A570 VanDerWaalsContact C-N 3.34Å; A568-A570 PolarHBondContact O-N 2.75Å; A568-M571 PolarHBondContact O-N 3.22Å; A568-Q572 PolarHBondContact O-N 3.22Å; A568-Q572 VanDerWaalsContact O-N 3.15Å
569	E	56.1	Low	44.3	Very low	75 Å²	75	98.9 Å²	98.9	35%	0.35	53%	0.534	S	S	.	.	H	α-helix	trans	-61.6	-40.2	175.4	-72.2	164.8	-175	0	0	111	K525 K565 A573	K525-E569 IonicContact NZ-OE2 3.78Å; K525-E569 PolarHBondContact NZ-OE2 2.87Å; K565-E569 VanDerWaalsContact CE-OE1 3.29Å; K565-E569 WeakPolarHBondContact CE-OE1 3.01Å; K565-E569 WeakPolarHBondContact O-CB 3.04Å; K565-E569 VanDerWaalsContact O-CG 3.28Å; K565-E569 WeakPolarHBondContact O-CG 3.4Å; K565-E569 PolarHBondContact O-N 2.92Å; E569-A573 PolarHBondContact O-N 2.04Å
570	A	50	Low	44	Very low	41 Å²	41	102.9 Å²	102.9	34%	0.339	55%	0.55	S	S	.	*	H	α-helix	trans	-71.6	-33.7	177.3	0	0	0	0	0	114.1	Q566 A567 A568 A573 Q574	Q566-A570 WeakPolarHBondContact O-CB 3.45Å; Q566-A570 PolarHBondContact O-N 3.37Å; A567-A570 PolarHBondContact O-N 3.34Å; A568-A570 VanDerWaalsContact C-N 3.34Å; A568-A570 PolarHBondContact O-N 2.75Å; A570-A573 PolarHBondContact O-N 3.44Å; A570-Q574 PolarHBondContact O-N 3.41Å
571	M	46.4	Very low	43.9	Very low	76 Å²	76	106.5 Å²	106.5	37%	0.374	56%	0.556	S	S	.	*	H	α-helix	trans	-70.1	-38.5	176.5	-70.9	170.9	82.8	0	0	111.6	A567 A568 A573 Q574 I576 L578	A567-M571 WeakPolarHBondContact O-CB 3.44Å; A567-M571 VanDerWaalsContact O-CG 3.22Å; A567-M571 WeakPolarHBondContact O-CG 3.49Å; A567-M571 PolarHBondContact O-N 2.81Å; A568-M571 PolarHBondContact O-N 3.22Å; M571-A573 VanDerWaalsContact C-N 3.35Å; M571-Q574 PolarHBondContact O-N 3.45Å; M571-I576 WeakPolarHBondContact O-CB 3.32Å; M571-I576 PolarHBondContact O-N 3.49Å; M571-L578 HydrophobicContact CB-CD1 4.26Å; M571-L578 HydrophobicContact CE-CD1 4.15Å; M571-L578 HydrophobicContact CE-CD2 4.13Å; M571-L578 HydrophobicContact SD-CD1 4.3Å
572	Q	52.2	Low	43.8	Very low	143 Å²	143	105.7 Å²	105.7	67%	0.668	56%	0.556	S	S	*	*	H	α-helix	trans	-65.8	-36.3	173.1	-74.2	-178.3	-31.9	0	0	112.4	A568 Q574 G575	A568-Q572 PolarHBondContact O-N 3.22Å; A568-Q572 VanDerWaalsContact O-N 3.15Å; Q572-Q574 PolarHBondContact O-N 2.8Å; Q572-Q574 VanDerWaalsContact O-N 3.16Å; Q572-G575 PolarHBondContact O-N 2.83Å; Q572-G575 VanDerWaalsContact O-N 3.13Å
573	A	48.1	Very low	43.4	Very low	83 Å²	83	111 Å²	111	69%	0.686	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-10.1	175.4	0	0	0	0	0	114.6	E569 A570 M571	E569-A573 PolarHBondContact O-N 2.04Å; A570-A573 PolarHBondContact O-N 3.44Å; M571-A573 VanDerWaalsContact C-N 3.35Å
574	Q	44.2	Very low	43.1	Very low	153 Å²	153	115.3 Å²	115.3	72%	0.715	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	11.9	174.4	-66.1	-170.3	4	0	0	113.5	A570 M571 Q572 I576	A570-Q574 PolarHBondContact O-N 3.41Å; M571-Q574 PolarHBondContact O-N 3.45Å; Q572-Q574 PolarHBondContact O-N 2.8Å; Q572-Q574 VanDerWaalsContact O-N 3.16Å; Q574-I576 HydrophobicContact CB-CD1 4.11Å; Q574-I576 HydrophobicContact CB-CG1 4.15Å; Q574-I576 PolarHBondContact O-N 3.43Å
575	G	37.6	Very low	42.6	Very low	66 Å²	66	120.1 Å²	120.1	68%	0.68	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.3	10.5	179.5	0	0	0	0	0	114.5	Q572 K577	Q572-G575 PolarHBondContact O-N 2.83Å; Q572-G575 VanDerWaalsContact O-N 3.13Å; G575-K577 PolarHBondContact O-N 2.98Å
576	I	40	Very low	41.5	Very low	77 Å²	77	119.5 Å²	119.5	40%	0.395	61%	0.611	S	S	.	*			trans	-80.1	105.2	-178.9	-54	172.8	0	0	0	108.9	M571 Q574 L578	M571-I576 WeakPolarHBondContact O-CB 3.32Å; M571-I576 PolarHBondContact O-N 3.49Å; Q574-I576 HydrophobicContact CB-CD1 4.11Å; Q574-I576 HydrophobicContact CB-CG1 4.15Å; Q574-I576 PolarHBondContact O-N 3.43Å; I576-L578 PolarHBondContact O-N 3.16Å; I576-L578 VanDerWaalsContact O-N 3.16Å
577	K	39.4	Very low	40.4	Very low	205 Å²	205	127.5 Å²	127.5	89%	0.891	65%	0.646	S	S	*	*			trans	-73.9	99.6	173.9	-75.5	-176.3	175.9	179	0	110.8	G575	G575-K577 PolarHBondContact O-N 2.98Å
578	L	42.9	Very low	39.4	Very low	96 Å²	96	131.5 Å²	131.5	50%	0.503	67%	0.665	S	S	.	*			trans	-74.7	136.7	168.6	-74.2	162.7	0	0	0	110.7	M571 I576	M571-L578 HydrophobicContact CB-CD1 4.26Å; M571-L578 HydrophobicContact CE-CD1 4.15Å; M571-L578 HydrophobicContact CE-CD2 4.13Å; M571-L578 HydrophobicContact SD-CD1 4.3Å; I576-L578 PolarHBondContact O-N 3.16Å; I576-L578 VanDerWaalsContact O-N 3.16Å
579	H	37.6	Very low	38.4	Very low	154 Å²	154	134.9 Å²	134.9	71%	0.713	68%	0.681	S	S	*	*			trans	-93	152.4	-171	-139.6	-85.4	0	0	0	111.9	K581 D582	H579-K581 PolarHBondContact O-N 3.24Å; H579-D582 PolarHBondContact O-N 3.2Å
580	Q	35.1	Very low	37	Very low	188 Å²	188	137.7 Å²	137.7	88%	0.879	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	10.8	-165.4	-152.2	173	5.8	0	0	116.3
581	K	33.6	Very low	35.8	Very low	191 Å²	191	144.6 Å²	144.6	83%	0.83	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	-10.5	-179.1	-77.8	-173.9	173.6	-179.9	0	114.6	H579 F583	H579-K581 PolarHBondContact O-N 3.24Å; K581-F583 VanDerWaalsContact C-N 3.31Å; K581-F583 PolarHBondContact O-N 2.85Å
582	D	36.1	Very low	35	Very low	120 Å²	120	149.2 Å²	149.2	64%	0.642	75%	0.751	S	S	*	*	S	Bend	trans	-89.8	10.3	-171.9	-53.6	-39.1	0	0	0	113.9	H579	H579-D582 PolarHBondContact O-N 3.2Å
583	F	33.7	Very low	33.8	Very low	192 Å²	192	148.4 Å²	148.4	84%	0.842	76%	0.761	S	S	*	*			trans	-98.5	3.4	-162	-129.6	-93	0	0	0	116.2	K581	K581-F583 VanDerWaalsContact C-N 3.31Å; K581-F583 PolarHBondContact O-N 2.85Å
584	F	32.5	Very low	32.8	Very low	202 Å²	202	147.7 Å²	147.7	89%	0.886	76%	0.762	S	S	*	*	S	Bend	trans	-109.2	-1.6	-163.8	-131.3	-89.1	0	0	0	116.9
585	F	31.5	Very low	32.1	Very low	209 Å²	209	151.9 Å²	151.9	92%	0.917	77%	0.771	S	S	*	*	S	Bend	trans	-105.9	8.8	-171.1	-140.3	-95.8	0	0	0	115.7
586	L	26.7	Very low	31.6	Very low	117 Å²	117	155.5 Å²	155.5	61%	0.613	78%	0.779	S	S	*	*	S	Bend	trans	-120.8	40.1	-173.3	-84.3	165.2	0	0	0	114.2	M564	M564-L586 HydrophobicContact CE-CD2 4.34Å; M564-L586 HydrophobicContact SD-CD1 3.65Å; M564-L586 HydrophobicContact SD-CD2 3.67Å; M564-L586 HydrophobicContact SD-CG 4.34Å
587	K	26.4	Very low	31.1	Very low	194 Å²	194	157.2 Å²	157.2	84%	0.843	79%	0.79	S	S	*	*			trans	-134.2	140.3	164.4	-94.4	-177.1	173.1	178.9	0	110
588	T	27.4	Very low	30.8	Very low	135 Å²	135	154.1 Å²	154.1	83%	0.828	79%	0.792	S	S	*	*	S	Bend	trans	109	116	160.5	-37.4	0	0	0	0	115.7
589	V	28.9	Very low	30.3	Very low	116 Å²	116	155.7 Å²	155.7	70%	0.703	80%	0.801	S	S	*	*			trans	81.4	74.8	164.2	-147.5	0	0	0	0	120.7
590	T	25.9	Very low	29.8	Very low	133 Å²	133	159.2 Å²	159.2	82%	0.816	81%	0.808	S	S	*	*				-73.2	116.7	127	46.9	0	0	0	0	110.1
591	K	26.5	Very low	29.4	Very low	187 Å²	187	157.5 Å²	157.5	81%	0.813	80%	0.804	S	S	*	*			trans	171.4	154.5	151.8	-104.9	174.7	179.8	-176.7	0	112.4
592	L	27.6	Very low	29.1	Very low	172 Å²	172	156.4 Å²	156.4	90%	0.901	80%	0.802	S	S	*	*			trans	83.7	78.7	170.5	-59.9	168.3	0	0	0	117.3
593	S	28	Very low	28.6	Very low	127 Å²	127	155.4 Å²	155.4	89%	0.888	80%	0.804	S	S	*	*			trans	-59.5	147.8	142.9	171.1	0	0	0	0	111.2
594	G	26.3	Very low	28.4	Very low	68 Å²	68	152.9 Å²	152.9	70%	0.701	80%	0.798	S	S	*	*			trans	113.2	116.7	155.6	0	0	0	0	0	117.5
595	R	31.1	Very low	28.3	Very low	240 Å²	240	149 Å²	149	91%	0.906	78%	0.781	S	S	*	*			trans	-7.8	132.7	151.5	-93.7	174.6	166.1	158.5	-3.2	117.1
596	V	27.4	Very low	28.1	Very low	142 Å²	142	149.7 Å²	149.7	86%	0.861	78%	0.777	S	S	*	*				-152.8	139.3	117.5	176.7	0	0	0	0	109
597	D	29.6	Very low	28.3	Very low	114 Å²	114	150.8 Å²	150.8	61%	0.61	79%	0.793	S	S	*	*			trans	-66.6	136	171.7	-92.6	-88.8	0	0	0	113.5	N599	D597-N599 PolarHBondContact OD1-ND2 2.94Å
598	C	32.9	Very low	28.6	Very low	140 Å²	140	145.1 Å²	145.1	95%	0.946	78%	0.778	S	S	*	*			trans	-128.3	73.5	154.2	-88.4	0	0	0	0	109.5
599	N	31.5	Very low	28.7	Very low	129 Å²	129	149.2 Å²	149.2	69%	0.69	78%	0.78	S	S	*	*			trans	-89.1	150.2	177.3	-109.2	-57.4	0	0	0	111.9	D597	D597-N599 PolarHBondContact OD1-ND2 2.94Å
600	R	27.6	Very low	28.7	Very low	227 Å²	227	151.5 Å²	151.5	86%	0.857	79%	0.786	S	S	*	*			trans	88.6	131.1	167.5	-59.6	-178.4	173.7	178.7	-2.2	119.9
601	L	26.1	Very low	28.9	Very low	152 Å²	152	148.3 Å²	148.3	80%	0.796	78%	0.78	S	S	*	*			trans	74.7	96.8	150.6	-71.3	158.6	0	0	0	118.7
602	H	27.1	Very low	29.1	Very low	168 Å²	168	149.5 Å²	149.5	78%	0.778	79%	0.785	S	S	*	*			trans	44.5	111.5	137.6	-83.3	-87	0	0	0	119.5
603	S	26.7	Very low	29.1	Very low	99 Å²	99	145.6 Å²	145.6	69%	0.692	78%	0.778	S	S	*	*			trans	75.2	90.5	138.7	-56.8	0	0	0	0	118.4
604	I	29.3	Very low	29	Very low	140 Å²	140	151 Å²	151	72%	0.718	78%	0.781	S	S	*	*			trans	102.4	91.3	135.2	-59.2	175.3	0	0	0	118.1
605	K	30.4	Very low	29.2	Very low	120 Å²	120	151.3 Å²	151.3	52%	0.522	78%	0.784	S	S	.	*				64.1	105.7	128.9	-61.2	177.4	169	103.4	0	118.9	D619	K605-D619 IonicContact NZ-OD2 3.2Å; K605-D619 PolarHBondContact NZ-OD2 3.27Å
606	R	27.7	Very low	29.3	Very low	223 Å²	223	145.8 Å²	145.8	84%	0.842	78%	0.782	S	S	*	*				-174.6	109.6	108.7	-100.3	173.2	-176.2	179	3.6	115.1
607	C	29.7	Very low	29.7	Very low	140 Å²	140	146.7 Å²	146.7	95%	0.946	77%	0.774	S	S	*	*	S	Bend	trans	-141.9	130.7	138.3	-91.4	0	0	0	0	105.6
608	S	33	Very low	29.8	Very low	76 Å²	76	150.4 Å²	150.4	53%	0.531	79%	0.79	S	S	.	*			trans	-141.1	158.9	-148.3	-44.7	0	0	0	0	116
609	Y	30.3	Very low	29.8	Very low	221 Å²	221	149 Å²	149	87%	0.867	77%	0.773	S	S	*	*			trans	78.5	148.6	153.1	-71.5	-50.6	0	0	0	118.6
610	I	28.8	Very low	29.8	Very low	163 Å²	163	149.7 Å²	149.7	84%	0.836	78%	0.777	S	S	*	*			cis	-126.5	144.5	-1.5	-51.2	168.2	0	0	0	110.2
611	G	30.2	Very low	30.2	Very low	67 Å²	67	147 Å²	147	69%	0.691	77%	0.774	S	S	*	*			trans	-150.4	127.3	156.8	0	0	0	0	0	112.2
612	K	30.4	Very low	30.5	Very low	211 Å²	211	143.4 Å²	143.4	92%	0.917	76%	0.759	S	S	*	*			trans	60.5	144	170.8	-64.4	-179.5	179.3	177.4	0	118.8
613	A	26.6	Very low	31	Very low	90 Å²	90	144.8 Å²	144.8	74%	0.744	77%	0.765	S	S	*	*	S	Bend	trans	-76.9	140	169.5	0	0	0	0	0	111.2
614	Y	27.4	Very low	32	Very low	242 Å²	242	148 Å²	148	95%	0.949	78%	0.775	S	S	*	*	S	Bend	trans	42.4	109.6	162.3	-80.9	-92.4	0	0	0	119.1
615	G	29.8	Very low	33.2	Very low	74 Å²	74	143.5 Å²	143.5	76%	0.763	75%	0.751	S	S	*	*			trans	161.5	75.6	166.9	0	0	0	0	0	114.6
616	S	33.5	Very low	34.8	Very low	123 Å²	123	142.1 Å²	142.1	86%	0.86	75%	0.75	S	S	*	*			trans	-1.4	131.1	165.2	47.7	0	0	0	0	120.7
617	K	36.1	Very low	36.9	Very low	162 Å²	162	131.5 Å²	131.5	70%	0.704	71%	0.71	S	S	*	*			trans	-57.8	152.1	172.4	-57.7	162.3	179	156.1	0	114.4
618	M	31.9	Very low	39.2	Very low	191 Å²	191	128.1 Å²	128.1	94%	0.941	69%	0.688	S	S	*	*				-147.8	134.8	125.2	-144.1	159.5	117.2	0	0	108.7
619	D	32.1	Very low	41.6	Very low	110 Å²	110	127.3 Å²	127.3	59%	0.588	68%	0.681	S	S	*	*			trans	-85.8	141.5	-176.6	-62.7	-50.3	0	0	0	109.4	K605	K605-D619 IonicContact NZ-OD2 3.2Å; K605-D619 PolarHBondContact NZ-OD2 3.27Å
620	D	32.4	Very low	44.1	Very low	144 Å²	144	117 Å²	117	77%	0.77	64%	0.641	S	S	*	*				-176.4	147.8	129.6	-109.7	-22.3	0	0	0	116.5
621	E	35	Very low	46.8	Very low	172 Å²	172	110 Å²	110	80%	0.804	61%	0.607	S	S	*	*			trans	28.8	95.5	156.6	-60.2	-176.4	158.1	0	0	120.2
622	T	33.1	Very low	49.5	Very low	76 Å²	76	109.9 Å²	109.9	47%	0.466	59%	0.586	S	S	.	*			trans	-161.6	58	155.7	29.6	0	0	0	0	112.9	I625	T622-I625 HydrophobicContact CG2-CD1 3.5Å; T622-I625 VanDerWaalsContact CG2-CD1 3.5Å
623	E	36.7	Very low	52	Low	197 Å²	197	101.6 Å²	101.6	92%	0.921	55%	0.549	S	S	*	.			trans	-91.3	141.5	166.8	-72.9	-168.9	151.7	0	0	111.3
624	N	48.2	Very low	54.6	Low	167 Å²	167	98.9 Å²	98.9	89%	0.893	52%	0.522	S	S	*	.			trans	72.6	46.1	175.7	-120.5	9	0	0	0	118.5
625	I	54.3	Low	56.7	Low	44 Å²	44	95.9 Å²	95.9	23%	0.226	51%	0.509	C	S	.	.			trans	-93.2	98.5	166.9	-61.8	158.7	0	0	0	110.2	T622 Y633 A653	T622-I625 HydrophobicContact CG2-CD1 3.5Å; T622-I625 VanDerWaalsContact CG2-CD1 3.5Å; I625-Y633 HydrophobicContact CB-CD2 4.41Å; I625-Y633 HydrophobicContact CD1-CD1 3.7Å; I625-Y633 HydrophobicContact CD1-CD2 4.34Å; I625-Y633 HydrophobicContact CD1-CE1 3.33Å; I625-Y633 HydrophobicContact CD1-CE2 4.03Å; I625-Y633 HydrophobicContact CD1-CG 4.16Å; I625-Y633 VanDerWaalsContact CD1-CZ 3.5Å; I625-Y633 HydrophobicContact CG1-CD1 4.37Å; I625-Y633 HydrophobicContact CG1-CD2 4.12Å; I625-Y633 HydrophobicContact CG1-CE1 4.05Å; I625-Y633 HydrophobicContact CG1-CE2 3.78Å; I625-Y633 HydrophobicContact CG1-CG 4.37Å; I625-Y633 HydrophobicContact CG2-CD1 4.11Å; I625-Y633 HydrophobicContact CG2-CD2 3.4Å; I625-Y633 VanDerWaalsContact CG2-CD2 3.4Å; I625-Y633 HydrophobicContact CG2-CE2 3.96Å; I625-Y633 HydrophobicContact CG2-CG 3.47Å; I625-Y633 VanDerWaalsContact CG2-CG 3.47Å; I625-A653 WeakPolarHBondContact O-CB 3.05Å
626	D	63.9	Low	58.5	Low	91 Å²	91	102.8 Å²	102.8	49%	0.487	51%	0.512	S	S	.	.			trans	-111.5	67.1	172.8	-166.8	16.3	0	0	0	111.8	S628 K652	D626-S628 PolarHBondContact O-N 2.74Å; D626-K652 WeakPolarHBondContact OD1-CD 3.43Å; D626-K652 WeakPolarHBondContact OD1-CE 3Å; D626-K652 IonicContact OD1-NZ 2.7Å; D626-K652 PolarHBondContact OD1-NZ 3.05Å; D626-K652 IonicContact OD2-NZ 3.61Å; D626-K652 PolarHBondContact OD2-NZ 3.13Å
627	C	71.2	Confident	60.3	Low	1 Å²	1	102.4 Å²	102.4	1%	0.007	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-66.7	120.8	167.7	-60.4	0	0	0	0	109.4	S631 Y633 C640 K652 A653	C627-S631 WeakPolarHBondContact CB-OG 3.21Å; C627-Y633 VanDerWaalsContact SG-CB 3.57Å; C627-C640 WeakPolarHBondContact CA-SG 3.27Å; C627-C640 HydrophobicContact CB-CB 3.86Å; C627-C640 WeakPolarHBondContact CB-SG 3.07Å; C627-C640 WeakPolarHBondContact SG-CB 3.42Å; C627-C640 CovalentContact SG-SG 2.04Å; C627-C640 PolarHBondContact SG-SG 2.76Å; C627-K652 WeakPolarHBondContact O-CA 3.08Å; C627-A653 PolarHBondContact O-N 3.48Å
628	S	79.3	Confident	61.9	Low	69 Å²	69	96.8 Å²	96.8	48%	0.483	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-64.9	155.8	-179.5	-71.1	0	0	0	0	112.3	D626 G630 S631	D626-S628 PolarHBondContact O-N 2.74Å; S628-G630 PolarHBondContact O-N 3.48Å; S628-S631 PolarHBondContact N-OG 3.25Å; S628-S631 PolarHBondContact O-N 3.29Å; S628-S631 PolarHBondContact O-OG 3.21Å
629	P	82.4	Confident	64	Low	58 Å²	58	92.8 Å²	92.8	38%	0.377	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	134.9	170.1	-25	35.7	0	0	0	110.7	Q649 K652	P629-Q649 CarbonylContact C-O 3.46Å; P629-Q649 WeakPolarHBondContact CA-O 3.27Å; P629-K652 HydrophobicContact CG-CG 4.19Å
630	G	82.2	Confident	66.5	Low	4 Å²	4	90.6 Å²	90.6	4%	0.041	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.3	1.8	-166.5	0	0	0	0	0	114.8	S628 S642 C643 Q649 G672	S628-G630 PolarHBondContact O-N 3.48Å; G630-S642 WeakPolarHBondContact O-CA 3.29Å; G630-C643 PolarHBondContact O-N 2.8Å; G630-Q649 PolarHBondContact N-O 3.21Å; G630-G672 VanDerWaalsContact CA-O 3.26Å; G630-G672 WeakPolarHBondContact CA-O 3.41Å; G630-G672 WeakPolarHBondContact O-CA 3.23Å
631	S	86.8	Confident	68.8	Low	16 Å²	16	87.3 Å²	87.3	11%	0.112	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	156.5	176.5	63.6	0	0	0	0	113.6	C627 S628 F641	C627-S631 WeakPolarHBondContact CB-OG 3.21Å; S628-S631 PolarHBondContact N-OG 3.25Å; S628-S631 PolarHBondContact O-N 3.29Å; S628-S631 PolarHBondContact O-OG 3.21Å; S631-F641 CarbonylContact C-O 3.5Å; S631-F641 WeakPolarHBondContact CA-O 3.49Å; S631-F641 WeakPolarHBondContact CB-O 3.39Å
632	Y	87	Confident	71.2	Confident	65 Å²	65	82.5 Å²	82.5	26%	0.255	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	149.6	175.5	77.9	-87.1	0	0	0	111.2	D634 C640 F641 S654	Y632-D634 HydrophobicContact CE2-CB 4.12Å; Y632-C640 CarbonylContact O-C 3.48Å; Y632-C640 WeakPolarHBondContact O-CA 3.47Å; Y632-F641 HydrophobicContact CD1-CB 3.93Å; Y632-F641 VanDerWaalsContact CD1-O 3.28Å; Y632-F641 WeakPolarHBondContact CD1-O 3.49Å; Y632-F641 HydrophobicContact CE1-CB 3.39Å; Y632-F641 HydrophobicContact CE1-CG 4.41Å; Y632-F641 HydrophobicContact CE2-CB 4.25Å; Y632-F641 PolarHBondContact N-O 2.02Å; Y632-F641 PolarHBondContact O-N 2.91Å; Y632-S654 CarbonylContact C-O 3.6Å; Y632-S654 WeakPolarHBondContact CA-O 3.48Å
633	Y	83.1	Confident	73.5	Confident	38 Å²	38	78.9 Å²	78.9	15%	0.149	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	123.3	176.6	-173.7	-109.5	0	0	0	111.8	I625 C627 R635 S654 L655	I625-Y633 HydrophobicContact CB-CD2 4.41Å; I625-Y633 HydrophobicContact CD1-CD1 3.7Å; I625-Y633 HydrophobicContact CD1-CD2 4.34Å; I625-Y633 HydrophobicContact CD1-CE1 3.33Å; I625-Y633 HydrophobicContact CD1-CE2 4.03Å; I625-Y633 HydrophobicContact CD1-CG 4.16Å; I625-Y633 VanDerWaalsContact CD1-CZ 3.5Å; I625-Y633 HydrophobicContact CG1-CD1 4.37Å; I625-Y633 HydrophobicContact CG1-CD2 4.12Å; I625-Y633 HydrophobicContact CG1-CE1 4.05Å; I625-Y633 HydrophobicContact CG1-CE2 3.78Å; I625-Y633 HydrophobicContact CG1-CG 4.37Å; I625-Y633 HydrophobicContact CG2-CD1 4.11Å; I625-Y633 HydrophobicContact CG2-CD2 3.4Å; I625-Y633 VanDerWaalsContact CG2-CD2 3.4Å; I625-Y633 HydrophobicContact CG2-CE2 3.96Å; I625-Y633 HydrophobicContact CG2-CG 3.47Å; I625-Y633 VanDerWaalsContact CG2-CG 3.47Å; C627-Y633 VanDerWaalsContact SG-CB 3.57Å; Y633-R635 HydrophobicContact CD1-CG 3.91Å; Y633-R635 HydrophobicContact CE1-CB 4.44Å; Y633-R635 HydrophobicContact CE1-CG 3.87Å; Y633-S654 PolarHBondContact N-O 3.44Å; Y633-L655 HydrophobicContact CD1-CD2 4.29Å
634	D	80.5	Confident	75.3	Confident	33 Å²	33	72.8 Å²	72.8	18%	0.176	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	104.3	170.9	-169.4	-20.4	0	0	0	110.8	Y632 R636 H637 G638 L639 F641	Y632-D634 HydrophobicContact CE2-CB 4.12Å; D634-R636 PolarHBondContact O-N 3.37Å; D634-R636 VanDerWaalsContact O-N 3.1Å; D634-R636 WeakPolarHBondContact OD1-CA 3.42Å; D634-R636 VanDerWaalsContact OD1-CB 3.23Å; D634-R636 WeakPolarHBondContact OD1-CB 3.29Å; D634-R636 PolarHBondContact OD1-N 3.44Å; D634-H637 HydrophobicContact CB-CB 4.44Å; D634-H637 VanDerWaalsContact CG-ND1 3.33Å; D634-H637 PolarHBondContact O-N 2.95Å; D634-H637 VanDerWaalsContact O-N 3.14Å; D634-H637 IonicContact OD1-ND1 2.94Å; D634-H637 IonicContact OD2-CE1 3.02Å; D634-H637 IonicContact OD2-CG 2.87Å; D634-H637 IonicContact OD2-ND1 3.82Å; D634-H637 PolarHBondContact OD2-ND1 2.82Å; D634-G638 PolarHBondContact O-N 2.04Å; D634-L639 PolarHBondContact N-O 3.29Å; D634-F641 HydrophobicContact CB-CD2 3.56Å; D634-F641 HydrophobicContact CB-CE2 3.58Å
635	R	71	Confident	76.4	Confident	178 Å²	178	70.9 Å²	70.9	67%	0.672	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-21.2	175.4	-73.2	-177.6	166.1	-153	-9.4	114.4	Y633 L655	Y633-R635 HydrophobicContact CD1-CG 3.91Å; Y633-R635 HydrophobicContact CE1-CB 4.44Å; Y633-R635 HydrophobicContact CE1-CG 3.87Å; R635-L655 HydrophobicContact CG-CD2 4.16Å
636	R	68	Low	77.1	Confident	220 Å²	220	69.6 Å²	69.6	83%	0.83	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-21.3	-178.3	-154.5	-174.3	-59.5	-133.5	1.2	112.7	D634	D634-R636 PolarHBondContact O-N 3.37Å; D634-R636 VanDerWaalsContact O-N 3.1Å; D634-R636 WeakPolarHBondContact OD1-CA 3.42Å; D634-R636 VanDerWaalsContact OD1-CB 3.23Å; D634-R636 WeakPolarHBondContact OD1-CB 3.29Å; D634-R636 PolarHBondContact OD1-N 3.44Å
637	H	70.9	Confident	78	Confident	115 Å²	115	66.5 Å²	66.5	53%	0.532	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	-12	-177.6	-61.8	110.7	0	0	0	113.4	D634 L639 F641	D634-H637 HydrophobicContact CB-CB 4.44Å; D634-H637 VanDerWaalsContact CG-ND1 3.33Å; D634-H637 PolarHBondContact O-N 2.95Å; D634-H637 VanDerWaalsContact O-N 3.14Å; D634-H637 IonicContact OD1-ND1 2.94Å; D634-H637 IonicContact OD2-CE1 3.02Å; D634-H637 IonicContact OD2-CG 2.87Å; D634-H637 IonicContact OD2-ND1 3.82Å; D634-H637 PolarHBondContact OD2-ND1 2.82Å; H637-L639 VanDerWaalsContact C-N 3.26Å; H637-L639 HydrophobicContact CB-CB 4.46Å; H637-L639 HydrophobicContact CB-CD1 4.42Å; H637-L639 PolarHBondContact O-N 3.41Å; H637-F641 HydrophobicContact CB-CE2 4Å; H637-F641 HydrophobicContact CB-CZ 4.3Å
638	G	70.7	Confident	78.6	Confident	44 Å²	44	68.3 Å²	68.3	45%	0.454	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	17.5	-177.6	0	0	0	0	0	114.1	D634	D634-G638 PolarHBondContact O-N 2.04Å
639	L	75.9	Confident	78.9	Confident	106 Å²	106	65.5 Å²	65.5	56%	0.555	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.5	150.5	-167.8	-70.6	169.2	0	0	0	112.3	D634 H637 F641	D634-L639 PolarHBondContact N-O 3.29Å; H637-L639 VanDerWaalsContact C-N 3.26Å; H637-L639 HydrophobicContact CB-CB 4.46Å; H637-L639 HydrophobicContact CB-CD1 4.42Å; H637-L639 PolarHBondContact O-N 3.41Å; L639-F641 HydrophobicContact CB-CD2 4.32Å; L639-F641 HydrophobicContact CB-CE2 3.82Å; L639-F641 HydrophobicContact CB-CZ 4.48Å
640	C	83.2	Confident	78.7	Confident	65 Å²	65	65.6 Å²	65.6	44%	0.439	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	123.7	167.8	-60.3	0	0	0	0	110.3	C627 Y632	C627-C640 WeakPolarHBondContact CA-SG 3.27Å; C627-C640 HydrophobicContact CB-CB 3.86Å; C627-C640 WeakPolarHBondContact CB-SG 3.07Å; C627-C640 WeakPolarHBondContact SG-CB 3.42Å; C627-C640 CovalentContact SG-SG 2.04Å; C627-C640 PolarHBondContact SG-SG 2.76Å; Y632-C640 CarbonylContact O-C 3.48Å; Y632-C640 WeakPolarHBondContact O-CA 3.47Å
641	F	82.2	Confident	78.4	Confident	75 Å²	75	70.8 Å²	70.8	33%	0.329	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.7	177.1	-75.7	-95.3	0	0	0	110.8	S631 Y632 D634 H637 L639	S631-F641 CarbonylContact C-O 3.5Å; S631-F641 WeakPolarHBondContact CA-O 3.49Å; S631-F641 WeakPolarHBondContact CB-O 3.39Å; Y632-F641 HydrophobicContact CD1-CB 3.93Å; Y632-F641 VanDerWaalsContact CD1-O 3.28Å; Y632-F641 WeakPolarHBondContact CD1-O 3.49Å; Y632-F641 HydrophobicContact CE1-CB 3.39Å; Y632-F641 HydrophobicContact CE1-CG 4.41Å; Y632-F641 HydrophobicContact CE2-CB 4.25Å; Y632-F641 PolarHBondContact N-O 2.02Å; Y632-F641 PolarHBondContact O-N 2.91Å; D634-F641 HydrophobicContact CB-CD2 3.56Å; D634-F641 HydrophobicContact CB-CE2 3.58Å; H637-F641 HydrophobicContact CB-CE2 4Å; H637-F641 HydrophobicContact CB-CZ 4.3Å; L639-F641 HydrophobicContact CB-CD2 4.32Å; L639-F641 HydrophobicContact CB-CE2 3.82Å; L639-F641 HydrophobicContact CB-CZ 4.48Å
642	S	83.7	Confident	77.8	Confident	71 Å²	71	75.5 Å²	75.5	50%	0.497	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	142.3	175.8	-44	0	0	0	0	111.5	G630 S644	G630-S642 WeakPolarHBondContact O-CA 3.29Å; S642-S644 PolarHBondContact O-N 2.03Å
643	C	81.5	Confident	77	Confident	0 Å²	0	75 Å²	75	0%	0	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-59.4	129.8	174.9	-65.2	0	0	0	0	111.6	G630 Q649 C657 G672	G630-C643 PolarHBondContact O-N 2.8Å; C643-Q649 WeakPolarHBondContact SG-CB 3.02Å; C643-C657 WeakPolarHBondContact CA-SG 3.26Å; C643-C657 HydrophobicContact CB-CB 3.78Å; C643-C657 WeakPolarHBondContact CB-SG 3.19Å; C643-C657 WeakPolarHBondContact SG-CB 3.05Å; C643-C657 CovalentContact SG-SG 2.04Å; C643-C657 PolarHBondContact SG-SG 3Å; C643-G672 PolarHBondContact O-N 3.39Å
644	S	76	Confident	76.8	Confident	69 Å²	69	74 Å²	74	48%	0.483	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-79.6	159	-177.7	54.1	0	0	0	0	111.4	S642 G646 T647	S642-S644 PolarHBondContact O-N 2.03Å; S644-G646 PolarHBondContact O-N 3.28Å; S644-T647 PolarHBondContact N-OG1 3.31Å; S644-T647 PolarHBondContact O-N 2.76Å; S644-T647 PolarHBondContact O-OG1 3.01Å
645	R	70.1	Confident	77	Confident	127 Å²	127	77.3 Å²	77.3	48%	0.479	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	129	-174.9	-78.5	-177.8	177.7	147.7	-3.8	112.7	T666 R668	R645-T666 WeakPolarHBondContact CA-OG1 3.05Å; R645-R668 PolarHBondContact NE-O 2.93Å; R645-R668 PolarHBondContact NH2-O 2.88Å
646	G	70	Confident	77.5	Confident	16 Å²	16	71.7 Å²	71.7	17%	0.165	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.2	7.7	-173.2	0	0	0	0	0	114.1	S644 P659 C660 T666	S644-G646 PolarHBondContact O-N 3.28Å; G646-P659 WeakPolarHBondContact O-CA 3.26Å; G646-C660 PolarHBondContact O-N 3Å; G646-T666 PolarHBondContact N-OG1 2.04Å
647	T	81.6	Confident	78.4	Confident	27 Å²	27	62.6 Å²	62.6	17%	0.166	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	153.7	172.7	71.9	0	0	0	0	111.8	S644 C657 M658 T666	S644-T647 PolarHBondContact N-OG1 3.31Å; S644-T647 PolarHBondContact O-N 2.76Å; S644-T647 PolarHBondContact O-OG1 3.01Å; T647-C657 WeakPolarHBondContact OG1-CB 3.43Å; T647-M658 CarbonylContact C-O 3.36Å; T647-M658 WeakPolarHBondContact CA-O 3.06Å; T647-M658 VanDerWaalsContact CB-O 3.29Å; T647-M658 WeakPolarHBondContact CB-O 3.38Å; T647-T666 WeakPolarHBondContact O-CG2 3.02Å
648	Y	84.6	Confident	79	Confident	38 Å²	38	60.5 Å²	60.5	15%	0.149	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	161.1	-179	72	-79.6	0	0	0	111.3	P650 M658 P659 A673 V676	Y648-P650 HydrophobicContact CE2-CG 4.48Å; Y648-M658 HydrophobicContact CD1-CB 4.33Å; Y648-M658 WeakPolarHBondContact CD1-O 3.39Å; Y648-M658 HydrophobicContact CD2-CE 4.49Å; Y648-M658 HydrophobicContact CE1-CB 3.93Å; Y648-M658 HydrophobicContact CE2-CE 3.8Å; Y648-M658 PolarHBondContact N-O 3.03Å; Y648-M658 PolarHBondContact O-N 2.82Å; Y648-P659 WeakPolarHBondContact CE1-O 3.31Å; Y648-A673 CarbonylContact C-O 3.56Å; Y648-A673 WeakPolarHBondContact CA-O 3.27Å; Y648-A673 WeakPolarHBondContact CB-O 3.49Å; Y648-V676 HydrophobicContact CD2-CB 4.27Å; Y648-V676 HydrophobicContact CE1-CB 4.19Å; Y648-V676 HydrophobicContact CE1-CG2 3.97Å; Y648-V676 HydrophobicContact CE2-CB 3.73Å; Y648-V676 HydrophobicContact CE2-CG2 4.36Å
649	Q	85.8	Confident	79.5	Confident	10 Å²	10	62.9 Å²	62.9	5%	0.047	36%	0.359	C	S	.	.			trans	-150.1	103.3	177.1	-176.5	49.6	-90.3	0	0	113.3	P629 G630 C643 L651 S654 A656 A673	P629-Q649 CarbonylContact C-O 3.46Å; P629-Q649 WeakPolarHBondContact CA-O 3.27Å; G630-Q649 PolarHBondContact N-O 3.21Å; C643-Q649 WeakPolarHBondContact SG-CB 3.02Å; Q649-L651 WeakPolarHBondContact CG-O 3.13Å; Q649-S654 VanDerWaalsContact CD-CB 3.48Å; Q649-S654 PolarHBondContact NE2-OG 3.4Å; Q649-S654 PolarHBondContact OE1-OG 2.77Å; Q649-A656 PolarHBondContact NE2-O 2.91Å; Q649-A673 PolarHBondContact N-O 3.22Å
650	P	77.9	Confident	79.4	Confident	61 Å²	61	58.7 Å²	58.7	40%	0.396	34%	0.339	S	S	.	.			trans	-76.2	-18.8	176.2	29	-34.1	0	0	0	114.7	Y648 M658 S674	Y648-P650 HydrophobicContact CE2-CG 4.48Å; P650-M658 HydrophobicContact CG-CE 3.71Å; P650-S674 WeakPolarHBondContact CA-O 3.47Å; P650-S674 VanDerWaalsContact CB-O 3.29Å; P650-S674 WeakPolarHBondContact CB-O 3.45Å
651	L	76.6	Confident	79	Confident	112 Å²	112	58.7 Å²	58.7	59%	0.586	34%	0.338	S	S	*	.	S	Bend	trans	-98.9	129.8	-172.1	-61.7	173.4	0	0	0	112.4	Q649 S654	Q649-L651 WeakPolarHBondContact CG-O 3.13Å; L651-S654 WeakPolarHBondContact CB-OG 3.47Å; L651-S654 PolarHBondContact O-OG 2.96Å
652	K	74.1	Confident	77.8	Confident	116 Å²	116	63.5 Å²	63.5	50%	0.504	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	152.1	167.8	-79.6	-177.7	159.9	-127.2	0	112	D626 C627 P629 S654	D626-K652 WeakPolarHBondContact OD1-CD 3.43Å; D626-K652 WeakPolarHBondContact OD1-CE 3Å; D626-K652 IonicContact OD1-NZ 2.7Å; D626-K652 PolarHBondContact OD1-NZ 3.05Å; D626-K652 IonicContact OD2-NZ 3.61Å; D626-K652 PolarHBondContact OD2-NZ 3.13Å; C627-K652 WeakPolarHBondContact O-CA 3.08Å; P629-K652 HydrophobicContact CG-CG 4.19Å; K652-S654 PolarHBondContact O-N 3.47Å; K652-S654 VanDerWaalsContact O-N 3.16Å
653	A	69.4	Low	76.5	Confident	53 Å²	53	70.9 Å²	70.9	44%	0.438	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	27.4	173.8	0	0	0	0	0	115.6	I625 C627	I625-A653 WeakPolarHBondContact O-CB 3.05Å; C627-A653 PolarHBondContact O-N 3.48Å
654	S	80	Confident	75.8	Confident	18 Å²	18	73.2 Å²	73.2	13%	0.126	39%	0.39	C	S	.	.			trans	-75	148.2	179.4	-66.7	0	0	0	0	113	Y632 Y633 Q649 L651 K652	Y632-S654 CarbonylContact C-O 3.6Å; Y632-S654 WeakPolarHBondContact CA-O 3.48Å; Y633-S654 PolarHBondContact N-O 3.44Å; Q649-S654 VanDerWaalsContact CD-CB 3.48Å; Q649-S654 PolarHBondContact NE2-OG 3.4Å; Q649-S654 PolarHBondContact OE1-OG 2.77Å; L651-S654 WeakPolarHBondContact CB-OG 3.47Å; L651-S654 PolarHBondContact O-OG 2.96Å; K652-S654 PolarHBondContact O-N 3.47Å; K652-S654 VanDerWaalsContact O-N 3.16Å
655	L	83	Confident	75.1	Confident	103 Å²	103	76.6 Å²	76.6	54%	0.539	39%	0.392	S	S	.	.	S	Bend	trans	-92.3	-5.5	178	-67	170	0	0	0	114.4	Y633 R635	Y633-L655 HydrophobicContact CD1-CD2 4.29Å; R635-L655 HydrophobicContact CG-CD2 4.16Å
656	A	83	Confident	74.6	Confident	60 Å²	60	70.6 Å²	70.6	50%	0.496	37%	0.37	S	S	.	.	S	Bend	trans	-156.6	166.6	177.4	0	0	0	0	0	110.8	Q649	Q649-A656 PolarHBondContact NE2-O 2.91Å
657	C	85.6	Confident	73.8	Confident	28 Å²	28	71.4 Å²	71.4	19%	0.189	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-99.3	149.9	170.3	-59.6	0	0	0	0	111.4	C643 T647	C643-C657 WeakPolarHBondContact CA-SG 3.26Å; C643-C657 HydrophobicContact CB-CB 3.78Å; C643-C657 WeakPolarHBondContact CB-SG 3.19Å; C643-C657 WeakPolarHBondContact SG-CB 3.05Å; C643-C657 CovalentContact SG-SG 2.04Å; C643-C657 PolarHBondContact SG-SG 3Å; T647-C657 WeakPolarHBondContact OG1-CB 3.43Å
658	M	84.5	Confident	72.3	Confident	71 Å²	71	77 Å²	77	35%	0.35	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	139.4	176.1	-68.4	-173	-79.7	0	0	111	T647 Y648 P650	T647-M658 CarbonylContact C-O 3.36Å; T647-M658 WeakPolarHBondContact CA-O 3.06Å; T647-M658 VanDerWaalsContact CB-O 3.29Å; T647-M658 WeakPolarHBondContact CB-O 3.38Å; Y648-M658 HydrophobicContact CD1-CB 4.33Å; Y648-M658 WeakPolarHBondContact CD1-O 3.39Å; Y648-M658 HydrophobicContact CD2-CE 4.49Å; Y648-M658 HydrophobicContact CE1-CB 3.93Å; Y648-M658 HydrophobicContact CE2-CE 3.8Å; Y648-M658 PolarHBondContact N-O 3.03Å; Y648-M658 PolarHBondContact O-N 2.82Å; P650-M658 HydrophobicContact CG-CE 3.71Å
659	P	81.2	Confident	70.5	Confident	95 Å²	95	78.8 Å²	78.8	62%	0.617	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.4	146.8	175.8	30.1	-34.6	0	0	0	112.2	G646 Y648	G646-P659 WeakPolarHBondContact O-CA 3.26Å; Y648-P659 WeakPolarHBondContact CE1-O 3.31Å
660	C	74.4	Confident	69	Low	17 Å²	17	80.6 Å²	80.6	12%	0.115	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-58.4	152.9	165	-73.8	0	0	0	0	110.6	G646 I664 T666 C679	G646-C660 PolarHBondContact O-N 3Å; C660-I664 WeakPolarHBondContact CB-O 3.35Å; C660-T666 VanDerWaalsContact SG-CG2 3.59Å; C660-T666 PolarHBondContact SG-N 2.89Å; C660-C679 HydrophobicContact CB-CB 3.89Å; C660-C679 WeakPolarHBondContact CB-SG 3.32Å; C660-C679 WeakPolarHBondContact SG-CB 3.39Å; C660-C679 CovalentContact SG-SG 2.05Å; C660-C679 PolarHBondContact SG-SG 3.26Å
661	P	74.1	Confident	68.1	Low	65 Å²	65	85.2 Å²	85.2	42%	0.422	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-59.9	166.2	172.6	-18.3	30.2	0	0	0	112.6	R663 I664 V676	P661-R663 PolarHBondContact O-N 3.35Å; P661-I664 HydrophobicContact CB-CD1 3.92Å; P661-I664 HydrophobicContact CB-CG1 4.06Å; P661-I664 HydrophobicContact CG-CD1 3.89Å; P661-I664 HydrophobicContact CG-CG1 4.38Å; P661-I664 WeakPolarHBondContact O-CG1 2.96Å; P661-I664 PolarHBondContact O-N 2.73Å; P661-V676 HydrophobicContact CG-CG2 4.31Å
662	E	57.7	Low	67.5	Low	177 Å²	177	80.7 Å²	80.7	83%	0.827	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	140.8	-176.9	-70.6	-157.4	165.2	0	0	113.2	I664	E662-I664 PolarHBondContact O-N 3.28Å
663	R	56.4	Low	67.3	Low	226 Å²	226	75.2 Å²	75.2	85%	0.853	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	-12.8	178.6	-50.3	-177.2	-176.4	-135.3	-3.4	116.9	P661	P661-R663 PolarHBondContact O-N 3.35Å
664	I	65.2	Low	67.8	Low	48 Å²	48	75.2 Å²	75.2	25%	0.246	39%	0.385	C	S	.	.			trans	-100.4	152.9	174.2	30.2	-178.5	0	0	0	112.2	C660 P661 E662 C679 A680 E681	C660-I664 WeakPolarHBondContact CB-O 3.35Å; P661-I664 HydrophobicContact CB-CD1 3.92Å; P661-I664 HydrophobicContact CB-CG1 4.06Å; P661-I664 HydrophobicContact CG-CD1 3.89Å; P661-I664 HydrophobicContact CG-CG1 4.38Å; P661-I664 WeakPolarHBondContact O-CG1 2.96Å; P661-I664 PolarHBondContact O-N 2.73Å; E662-I664 PolarHBondContact O-N 3.28Å; I664-C679 HydrophobicContact CB-CB 4.2Å; I664-C679 HydrophobicContact CD1-CB 4.37Å; I664-A680 VanDerWaalsContact CG2-C 3.42Å; I664-E681 HydrophobicContact CG2-CB 4.32Å; I664-E681 HydrophobicContact CG2-CG 3.57Å
665	R	62.5	Low	67.5	Low	140 Å²	140	77.1 Å²	77.1	53%	0.528	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	150.7	176.3	-72	-168.3	176	-159.5	-3.6	110.5	N667 C679 A680 F693	R665-N667 PolarHBondContact O-N 3.02Å; R665-C679 CarbonylContact O-C 3.56Å; R665-C679 WeakPolarHBondContact O-CA 3.28Å; R665-A680 PolarHBondContact N-O 3.26Å; R665-A680 PolarHBondContact O-N 3.4Å; R665-F693 HydrophobicContact CB-CE1 4Å; R665-F693 HydrophobicContact CB-CZ 4.03Å
666	T	58.3	Low	67.1	Low	2 Å²	2	75 Å²	75	1%	0.012	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	139	166.7	61.8	0	0	0	0	109.3	R645 G646 T647 C660 A673 D678	R645-T666 WeakPolarHBondContact CA-OG1 3.05Å; G646-T666 PolarHBondContact N-OG1 2.04Å; T647-T666 WeakPolarHBondContact O-CG2 3.02Å; C660-T666 VanDerWaalsContact SG-CG2 3.59Å; C660-T666 PolarHBondContact SG-N 2.89Å; T666-A673 HydrophobicContact CG2-CB 3.6Å; T666-D678 WeakPolarHBondContact CA-O 3.35Å
667	N	54.5	Low	66.3	Low	33 Å²	33	79.6 Å²	79.6	18%	0.176	40%	0.396	C	S	.	.			trans	-58.1	161.9	-173.8	78.4	44.2	0	0	0	111.5	R665 A669 I670 D678 T691 F693	R665-N667 PolarHBondContact O-N 3.02Å; N667-A669 PolarHBondContact O-N 3.33Å; N667-A669 WeakPolarHBondContact OD1-CA 3.29Å; N667-A669 WeakPolarHBondContact OD1-CB 3.5Å; N667-A669 PolarHBondContact OD1-N 3.4Å; N667-I670 VanDerWaalsContact ND2-CD1 3.25Å; N667-I670 WeakPolarHBondContact ND2-CD1 3.45Å; N667-I670 PolarHBondContact O-N 2.83Å; N667-I670 PolarHBondContact OD1-N 2.92Å; N667-I670 VanDerWaalsContact OD1-N 3.12Å; N667-D678 PolarHBondContact N-O 3.12Å; N667-T691 HydrophobicContact CB-CG2 4.26Å; N667-F693 HydrophobicContact CB-CD2 4.48Å
668	R	49	Very low	65.4	Low	144 Å²	144	80.3 Å²	80.3	54%	0.543	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-16.4	-175.1	-100.4	177.6	172.1	-176.4	-2.3	114.7	R645 F693	R645-R668 PolarHBondContact NE-O 2.93Å; R645-R668 PolarHBondContact NH2-O 2.88Å; R668-F693 HydrophobicContact CG-CE2 4.25Å
669	A	47.3	Very low	64.7	Low	76 Å²	76	77.6 Å²	77.6	63%	0.628	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-26.9	-175.1	0	0	0	0	0	114.4	N667 Y671	N667-A669 PolarHBondContact O-N 3.33Å; N667-A669 WeakPolarHBondContact OD1-CA 3.29Å; N667-A669 WeakPolarHBondContact OD1-CB 3.5Å; N667-A669 PolarHBondContact OD1-N 3.4Å; A669-Y671 PolarHBondContact O-N 2.92Å
670	I	53.6	Low	63.9	Low	48 Å²	48	74 Å²	74	25%	0.246	36%	0.364	C	S	.	.			trans	-91.8	99.6	-171.9	-57.5	173.2	0	0	0	111.3	N667 A673 D678	N667-I670 VanDerWaalsContact ND2-CD1 3.25Å; N667-I670 WeakPolarHBondContact ND2-CD1 3.45Å; N667-I670 PolarHBondContact O-N 2.83Å; N667-I670 PolarHBondContact OD1-N 2.92Å; N667-I670 VanDerWaalsContact OD1-N 3.12Å; I670-A673 HydrophobicContact CG2-CB 3.89Å; I670-D678 HydrophobicContact CD1-CB 4.26Å
671	Y	60.8	Low	63.6	Low	157 Å²	157	78.1 Å²	78.1	62%	0.616	38%	0.382	S	S	*	.	S	Bend	trans	-75.2	135.2	148	-77.5	-91.9	0	0	0	108.2	A669	A669-Y671 PolarHBondContact O-N 2.92Å
672	G	63.4	Low	63.6	Low	18 Å²	18	81.3 Å²	81.3	19%	0.186	39%	0.385	C	S	.	.	S	Bend	trans	72.2	49.1	179.8	0	0	0	0	0	115.2	G630 C643 S674	G630-G672 VanDerWaalsContact CA-O 3.26Å; G630-G672 WeakPolarHBondContact CA-O 3.41Å; G630-G672 WeakPolarHBondContact O-CA 3.23Å; C643-G672 PolarHBondContact O-N 3.39Å; G672-S674 PolarHBondContact O-N 2.89Å
673	A	70.4	Confident	64.7	Low	1 Å²	1	72.9 Å²	72.9	1%	0.008	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-58.6	126.4	168.5	0	0	0	0	0	110	Y648 Q649 T666 I670 D678	Y648-A673 CarbonylContact C-O 3.56Å; Y648-A673 WeakPolarHBondContact CA-O 3.27Å; Y648-A673 WeakPolarHBondContact CB-O 3.49Å; Q649-A673 PolarHBondContact N-O 3.22Å; T666-A673 HydrophobicContact CG2-CB 3.6Å; I670-A673 HydrophobicContact CG2-CB 3.89Å; A673-D678 HydrophobicContact CB-CB 3.9Å
674	S	79.9	Confident	66.2	Low	52 Å²	52	67.2 Å²	67.2	36%	0.364	33%	0.328	S	S	.	.			trans	-95.6	-11	176.5	59	0	0	0	0	112	P650 G672	P650-S674 WeakPolarHBondContact CA-O 3.47Å; P650-S674 VanDerWaalsContact CB-O 3.29Å; P650-S674 WeakPolarHBondContact CB-O 3.45Å; G672-S674 PolarHBondContact O-N 2.89Å
675	N	73.4	Confident	67.3	Low	59 Å²	59	66.6 Å²	66.6	32%	0.316	33%	0.327	S	S	.	.	S	Bend	trans	-129.9	143.1	-172.1	-167.5	-17.1	0	0	0	111.8	Q677 D678	N675-Q677 PolarHBondContact ND2-OE1 2.84Å; N675-Q677 PolarHBondContact O-N 2.79Å; N675-Q677 WeakPolarHBondContact OD1-CB 3.3Å; N675-Q677 WeakPolarHBondContact OD1-CG 2.83Å; N675-Q677 PolarHBondContact OD1-N 2.83Å; N675-D678 PolarHBondContact N-OD2 2.84Å; N675-D678 WeakPolarHBondContact O-CB 3.43Å; N675-D678 PolarHBondContact O-N 3.26Å; N675-D678 VanDerWaalsContact O-N 3.16Å
676	V	75	Confident	68.4	Low	58 Å²	58	59.9 Å²	59.9	35%	0.352	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-64.4	-24.2	172.8	70.6	0	0	0	0	111.8	Y648 P661 D678 C679	Y648-V676 HydrophobicContact CD2-CB 4.27Å; Y648-V676 HydrophobicContact CE1-CB 4.19Å; Y648-V676 HydrophobicContact CE1-CG2 3.97Å; Y648-V676 HydrophobicContact CE2-CB 3.73Å; Y648-V676 HydrophobicContact CE2-CG2 4.36Å; P661-V676 HydrophobicContact CG-CG2 4.31Å; V676-D678 PolarHBondContact O-N 3.22Å; V676-C679 VanDerWaalsContact O-CB 3.24Å; V676-C679 WeakPolarHBondContact O-CB 3.15Å; V676-C679 PolarHBondContact O-N 3.14Å; V676-C679 VanDerWaalsContact O-N 3.12Å; V676-C679 PolarHBondContact O-SG 3.34Å
677	Q	66.1	Low	69.9	Low	156 Å²	156	63.2 Å²	63.2	73%	0.729	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-68.6	-14.2	176.2	-63.9	163.6	-11.1	0	0	112.9	N675 C679	N675-Q677 PolarHBondContact ND2-OE1 2.84Å; N675-Q677 PolarHBondContact O-N 2.79Å; N675-Q677 WeakPolarHBondContact OD1-CB 3.3Å; N675-Q677 WeakPolarHBondContact OD1-CG 2.83Å; N675-Q677 PolarHBondContact OD1-N 2.83Å; Q677-C679 PolarHBondContact O-N 2.87Å
678	D	66.6	Low	71.4	Confident	44 Å²	44	63.4 Å²	63.4	24%	0.235	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-75.5	-10.8	172.1	-60.8	-42	0	0	0	112.6	T666 N667 I670 A673 N675 V676	T666-D678 WeakPolarHBondContact CA-O 3.35Å; N667-D678 PolarHBondContact N-O 3.12Å; I670-D678 HydrophobicContact CD1-CB 4.26Å; A673-D678 HydrophobicContact CB-CB 3.9Å; N675-D678 PolarHBondContact N-OD2 2.84Å; N675-D678 WeakPolarHBondContact O-CB 3.43Å; N675-D678 PolarHBondContact O-N 3.26Å; N675-D678 VanDerWaalsContact O-N 3.16Å; V676-D678 PolarHBondContact O-N 3.22Å
679	C	69.5	Low	72.8	Confident	14 Å²	14	57.1 Å²	57.1	10%	0.095	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	114.7	174.2	-57	0	0	0	0	110.6	C660 I664 R665 V676 Q677	C660-C679 HydrophobicContact CB-CB 3.89Å; C660-C679 WeakPolarHBondContact CB-SG 3.32Å; C660-C679 WeakPolarHBondContact SG-CB 3.39Å; C660-C679 CovalentContact SG-SG 2.05Å; C660-C679 PolarHBondContact SG-SG 3.26Å; I664-C679 HydrophobicContact CB-CB 4.2Å; I664-C679 HydrophobicContact CD1-CB 4.37Å; R665-C679 CarbonylContact O-C 3.56Å; R665-C679 WeakPolarHBondContact O-CA 3.28Å; V676-C679 VanDerWaalsContact O-CB 3.24Å; V676-C679 WeakPolarHBondContact O-CB 3.15Å; V676-C679 PolarHBondContact O-N 3.14Å; V676-C679 VanDerWaalsContact O-N 3.12Å; V676-C679 PolarHBondContact O-SG 3.34Å; Q677-C679 PolarHBondContact O-N 2.87Å
680	A	64.6	Low	73.9	Confident	18 Å²	18	62.1 Å²	62.1	15%	0.149	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	157.1	-175.4	0	0	0	0	0	113.1	I664 R665 F693	I664-A680 VanDerWaalsContact CG2-C 3.42Å; R665-A680 PolarHBondContact N-O 3.26Å; R665-A680 PolarHBondContact O-N 3.4Å; A680-F693 HydrophobicContact CB-CB 3.82Å; A680-F693 WeakPolarHBondContact O-CD1 3.37Å
681	E	68.4	Low	74.3	Confident	104 Å²	104	61.4 Å²	61.4	49%	0.486	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-81.4	155.5	176.6	-81.9	-147.8	170.7	0	0	111.9	I664 F693 E694	I664-E681 HydrophobicContact CG2-CB 4.32Å; I664-E681 HydrophobicContact CG2-CG 3.57Å; E681-F693 CarbonylContact O-C 3.51Å; E681-F693 WeakPolarHBondContact O-CA 3.07Å; E681-F693 WeakPolarHBondContact O-CB 3.23Å; E681-F693 WeakPolarHBondContact O-CD1 3.1Å; E681-E694 PolarHBondContact O-N 3.09Å
682	R	74	Confident	74.8	Confident	132 Å²	132	54 Å²	54	50%	0.498	27%	0.271	S	S	.	.	B	Isolated β-bridge	trans	-77.3	138.7	178.6	-67.8	-172.1	-170.5	-152.1	7.6	111.7	K684 G692 F693	R682-K684 PolarHBondContact O-N 3.13Å; R682-G692 WeakPolarHBondContact CA-O 3.3Å; R682-F693 HydrophobicContact CG-CD1 3.86Å; R682-F693 HydrophobicContact CG-CE1 3.52Å; R682-F693 HydrophobicContact CG-CZ 4.21Å
683	C	80.8	Confident	75.1	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-52.6	131.7	175.7	-57.4	0	0	0	0	112.7	S689 G692 C696 R708 G709	C683-S689 PolarHBondContact SG-OG 3.37Å; C683-G692 PolarHBondContact N-O 3.37Å; C683-G692 VanDerWaalsContact N-O 3.11Å; C683-C696 WeakPolarHBondContact CA-SG 3.36Å; C683-C696 HydrophobicContact CB-CB 3.78Å; C683-C696 WeakPolarHBondContact CB-SG 3.5Å; C683-C696 WeakPolarHBondContact SG-CB 3.44Å; C683-C696 CovalentContact SG-SG 2.03Å; C683-C696 PolarHBondContact SG-SG 3.3Å; C683-R708 CarbonylContact O-C 3.57Å; C683-R708 VanDerWaalsContact O-CA 3.22Å; C683-R708 WeakPolarHBondContact O-CA 3.23Å; C683-G709 PolarHBondContact O-N 2.91Å
684	K	86.2	Confident	74.9	Confident	107 Å²	107	58.7 Å²	58.7	47%	0.465	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-69.2	156.6	172.4	60.1	-164.1	171.7	-168.2	0	111.5	R682 Y687	R682-K684 PolarHBondContact O-N 3.13Å; K684-Y687 HydrophobicContact CD-CD2 4.18Å; K684-Y687 HydrophobicContact CD-CE2 4.34Å; K684-Y687 HydrophobicContact CG-CD2 3.61Å; K684-Y687 HydrophobicContact CG-CE2 4.24Å; K684-Y687 HydrophobicContact CG-CG 3.99Å; K684-Y687 WeakPolarHBondContact O-CB 3.02Å; K684-Y687 PolarHBondContact O-N 3.15Å
685	P	89.2	Confident	74.3	Confident	35 Å²	35	62 Å²	62	23%	0.227	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	144.7	173.3	-24.8	36.4	0	0	0	111.6	Y687 Q705 R708 R728	P685-Y687 VanDerWaalsContact C-N 3.27Å; P685-Q705 CarbonylContact C-O 3.57Å; P685-R708 HydrophobicContact CG-CG 4.32Å; P685-R728 HydrophobicContact CB-CG 4.33Å
686	G	85.7	Confident	74.6	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	-7.4	-166.9	0	0	0	0	0	114.5	P698 C699 Q705 G726 V727	G686-P698 CarbonylContact O-C 3.4Å; G686-P698 WeakPolarHBondContact O-CA 3.41Å; G686-C699 PolarHBondContact O-N 3.24Å; G686-Q705 PolarHBondContact N-O 2.77Å; G686-G726 WeakPolarHBondContact CA-O 3.42Å; G686-G726 VanDerWaalsContact O-CA 3.29Å; G686-G726 WeakPolarHBondContact O-CA 3.4Å; G686-V727 WeakPolarHBondContact CA-O 3.31Å
687	Y	89	Confident	74.9	Confident	71 Å²	71	60.9 Å²	60.9	28%	0.278	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	150.8	-176.5	-65.1	-113.2	0	0	0	111.4	K684 P685 C696 Q697 P698	K684-Y687 HydrophobicContact CD-CD2 4.18Å; K684-Y687 HydrophobicContact CD-CE2 4.34Å; K684-Y687 HydrophobicContact CG-CD2 3.61Å; K684-Y687 HydrophobicContact CG-CE2 4.24Å; K684-Y687 HydrophobicContact CG-CG 3.99Å; K684-Y687 WeakPolarHBondContact O-CB 3.02Å; K684-Y687 PolarHBondContact O-N 3.15Å; P685-Y687 VanDerWaalsContact C-N 3.27Å; Y687-C696 HydrophobicContact CD1-CB 4.45Å; Y687-Q697 CarbonylContact C-O 3.52Å; Y687-Q697 WeakPolarHBondContact CA-O 3.3Å; Y687-Q697 WeakPolarHBondContact CB-O 3.41Å; Y687-P698 HydrophobicContact CD1-CB 4.24Å; Y687-P698 HydrophobicContact CE1-CB 4.02Å
688	F	87	Confident	75.9	Confident	38 Å²	38	55.7 Å²	55.7	17%	0.167	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	164.4	179.8	79.3	-74	0	0	0	111.4	C696 Q697 C713	F688-C696 CarbonylContact O-C 3.56Å; F688-C696 VanDerWaalsContact O-CA 3.3Å; F688-C696 WeakPolarHBondContact O-CA 3.3Å; F688-Q697 HydrophobicContact CD1-CB 4.21Å; F688-Q697 WeakPolarHBondContact CD1-O 3.5Å; F688-Q697 HydrophobicContact CE1-CB 3.74Å; F688-Q697 HydrophobicContact CZ-CB 4.14Å; F688-Q697 PolarHBondContact N-O 2.95Å; F688-Q697 PolarHBondContact O-N 3.38Å; F688-C713 WeakPolarHBondContact CD1-SG 3.39Å
689	S	77.4	Confident	76.7	Confident	12 Å²	12	53.6 Å²	53.6	8%	0.084	27%	0.269	C	S	.	.			trans	-157.9	153.5	164.5	73.4	0	0	0	0	107.8	C683 T691 G692 F693 P695 S711	C683-S689 PolarHBondContact SG-OG 3.37Å; S689-T691 PolarHBondContact O-N 3.46Å; S689-G692 PolarHBondContact O-N 2.92Å; S689-G692 PolarHBondContact OG-N 3.21Å; S689-G692 VanDerWaalsContact OG-N 3.16Å; S689-F693 WeakPolarHBondContact CB-O 3.44Å; S689-F693 PolarHBondContact OG-N 3.48Å; S689-F693 PolarHBondContact OG-O 3.41Å; S689-P695 WeakPolarHBondContact CB-O 3.24Å; S689-S711 VanDerWaalsContact O-CA 3.25Å; S689-S711 WeakPolarHBondContact O-CA 3.48Å
690	E	70.5	Confident	77.2	Confident	181 Å²	181	57.8 Å²	57.8	85%	0.846	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-35.6	-177.3	-59.5	-176.6	142.6	0	0	113.7	S711	E690-S711 WeakPolarHBondContact O-CB 3.13Å
691	T	61.8	Low	77.6	Confident	33 Å²	33	59.1 Å²	59.1	20%	0.202	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-16.1	-179.8	69.3	0	0	0	0	114	N667 S689 F693	N667-T691 HydrophobicContact CB-CG2 4.26Å; S689-T691 PolarHBondContact O-N 3.46Å; T691-F693 VanDerWaalsContact C-N 3.31Å; T691-F693 VanDerWaalsContact O-CD2 3.31Å; T691-F693 WeakPolarHBondContact O-CD2 3.37Å; T691-F693 PolarHBondContact OG1-N 3Å
692	G	72.3	Confident	77.8	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.01	28%	0.276	C	S	.	.	S	Bend	trans	79.4	7.8	-169.9	0	0	0	0	0	114.5	R682 C683 S689 G709	R682-G692 WeakPolarHBondContact CA-O 3.3Å; C683-G692 PolarHBondContact N-O 3.37Å; C683-G692 VanDerWaalsContact N-O 3.11Å; S689-G692 PolarHBondContact O-N 2.92Å; S689-G692 PolarHBondContact OG-N 3.21Å; S689-G692 VanDerWaalsContact OG-N 3.16Å; G692-G709 WeakPolarHBondContact O-CA 3.43Å
693	F	68.5	Low	78.3	Confident	16 Å²	16	52 Å²	52	7%	0.07	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-125.4	161.1	-179.9	-62.6	-88.6	0	0	0	112.6	R665 N667 R668 A680 E681 R682 S689 T691	R665-F693 HydrophobicContact CB-CE1 4Å; R665-F693 HydrophobicContact CB-CZ 4.03Å; N667-F693 HydrophobicContact CB-CD2 4.48Å; R668-F693 HydrophobicContact CG-CE2 4.25Å; A680-F693 HydrophobicContact CB-CB 3.82Å; A680-F693 WeakPolarHBondContact O-CD1 3.37Å; E681-F693 CarbonylContact O-C 3.51Å; E681-F693 WeakPolarHBondContact O-CA 3.07Å; E681-F693 WeakPolarHBondContact O-CB 3.23Å; E681-F693 WeakPolarHBondContact O-CD1 3.1Å; R682-F693 HydrophobicContact CG-CD1 3.86Å; R682-F693 HydrophobicContact CG-CE1 3.52Å; R682-F693 HydrophobicContact CG-CZ 4.21Å; S689-F693 WeakPolarHBondContact CB-O 3.44Å; S689-F693 PolarHBondContact OG-N 3.48Å; S689-F693 PolarHBondContact OG-O 3.41Å; T691-F693 VanDerWaalsContact C-N 3.31Å; T691-F693 VanDerWaalsContact O-CD2 3.31Å; T691-F693 WeakPolarHBondContact O-CD2 3.37Å; T691-F693 PolarHBondContact OG1-N 3Å
694	E	67.2	Low	78.7	Confident	101 Å²	101	53.1 Å²	53.1	47%	0.472	27%	0.271	S	S	.	.	S	Bend	trans	-60.8	146.6	-179.1	-72.4	-164.7	155.4	0	0	113.2	E681	E681-E694 PolarHBondContact O-N 3.09Å
695	P	68.1	Low	78.7	Confident	122 Å²	122	48 Å²	48	79%	0.792	25%	0.249	S	C	*	.	S	Bend	cis	-74.8	139.5	3.6	31.4	-35.6	0	0	0	113.1	S689	S689-P695 WeakPolarHBondContact CB-O 3.24Å
696	C	78.8	Confident	78.6	Confident	28 Å²	28	50.4 Å²	50.4	19%	0.189	26%	0.26	C	S	.	.			trans	-112.3	138.2	-177.4	-53.7	0	0	0	0	112.1	C683 Y687 F688	C683-C696 WeakPolarHBondContact CA-SG 3.36Å; C683-C696 HydrophobicContact CB-CB 3.78Å; C683-C696 WeakPolarHBondContact CB-SG 3.5Å; C683-C696 WeakPolarHBondContact SG-CB 3.44Å; C683-C696 CovalentContact SG-SG 2.03Å; C683-C696 PolarHBondContact SG-SG 3.3Å; Y687-C696 HydrophobicContact CD1-CB 4.45Å; F688-C696 CarbonylContact O-C 3.56Å; F688-C696 VanDerWaalsContact O-CA 3.3Å; F688-C696 WeakPolarHBondContact O-CA 3.3Å
697	Q	82	Confident	78.5	Confident	66 Å²	66	54.7 Å²	54.7	31%	0.308	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	145.8	173.8	-67.2	173.7	-35.8	0	0	110.3	Y687 F688	Y687-Q697 CarbonylContact C-O 3.52Å; Y687-Q697 WeakPolarHBondContact CA-O 3.3Å; Y687-Q697 WeakPolarHBondContact CB-O 3.41Å; F688-Q697 HydrophobicContact CD1-CB 4.21Å; F688-Q697 WeakPolarHBondContact CD1-O 3.5Å; F688-Q697 HydrophobicContact CE1-CB 3.74Å; F688-Q697 HydrophobicContact CZ-CB 4.14Å; F688-Q697 PolarHBondContact N-O 2.95Å; F688-Q697 PolarHBondContact O-N 3.38Å
698	P	86.6	Confident	78.3	Confident	47 Å²	47	60.3 Å²	60.3	31%	0.305	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	153.8	170.6	31.6	-35	0	0	0	110.8	G686 Y687 L700	G686-P698 CarbonylContact O-C 3.4Å; G686-P698 WeakPolarHBondContact O-CA 3.41Å; Y687-P698 HydrophobicContact CD1-CB 4.24Å; Y687-P698 HydrophobicContact CE1-CB 4.02Å; P698-L700 PolarHBondContact O-N 3.09Å
699	C	83.4	Confident	77.8	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-63.9	133.1	168.9	-64.3	0	0	0	0	111.1	G686 Y703 Q705 C713 Y725 G726	G686-C699 PolarHBondContact O-N 3.24Å; C699-Y703 WeakPolarHBondContact CB-O 3.29Å; C699-Q705 VanDerWaalsContact SG-CB 3.55Å; C699-C713 WeakPolarHBondContact CA-SG 3.43Å; C699-C713 HydrophobicContact CB-CB 3.82Å; C699-C713 WeakPolarHBondContact CB-SG 3.35Å; C699-C713 WeakPolarHBondContact SG-CB 3.45Å; C699-C713 CovalentContact SG-SG 2.04Å; C699-C713 PolarHBondContact SG-SG 3.08Å; C699-Y725 WeakPolarHBondContact O-CA 3.03Å; C699-G726 PolarHBondContact O-N 2.98Å
700	L	80.6	Confident	78	Confident	101 Å²	101	61.8 Å²	61.8	53%	0.529	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-71.3	166.4	176.3	-64.5	176.2	0	0	0	112.1	P698 G702 Y703 Y725	P698-L700 PolarHBondContact O-N 3.09Å; L700-G702 PolarHBondContact O-N 3.37Å; L700-Y703 HydrophobicContact CB-CD2 4.41Å; L700-Y703 WeakPolarHBondContact O-CA 3.5Å; L700-Y703 WeakPolarHBondContact O-CB 3.45Å; L700-Y703 PolarHBondContact O-N 2.67Å; L700-Y725 HydrophobicContact CD2-CD1 4.37Å; L700-Y725 HydrophobicContact CD2-CE1 4.18Å
701	D	72.7	Confident	78.4	Confident	46 Å²	46	56.1 Å²	56.1	25%	0.246	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	133.9	-179.2	-55.8	-47.6	0	0	0	112	Y703 T722 Y725	D701-Y703 VanDerWaalsContact C-N 3.32Å; D701-Y703 WeakPolarHBondContact O-CD2 3.43Å; D701-T722 WeakPolarHBondContact CA-OG1 3.49Å; D701-Y725 WeakPolarHBondContact OD1-CE1 3.44Å; D701-Y725 WeakPolarHBondContact OD2-CE1 3.22Å; D701-Y725 PolarHBondContact OD2-OH 2.87Å
702	G	72.2	Confident	79.5	Confident	10 Å²	10	57 Å²	57	10%	0.103	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	8.7	-172.2	0	0	0	0	0	114.7	L700 C716 T722	L700-G702 PolarHBondContact O-N 3.37Å; G702-C716 PolarHBondContact O-N 2.58Å; G702-T722 PolarHBondContact N-OG1 2.98Å
703	Y	85.2	Confident	80.2	Confident	77 Å²	77	58 Å²	58	30%	0.302	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	145.5	174.7	-60.8	-99.9	0	0	0	112.7	C699 L700 D701 C713 K714 R715	C699-Y703 WeakPolarHBondContact CB-O 3.29Å; L700-Y703 HydrophobicContact CB-CD2 4.41Å; L700-Y703 WeakPolarHBondContact O-CA 3.5Å; L700-Y703 WeakPolarHBondContact O-CB 3.45Å; L700-Y703 PolarHBondContact O-N 2.67Å; D701-Y703 VanDerWaalsContact C-N 3.32Å; D701-Y703 WeakPolarHBondContact O-CD2 3.43Å; Y703-C713 HydrophobicContact CD1-CB 4.37Å; Y703-C713 HydrophobicContact CG-CB 4.42Å; Y703-K714 CarbonylContact C-O 3.57Å; Y703-K714 VanDerWaalsContact CA-O 3.24Å; Y703-K714 WeakPolarHBondContact CA-O 3.28Å; Y703-R715 HydrophobicContact CD1-CB 3.89Å; Y703-R715 HydrophobicContact CD1-CG 4.28Å; Y703-R715 HydrophobicContact CE1-CB 3.68Å; Y703-R715 HydrophobicContact CE1-CG 3.88Å; Y703-R715 PolarHBondContact OH-NE 2.04Å; Y703-R715 VanDerWaalsContact OH-NE 3.15Å; Y703-R715 PolarHBondContact OH-NH2 2.83Å
704	F	88.3	Confident	81.1	Confident	23 Å²	23	59.5 Å²	59.5	10%	0.101	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	161.5	179.7	70.1	-84.6	0	0	0	112.1	K714 R715 V727	F704-K714 HydrophobicContact CD1-CB 4.14Å; F704-K714 VanDerWaalsContact CD1-O 3.29Å; F704-K714 WeakPolarHBondContact CD1-O 3.22Å; F704-K714 HydrophobicContact CD2-CB 4.28Å; F704-K714 HydrophobicContact CD2-CD 4.5Å; F704-K714 HydrophobicContact CE1-CB 3.7Å; F704-K714 HydrophobicContact CE2-CB 3.85Å; F704-K714 HydrophobicContact CE2-CD 3.72Å; F704-K714 HydrophobicContact CE2-CG 4.34Å; F704-K714 HydrophobicContact CG-CB 4.4Å; F704-K714 HydrophobicContact CZ-CB 3.52Å; F704-K714 HydrophobicContact CZ-CD 3.96Å; F704-K714 HydrophobicContact CZ-CG 4.34Å; F704-K714 PolarHBondContact N-O 3.08Å; F704-K714 WeakPolarHBondContact O-CB 3.17Å; F704-K714 PolarHBondContact O-N 2.02Å; F704-R715 WeakPolarHBondContact CE1-O 3.3Å; F704-V727 CarbonylContact C-O 3.53Å; F704-V727 VanDerWaalsContact CA-O 3.29Å; F704-V727 WeakPolarHBondContact CA-O 3.24Å; F704-V727 HydrophobicContact CB-CB 4.28Å; F704-V727 HydrophobicContact CB-CG1 3.7Å
705	Q	86.9	Confident	82	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.316	C	S	.	.			trans	-152.4	124.3	172.4	168.6	50	5.9	0	0	113.9	P685 G686 C699 E707 R710 V727 R728	P685-Q705 CarbonylContact C-O 3.57Å; G686-Q705 PolarHBondContact N-O 2.77Å; C699-Q705 VanDerWaalsContact SG-CB 3.55Å; Q705-E707 VanDerWaalsContact NE2-C 3.32Å; Q705-E707 VanDerWaalsContact NE2-CA 3.28Å; Q705-E707 VanDerWaalsContact NE2-CB 3.26Å; Q705-E707 PolarHBondContact NE2-O 2.74Å; Q705-R710 HydrophobicContact CG-CB 4.36Å; Q705-V727 PolarHBondContact N-O 3.11Å; Q705-R728 CarbonylContact C-O 3.52Å
706	N	86.3	Confident	82.4	Confident	86 Å²	86	57 Å²	57	46%	0.46	28%	0.281	S	S	.	.			trans	-101.8	-13.7	-174.3	65.5	-44.6	0	0	0	115.9	K714 R728	N706-K714 PolarHBondContact OD1-NZ 2.79Å; N706-R728 VanDerWaalsContact CA-O 3.23Å; N706-R728 WeakPolarHBondContact CA-O 3.46Å; N706-R728 WeakPolarHBondContact CB-O 3.35Å; N706-R728 PolarHBondContact N-O 2.03Å
707	E	83	Confident	82.1	Confident	90 Å²	90	64.1 Å²	64.1	42%	0.421	31%	0.308	S	S	.	.	S	Bend	trans	-105.4	158.5	-175.9	-48.3	140.1	-162.1	0	0	112.5	Q705 K714	Q705-E707 VanDerWaalsContact NE2-C 3.32Å; Q705-E707 VanDerWaalsContact NE2-CA 3.28Å; Q705-E707 VanDerWaalsContact NE2-CB 3.26Å; Q705-E707 PolarHBondContact NE2-O 2.74Å; E707-K714 IonicContact OE1-NZ 3.75Å; E707-K714 PolarHBondContact OE1-NZ 3.47Å
708	R	85.8	Confident	80.7	Confident	188 Å²	188	68.8 Å²	68.8	71%	0.709	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	130.5	175.3	-74.8	-176.1	-177.8	-153	2.1	112.9	C683 P685	C683-R708 CarbonylContact O-C 3.57Å; C683-R708 VanDerWaalsContact O-CA 3.22Å; C683-R708 WeakPolarHBondContact O-CA 3.23Å; P685-R708 HydrophobicContact CG-CG 4.32Å
709	G	75.7	Confident	79.2	Confident	15 Å²	15	74.2 Å²	74.2	16%	0.155	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	42.8	170.4	0	0	0	0	0	114.9	C683 G692	C683-G709 PolarHBondContact O-N 2.91Å; G692-G709 WeakPolarHBondContact O-CA 3.43Å
710	R	82	Confident	78.3	Confident	67 Å²	67	79.8 Å²	79.8	25%	0.253	37%	0.373	S	S	.	.			trans	-90.4	148.9	176.2	-166.3	175.7	-172.7	-106	6.1	111	Q705 S712 C713	Q705-R710 HydrophobicContact CG-CB 4.36Å; R710-S712 VanDerWaalsContact C-N 3.33Å; R710-S712 VanDerWaalsContact CD-O 3.3Å; R710-S712 WeakPolarHBondContact CD-O 3.41Å; R710-S712 WeakPolarHBondContact CG-O 3.01Å; R710-S712 VanDerWaalsContact NH1-C 3.32Å; R710-S712 PolarHBondContact NH1-O 3.36Å; R710-S712 PolarHBondContact NH1-OG 3.38Å; R710-C713 PolarHBondContact NH1-O 2.78Å
711	S	78.5	Confident	77.6	Confident	62 Å²	62	76.8 Å²	76.8	43%	0.434	36%	0.359	S	S	.	.	S	Bend	trans	-84	-1.7	-177.7	51.8	0	0	0	0	115.6	S689 E690	S689-S711 VanDerWaalsContact O-CA 3.25Å; S689-S711 WeakPolarHBondContact O-CA 3.48Å; E690-S711 WeakPolarHBondContact O-CB 3.13Å
712	S	85.5	Confident	77.3	Confident	51 Å²	51	74.7 Å²	74.7	36%	0.357	35%	0.347	S	S	.	.	S	Bend	trans	-163	166	-178.9	58.7	0	0	0	0	110.6	R710	R710-S712 VanDerWaalsContact C-N 3.33Å; R710-S712 VanDerWaalsContact CD-O 3.3Å; R710-S712 WeakPolarHBondContact CD-O 3.41Å; R710-S712 WeakPolarHBondContact CG-O 3.01Å; R710-S712 VanDerWaalsContact NH1-C 3.32Å; R710-S712 PolarHBondContact NH1-O 3.36Å; R710-S712 PolarHBondContact NH1-OG 3.38Å
713	C	87.4	Confident	76.8	Confident	21 Å²	21	78.8 Å²	78.8	14%	0.142	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-91	165.1	169.7	-59.3	0	0	0	0	112	F688 C699 Y703 R710	F688-C713 WeakPolarHBondContact CD1-SG 3.39Å; C699-C713 WeakPolarHBondContact CA-SG 3.43Å; C699-C713 HydrophobicContact CB-CB 3.82Å; C699-C713 WeakPolarHBondContact CB-SG 3.35Å; C699-C713 WeakPolarHBondContact SG-CB 3.45Å; C699-C713 CovalentContact SG-SG 2.04Å; C699-C713 PolarHBondContact SG-SG 3.08Å; Y703-C713 HydrophobicContact CD1-CB 4.37Å; Y703-C713 HydrophobicContact CG-CB 4.42Å; R710-C713 PolarHBondContact NH1-O 2.78Å
714	K	87.8	Confident	75.9	Confident	49 Å²	49	79.3 Å²	79.3	21%	0.213	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	131.3	174.8	-61.2	175.5	-176.3	173.4	0	107.4	Y703 F704 N706 E707	Y703-K714 CarbonylContact C-O 3.57Å; Y703-K714 VanDerWaalsContact CA-O 3.24Å; Y703-K714 WeakPolarHBondContact CA-O 3.28Å; F704-K714 HydrophobicContact CD1-CB 4.14Å; F704-K714 VanDerWaalsContact CD1-O 3.29Å; F704-K714 WeakPolarHBondContact CD1-O 3.22Å; F704-K714 HydrophobicContact CD2-CB 4.28Å; F704-K714 HydrophobicContact CD2-CD 4.5Å; F704-K714 HydrophobicContact CE1-CB 3.7Å; F704-K714 HydrophobicContact CE2-CB 3.85Å; F704-K714 HydrophobicContact CE2-CD 3.72Å; F704-K714 HydrophobicContact CE2-CG 4.34Å; F704-K714 HydrophobicContact CG-CB 4.4Å; F704-K714 HydrophobicContact CZ-CB 3.52Å; F704-K714 HydrophobicContact CZ-CD 3.96Å; F704-K714 HydrophobicContact CZ-CG 4.34Å; F704-K714 PolarHBondContact N-O 3.08Å; F704-K714 WeakPolarHBondContact O-CB 3.17Å; F704-K714 PolarHBondContact O-N 2.02Å; N706-K714 PolarHBondContact OD1-NZ 2.79Å; E707-K714 IonicContact OE1-NZ 3.75Å; E707-K714 PolarHBondContact OE1-NZ 3.47Å
715	R	84.4	Confident	75.5	Confident	162 Å²	162	85.1 Å²	85.1	61%	0.611	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	142.1	175.2	-165.3	-175	-79.9	-173.8	-4.6	109.8	Y703 F704	Y703-R715 HydrophobicContact CD1-CB 3.89Å; Y703-R715 HydrophobicContact CD1-CG 4.28Å; Y703-R715 HydrophobicContact CE1-CB 3.68Å; Y703-R715 HydrophobicContact CE1-CG 3.88Å; Y703-R715 PolarHBondContact OH-NE 2.04Å; Y703-R715 VanDerWaalsContact OH-NE 3.15Å; Y703-R715 PolarHBondContact OH-NH2 2.83Å; F704-R715 WeakPolarHBondContact CE1-O 3.3Å
716	C	77.3	Confident	75.2	Confident	8 Å²	8	85.6 Å²	85.6	5%	0.054	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-56.5	158.7	164.5	-68.2	0	0	0	0	110.9	G702 Y720 C733	G702-C716 PolarHBondContact O-N 2.58Å; C716-Y720 WeakPolarHBondContact CB-O 3.39Å; C716-C733 HydrophobicContact CB-CB 3.77Å; C716-C733 WeakPolarHBondContact CB-SG 3.36Å; C716-C733 WeakPolarHBondContact SG-CB 3.27Å; C716-C733 CovalentContact SG-SG 2.04Å; C716-C733 PolarHBondContact SG-SG 2.77Å
717	K	72.8	Confident	74.9	Confident	177 Å²	177	81.8 Å²	81.8	77%	0.77	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-64.3	149.8	172.9	-71.4	-178	178.3	178.5	0	109.3	Q719 Y720	K717-Q719 PolarHBondContact O-N 2.97Å; K717-Y720 HydrophobicContact CB-CD2 4.16Å; K717-Y720 PolarHBondContact O-N 2.85Å
718	H	52.8	Low	75.1	Confident	164 Å²	164	85 Å²	85	76%	0.759	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	135.9	176	-82.1	70.3	0	0	0	110
719	Q	53.9	Low	74.9	Confident	161 Å²	161	78 Å²	78	75%	0.752	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.4	-1.9	-171.4	-51.2	178	2	0	0	117.7	K717	K717-Q719 PolarHBondContact O-N 2.97Å
720	Y	65.9	Low	75	Confident	118 Å²	118	80.6 Å²	80.6	46%	0.463	39%	0.393	S	S	.	.			trans	-119.3	140.8	176.5	-58.5	-95.5	0	0	0	111.9	C716 K717 C733 S734 A735	C716-Y720 WeakPolarHBondContact CB-O 3.39Å; K717-Y720 HydrophobicContact CB-CD2 4.16Å; K717-Y720 PolarHBondContact O-N 2.85Å; Y720-C733 VanDerWaalsContact CD1-O 3.26Å; Y720-C733 WeakPolarHBondContact CD1-O 3.07Å; Y720-S734 WeakPolarHBondContact CA-O 3.43Å; Y720-A735 HydrophobicContact CD1-CB 4.23Å; Y720-A735 HydrophobicContact CE1-CB 4.3Å
721	T	64.7	Low	74.7	Confident	38 Å²	38	83.2 Å²	83.2	23%	0.233	42%	0.416	C	S	.	.	B	Isolated β-bridge	trans	-126.2	174.1	175.5	-163.6	0	0	0	0	111.2	C733 S734 P736	T721-C733 CarbonylContact O-C 3.59Å; T721-C733 VanDerWaalsContact O-CA 3.29Å; T721-C733 WeakPolarHBondContact O-CA 3Å; T721-S734 PolarHBondContact N-O 3.16Å; T721-S734 PolarHBondContact O-N 2.81Å; T721-P736 HydrophobicContact CG2-CB 4.33Å; T721-P736 HydrophobicContact CG2-CG 4.4Å
722	T	66.4	Low	74.3	Confident	1 Å²	1	84.4 Å²	84.4	1%	0.006	42%	0.415	C	S	.	.			trans	-108.4	144.8	172.6	53.6	0	0	0	0	109.6	D701 G702 T724 V727	D701-T722 WeakPolarHBondContact CA-OG1 3.49Å; G702-T722 PolarHBondContact N-OG1 2.98Å; T722-T724 VanDerWaalsContact C-N 3.33Å; T722-V727 HydrophobicContact CG2-CB 3.81Å; T722-V727 HydrophobicContact CG2-CG1 3.85Å; T722-V727 HydrophobicContact CG2-CG2 3.67Å
723	V	61.9	Low	73.6	Confident	96 Å²	96	82.6 Å²	82.6	58%	0.582	40%	0.402	S	S	*	.	S	Bend	trans	-82.7	-14.2	-177.9	-165.8	0	0	0	0	112
724	T	67.1	Low	72.4	Confident	89 Å²	89	84.4 Å²	84.4	55%	0.546	42%	0.415	S	S	.	.	S	Bend	trans	-147.6	159.7	-176.1	55.7	0	0	0	0	111.9	T722 V727	T722-T724 VanDerWaalsContact C-N 3.33Å; T724-V727 WeakPolarHBondContact O-CG2 3.44Å
725	Y	80.2	Confident	70.8	Confident	144 Å²	144	85.1 Å²	85.1	57%	0.565	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	147.4	171.7	-61.1	-58.2	0	0	0	113.2	C699 L700 D701	C699-Y725 WeakPolarHBondContact O-CA 3.03Å; L700-Y725 HydrophobicContact CD2-CD1 4.37Å; L700-Y725 HydrophobicContact CD2-CE1 4.18Å; D701-Y725 WeakPolarHBondContact OD1-CE1 3.44Å; D701-Y725 WeakPolarHBondContact OD2-CE1 3.22Å; D701-Y725 PolarHBondContact OD2-OH 2.87Å
726	G	79	Confident	69.3	Low	11 Å²	11	79.8 Å²	79.8	11%	0.113	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	25.2	169.3	0	0	0	0	0	115.2	G686 C699	G686-G726 WeakPolarHBondContact CA-O 3.42Å; G686-G726 VanDerWaalsContact O-CA 3.29Å; G686-G726 WeakPolarHBondContact O-CA 3.4Å; C699-G726 PolarHBondContact O-N 2.98Å
727	V	81.7	Confident	68.3	Low	5 Å²	5	86.4 Å²	86.4	3%	0.03	45%	0.446	C	S	.	.			trans	-61.3	137.3	-178.6	166.5	0	0	0	0	113	G686 F704 Q705 T722 T724 S729 E732	G686-V727 WeakPolarHBondContact CA-O 3.31Å; F704-V727 CarbonylContact C-O 3.53Å; F704-V727 VanDerWaalsContact CA-O 3.29Å; F704-V727 WeakPolarHBondContact CA-O 3.24Å; F704-V727 HydrophobicContact CB-CB 4.28Å; F704-V727 HydrophobicContact CB-CG1 3.7Å; Q705-V727 PolarHBondContact N-O 3.11Å; T722-V727 HydrophobicContact CG2-CB 3.81Å; T722-V727 HydrophobicContact CG2-CG1 3.85Å; T722-V727 HydrophobicContact CG2-CG2 3.67Å; T724-V727 WeakPolarHBondContact O-CG2 3.44Å; V727-S729 VanDerWaalsContact CG1-O 3.26Å; V727-S729 WeakPolarHBondContact CG1-O 3.25Å; V727-E732 HydrophobicContact CG1-CB 3.49Å; V727-E732 VanDerWaalsContact CG1-CB 3.49Å; V727-E732 HydrophobicContact CG1-CG 4.23Å; V727-E732 HydrophobicContact CG2-CB 4.38Å
728	R	86.4	Confident	68	Low	159 Å²	159	86.8 Å²	86.8	60%	0.6	44%	0.443	S	S	*	.			trans	-97.5	-21.8	-171.6	-60.2	-178	-175.9	164.7	7.3	113.4	P685 Q705 N706 E732	P685-R728 HydrophobicContact CB-CG 4.33Å; Q705-R728 CarbonylContact C-O 3.52Å; N706-R728 VanDerWaalsContact CA-O 3.23Å; N706-R728 WeakPolarHBondContact CA-O 3.46Å; N706-R728 WeakPolarHBondContact CB-O 3.35Å; N706-R728 PolarHBondContact N-O 2.03Å; R728-E732 PolarHBondContact N-OE1 3.35Å
729	S	81.3	Confident	69.1	Low	40 Å²	40	79 Å²	79	28%	0.28	41%	0.407	S	S	.	.			trans	-132.3	150.5	-171.8	-171.7	0	0	0	0	113	V727 V731 E732	V727-S729 VanDerWaalsContact CG1-O 3.26Å; V727-S729 WeakPolarHBondContact CG1-O 3.25Å; S729-V731 PolarHBondContact O-N 3.33Å; S729-V731 WeakPolarHBondContact OG-CG2 3.12Å; S729-V731 PolarHBondContact OG-N 3.27Å; S729-E732 WeakPolarHBondContact CB-OE1 3.41Å; S729-E732 PolarHBondContact N-OE1 3.44Å; S729-E732 PolarHBondContact O-N 3.49Å
730	S	77.3	Confident	70.5	Confident	69 Å²	69	77.4 Å²	77.4	48%	0.483	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-66.7	-13.7	167.9	56.3	0	0	0	0	113.4	E732 C733	S730-E732 VanDerWaalsContact C-N 3.35Å; S730-C733 WeakPolarHBondContact O-CB 3.44Å; S730-C733 PolarHBondContact O-N 2.79Å
731	V	76.8	Confident	71.5	Confident	122 Å²	122	72.8 Å²	72.8	74%	0.739	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-77.1	-25.1	179.7	-177.8	0	0	0	0	111.5	S729 C733	S729-V731 PolarHBondContact O-N 3.33Å; S729-V731 WeakPolarHBondContact OG-CG2 3.12Å; S729-V731 PolarHBondContact OG-N 3.27Å; V731-C733 PolarHBondContact O-N 3.35Å
732	E	70.3	Confident	72.5	Confident	87 Å²	87	71 Å²	71	41%	0.407	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-82.7	-0.8	175.2	-64.2	162.2	-96.4	0	0	112.1	V727 R728 S729 S730 S734	V727-E732 HydrophobicContact CG1-CB 3.49Å; V727-E732 VanDerWaalsContact CG1-CB 3.49Å; V727-E732 HydrophobicContact CG1-CG 4.23Å; V727-E732 HydrophobicContact CG2-CB 4.38Å; R728-E732 PolarHBondContact N-OE1 3.35Å; S729-E732 WeakPolarHBondContact CB-OE1 3.41Å; S729-E732 PolarHBondContact N-OE1 3.44Å; S729-E732 PolarHBondContact O-N 3.49Å; S730-E732 VanDerWaalsContact C-N 3.35Å; E732-S734 PolarHBondContact O-N 2.59Å
733	C	70.7	Confident	73.5	Confident	14 Å²	14	72 Å²	72	10%	0.095	38%	0.381	C	S	.	.			trans	-74.5	96.2	167.8	-64.2	0	0	0	0	109	C716 Y720 T721 S730 V731	C716-C733 HydrophobicContact CB-CB 3.77Å; C716-C733 WeakPolarHBondContact CB-SG 3.36Å; C716-C733 WeakPolarHBondContact SG-CB 3.27Å; C716-C733 CovalentContact SG-SG 2.04Å; C716-C733 PolarHBondContact SG-SG 2.77Å; Y720-C733 VanDerWaalsContact CD1-O 3.26Å; Y720-C733 WeakPolarHBondContact CD1-O 3.07Å; T721-C733 CarbonylContact O-C 3.59Å; T721-C733 VanDerWaalsContact O-CA 3.29Å; T721-C733 WeakPolarHBondContact O-CA 3Å; S730-C733 WeakPolarHBondContact O-CB 3.44Å; S730-C733 PolarHBondContact O-N 2.79Å; V731-C733 PolarHBondContact O-N 3.35Å
734	S	62.1	Low	74.5	Confident	59 Å²	59	69.5 Å²	69.5	41%	0.413	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-92.5	150.1	177.6	-63.2	0	0	0	0	111.1	Y720 T721 E732	Y720-S734 WeakPolarHBondContact CA-O 3.43Å; T721-S734 PolarHBondContact N-O 3.16Å; T721-S734 PolarHBondContact O-N 2.81Å; E732-S734 PolarHBondContact O-N 2.59Å
735	A	52.9	Low	75	Confident	63 Å²	63	67.1 Å²	67.1	52%	0.521	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-72.1	132.8	166.9	0	0	0	0	0	108.2	Y720	Y720-A735 HydrophobicContact CD1-CB 4.23Å; Y720-A735 HydrophobicContact CE1-CB 4.3Å
736	P	54.3	Low	74.7	Confident	51 Å²	51	62 Å²	62	33%	0.331	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-62.4	146.9	170.1	27.6	-32.3	0	0	0	109.5	T721 R738 Y745	T721-P736 HydrophobicContact CG2-CB 4.33Å; T721-P736 HydrophobicContact CG2-CG 4.4Å; P736-R738 PolarHBondContact O-N 3.27Å; P736-Y745 HydrophobicContact CB-CD1 4.11Å; P736-Y745 HydrophobicContact CB-CE1 4.15Å; P736-Y745 HydrophobicContact CB-CG 4.3Å
737	E	56.3	Low	73.9	Confident	147 Å²	147	65.5 Å²	65.5	69%	0.687	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-58.1	136.5	173.7	-73.9	-168.3	144.3	0	0	109.9	C739	E737-C739 PolarHBondContact O-N 3.05Å
738	R	66	Low	72.8	Confident	185 Å²	185	71.4 Å²	71.4	70%	0.698	38%	0.381	S	S	*	.			trans	-76.1	100.9	-178	-67.2	-173.8	179.1	-155.9	-0.6	109.7	P736 Q740 E764	P736-R738 PolarHBondContact O-N 3.27Å; R738-Q740 PolarHBondContact O-N 3.43Å; R738-E764 HydrophobicContact CB-CG 4.33Å
739	C	76.5	Confident	72	Confident	1 Å²	1	68 Å²	68	1%	0.007	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-62.9	131	177	-61.7	0	0	0	0	112	E737 T743 F744 Y745 C752 E764 G765	E737-C739 PolarHBondContact O-N 3.05Å; C739-T743 WeakPolarHBondContact CB-OG1 3.48Å; C739-F744 VanDerWaalsContact SG-C 3.55Å; C739-Y745 VanDerWaalsContact SG-CA 3.5Å; C739-Y745 VanDerWaalsContact SG-CB 3.56Å; C739-Y745 PolarHBondContact SG-N 3.04Å; C739-Y745 VanDerWaalsContact SG-N 3.37Å; C739-C752 WeakPolarHBondContact CA-SG 3.49Å; C739-C752 HydrophobicContact CB-CB 3.8Å; C739-C752 WeakPolarHBondContact CB-SG 3.24Å; C739-C752 VanDerWaalsContact SG-CA 3.53Å; C739-C752 WeakPolarHBondContact SG-CB 3.39Å; C739-C752 CovalentContact SG-SG 2.04Å; C739-C752 PolarHBondContact SG-SG 2.81Å; C739-E764 CarbonylContact O-C 3.46Å; C739-E764 WeakPolarHBondContact O-CA 3.38Å; C739-G765 PolarHBondContact O-N 3.02Å
740	Q	83.2	Confident	71.4	Confident	126 Å²	126	68.3 Å²	68.3	59%	0.589	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-61.9	160.7	-179	-68.5	-169	-4.5	0	0	112.2	R738 G742 T743 Q761	R738-Q740 PolarHBondContact O-N 3.43Å; Q740-G742 PolarHBondContact O-N 3.39Å; Q740-G742 VanDerWaalsContact O-N 3.13Å; Q740-T743 PolarHBondContact N-OG1 3.02Å; Q740-T743 PolarHBondContact O-N 3.48Å; Q740-T743 PolarHBondContact O-OG1 2.78Å; Q740-Q761 PolarHBondContact O-NE2 3.03Å; Q740-Q761 VanDerWaalsContact O-NE2 3.13Å
741	A	85.6	Confident	71.2	Confident	21 Å²	21	66.9 Å²	66.9	17%	0.174	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	121.1	178.2	0	0	0	0	0	111.4	Q761 R784	A741-Q761 VanDerWaalsContact CA-OE1 3.29Å; A741-R784 HydrophobicContact CB-CG 3.93Å; A741-R784 WeakPolarHBondContact O-CG 3.49Å; A741-R784 PolarHBondContact O-NE 3.41Å; A741-R784 PolarHBondContact O-NH2 2.89Å
742	G	86.2	Confident	71.5	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.01	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	108.5	-11.1	-172.2	0	0	0	0	0	115.1	Q740 C755 Q761 E782	Q740-G742 PolarHBondContact O-N 3.39Å; Q740-G742 VanDerWaalsContact O-N 3.13Å; G742-C755 WeakPolarHBondContact O-CB 3.09Å; G742-C755 PolarHBondContact O-N 2.79Å; G742-C755 PolarHBondContact O-SG 3.01Å; G742-Q761 PolarHBondContact N-O 3.34Å; G742-E782 WeakPolarHBondContact CA-O 3.43Å; G742-E782 WeakPolarHBondContact O-CA 3.07Å
743	T	88.7	Confident	72.2	Confident	23 Å²	23	62 Å²	62	14%	0.141	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	159.4	178.2	62.9	0	0	0	0	112	C739 Q740 L753 Q761	C739-T743 WeakPolarHBondContact CB-OG1 3.48Å; Q740-T743 PolarHBondContact N-OG1 3.02Å; Q740-T743 PolarHBondContact O-N 3.48Å; Q740-T743 PolarHBondContact O-OG1 2.78Å; T743-L753 CarbonylContact C-O 3.56Å; T743-L753 WeakPolarHBondContact CA-O 3.42Å; T743-L753 WeakPolarHBondContact CB-O 3.22Å; T743-Q761 WeakPolarHBondContact O-CG 3.34Å; T743-Q761 PolarHBondContact O-NE2 3.12Å
744	F	83	Confident	73.1	Confident	43 Å²	43	64.1 Å²	64.1	19%	0.189	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	153	177.6	75.6	-77.3	0	0	0	110.7	C739 D746 C752 L753 C769	C739-F744 VanDerWaalsContact SG-C 3.55Å; F744-D746 HydrophobicContact CD2-CB 4.5Å; F744-D746 HydrophobicContact CE2-CB 3.81Å; F744-D746 HydrophobicContact CZ-CB 4.24Å; F744-D746 PolarHBondContact O-N 3.26Å; F744-C752 CarbonylContact O-C 3.48Å; F744-C752 VanDerWaalsContact O-CA 3.28Å; F744-C752 WeakPolarHBondContact O-CA 3.25Å; F744-L753 HydrophobicContact CD1-CB 4.12Å; F744-L753 VanDerWaalsContact CD1-O 3.29Å; F744-L753 WeakPolarHBondContact CD1-O 3.28Å; F744-L753 HydrophobicContact CE1-CB 3.57Å; F744-L753 HydrophobicContact CZ-CB 3.91Å; F744-L753 HydrophobicContact CZ-CD1 4.1Å; F744-L753 PolarHBondContact N-O 3.48Å; F744-L753 PolarHBondContact O-N 2.65Å; F744-C769 WeakPolarHBondContact CD1-SG 3.13Å
745	Y	77	Confident	74.3	Confident	39 Å²	39	61.3 Å²	61.3	15%	0.153	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	108	179.2	-167.3	-100.9	0	0	0	110.5	P736 C739 A750	P736-Y745 HydrophobicContact CB-CD1 4.11Å; P736-Y745 HydrophobicContact CB-CE1 4.15Å; P736-Y745 HydrophobicContact CB-CG 4.3Å; C739-Y745 VanDerWaalsContact SG-CA 3.5Å; C739-Y745 VanDerWaalsContact SG-CB 3.56Å; C739-Y745 PolarHBondContact SG-N 3.04Å; C739-Y745 VanDerWaalsContact SG-N 3.37Å; Y745-A750 WeakPolarHBondContact OH-CA 3.26Å; Y745-A750 PolarHBondContact OH-O 2.95Å
746	D	73.4	Confident	75.8	Confident	36 Å²	36	61.7 Å²	61.7	19%	0.193	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	113.4	174.7	-174.4	-32.5	0	0	0	109.6	F744 T748 V749 A750 A751 L753	F744-D746 HydrophobicContact CD2-CB 4.5Å; F744-D746 HydrophobicContact CE2-CB 3.81Å; F744-D746 HydrophobicContact CZ-CB 4.24Å; F744-D746 PolarHBondContact O-N 3.26Å; D746-T748 PolarHBondContact O-N 3.16Å; D746-T748 WeakPolarHBondContact OD1-CA 3.4Å; D746-T748 WeakPolarHBondContact OD1-CB 3.45Å; D746-T748 PolarHBondContact OD1-N 3.13Å; D746-T748 PolarHBondContact OD1-OG1 3.24Å; D746-V749 HydrophobicContact CB-CG2 3.69Å; D746-V749 PolarHBondContact O-N 2.86Å; D746-A750 WeakPolarHBondContact O-CA 3.41Å; D746-A750 PolarHBondContact O-N 2.79Å; D746-A751 PolarHBondContact N-O 2.74Å; D746-A751 PolarHBondContact O-N 2.79Å; D746-L753 HydrophobicContact CB-CD1 3.64Å; D746-L753 HydrophobicContact CB-CG 3.9Å; D746-L753 WeakPolarHBondContact OD2-CD1 3.37Å
747	V	61.5	Low	77.1	Confident	85 Å²	85	63 Å²	63	52%	0.515	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-24.6	-177	-153.9	0	0	0	0	112.4
748	T	59.9	Low	78.2	Confident	128 Å²	128	57.8 Å²	57.8	79%	0.785	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-31.6	-176.7	71	0	0	0	0	112.9	D746	D746-T748 PolarHBondContact O-N 3.16Å; D746-T748 WeakPolarHBondContact OD1-CA 3.4Å; D746-T748 WeakPolarHBondContact OD1-CB 3.45Å; D746-T748 PolarHBondContact OD1-N 3.13Å; D746-T748 PolarHBondContact OD1-OG1 3.24Å
749	V	69.6	Low	79.2	Confident	87 Å²	87	50.1 Å²	50.1	53%	0.527	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-1.9	173.3	-88	0	0	0	0	113.4	D746 A751 L753	D746-V749 HydrophobicContact CB-CG2 3.69Å; D746-V749 PolarHBondContact O-N 2.86Å; V749-A751 PolarHBondContact O-N 3.3Å; V749-L753 HydrophobicContact CG2-CD1 3.96Å; V749-L753 HydrophobicContact CG2-CD2 4.36Å; V749-L753 HydrophobicContact CG2-CG 4.21Å
750	A	67.1	Low	79.8	Confident	47 Å²	47	52.4 Å²	52.4	39%	0.388	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	33.7	-178.6	0	0	0	0	0	114.1	Y745 D746	Y745-A750 WeakPolarHBondContact OH-CA 3.26Å; Y745-A750 PolarHBondContact OH-O 2.95Å; D746-A750 WeakPolarHBondContact O-CA 3.41Å; D746-A750 PolarHBondContact O-N 2.79Å
751	A	74.1	Confident	79.8	Confident	39 Å²	39	46.4 Å²	46.4	32%	0.322	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	159	-171	0	0	0	0	0	112.6	D746 V749 L753	D746-A751 PolarHBondContact N-O 2.74Å; D746-A751 PolarHBondContact O-N 2.79Å; V749-A751 PolarHBondContact O-N 3.3Å; A751-L753 PolarHBondContact O-N 3.14Å
752	C	82.9	Confident	79.7	Confident	48 Å²	48	48.1 Å²	48.1	32%	0.324	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	114.2	172.8	-63.1	0	0	0	0	111.3	C739 F744	C739-C752 WeakPolarHBondContact CA-SG 3.49Å; C739-C752 HydrophobicContact CB-CB 3.8Å; C739-C752 WeakPolarHBondContact CB-SG 3.24Å; C739-C752 VanDerWaalsContact SG-CA 3.53Å; C739-C752 WeakPolarHBondContact SG-CB 3.39Å; C739-C752 CovalentContact SG-SG 2.04Å; C739-C752 PolarHBondContact SG-SG 2.81Å; F744-C752 CarbonylContact O-C 3.48Å; F744-C752 VanDerWaalsContact O-CA 3.28Å; F744-C752 WeakPolarHBondContact O-CA 3.25Å
753	L	85.2	Confident	79.3	Confident	60 Å²	60	54.4 Å²	54.4	31%	0.314	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	148.3	177.4	-66.7	-172.4	0	0	0	112.3	T743 F744 D746 V749 A751	T743-L753 CarbonylContact C-O 3.56Å; T743-L753 WeakPolarHBondContact CA-O 3.42Å; T743-L753 WeakPolarHBondContact CB-O 3.22Å; F744-L753 HydrophobicContact CD1-CB 4.12Å; F744-L753 VanDerWaalsContact CD1-O 3.29Å; F744-L753 WeakPolarHBondContact CD1-O 3.28Å; F744-L753 HydrophobicContact CE1-CB 3.57Å; F744-L753 HydrophobicContact CZ-CB 3.91Å; F744-L753 HydrophobicContact CZ-CD1 4.1Å; F744-L753 PolarHBondContact N-O 3.48Å; F744-L753 PolarHBondContact O-N 2.65Å; D746-L753 HydrophobicContact CB-CD1 3.64Å; D746-L753 HydrophobicContact CB-CG 3.9Å; D746-L753 WeakPolarHBondContact OD2-CD1 3.37Å; V749-L753 HydrophobicContact CG2-CD1 3.96Å; V749-L753 HydrophobicContact CG2-CD2 4.36Å; V749-L753 HydrophobicContact CG2-CG 4.21Å; A751-L753 PolarHBondContact O-N 3.14Å
754	P	88.9	Confident	78.9	Confident	58 Å²	58	59.3 Å²	59.3	38%	0.377	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	139	175.8	30.1	-36.6	0	0	0	111.8	P781 E782	P754-P781 HydrophobicContact CB-CB 4.3Å; P754-E782 HydrophobicContact CB-CG 3.41Å; P754-E782 VanDerWaalsContact CB-CG 3.41Å
755	C	87.5	Confident	78.2	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-63.3	129.4	174.8	-73.6	0	0	0	0	111.5	G742 Q761 C769 P781 E782	G742-C755 WeakPolarHBondContact O-CB 3.09Å; G742-C755 PolarHBondContact O-N 2.79Å; G742-C755 PolarHBondContact O-SG 3.01Å; C755-Q761 WeakPolarHBondContact SG-CB 3.4Å; C755-C769 WeakPolarHBondContact CA-SG 3.18Å; C755-C769 HydrophobicContact CB-CB 3.79Å; C755-C769 WeakPolarHBondContact CB-SG 3.27Å; C755-C769 WeakPolarHBondContact SG-CB 3.12Å; C755-C769 CovalentContact SG-SG 2.03Å; C755-C769 PolarHBondContact SG-SG 2.9Å; C755-P781 WeakPolarHBondContact O-CA 3.45Å; C755-E782 PolarHBondContact O-N 2.82Å
756	P	84.3	Confident	77.7	Confident	71 Å²	71	58.6 Å²	58.6	46%	0.461	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-66	161.4	179.5	25	-33.5	0	0	0	112.4	T759	P756-T759 WeakPolarHBondContact CD-OG1 3.17Å; P756-T759 HydrophobicContact CG-CG2 4.17Å; P756-T759 WeakPolarHBondContact CG-OG1 3.31Å; P756-T759 WeakPolarHBondContact O-CA 3.21Å; P756-T759 PolarHBondContact O-N 2.85Å; P756-T759 VanDerWaalsContact O-O 3.05Å; P756-T759 PolarHBondContact O-OG1 2.71Å
757	V	82.6	Confident	77.7	Confident	78 Å²	78	62.2 Å²	62.2	47%	0.473	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	143.1	178.4	-179.3	0	0	0	0	110.7	T759 T778 P781	V757-T759 PolarHBondContact O-N 3.3Å; V757-T778 WeakPolarHBondContact CA-OG1 3.03Å; V757-P781 HydrophobicContact CG2-CG 4.23Å
758	A	79	Confident	78.6	Confident	37 Å²	37	63.6 Å²	63.6	31%	0.306	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	11	-168.7	0	0	0	0	0	115.6	C772 T777 T778	A758-C772 WeakPolarHBondContact O-CB 3.39Å; A758-C772 PolarHBondContact O-N 3.42Å; A758-T777 WeakPolarHBondContact CA-OG1 3.47Å; A758-T777 PolarHBondContact N-OG1 3.29Å; A758-T778 PolarHBondContact N-OG1 3.09Å
759	T	87.9	Confident	79.7	Confident	24 Å²	24	58.9 Å²	58.9	15%	0.147	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	148.7	166.2	76.4	0	0	0	0	111.1	P756 V757 C769 I770 T778	P756-T759 WeakPolarHBondContact CD-OG1 3.17Å; P756-T759 HydrophobicContact CG-CG2 4.17Å; P756-T759 WeakPolarHBondContact CG-OG1 3.31Å; P756-T759 WeakPolarHBondContact O-CA 3.21Å; P756-T759 PolarHBondContact O-N 2.85Å; P756-T759 VanDerWaalsContact O-O 3.05Å; P756-T759 PolarHBondContact O-OG1 2.71Å; V757-T759 PolarHBondContact O-N 3.3Å; T759-C769 WeakPolarHBondContact OG1-CB 3.44Å; T759-I770 CarbonylContact C-O 3.58Å; T759-I770 WeakPolarHBondContact CA-O 3.27Å; T759-I770 WeakPolarHBondContact CB-O 3.38Å; T759-T778 WeakPolarHBondContact O-CG2 2.95Å
760	Y	88.8	Confident	80.5	Confident	50 Å²	50	57.2 Å²	57.2	20%	0.196	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	155.5	-177.9	77.7	-71.5	0	0	0	111.4	P762 I770 S783 R784 C786	Y760-P762 HydrophobicContact CD2-CB 4.23Å; Y760-P762 HydrophobicContact CD2-CG 4.24Å; Y760-P762 HydrophobicContact CE2-CB 4.03Å; Y760-P762 HydrophobicContact CE2-CG 3.84Å; Y760-I770 HydrophobicContact CD1-CB 3.88Å; Y760-I770 HydrophobicContact CD1-CG2 4.3Å; Y760-I770 WeakPolarHBondContact CD1-O 3.37Å; Y760-I770 HydrophobicContact CE1-CB 3.61Å; Y760-I770 HydrophobicContact CE1-CG2 3.58Å; Y760-I770 HydrophobicContact CE2-CD1 4.41Å; Y760-I770 PolarHBondContact N-O 3.25Å; Y760-I770 WeakPolarHBondContact O-CB 3.29Å; Y760-I770 PolarHBondContact O-N 3.19Å; Y760-S783 VanDerWaalsContact CA-O 3.26Å; Y760-S783 WeakPolarHBondContact CA-O 3.5Å; Y760-S783 VanDerWaalsContact CB-O 3.24Å; Y760-S783 WeakPolarHBondContact CB-O 3.44Å; Y760-R784 WeakPolarHBondContact CD2-O 3.39Å; Y760-C786 WeakPolarHBondContact CD1-SG 3.26Å; Y760-C786 VanDerWaalsContact CE1-SG 3.6Å
761	Q	83.3	Confident	81.2	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	34%	0.337	C	S	.	.			trans	-128.6	116.6	171.4	-170.2	-87.4	56.1	0	0	108.2	Q740 A741 G742 T743 C755 M763 Q766 S783 R784	Q740-Q761 PolarHBondContact O-NE2 3.03Å; Q740-Q761 VanDerWaalsContact O-NE2 3.13Å; A741-Q761 VanDerWaalsContact CA-OE1 3.29Å; G742-Q761 PolarHBondContact N-O 3.34Å; T743-Q761 WeakPolarHBondContact O-CG 3.34Å; T743-Q761 PolarHBondContact O-NE2 3.12Å; C755-Q761 WeakPolarHBondContact SG-CB 3.4Å; Q761-M763 PolarHBondContact NE2-O 2.85Å; Q761-M763 PolarHBondContact OE1-O 3.45Å; Q761-Q766 HydrophobicContact CG-CB 3.76Å; Q761-Q766 HydrophobicContact CG-CG 4.24Å; Q761-S783 PolarHBondContact N-O 2.82Å; Q761-R784 WeakPolarHBondContact O-CA 3.02Å
762	P	82.1	Confident	81.5	Confident	56 Å²	56	58.4 Å²	58.4	36%	0.364	33%	0.325	S	S	.	.			trans	-94.9	-14.5	-176.1	35.2	-34.7	0	0	0	114.9	Y760 I770	Y760-P762 HydrophobicContact CD2-CB 4.23Å; Y760-P762 HydrophobicContact CD2-CG 4.24Å; Y760-P762 HydrophobicContact CE2-CB 4.03Å; Y760-P762 HydrophobicContact CE2-CG 3.84Å; P762-I770 HydrophobicContact CG-CD1 3.92Å
763	M	77.7	Confident	81	Confident	134 Å²	134	59.5 Å²	59.5	66%	0.66	33%	0.331	S	S	*	.	S	Bend	trans	-128.2	124	-170.4	-70.2	-172.9	67.4	0	0	113	Q761 G765 Q766	Q761-M763 PolarHBondContact NE2-O 2.85Å; Q761-M763 PolarHBondContact OE1-O 3.45Å; M763-G765 PolarHBondContact O-N 3.36Å; M763-Q766 WeakPolarHBondContact O-CB 3.09Å; M763-Q766 PolarHBondContact O-N 3.45Å
764	E	80.8	Confident	80	Confident	125 Å²	125	57.7 Å²	57.7	58%	0.584	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	132	176.3	-174.7	173	-123.2	0	0	112.8	R738 C739	R738-E764 HydrophobicContact CB-CG 4.33Å; C739-E764 CarbonylContact O-C 3.46Å; C739-E764 WeakPolarHBondContact O-CA 3.38Å
765	G	68.1	Low	78.6	Confident	40 Å²	40	58.4 Å²	58.4	41%	0.412	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	8.6	-177.9	0	0	0	0	0	115.6	C739 M763	C739-G765 PolarHBondContact O-N 3.02Å; M763-G765 PolarHBondContact O-N 3.36Å
766	Q	67.8	Low	77.8	Confident	27 Å²	27	60.8 Å²	60.8	13%	0.126	34%	0.34	C	S	.	.			trans	-78	134.3	173.9	-168.3	177.5	-16.2	0	0	111.3	Q761 M763 F768 I770	Q761-Q766 HydrophobicContact CG-CB 3.76Å; Q761-Q766 HydrophobicContact CG-CG 4.24Å; M763-Q766 WeakPolarHBondContact O-CB 3.09Å; M763-Q766 PolarHBondContact O-N 3.45Å; Q766-F768 HydrophobicContact CG-CD1 4.01Å; Q766-F768 HydrophobicContact CG-CE1 3.93Å; Q766-F768 HydrophobicContact CG-CG 4.49Å; Q766-F768 HydrophobicContact CG-CZ 4.38Å; Q766-F768 WeakPolarHBondContact CG-O 3.24Å; Q766-F768 PolarHBondContact NE2-O 3.29Å; Q766-F768 VanDerWaalsContact NE2-O 3.15Å; Q766-I770 VanDerWaalsContact NE2-CG1 3.3Å
767	D	72.3	Confident	77.5	Confident	112 Å²	112	58.6 Å²	58.6	60%	0.599	33%	0.325	S	S	*	.	S	Bend	trans	-91.9	2	-175	54.8	-17.8	0	0	0	114.1
768	F	80.1	Confident	77.1	Confident	115 Å²	115	54.9 Å²	54.9	50%	0.504	30%	0.303	S	S	.	.	S	Bend	trans	-144.4	154.2	175.7	66.4	-82.8	0	0	0	112.2	Q766 I770	Q766-F768 HydrophobicContact CG-CD1 4.01Å; Q766-F768 HydrophobicContact CG-CE1 3.93Å; Q766-F768 HydrophobicContact CG-CG 4.49Å; Q766-F768 HydrophobicContact CG-CZ 4.38Å; Q766-F768 WeakPolarHBondContact CG-O 3.24Å; Q766-F768 PolarHBondContact NE2-O 3.29Å; Q766-F768 VanDerWaalsContact NE2-O 3.15Å; F768-I770 HydrophobicContact CE2-CG1 4.11Å
769	C	84.3	Confident	76.5	Confident	28 Å²	28	55.9 Å²	55.9	19%	0.189	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-88.9	137.3	170.7	-58.6	0	0	0	0	111.2	F744 C755 T759	F744-C769 WeakPolarHBondContact CD1-SG 3.13Å; C755-C769 WeakPolarHBondContact CA-SG 3.18Å; C755-C769 HydrophobicContact CB-CB 3.79Å; C755-C769 WeakPolarHBondContact CB-SG 3.27Å; C755-C769 WeakPolarHBondContact SG-CB 3.12Å; C755-C769 CovalentContact SG-SG 2.03Å; C755-C769 PolarHBondContact SG-SG 2.9Å; T759-C769 WeakPolarHBondContact OG1-CB 3.44Å
770	I	85.6	Confident	75.9	Confident	52 Å²	52	57 Å²	57	27%	0.267	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	125.1	178.1	-48.4	179.9	0	0	0	108.6	T759 Y760 P762 Q766 F768 C772	T759-I770 CarbonylContact C-O 3.58Å; T759-I770 WeakPolarHBondContact CA-O 3.27Å; T759-I770 WeakPolarHBondContact CB-O 3.38Å; Y760-I770 HydrophobicContact CD1-CB 3.88Å; Y760-I770 HydrophobicContact CD1-CG2 4.3Å; Y760-I770 WeakPolarHBondContact CD1-O 3.37Å; Y760-I770 HydrophobicContact CE1-CB 3.61Å; Y760-I770 HydrophobicContact CE1-CG2 3.58Å; Y760-I770 HydrophobicContact CE2-CD1 4.41Å; Y760-I770 PolarHBondContact N-O 3.25Å; Y760-I770 WeakPolarHBondContact O-CB 3.29Å; Y760-I770 PolarHBondContact O-N 3.19Å; P762-I770 HydrophobicContact CG-CD1 3.92Å; Q766-I770 VanDerWaalsContact NE2-CG1 3.3Å; F768-I770 HydrophobicContact CE2-CG1 4.11Å; I770-C772 PolarHBondContact O-N 3.26Å
771	K	83	Confident	75.3	Confident	102 Å²	102	57.7 Å²	57.7	44%	0.443	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	136.5	171.9	-166.8	175.7	-177.9	-180	0	109.3	E798	K771-E798 IonicContact NZ-OE2 2.68Å
772	C	80.5	Confident	75.1	Confident	10 Å²	10	63.5 Å²	63.5	7%	0.068	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-62	128.7	179.7	-80.1	0	0	0	0	111	A758 I770 L776 C786	A758-C772 WeakPolarHBondContact O-CB 3.39Å; A758-C772 PolarHBondContact O-N 3.42Å; I770-C772 PolarHBondContact O-N 3.26Å; C772-L776 HydrophobicContact CB-CB 4.15Å; C772-L776 WeakPolarHBondContact CB-O 3.48Å; C772-C786 WeakPolarHBondContact CA-SG 3.38Å; C772-C786 HydrophobicContact CB-CB 3.74Å; C772-C786 WeakPolarHBondContact CB-SG 3.13Å; C772-C786 WeakPolarHBondContact SG-CB 3.49Å; C772-C786 CovalentContact SG-SG 2.03Å; C772-C786 PolarHBondContact SG-SG 2.91Å
773	P	71.6	Confident	75.1	Confident	70 Å²	70	61.4 Å²	61.4	46%	0.455	35%	0.35	S	S	.	.	S	Bend	trans	-74.6	132.8	-177.5	27.1	-31.7	0	0	0	111	L776	P773-L776 HydrophobicContact CG-CD1 4.19Å; P773-L776 WeakPolarHBondContact O-CB 3.39Å; P773-L776 WeakPolarHBondContact O-CD1 3.4Å; P773-L776 WeakPolarHBondContact O-CG 3.21Å
774	G	64.3	Low	75.5	Confident	22 Å²	22	61.7 Å²	61.7	23%	0.227	34%	0.343	C	S	.	.	S	Bend	trans	76.1	-149.3	177.1	0	0	0	0	0	113.5	L776 S813	G774-L776 PolarHBondContact O-N 3.16Å; G774-S813 WeakPolarHBondContact CA-O 3.43Å
775	N	58.9	Low	75.7	Confident	74 Å²	74	60.1 Å²	60.1	40%	0.396	34%	0.343	S	S	.	.	S	Bend	trans	-83.1	30.6	172.5	-64	26.1	0	0	0	111.9	W814	N775-W814 VanDerWaalsContact OD1-CD1 3.25Å
776	L	71.7	Confident	76.3	Confident	49 Å²	49	59.5 Å²	59.5	26%	0.257	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	149.4	174.1	-53.9	178.3	0	0	0	109.3	C772 P773 G774 C786 R787 K788	C772-L776 HydrophobicContact CB-CB 4.15Å; C772-L776 WeakPolarHBondContact CB-O 3.48Å; P773-L776 HydrophobicContact CG-CD1 4.19Å; P773-L776 WeakPolarHBondContact O-CB 3.39Å; P773-L776 WeakPolarHBondContact O-CD1 3.4Å; P773-L776 WeakPolarHBondContact O-CG 3.21Å; G774-L776 PolarHBondContact O-N 3.16Å; L776-C786 HydrophobicContact CB-CB 3.57Å; L776-C786 HydrophobicContact CD1-CB 3.91Å; L776-C786 HydrophobicContact CG-CB 4.38Å; L776-R787 CarbonylContact C-O 3.59Å; L776-R787 VanDerWaalsContact CA-O 3.23Å; L776-R787 WeakPolarHBondContact CA-O 3.48Å; L776-K788 HydrophobicContact CD2-CB 4.15Å; L776-K788 HydrophobicContact CD2-CG 3.32Å
777	T	76.3	Confident	76.5	Confident	26 Å²	26	64.5 Å²	64.5	16%	0.16	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	162.2	169.1	-179.4	0	0	0	0	109.4	A758 R787 V789	A758-T777 WeakPolarHBondContact CA-OG1 3.47Å; A758-T777 PolarHBondContact N-OG1 3.29Å; T777-R787 PolarHBondContact N-O 3.3Å; T777-R787 WeakPolarHBondContact O-CA 3.41Å; T777-R787 PolarHBondContact O-N 3.34Å; T777-V789 HydrophobicContact CG2-CB 3.66Å; T777-V789 HydrophobicContact CG2-CG2 3.18Å
778	T	75	Confident	75.8	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.352	C	S	.	.			trans	-79.5	-23.2	-179.3	41.5	0	0	0	0	113.4	V757 A758 T759 S780 S783 R787	V757-T778 WeakPolarHBondContact CA-OG1 3.03Å; A758-T778 PolarHBondContact N-OG1 3.09Å; T759-T778 WeakPolarHBondContact O-CG2 2.95Å; T778-S780 VanDerWaalsContact CB-O 3.29Å; T778-S780 WeakPolarHBondContact CB-O 3.47Å; T778-S780 PolarHBondContact O-N 3.45Å; T778-S780 PolarHBondContact OG1-O 3.29Å; T778-S783 PolarHBondContact O-OG 2.05Å; T778-S783 VanDerWaalsContact O-OG 3.13Å; T778-R787 VanDerWaalsContact O-CZ 3.31Å; T778-R787 PolarHBondContact O-NE 3.46Å; T778-R787 PolarHBondContact O-NH2 3.12Å; T778-R787 VanDerWaalsContact O-NH2 3.11Å
779	G	67.4	Low	74.4	Confident	58 Å²	58	65.6 Å²	65.6	60%	0.598	36%	0.357	S	S	*	.	S	Bend	trans	73.1	-24.5	-178.7	0	0	0	0	0	114.5
780	S	74.8	Confident	72.7	Confident	46 Å²	46	69.8 Å²	69.8	32%	0.322	38%	0.377	S	S	.	.	S	Bend	trans	-142.5	161.2	170.5	67.9	0	0	0	0	109.7	T778 S783	T778-S780 VanDerWaalsContact CB-O 3.29Å; T778-S780 WeakPolarHBondContact CB-O 3.47Å; T778-S780 PolarHBondContact O-N 3.45Å; T778-S780 PolarHBondContact OG1-O 3.29Å; S780-S783 PolarHBondContact O-OG 2.83Å; S780-S783 PolarHBondContact OG-OG 3.48Å
781	P	75.3	Confident	71	Confident	66 Å²	66	77.8 Å²	77.8	43%	0.429	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	170.3	158.3	-21.6	34	0	0	0	112.1	P754 C755 V757 S783	P754-P781 HydrophobicContact CB-CB 4.3Å; C755-P781 WeakPolarHBondContact O-CA 3.45Å; V757-P781 HydrophobicContact CG2-CG 4.23Å; P781-S783 PolarHBondContact O-N 3.29Å
782	E	80.5	Confident	69.6	Low	122 Å²	122	78.3 Å²	78.3	57%	0.57	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	5.1	176.2	-58.9	-177.5	167.9	0	0	116.6	G742 P754 C755 R784	G742-E782 WeakPolarHBondContact CA-O 3.43Å; G742-E782 WeakPolarHBondContact O-CA 3.07Å; P754-E782 HydrophobicContact CB-CG 3.41Å; P754-E782 VanDerWaalsContact CB-CG 3.41Å; C755-E782 PolarHBondContact O-N 2.82Å; E782-R784 PolarHBondContact O-N 2.61Å
783	S	81.4	Confident	68.5	Low	11 Å²	11	83 Å²	83	8%	0.077	45%	0.449	C	S	.	.			trans	-69.5	137.1	-177	-72.2	0	0	0	0	112.2	Y760 Q761 T778 S780 P781 R787	Y760-S783 VanDerWaalsContact CA-O 3.26Å; Y760-S783 WeakPolarHBondContact CA-O 3.5Å; Y760-S783 VanDerWaalsContact CB-O 3.24Å; Y760-S783 WeakPolarHBondContact CB-O 3.44Å; Q761-S783 PolarHBondContact N-O 2.82Å; T778-S783 PolarHBondContact O-OG 2.05Å; T778-S783 VanDerWaalsContact O-OG 3.13Å; S780-S783 PolarHBondContact O-OG 2.83Å; S780-S783 PolarHBondContact OG-OG 3.48Å; P781-S783 PolarHBondContact O-N 3.29Å; S783-R787 PolarHBondContact OG-NH2 2.9Å
784	R	85.9	Confident	68.2	Low	140 Å²	140	85.7 Å²	85.7	53%	0.528	46%	0.46	S	S	.	.	S	Bend	trans	-89.3	-6.7	176.9	-59.4	176.9	-176.6	176.2	-1.4	114.2	A741 Y760 Q761 E782	A741-R784 HydrophobicContact CB-CG 3.93Å; A741-R784 WeakPolarHBondContact O-CG 3.49Å; A741-R784 PolarHBondContact O-NE 3.41Å; A741-R784 PolarHBondContact O-NH2 2.89Å; Y760-R784 WeakPolarHBondContact CD2-O 3.39Å; Q761-R784 WeakPolarHBondContact O-CA 3.02Å; E782-R784 PolarHBondContact O-N 2.61Å
785	T	84.3	Confident	68.2	Low	93 Å²	93	87.7 Å²	87.7	57%	0.571	48%	0.48	S	S	*	.	S	Bend	trans	-150.2	155.2	-177.3	61.4	0	0	0	0	110.1
786	C	81.4	Confident	68.5	Low	27 Å²	27	89.5 Å²	89.5	18%	0.182	49%	0.489	C	S	.	.			trans	-96.7	141.6	174.9	-59	0	0	0	0	111.7	Y760 C772 L776	Y760-C786 WeakPolarHBondContact CD1-SG 3.26Å; Y760-C786 VanDerWaalsContact CE1-SG 3.6Å; C772-C786 WeakPolarHBondContact CA-SG 3.38Å; C772-C786 HydrophobicContact CB-CB 3.74Å; C772-C786 WeakPolarHBondContact CB-SG 3.13Å; C772-C786 WeakPolarHBondContact SG-CB 3.49Å; C772-C786 CovalentContact SG-SG 2.03Å; C772-C786 PolarHBondContact SG-SG 2.91Å; L776-C786 HydrophobicContact CB-CB 3.57Å; L776-C786 HydrophobicContact CD1-CB 3.91Å; L776-C786 HydrophobicContact CG-CB 4.38Å
787	R	71.9	Confident	68.5	Low	132 Å²	132	89.9 Å²	89.9	50%	0.498	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	150.7	-175.8	-34.4	-177	-152.4	-164.1	5.6	108.9	L776 T777 T778 S783 V789	L776-R787 CarbonylContact C-O 3.59Å; L776-R787 VanDerWaalsContact CA-O 3.23Å; L776-R787 WeakPolarHBondContact CA-O 3.48Å; T777-R787 PolarHBondContact N-O 3.3Å; T777-R787 WeakPolarHBondContact O-CA 3.41Å; T777-R787 PolarHBondContact O-N 3.34Å; T778-R787 VanDerWaalsContact O-CZ 3.31Å; T778-R787 PolarHBondContact O-NE 3.46Å; T778-R787 PolarHBondContact O-NH2 3.12Å; T778-R787 VanDerWaalsContact O-NH2 3.11Å; S783-R787 PolarHBondContact OG-NH2 2.9Å; R787-V789 PolarHBondContact O-N 2.8Å
788	K	57	Low	68.3	Low	150 Å²	150	92.2 Å²	92.2	65%	0.652	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	122.2	167	-81.6	-175	173.4	177	0	108.5	L776	L776-K788 HydrophobicContact CD2-CB 4.15Å; L776-K788 HydrophobicContact CD2-CG 3.32Å
789	V	51.9	Low	68.1	Low	99 Å²	99	93.9 Å²	93.9	60%	0.6	51%	0.509	S	S	*	.			trans	-84.8	144.3	163.1	152.8	0	0	0	0	109.9	T777 R787	T777-V789 HydrophobicContact CG2-CB 3.66Å; T777-V789 HydrophobicContact CG2-CG2 3.18Å; R787-V789 PolarHBondContact O-N 2.8Å
790	D	47.5	Very low	68	Low	116 Å²	116	92.8 Å²	92.8	62%	0.62	49%	0.491	S	S	*	.			trans	-107.8	137.8	-158.9	-160.4	26.6	0	0	0	110.4
791	R	50.4	Low	67.6	Low	220 Å²	220	94.7 Å²	94.7	83%	0.83	50%	0.498	S	S	*	.			trans	59.8	74.5	163.5	-54.4	169.9	-157.7	-140.7	1.4	118.6
792	T	53.2	Low	66.8	Low	114 Å²	114	95.6 Å²	95.6	70%	0.699	49%	0.494	S	S	*	.			trans	-114.6	152.8	148.8	60.2	0	0	0	0	110.7	N794	T792-N794 VanDerWaalsContact C-N 3.31Å; T792-N794 VanDerWaalsContact CB-O 3.25Å; T792-N794 WeakPolarHBondContact CB-O 3.02Å; T792-N794 PolarHBondContact OG1-O 2.9Å
793	S	57.5	Low	65.7	Low	109 Å²	109	94.9 Å²	94.9	76%	0.762	50%	0.5	S	S	*	.	S	Bend	trans	-80.2	-13.4	177.1	40.4	0	0	0	0	114.1
794	N	65.5	Low	64.9	Low	126 Å²	126	100 Å²	100	67%	0.674	53%	0.526	S	S	*	.			trans	-153.7	162.9	-172.4	52.6	-25.4	0	0	0	108.6	T792	T792-N794 VanDerWaalsContact C-N 3.31Å; T792-N794 VanDerWaalsContact CB-O 3.25Å; T792-N794 WeakPolarHBondContact CB-O 3.02Å; T792-N794 PolarHBondContact OG1-O 2.9Å
795	G	64.7	Low	63.8	Low	63 Å²	63	99.6 Å²	99.6	65%	0.649	53%	0.534	S	S	*	.			trans	176.1	153.9	177.2	0	0	0	0	0	111.2
796	L	65	Low	62.9	Low	112 Å²	112	97.7 Å²	97.7	59%	0.586	52%	0.517	S	S	*	.			trans	-92.3	151	175.5	-176.1	61.2	0	0	0	110.2	E798 L829	L796-E798 HydrophobicContact CD2-CG 4.22Å; L796-E798 WeakPolarHBondContact CD2-OE1 3.45Å; L796-E798 HydrophobicContact CG-CG 4.1Å; L796-L829 HydrophobicContact CD1-CD1 3.72Å
797	F	72.1	Confident	62.2	Low	57 Å²	57	99.1 Å²	99.1	25%	0.25	53%	0.526	C	S	.	.			trans	-142.8	137.9	170.4	59.4	-94.4	0	0	0	110.6	W814 L816 I826	F797-W814 VanDerWaalsContact CB-CD1 3.49Å; F797-W814 HydrophobicContact CB-CD2 4.23Å; F797-W814 HydrophobicContact CB-CG 3.99Å; F797-W814 AromaticContact CD2-CD2 3.72Å; F797-W814 HydrophobicContact CD2-CD2 3.72Å; F797-W814 AromaticContact CD2-CE2 3.92Å; F797-W814 AromaticContact CD2-CE3 3.92Å; F797-W814 HydrophobicContact CD2-CE3 3.92Å; F797-W814 HydrophobicContact CD2-CG 4.08Å; F797-W814 HydrophobicContact CD2-CH2 4.44Å; F797-W814 HydrophobicContact CD2-CZ2 4.3Å; F797-W814 HydrophobicContact CD2-CZ3 4.27Å; F797-W814 HydrophobicContact CE2-CD2 4.43Å; F797-W814 HydrophobicContact CE2-CE3 4.23Å; F797-W814 HydrophobicContact CG-CD2 4.21Å; F797-W814 HydrophobicContact CG-CG 4.12Å; F797-L816 HydrophobicContact CE1-CD1 4.36Å; F797-I826 HydrophobicContact CE1-CG2 4.43Å; F797-I826 HydrophobicContact CZ-CG2 3.84Å
798	E	72.6	Confident	62	Low	76 Å²	76	98.1 Å²	98.1	36%	0.355	54%	0.539	S	S	.	.			trans	-139.6	151.8	-168.7	-56.2	167.8	151.1	0	0	109.8	K771 L796 Y802 W814	K771-E798 IonicContact NZ-OE2 2.68Å; L796-E798 HydrophobicContact CD2-CG 4.22Å; L796-E798 WeakPolarHBondContact CD2-OE1 3.45Å; L796-E798 HydrophobicContact CG-CG 4.1Å; E798-Y802 HydrophobicContact CB-CD1 4.18Å; E798-Y802 HydrophobicContact CB-CG 4.31Å; E798-Y802 HydrophobicContact CG-CD1 3.95Å; E798-W814 WeakPolarHBondContact O-CZ2 3.43Å
799	S	70.3	Confident	62.4	Low	34 Å²	34	99 Å²	99	24%	0.238	55%	0.551	C	S	.	*			trans	-63.9	156.3	167.4	49.8	0	0	0	0	111.4	Y802	S799-Y802 WeakPolarHBondContact O-CB 3.4Å; S799-Y802 PolarHBondContact O-N 2.86Å
800	P	63.9	Low	63	Low	35 Å²	35	97 Å²	97	23%	0.227	54%	0.539	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	142.3	164.7	-27.8	37.4	0	0	0	110.9	Y802 Y806 V810 C812	P800-Y802 VanDerWaalsContact C-N 3.26Å; P800-Y802 PolarHBondContact O-N 3.04Å; P800-Y806 WeakPolarHBondContact O-CB 3.34Å; P800-V810 HydrophobicContact CG-CG1 3.91Å; P800-C812 WeakPolarHBondContact CD-SG 3.31Å
801	N	66.6	Low	64	Low	86 Å²	86	96.1 Å²	96.1	46%	0.46	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	-14.7	-176.3	-59.5	-4.2	0	0	0	118.4	N804 N805	N801-N804 CarbonylContact C-O 3.34Å; N801-N804 HydrophobicContact CB-CB 4.29Å; N801-N804 WeakPolarHBondContact O-CA 3.44Å; N801-N804 VanDerWaalsContact O-CB 3.28Å; N801-N804 WeakPolarHBondContact O-CB 3.31Å; N801-N804 PolarHBondContact O-N 2.94Å; N801-N804 PolarHBondContact O-ND2 3.35Å; N801-N804 VanDerWaalsContact O-ND2 3.16Å; N801-N805 VanDerWaalsContact CB-O 3.25Å; N801-N805 WeakPolarHBondContact CB-O 3.49Å; N801-N805 PolarHBondContact ND2-O 2.77Å
802	Y	59.7	Low	64.7	Low	86 Å²	86	87.6 Å²	87.6	34%	0.337	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.9	131.1	178.1	-178.9	-95.1	0	0	0	112	E798 S799 P800 D830	E798-Y802 HydrophobicContact CB-CD1 4.18Å; E798-Y802 HydrophobicContact CB-CG 4.31Å; E798-Y802 HydrophobicContact CG-CD1 3.95Å; S799-Y802 WeakPolarHBondContact O-CB 3.4Å; S799-Y802 PolarHBondContact O-N 2.86Å; P800-Y802 VanDerWaalsContact C-N 3.26Å; P800-Y802 PolarHBondContact O-N 3.04Å; Y802-D830 HydrophobicContact CE2-CB 3.79Å; Y802-D830 WeakPolarHBondContact CE2-OD2 3.4Å; Y802-D830 WeakPolarHBondContact OH-CB 3.37Å
803	P	57.5	Low	65.5	Low	107 Å²	107	84.7 Å²	84.7	70%	0.695	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	cis	-81.4	-1.7	7.7	33.9	-37.6	0	0	0	115.9
804	N	63.3	Low	66.1	Low	118 Å²	118	82.7 Å²	82.7	63%	0.631	48%	0.476	S	S	*	.	S	Bend	trans	-76.4	163.7	175.8	-47.4	-82.1	0	0	0	111.7	N801 Y806	N801-N804 CarbonylContact C-O 3.34Å; N801-N804 HydrophobicContact CB-CB 4.29Å; N801-N804 WeakPolarHBondContact O-CA 3.44Å; N801-N804 VanDerWaalsContact O-CB 3.28Å; N801-N804 WeakPolarHBondContact O-CB 3.31Å; N801-N804 PolarHBondContact O-N 2.94Å; N801-N804 PolarHBondContact O-ND2 3.35Å; N801-N804 VanDerWaalsContact O-ND2 3.16Å; N804-Y806 PolarHBondContact O-N 2.85Å
805	N	64.3	Low	66.3	Low	132 Å²	132	85.1 Å²	85.1	71%	0.706	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-53.9	130.6	177.8	-72.3	-9.3	0	0	0	112.6	N801	N801-N805 VanDerWaalsContact CB-O 3.25Å; N801-N805 WeakPolarHBondContact CB-O 3.49Å; N801-N805 PolarHBondContact ND2-O 2.77Å
806	Y	64.7	Low	66.5	Low	52 Å²	52	85.3 Å²	85.3	20%	0.204	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-71.2	148.8	174.3	52.7	-89.1	0	0	0	110.8	P800 N804 A834 D840	P800-Y806 WeakPolarHBondContact O-CB 3.34Å; N804-Y806 PolarHBondContact O-N 2.85Å; Y806-A834 PolarHBondContact OH-N 2.82Å; Y806-D840 WeakPolarHBondContact CE2-OD2 3.35Å; Y806-D840 VanDerWaalsContact OH-CG 3.27Å; Y806-D840 PolarHBondContact OH-OD2 3.1Å
807	P	67.2	Low	66.6	Low	58 Å²	58	89.6 Å²	89.6	38%	0.377	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-65.2	143.8	176.3	-14.4	26.8	0	0	0	111.5	V810	P807-V810 HydrophobicContact CB-CG2 3.72Å; P807-V810 HydrophobicContact CG-CG2 4Å; P807-V810 VanDerWaalsContact O-CB 3.31Å; P807-V810 WeakPolarHBondContact O-CB 3.45Å; P807-V810 WeakPolarHBondContact O-CG2 3.35Å; P807-V810 PolarHBondContact O-N 2.04Å
808	S	66.2	Low	66.3	Low	110 Å²	110	88.5 Å²	88.5	77%	0.769	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	148	178	-45.2	0	0	0	0	112.3	V810	S808-V810 VanDerWaalsContact C-N 3.25Å; S808-V810 PolarHBondContact O-N 2.83Å
809	N	66.4	Low	66.2	Low	168 Å²	168	89.2 Å²	89.2	90%	0.898	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	20.3	-176.5	-66.1	-33.9	0	0	0	115.8
810	V	63.5	Low	66.2	Low	57 Å²	57	98.2 Å²	98.2	35%	0.345	52%	0.524	S	S	.	.			trans	-80.5	120.8	176.1	165.8	0	0	0	0	111.7	P800 P807 S808	P800-V810 HydrophobicContact CG-CG1 3.91Å; P807-V810 HydrophobicContact CB-CG2 3.72Å; P807-V810 HydrophobicContact CG-CG2 4Å; P807-V810 VanDerWaalsContact O-CB 3.31Å; P807-V810 WeakPolarHBondContact O-CB 3.45Å; P807-V810 WeakPolarHBondContact O-CG2 3.35Å; P807-V810 PolarHBondContact O-N 2.04Å; S808-V810 VanDerWaalsContact C-N 3.25Å; S808-V810 PolarHBondContact O-N 2.83Å
811	S	69.2	Low	66.5	Low	99 Å²	99	100.5 Å²	100.5	69%	0.692	55%	0.554	S	S	*	*			trans	-101.6	110.5	174	-166.5	0	0	0	0	111.1
812	C	65.9	Low	66.6	Low	41 Å²	41	105 Å²	105	28%	0.277	57%	0.565	S	S	.	*			trans	-94.1	148.5	175.6	-59.5	0	0	0	0	111.2	P800 W814	P800-C812 WeakPolarHBondContact CD-SG 3.31Å; C812-W814 HydrophobicContact CB-CH2 3.3Å; C812-W814 HydrophobicContact CB-CZ2 3.6Å; C812-W814 HydrophobicContact CB-CZ3 3.82Å
813	S	69.8	Low	66.8	Low	52 Å²	52	108.3 Å²	108.3	36%	0.364	58%	0.577	S	S	.	*			trans	-154.6	116.2	177.6	-77.5	0	0	0	0	112.1	G774	G774-S813 WeakPolarHBondContact CA-O 3.43Å
814	W	69.2	Low	67.3	Low	67 Å²	67	106.6 Å²	106.6	25%	0.254	56%	0.561	S	S	.	*			trans	-105.4	139.3	178	-53.9	-89.4	0	0	0	110.6	N775 F797 E798 C812	N775-W814 VanDerWaalsContact OD1-CD1 3.25Å; F797-W814 VanDerWaalsContact CB-CD1 3.49Å; F797-W814 HydrophobicContact CB-CD2 4.23Å; F797-W814 HydrophobicContact CB-CG 3.99Å; F797-W814 AromaticContact CD2-CD2 3.72Å; F797-W814 HydrophobicContact CD2-CD2 3.72Å; F797-W814 AromaticContact CD2-CE2 3.92Å; F797-W814 AromaticContact CD2-CE3 3.92Å; F797-W814 HydrophobicContact CD2-CE3 3.92Å; F797-W814 HydrophobicContact CD2-CG 4.08Å; F797-W814 HydrophobicContact CD2-CH2 4.44Å; F797-W814 HydrophobicContact CD2-CZ2 4.3Å; F797-W814 HydrophobicContact CD2-CZ3 4.27Å; F797-W814 HydrophobicContact CE2-CD2 4.43Å; F797-W814 HydrophobicContact CE2-CE3 4.23Å; F797-W814 HydrophobicContact CG-CD2 4.21Å; F797-W814 HydrophobicContact CG-CG 4.12Å; E798-W814 WeakPolarHBondContact O-CZ2 3.43Å; C812-W814 HydrophobicContact CB-CH2 3.3Å; C812-W814 HydrophobicContact CB-CZ2 3.6Å; C812-W814 HydrophobicContact CB-CZ3 3.82Å
815	Y	69.4	Low	67.2	Low	177 Å²	177	105.1 Å²	105.1	69%	0.694	55%	0.552	S	S	*	*			trans	-114.5	97.3	-177.1	-73.9	-88	0	0	0	110.5
816	L	69.5	Low	67.2	Low	68 Å²	68	100 Å²	100	36%	0.356	53%	0.525	S	S	.	.			trans	-95	132.3	-179.6	-55.7	173.2	0	0	0	110.5	F797 I824 I826	F797-L816 HydrophobicContact CE1-CD1 4.36Å; L816-I824 HydrophobicContact CB-CD1 3.86Å; L816-I824 HydrophobicContact CB-CG2 4.15Å; L816-I824 HydrophobicContact CD1-CG2 3.88Å; L816-I826 HydrophobicContact CD1-CD1 3.82Å; L816-I826 HydrophobicContact CD1-CG1 3.84Å
817	K	67.5	Low	66.8	Low	202 Å²	202	101.7 Å²	101.7	88%	0.878	53%	0.533	S	S	*	.			trans	-139	111.3	178.3	-176.4	-176.2	179.2	-174.8	0	110.3
818	A	66.1	Low	66.9	Low	33 Å²	33	102 Å²	102	27%	0.273	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-82.7	151.2	172	0	0	0	0	0	112	R822 I824	A818-R822 HydrophobicContact CB-CB 4.16Å; A818-R822 WeakPolarHBondContact CB-O 3.29Å; A818-I824 HydrophobicContact CB-CD1 4.36Å; A818-I824 HydrophobicContact CB-CG1 3.68Å
819	P	69.5	Low	66.5	Low	91 Å²	91	103 Å²	103	59%	0.591	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-59.1	156.3	164	-22.6	33.7	0	0	0	112.3	G821 R822	P819-G821 PolarHBondContact O-N 3.27Å; P819-R822 PolarHBondContact O-N 3.28Å
820	K	69.9	Low	66.2	Low	223 Å²	223	99.4 Å²	99.4	97%	0.97	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	127.7	175.8	-169.4	179.3	-179.3	-176.4	0	109.8
821	G	72	Confident	66.5	Low	84 Å²	84	101 Å²	101	87%	0.866	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.2	-8.3	-177.1	0	0	0	0	0	115.7	P819	P819-G821 PolarHBondContact O-N 3.27Å
822	R	68.2	Low	66.1	Low	180 Å²	180	101.4 Å²	101.4	68%	0.679	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-100.3	151	171.6	-68.9	-156.4	178.2	-167.5	1.6	112.2	A818 P819	A818-R822 HydrophobicContact CB-CB 4.16Å; A818-R822 WeakPolarHBondContact CB-O 3.29Å; P819-R822 PolarHBondContact O-N 3.28Å
823	R	64.2	Low	66.2	Low	156 Å²	156	101.6 Å²	101.6	59%	0.589	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-97.1	152.8	174.8	-61.2	174.2	179.2	-136.8	-15.3	109.3	D877	R823-D877 IonicContact CZ-OD2 3.08Å; R823-D877 IonicContact NH1-OD1 3.85Å; R823-D877 IonicContact NH1-OD2 2.79Å; R823-D877 PolarHBondContact NH1-OD2 2.7Å; R823-D877 IonicContact NH2-OD2 2.73Å; R823-D877 PolarHBondContact NH2-OD2 3.03Å
824	I	67.2	Low	65.5	Low	70 Å²	70	101.7 Å²	101.7	36%	0.359	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-97.1	116.8	166.9	-56.5	168.8	0	0	0	105.6	L816 A818 I826	L816-I824 HydrophobicContact CB-CD1 3.86Å; L816-I824 HydrophobicContact CB-CG2 4.15Å; L816-I824 HydrophobicContact CD1-CG2 3.88Å; A818-I824 HydrophobicContact CB-CD1 4.36Å; A818-I824 HydrophobicContact CB-CG1 3.68Å; I824-I826 HydrophobicContact CG2-CG1 4.02Å
825	L	61.4	Low	64.8	Low	87 Å²	87	104.6 Å²	104.6	46%	0.455	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-87.9	136.2	160.5	-94.3	83.6	0	0	0	108.2	F827 Y881	L825-F827 HydrophobicContact CB-CE2 3.98Å; L825-F827 HydrophobicContact CB-CZ 4.42Å; L825-F827 HydrophobicContact CD2-CE1 4.18Å; L825-F827 HydrophobicContact CD2-CE2 3.81Å; L825-F827 HydrophobicContact CD2-CZ 3.4Å; L825-F827 VanDerWaalsContact CD2-CZ 3.4Å; L825-Y881 HydrophobicContact CD1-CE2 4.35Å; L825-Y881 HydrophobicContact CD2-CD2 3.58Å; L825-Y881 HydrophobicContact CD2-CE2 4.09Å; L825-Y881 HydrophobicContact CD2-CG 4.31Å; L825-Y881 HydrophobicContact CG-CD2 3.82Å; L825-Y881 HydrophobicContact CG-CE2 4.09Å
826	I	64.4	Low	63.8	Low	25 Å²	25	101.3 Å²	101.3	13%	0.128	53%	0.528	C	S	.	.	B	Isolated β-bridge	trans	-117.6	122.7	169.9	-66.4	171.3	0	0	0	106.1	F797 L816 I824 V828 I844	F797-I826 HydrophobicContact CE1-CG2 4.43Å; F797-I826 HydrophobicContact CZ-CG2 3.84Å; L816-I826 HydrophobicContact CD1-CD1 3.82Å; L816-I826 HydrophobicContact CD1-CG1 3.84Å; I824-I826 HydrophobicContact CG2-CG1 4.02Å; I826-V828 HydrophobicContact CG2-CG2 4.38Å; I826-I844 HydrophobicContact CD1-CD1 4.38Å
827	F	57.2	Low	62.8	Low	88 Å²	88	104.5 Å²	104.5	39%	0.386	54%	0.541	S	S	.	.			trans	-106.7	128.9	167.3	-60.7	-81.9	0	0	0	107	L825 L829 Y881 T883	L825-F827 HydrophobicContact CB-CE2 3.98Å; L825-F827 HydrophobicContact CB-CZ 4.42Å; L825-F827 HydrophobicContact CD2-CE1 4.18Å; L825-F827 HydrophobicContact CD2-CE2 3.81Å; L825-F827 HydrophobicContact CD2-CZ 3.4Å; L825-F827 VanDerWaalsContact CD2-CZ 3.4Å; F827-L829 HydrophobicContact CB-CD2 4.2Å; F827-Y881 VanDerWaalsContact CD1-O 3.24Å; F827-Y881 WeakPolarHBondContact CD1-O 3.05Å; F827-T883 HydrophobicContact CD1-CG2 3.94Å; F827-T883 HydrophobicContact CE1-CG2 3.84Å
828	V	68.4	Low	62.1	Low	63 Å²	63	98.4 Å²	98.4	38%	0.382	52%	0.523	S	S	.	.			trans	-96.8	108	169.9	178.9	0	0	0	0	105.2	I826 L831 L842 L880	I826-V828 HydrophobicContact CG2-CG2 4.38Å; V828-L831 HydrophobicContact CG1-CB 3.66Å; V828-L831 HydrophobicContact CG1-CD2 4.46Å; V828-L842 HydrophobicContact CG2-CD2 4.34Å; V828-L880 HydrophobicContact CG2-CD2 4.21Å
829	L	57.9	Low	61.8	Low	133 Å²	133	99 Å²	99	70%	0.696	53%	0.532	S	S	*	.	S	Bend	trans	-82.5	-35.8	-174.9	-59.6	-178.4	0	0	0	112	L796 F827	L796-L829 HydrophobicContact CD1-CD1 3.72Å; F827-L829 HydrophobicContact CB-CD2 4.2Å
830	D	60.3	Low	61.6	Low	91 Å²	91	96.6 Å²	96.6	49%	0.487	51%	0.514	S	S	.	.			trans	-147.2	148.7	170.1	-170.6	2.5	0	0	0	108.2	Y802	Y802-D830 HydrophobicContact CE2-CB 3.79Å; Y802-D830 WeakPolarHBondContact CE2-OD2 3.4Å; Y802-D830 WeakPolarHBondContact OH-CB 3.37Å
831	L	69.9	Low	61.2	Low	92 Å²	92	91.9 Å²	91.9	48%	0.482	49%	0.491	S	S	.	.			trans	-153.6	93.3	175.7	179.9	66.6	0	0	0	109.4	V828 L833 L842	V828-L831 HydrophobicContact CG1-CB 3.66Å; V828-L831 HydrophobicContact CG1-CD2 4.46Å; L831-L833 HydrophobicContact CD1-CD2 4.11Å; L831-L833 HydrophobicContact CD1-CG 4.36Å; L831-L833 HydrophobicContact CG-CG 4.27Å; L831-L842 HydrophobicContact CD2-CD2 4.24Å
832	N	61.2	Low	60.9	Low	107 Å²	107	90.5 Å²	90.5	57%	0.572	46%	0.464	S	S	*	.			trans	-92.4	127.4	166.9	-163.4	-11.8	0	0	0	109.5
833	L	66.1	Low	60.6	Low	45 Å²	45	83.5 Å²	83.5	24%	0.236	44%	0.441	C	S	.	.			trans	-117.3	137	173.6	-64.8	174.4	0	0	0	107.2	L831 D835 D840 F855	L831-L833 HydrophobicContact CD1-CD2 4.11Å; L831-L833 HydrophobicContact CD1-CG 4.36Å; L831-L833 HydrophobicContact CG-CG 4.27Å; L833-D835 PolarHBondContact O-N 2.82Å; L833-D835 VanDerWaalsContact O-N 3.1Å; L833-D840 HydrophobicContact CD2-CB 4Å; L833-F855 HydrophobicContact CD1-CB 3.91Å; L833-F855 HydrophobicContact CD1-CD2 4.39Å; L833-F855 HydrophobicContact CD1-CG 4.09Å
834	A	57	Low	60.8	Low	54 Å²	54	79.3 Å²	79.3	45%	0.446	43%	0.429	S	S	.	.			trans	-62.2	116.5	-178.5	0	0	0	0	0	111.3	Y806 D836 D840	Y806-A834 PolarHBondContact OH-N 2.82Å; A834-D836 PolarHBondContact O-N 3.38Å; A834-D836 VanDerWaalsContact O-N 3.1Å; A834-D840 WeakPolarHBondContact CB-OD2 3.29Å
835	D	53.6	Low	60.2	Low	127 Å²	127	82.6 Å²	82.6	68%	0.679	44%	0.437	S	S	*	.	S	Bend	trans	-60.4	-19.7	-178.4	-82.5	-41.6	0	0	0	113.9	L833	L833-D835 PolarHBondContact O-N 2.82Å; L833-D835 VanDerWaalsContact O-N 3.1Å
836	D	49.1	Very low	60.1	Low	109 Å²	109	83.1 Å²	83.1	58%	0.583	44%	0.436	S	S	*	.	S	Bend	trans	-111.8	93	-171.8	-159.4	14.9	0	0	0	112.4	A834	A834-D836 PolarHBondContact O-N 3.38Å; A834-D836 VanDerWaalsContact O-N 3.1Å
837	H	48.3	Very low	59.8	Low	134 Å²	134	88.9 Å²	88.9	62%	0.62	47%	0.467	S	S	*	.	S	Bend	trans	92.3	75.8	171.8	-49.6	13.1	0	0	0	118.7	G839	H837-G839 PolarHBondContact O-N 3Å
838	C	52.8	Low	59.3	Low	74 Å²	74	94.6 Å²	94.6	50%	0.5	49%	0.492	S	S	.	.	S	Bend	trans	46.8	11.1	136.2	-78.1	0	0	0	0	121.6	C856	C838-C856 HydrophobicContact CB-CB 4.28Å; C838-C856 WeakPolarHBondContact CB-SG 3.35Å; C838-C856 WeakPolarHBondContact SG-CB 3.02Å; C838-C856 CovalentContact SG-SG 2.04Å; C838-C856 PolarHBondContact SG-SG 3.25Å
839	G	60.1	Low	57.9	Low	45 Å²	45	95.1 Å²	95.1	46%	0.464	50%	0.495	S	S	.	.			trans	-102.7	-26.2	-170.8	0	0	0	0	0	114.1	H837 Y841	H837-G839 PolarHBondContact O-N 3Å; G839-Y841 VanDerWaalsContact O-CD1 3.31Å; G839-Y841 WeakPolarHBondContact O-CD1 3.4Å; G839-Y841 WeakPolarHBondContact O-CE1 3.41Å
840	D	64.9	Low	56.8	Low	41 Å²	41	97 Å²	97	22%	0.219	49%	0.493	C	S	.	.			trans	-98.4	136	-170.8	-62.2	-34.6	0	0	0	111.4	Y806 L833 A834	Y806-D840 WeakPolarHBondContact CE2-OD2 3.35Å; Y806-D840 VanDerWaalsContact OH-CG 3.27Å; Y806-D840 PolarHBondContact OH-OD2 3.1Å; L833-D840 HydrophobicContact CD2-CB 4Å; A834-D840 WeakPolarHBondContact CB-OD2 3.29Å
841	Y	61.2	Low	55.8	Low	125 Å²	125	98.3 Å²	98.3	49%	0.49	49%	0.492	S	S	.	.			trans	-154.8	139.6	-176.9	52.2	-94.8	0	0	0	112.1	G839 V843 Y853	G839-Y841 VanDerWaalsContact O-CD1 3.31Å; G839-Y841 WeakPolarHBondContact O-CD1 3.4Å; G839-Y841 WeakPolarHBondContact O-CE1 3.41Å; Y841-V843 HydrophobicContact CD2-CB 4.37Å; Y841-V843 HydrophobicContact CD2-CG2 3.58Å; Y841-V843 HydrophobicContact CE2-CG2 4.21Å; Y841-V843 HydrophobicContact CG-CG2 4.47Å; Y841-Y853 VanDerWaalsContact CB-O 3.24Å; Y841-Y853 WeakPolarHBondContact CB-O 3.36Å
842	L	66.3	Low	54.1	Low	55 Å²	55	101.8 Å²	101.8	29%	0.288	50%	0.499	S	S	.	.			trans	-93.8	125.8	166	-177.4	63.9	0	0	0	109.4	V828 L831	V828-L842 HydrophobicContact CG2-CD2 4.34Å; L831-L842 HydrophobicContact CD2-CD2 4.24Å
843	V	61.2	Low	53.2	Low	32 Å²	32	101.3 Å²	101.3	19%	0.194	49%	0.491	C	S	.	.			trans	-129.3	112.2	-179.5	167	0	0	0	0	111.2	Y841 R845 Y851 Y853	Y841-V843 HydrophobicContact CD2-CB 4.37Å; Y841-V843 HydrophobicContact CD2-CG2 3.58Å; Y841-V843 HydrophobicContact CE2-CG2 4.21Å; Y841-V843 HydrophobicContact CG-CG2 4.47Å; V843-R845 HydrophobicContact CG1-CG 3.58Å; V843-Y851 WeakPolarHBondContact CG1-O 3.06Å; V843-Y853 HydrophobicContact CG2-CD2 4.3Å
844	I	67.6	Low	51.8	Low	68 Å²	68	104.4 Å²	104.4	35%	0.349	51%	0.513	S	S	.	.			trans	-88.1	119.9	171.8	-56.6	176.7	0	0	0	108.6	I826	I826-I844 HydrophobicContact CD1-CD1 4.38Å
845	R	56.7	Low	50.9	Low	140 Å²	140	107.8 Å²	107.8	53%	0.528	52%	0.518	S	S	.	.			trans	-112.8	131.9	-177.1	-55.3	-174	178.8	143.2	1.9	111.9	V843	V843-R845 HydrophobicContact CG1-CG 3.58Å
846	K	58.5	Low	49.8	Very low	98 Å²	98	104.9 Å²	104.9	43%	0.426	51%	0.507	S	S	.	.	S	Bend	trans	-108.3	131.7	168.6	-168.2	176.4	-173.8	174.8	0	109.3	K848 V849 V875	K846-K848 VanDerWaalsContact C-N 3.33Å; K846-K848 PolarHBondContact O-N 3.3Å; K846-K848 VanDerWaalsContact O-N 3.12Å; K846-V849 PolarHBondContact O-N 2.84Å; K846-V875 PolarHBondContact NZ-O 3.31Å
847	N	57.4	Low	48.9	Very low	146 Å²	146	102.2 Å²	102.2	78%	0.781	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.2	44.6	171	-64.5	-7.2	0	0	0	116	V849	N847-V849 PolarHBondContact O-N 2.59Å; N847-V849 VanDerWaalsContact O-N 3.12Å
848	K	48	Very low	48	Very low	207 Å²	207	100.9 Å²	100.9	90%	0.9	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	1.6	-178.6	-56.1	-179.4	176.7	-180	0	116.4	K846 R850	K846-K848 VanDerWaalsContact C-N 3.33Å; K846-K848 PolarHBondContact O-N 3.3Å; K846-K848 VanDerWaalsContact O-N 3.12Å; K848-R850 PolarHBondContact O-N 2.68Å
849	V	38.6	Very low	46.7	Very low	75 Å²	75	108 Å²	108	46%	0.455	51%	0.512	S	S	.	.			trans	-69.9	129	171.8	-176.2	0	0	0	0	108.9	K846 N847 Y851	K846-V849 PolarHBondContact O-N 2.84Å; N847-V849 PolarHBondContact O-N 2.59Å; N847-V849 VanDerWaalsContact O-N 3.12Å; V849-Y851 HydrophobicContact CB-CE2 4.14Å; V849-Y851 HydrophobicContact CG1-CD2 4.35Å; V849-Y851 HydrophobicContact CG1-CE2 3.78Å
850	R	34.8	Very low	45.2	Very low	171 Å²	171	114 Å²	114	65%	0.645	53%	0.533	S	S	*	.			trans	-83.7	114.2	175	-70	-172.6	-177.3	-179.9	4.2	109.2	K848 Y852	K848-R850 PolarHBondContact O-N 2.68Å; R850-Y852 HydrophobicContact CB-CD2 4.24Å; R850-Y852 HydrophobicContact CB-CE2 4Å; R850-Y852 HydrophobicContact CG-CE2 4.48Å; R850-Y852 PolarHBondContact NH1-OH 2.83Å
851	Y	38.6	Very low	43.5	Very low	120 Å²	120	116 Å²	116	47%	0.471	55%	0.546	S	S	.	.			trans	-96.5	126	155.7	-64.4	-86.5	0	0	0	106.9	V843 V849	V843-Y851 WeakPolarHBondContact CG1-O 3.06Å; V849-Y851 HydrophobicContact CB-CE2 4.14Å; V849-Y851 HydrophobicContact CG1-CD2 4.35Å; V849-Y851 HydrophobicContact CG1-CE2 3.78Å
852	Y	35.1	Very low	41.8	Very low	164 Å²	164	115.4 Å²	115.4	64%	0.643	56%	0.556	S	S	*	*			trans	-98.2	130.9	175.1	-83	-91.9	0	0	0	108.5	R850	R850-Y852 HydrophobicContact CB-CD2 4.24Å; R850-Y852 HydrophobicContact CB-CE2 4Å; R850-Y852 HydrophobicContact CG-CE2 4.48Å; R850-Y852 PolarHBondContact NH1-OH 2.83Å
853	Y	42.3	Very low	40	Very low	98 Å²	98	119.7 Å²	119.7	38%	0.384	57%	0.572	S	S	.	*			trans	-122.9	92.6	170.7	-64.8	-75.2	0	0	0	107.8	Y841 V843 F855	Y841-Y853 VanDerWaalsContact CB-O 3.24Å; Y841-Y853 WeakPolarHBondContact CB-O 3.36Å; V843-Y853 HydrophobicContact CG2-CD2 4.3Å; Y853-F855 PolarHBondContact O-N 3.36Å; Y853-F855 VanDerWaalsContact O-N 3.13Å
854	P	35.4	Very low	38.2	Very low	110 Å²	110	122.3 Å²	122.3	71%	0.714	60%	0.597	S	S	*	*			trans	-78.3	91.8	175.1	31.7	-31	0	0	0	108.9	C856	P854-C856 VanDerWaalsContact C-N 3.27Å; P854-C856 PolarHBondContact O-N 2.9Å
855	F	38.5	Very low	36.4	Very low	124 Å²	124	127.6 Å²	127.6	54%	0.544	62%	0.62	S	S	.	*			trans	-76.8	86	167.2	-77.6	-78.2	0	0	0	109.1	L833 Y853	L833-F855 HydrophobicContact CD1-CB 3.91Å; L833-F855 HydrophobicContact CD1-CD2 4.39Å; L833-F855 HydrophobicContact CD1-CG 4.09Å; Y853-F855 PolarHBondContact O-N 3.36Å; Y853-F855 VanDerWaalsContact O-N 3.13Å
856	C	31.2	Very low	35	Very low	67 Å²	67	126.9 Å²	126.9	45%	0.453	62%	0.623	S	S	.	*			trans	-94.7	95.7	168.4	-89.9	0	0	0	0	109	C838 P854 M858	C838-C856 HydrophobicContact CB-CB 4.28Å; C838-C856 WeakPolarHBondContact CB-SG 3.35Å; C838-C856 WeakPolarHBondContact SG-CB 3.02Å; C838-C856 CovalentContact SG-SG 2.04Å; C838-C856 PolarHBondContact SG-SG 3.25Å; P854-C856 VanDerWaalsContact C-N 3.27Å; P854-C856 PolarHBondContact O-N 2.9Å; C856-M858 VanDerWaalsContact C-N 3.26Å; C856-M858 PolarHBondContact O-N 3.08Å
857	A	30.2	Very low	33.6	Very low	53 Å²	53	132.6 Å²	132.6	44%	0.438	64%	0.643	S	S	.	*			trans	-72.6	80.4	172.6	0	0	0	0	0	110.9
858	M	27.8	Very low	32	Very low	106 Å²	106	132.2 Å²	132.2	52%	0.522	64%	0.637	S	S	.	*	S	Bend	trans	-137.1	95.7	162.3	-89.1	-139.8	66.4	0	0	109.2	L142 C856	L142-M858 HydrophobicContact CD1-CE 3.6Å; L142-M858 HydrophobicContact CD1-SD 4.14Å; L142-M858 HydrophobicContact CD2-CE 3.63Å; L142-M858 HydrophobicContact CD2-SD 3.51Å; L142-M858 VanDerWaalsContact CD2-SD 3.51Å; L142-M858 HydrophobicContact CG-CE 4.27Å; L142-M858 HydrophobicContact CG-SD 4.43Å; C856-M858 VanDerWaalsContact C-N 3.26Å; C856-M858 PolarHBondContact O-N 3.08Å
859	R	27.2	Very low	31.1	Very low	223 Å²	223	126.7 Å²	126.7	84%	0.842	62%	0.62	S	S	*	*			trans	33.4	94.8	168	-79.4	-177.4	167.2	175.9	-5.5	116.3
860	L	28.5	Very low	30.5	Very low	172 Å²	172	127.6 Å²	127.6	90%	0.901	63%	0.625	S	S	*	*			trans	-107.2	95.3	148.2	-80.9	164.3	0	0	0	108.3
861	T	27.7	Very low	30.2	Very low	81 Å²	81	123.5 Å²	123.5	50%	0.497	62%	0.62	S	S	.	*			trans	-71.6	126.6	159.4	34.7	0	0	0	0	108.7	E171 F863	E171-T861 WeakPolarHBondContact OE2-CB 3.33Å; E171-T861 PolarHBondContact OE2-OG1 2.91Å; T861-F863 PolarHBondContact O-N 2.85Å
862	T	26.3	Very low	29.6	Very low	114 Å²	114	123.1 Å²	123.1	70%	0.699	62%	0.622	S	S	*	*	S	Bend	trans	32.5	57.8	149	45.9	0	0	0	0	119
863	F	27.8	Very low	29.3	Very low	145 Å²	145	120.3 Å²	120.3	64%	0.636	62%	0.618	S	S	*	*			trans	-119.4	114.1	130.3	-81.3	-98.4	0	0	0	104.9	T861	T861-F863 PolarHBondContact O-N 2.85Å
864	A	24.8	Very low	28.5	Very low	86 Å²	86	124.7 Å²	124.7	71%	0.711	64%	0.639	S	S	*	*				49.7	65.3	60.3	0	0	0	0	0	110.8
865	E	29.1	Very low	28.3	Very low	179 Å²	179	125.7 Å²	125.7	84%	0.836	64%	0.643	S	S	*	*			trans	-164	152.7	146.4	-109.7	160.8	-138.1	0	0	111.9
866	E	27.6	Very low	28.1	Very low	125 Å²	125	125.6 Å²	125.6	58%	0.584	64%	0.639	S	S	*	*			trans	-52.6	132.5	-170	-55.7	169.1	122.5	0	0	115.8	K908	E866-K908 IonicContact OE1-NZ 3.3Å; E866-K908 PolarHBondContact OE1-NZ 3.26Å
867	Y	27.9	Very low	28	Very low	218 Å²	218	125.4 Å²	125.4	86%	0.855	63%	0.634	S	S	*	*			trans	-129.9	64.6	143.8	-81	-74.7	0	0	0	111.7	V869	Y867-V869 HydrophobicContact CD1-CG2 4.19Å; Y867-V869 PolarHBondContact O-N 3.31Å
868	H	25.2	Very low	28	Very low	138 Å²	138	127 Å²	127	64%	0.639	64%	0.638	S	S	*	*			trans	-60.4	85.2	146.9	-80.3	-89.8	0	0	0	109.2	V870	H868-V870 HydrophobicContact CB-CG2 4.32Å; H868-V870 PolarHBondContact O-N 3.19Å
869	V	29.2	Very low	28.1	Very low	92 Å²	92	128.4 Å²	128.4	56%	0.558	64%	0.638	S	S	*	*			trans	-79.6	81.4	163.3	-175	0	0	0	0	108.3	Y867 V871	Y867-V869 HydrophobicContact CD1-CG2 4.19Å; Y867-V869 PolarHBondContact O-N 3.31Å; V869-V871 HydrophobicContact CG1-CG2 4.23Å; V869-V871 PolarHBondContact O-N 2.86Å
870	V	25.4	Very low	28.2	Very low	93 Å²	93	123.5 Å²	123.5	56%	0.564	63%	0.627	S	S	*	*			trans	-54.3	107.7	168.9	175.5	0	0	0	0	109	H868 E872	H868-V870 HydrophobicContact CB-CG2 4.32Å; H868-V870 PolarHBondContact O-N 3.19Å; V870-E872 HydrophobicContact CG1-CB 3.75Å; V870-E872 HydrophobicContact CG1-CG 3.79Å
871	V	27.3	Very low	28.1	Very low	86 Å²	86	119.8 Å²	119.8	52%	0.521	60%	0.602	S	S	.	*			trans	-112.1	58.2	158.1	-159.2	0	0	0	0	107.8	V869 R876	V869-V871 HydrophobicContact CG1-CG2 4.23Å; V869-V871 PolarHBondContact O-N 2.86Å; V871-R876 HydrophobicContact CG1-CB 3.95Å; V871-R876 HydrophobicContact CG1-CG 4.03Å; V871-R876 VanDerWaalsContact O-CB 3.23Å; V871-R876 WeakPolarHBondContact O-CB 3.19Å
872	E	27.9	Very low	28.1	Very low	112 Å²	112	124 Å²	124	52%	0.523	62%	0.616	S	S	.	*			trans	-75.5	148.2	170.2	-79.1	179.6	153	0	0	111.3	V870 R876	V870-E872 HydrophobicContact CG1-CB 3.75Å; V870-E872 HydrophobicContact CG1-CG 3.79Å; E872-R876 VanDerWaalsContact C-CD 3.43Å; E872-R876 WeakPolarHBondContact O-CD 3.2Å; E872-R876 VanDerWaalsContact O-CZ 3.25Å; E872-R876 PolarHBondContact O-NE 2.72Å; E872-R876 PolarHBondContact O-NH1 2.8Å
873	D	27.6	Very low	28.2	Very low	105 Å²	105	121.8 Å²	121.8	56%	0.561	60%	0.603	S	S	*	*	S	Bend	trans	88.3	65.5	166.2	-70.1	-14.7	0	0	0	124.4	R876	D873-R876 WeakPolarHBondContact O-CD 3.28Å; D873-R876 PolarHBondContact O-NE 2.66Å; D873-R876 PolarHBondContact O-NH2 2.85Å
874	F	26.8	Very low	28.2	Very low	189 Å²	189	120.7 Å²	120.7	83%	0.829	61%	0.608	S	S	*	*	S	Bend	trans	62.6	116.6	158.9	-52.8	-99.4	0	0	0	116.8	R876	F874-R876 PolarHBondContact O-NE 2.04Å
875	V	30.2	Very low	28.4	Very low	132 Å²	132	127.7 Å²	127.7	80%	0.8	62%	0.616	S	S	*	*	S	Bend	cis	-91.7	66.2	-2.3	-170.1	0	0	0	0	108.7	K846	K846-V875 PolarHBondContact NZ-O 3.31Å
876	R	35.4	Very low	28.2	Very low	121 Å²	121	124.1 Å²	124.1	46%	0.457	61%	0.611	S	S	.	*			trans	-103	-6.7	-148.3	-73.1	-179.6	-148.7	174.2	22.3	117.1	V871 E872 D873 F874 V878	V871-R876 HydrophobicContact CG1-CB 3.95Å; V871-R876 HydrophobicContact CG1-CG 4.03Å; V871-R876 VanDerWaalsContact O-CB 3.23Å; V871-R876 WeakPolarHBondContact O-CB 3.19Å; E872-R876 VanDerWaalsContact C-CD 3.43Å; E872-R876 WeakPolarHBondContact O-CD 3.2Å; E872-R876 VanDerWaalsContact O-CZ 3.25Å; E872-R876 PolarHBondContact O-NE 2.72Å; E872-R876 PolarHBondContact O-NH1 2.8Å; D873-R876 WeakPolarHBondContact O-CD 3.28Å; D873-R876 PolarHBondContact O-NE 2.66Å; D873-R876 PolarHBondContact O-NH2 2.85Å; F874-R876 PolarHBondContact O-NE 2.04Å; R876-V878 PolarHBondContact O-N 2.85Å
877	D	29.2	Very low	28.2	Very low	63 Å²	63	126.8 Å²	126.8	34%	0.337	62%	0.623	S	S	.	*			trans	-66.3	92.9	172	-78	-57.6	0	0	0	113.2	R823 R879	R823-D877 IonicContact CZ-OD2 3.08Å; R823-D877 IonicContact NH1-OD1 3.85Å; R823-D877 IonicContact NH1-OD2 2.79Å; R823-D877 PolarHBondContact NH1-OD2 2.7Å; R823-D877 IonicContact NH2-OD2 2.73Å; R823-D877 PolarHBondContact NH2-OD2 3.03Å; D877-R879 IonicContact OD1-CZ 3.43Å; D877-R879 VanDerWaalsContact OD1-CZ 3.3Å; D877-R879 IonicContact OD1-NE 2.93Å; D877-R879 PolarHBondContact OD1-NE 2.8Å; D877-R879 IonicContact OD1-NH2 3.74Å; D877-R879 PolarHBondContact OD1-NH2 3.36Å
878	V	29.6	Very low	28.1	Very low	88 Å²	88	118.7 Å²	118.7	53%	0.533	60%	0.598	S	S	.	*			trans	-106.3	115.7	139.8	175	0	0	0	0	105.4	R876	R876-V878 PolarHBondContact O-N 2.85Å
879	R	29.2	Very low	28.2	Very low	134 Å²	134	119.1 Å²	119.1	51%	0.506	60%	0.603	S	S	.	*			trans	-118.7	125.9	172.7	-58.2	-163.6	-153.8	179.7	-3.2	108.5	D877 Y881	D877-R879 IonicContact OD1-CZ 3.43Å; D877-R879 VanDerWaalsContact OD1-CZ 3.3Å; D877-R879 IonicContact OD1-NE 2.93Å; D877-R879 PolarHBondContact OD1-NE 2.8Å; D877-R879 IonicContact OD1-NH2 3.74Å; D877-R879 PolarHBondContact OD1-NH2 3.36Å; R879-Y881 HydrophobicContact CB-CD2 3.95Å; R879-Y881 HydrophobicContact CB-CE1 4.2Å; R879-Y881 HydrophobicContact CB-CE2 3.55Å; R879-Y881 HydrophobicContact CB-CG 4.47Å; R879-Y881 WeakPolarHBondContact CD-OH 3.5Å; R879-Y881 HydrophobicContact CG-CE2 4.39Å; R879-Y881 WeakPolarHBondContact O-CD2 3.29Å; R879-Y881 PolarHBondContact O-N 2.04Å
880	L	28.8	Very low	28.2	Very low	120 Å²	120	119.3 Å²	119.3	63%	0.628	60%	0.597	S	S	*	*	B	Isolated β-bridge	trans	-67.1	119.9	157.4	-78.1	156.8	0	0	0	106	V828	V828-L880 HydrophobicContact CG2-CD2 4.21Å
881	Y	28.2	Very low	28.4	Very low	95 Å²	95	123.5 Å²	123.5	37%	0.373	61%	0.607	S	S	.	*			trans	-110.7	125.3	173.8	-70.2	-79	0	0	0	108.1	L825 F827 R879	L825-Y881 HydrophobicContact CD1-CE2 4.35Å; L825-Y881 HydrophobicContact CD2-CD2 3.58Å; L825-Y881 HydrophobicContact CD2-CE2 4.09Å; L825-Y881 HydrophobicContact CD2-CG 4.31Å; L825-Y881 HydrophobicContact CG-CD2 3.82Å; L825-Y881 HydrophobicContact CG-CE2 4.09Å; F827-Y881 VanDerWaalsContact CD1-O 3.24Å; F827-Y881 WeakPolarHBondContact CD1-O 3.05Å; R879-Y881 HydrophobicContact CB-CD2 3.95Å; R879-Y881 HydrophobicContact CB-CE1 4.2Å; R879-Y881 HydrophobicContact CB-CE2 3.55Å; R879-Y881 HydrophobicContact CB-CG 4.47Å; R879-Y881 WeakPolarHBondContact CD-OH 3.5Å; R879-Y881 HydrophobicContact CG-CE2 4.39Å; R879-Y881 WeakPolarHBondContact O-CD2 3.29Å; R879-Y881 PolarHBondContact O-N 2.04Å
882	Q	26.8	Very low	28.6	Very low	168 Å²	168	125.1 Å²	125.1	79%	0.785	61%	0.613	S	S	*	*			trans	-66.6	147.3	156.2	-161.6	173.5	13.1	0	0	108.2	T884	Q882-T884 PolarHBondContact O-N 2.99Å
883	T	28.3	Very low	28.9	Very low	69 Å²	69	124.6 Å²	124.6	42%	0.423	62%	0.622	S	S	.	*			trans	-69.3	111.8	177.9	33.1	0	0	0	0	110.7	F413 F827	F413-T883 WeakPolarHBondContact CE2-OG1 3.32Å; F827-T883 HydrophobicContact CD1-CG2 3.94Å; F827-T883 HydrophobicContact CE1-CG2 3.84Å
884	T	28.1	Very low	29.4	Very low	121 Å²	121	126.8 Å²	126.8	74%	0.742	63%	0.628	S	S	*	*			trans	-27.2	142.8	161.5	49.5	0	0	0	0	114.3	Q882	Q882-T884 PolarHBondContact O-N 2.99Å
885	R	28.4	Very low	29.9	Very low	233 Å²	233	119.7 Å²	119.7	88%	0.879	60%	0.602	S	S	*	*			cis	-159.5	161.7	19.2	-99	152.7	-179	-172.9	0.7	105.4
886	S	25.5	Very low	30.3	Very low	105 Å²	105	118.3 Å²	118.3	73%	0.734	59%	0.59	S	S	*	*			cis	-168.5	101.7	0.8	42.7	0	0	0	0	110.6
887	E	26.7	Very low	30.4	Very low	180 Å²	180	117.2 Å²	117.2	84%	0.841	59%	0.593	S	S	*	*			trans	-165.9	144.7	158.2	-115.4	176	-145.9	0	0	110.4
888	P	27.5	Very low	30.9	Very low	49 Å²	49	119.8 Å²	119.8	32%	0.318	61%	0.606	S	S	.	*			trans	-82.8	138.8	-179.7	31.3	-34.1	0	0	0	113.7	F890 V919 P921	P888-F890 PolarHBondContact O-N 3.36Å; P888-V919 WeakPolarHBondContact CB-O 3.26Å; P888-V919 WeakPolarHBondContact CG-O 3.24Å; P888-P921 HydrophobicContact CB-CG 4.04Å; P888-P921 HydrophobicContact CG-CB 4.09Å; P888-P921 HydrophobicContact CG-CG 3.71Å
889	I	26.3	Very low	31.2	Very low	146 Å²	146	116.8 Å²	116.8	75%	0.749	59%	0.586	S	S	*	*			trans	-77.9	104.2	-168.4	-57.5	158.9	0	0	0	112.4
890	F	28.5	Very low	31.8	Very low	97 Å²	97	115.3 Å²	115.3	43%	0.425	59%	0.586	S	S	.	*			trans	-151.1	95.6	165.6	-66.8	-79.6	0	0	0	112.3	P888 M899 P921	P888-F890 PolarHBondContact O-N 3.36Å; F890-M899 HydrophobicContact CD1-CE 3.74Å; F890-M899 HydrophobicContact CE1-CE 3.26Å; F890-M899 HydrophobicContact CE1-CG 4.31Å; F890-M899 HydrophobicContact CE1-SD 4.34Å; F890-M899 HydrophobicContact CE2-CE 4.13Å; F890-M899 HydrophobicContact CG-CE 4.37Å; F890-M899 HydrophobicContact CZ-CE 3.47Å; F890-M899 VanDerWaalsContact CZ-CE 3.47Å; F890-P921 HydrophobicContact CD2-CB 4.34Å; F890-P921 HydrophobicContact CD2-CG 3.33Å; F890-P921 HydrophobicContact CE2-CG 3.42Å; F890-P921 VanDerWaalsContact CE2-CG 3.42Å; F890-P921 HydrophobicContact CG-CG 4.48Å
891	K	30.9	Very low	32.6	Very low	181 Å²	181	114.6 Å²	114.6	79%	0.787	58%	0.584	S	S	*	*			trans	-132	-10.8	173.4	-85.7	-173.5	178.2	173.5	0	116.6
892	N	31.2	Very low	33.3	Very low	119 Å²	119	112 Å²	112	64%	0.636	58%	0.576	S	S	*	*	S	Bend	trans	-116.4	147.1	-175.8	-65.7	17.7	0	0	0	112.2	H894 S895	N892-H894 VanDerWaalsContact C-N 3.3Å; N892-H894 PolarHBondContact O-N 2.04Å; N892-S895 WeakPolarHBondContact O-CB 3.09Å; N892-S895 PolarHBondContact O-N 3.24Å; N892-S895 VanDerWaalsContact O-N 3.07Å; N892-S895 PolarHBondContact O-OG 2.91Å
893	S	34.3	Very low	34.3	Very low	102 Å²	102	104.8 Å²	104.8	71%	0.713	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-30.5	-170.7	43.3	0	0	0	0	115.3	S895 L896	S893-S895 PolarHBondContact O-N 3.4Å; S893-L896 PolarHBondContact O-N 2.91Å
894	H	37.3	Very low	35.5	Very low	150 Å²	150	104.8 Å²	104.8	69%	0.694	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-8.8	176.3	-78	-67.5	0	0	0	114.8	N892 L896 D897	N892-H894 VanDerWaalsContact C-N 3.3Å; N892-H894 PolarHBondContact O-N 2.04Å; H894-L896 PolarHBondContact O-N 3.16Å; H894-D897 IonicContact ND1-OD2 2.83Å
895	S	38.3	Very low	36.7	Very low	40 Å²	40	103.2 Å²	103.2	28%	0.28	53%	0.534	S	S	.	.	H	α-helix	trans	-68.2	-18.5	174.3	-54	0	0	0	0	113.7	N892 S893 M899	N892-S895 WeakPolarHBondContact O-CB 3.09Å; N892-S895 PolarHBondContact O-N 3.24Å; N892-S895 VanDerWaalsContact O-N 3.07Å; N892-S895 PolarHBondContact O-OG 2.91Å; S893-S895 PolarHBondContact O-N 3.4Å; S895-M899 WeakPolarHBondContact O-CG 3.06Å; S895-M899 PolarHBondContact O-N 3.38Å
896	L	38.2	Very low	37.6	Very low	103 Å²	103	97 Å²	97	54%	0.539	52%	0.524	S	S	.	.	H	α-helix	trans	-77	-35	-178.1	-107.3	149.5	0	0	0	112.9	S893 H894 M899 M900	S893-L896 PolarHBondContact O-N 2.91Å; H894-L896 PolarHBondContact O-N 3.16Å; L896-M899 WeakPolarHBondContact O-CB 3.35Å; L896-M899 PolarHBondContact O-N 3.28Å; L896-M900 VanDerWaalsContact O-CG 3.31Å; L896-M900 WeakPolarHBondContact O-CG 3.35Å; L896-M900 PolarHBondContact O-N 3.4Å
897	D	37.6	Very low	39	Very low	99 Å²	99	100.1 Å²	100.1	53%	0.529	53%	0.527	S	S	.	.	H	α-helix	trans	-66.7	-47.1	178.3	-58.2	-42.7	0	0	0	110.6	H894 M899 M900 D901	H894-D897 IonicContact ND1-OD2 2.83Å; D897-M899 VanDerWaalsContact C-N 3.29Å; D897-M899 PolarHBondContact O-N 2.9Å; D897-M900 WeakPolarHBondContact O-CA 3.47Å; D897-M900 WeakPolarHBondContact O-CB 3.49Å; D897-M900 PolarHBondContact O-N 2.77Å; D897-D901 PolarHBondContact O-N 3.37Å; D897-D901 VanDerWaalsContact O-N 3.11Å
898	L	39.1	Very low	40.2	Very low	117 Å²	117	94.8 Å²	94.8	61%	0.613	50%	0.501	S	S	*	.	H	α-helix	trans	-64.2	-32.7	177	-156.3	81.2	0	0	0	112.8	M900 I902	L898-M900 VanDerWaalsContact C-N 3.33Å; L898-I902 WeakPolarHBondContact O-CG1 3.39Å; L898-I902 PolarHBondContact O-N 2.04Å
899	M	36.8	Very low	41	Very low	24 Å²	24	94.3 Å²	94.3	12%	0.118	50%	0.495	C	S	.	.	H	α-helix	trans	-64.6	-37.8	170.1	-85.3	-172.7	166.7	0	0	111.7	F890 S895 L896 D897 L903 F924 L927	F890-M899 HydrophobicContact CD1-CE 3.74Å; F890-M899 HydrophobicContact CE1-CE 3.26Å; F890-M899 HydrophobicContact CE1-CG 4.31Å; F890-M899 HydrophobicContact CE1-SD 4.34Å; F890-M899 HydrophobicContact CE2-CE 4.13Å; F890-M899 HydrophobicContact CG-CE 4.37Å; F890-M899 HydrophobicContact CZ-CE 3.47Å; F890-M899 VanDerWaalsContact CZ-CE 3.47Å; S895-M899 WeakPolarHBondContact O-CG 3.06Å; S895-M899 PolarHBondContact O-N 3.38Å; L896-M899 WeakPolarHBondContact O-CB 3.35Å; L896-M899 PolarHBondContact O-N 3.28Å; D897-M899 VanDerWaalsContact C-N 3.29Å; D897-M899 PolarHBondContact O-N 2.9Å; M899-L903 VanDerWaalsContact O-CB 3.28Å; M899-L903 WeakPolarHBondContact O-CB 3.33Å; M899-L903 VanDerWaalsContact O-CD1 3.29Å; M899-L903 WeakPolarHBondContact O-CD1 3.07Å; M899-L903 WeakPolarHBondContact O-CG 3.14Å; M899-L903 PolarHBondContact O-N 3.33Å; M899-F924 HydrophobicContact CE-CB 3.94Å; M899-F924 HydrophobicContact CE-CD2 3.42Å; M899-F924 VanDerWaalsContact CE-CD2 3.42Å; M899-F924 HydrophobicContact CE-CE2 4.27Å; M899-F924 HydrophobicContact CE-CG 4.03Å; M899-F924 HydrophobicContact SD-CD2 4.24Å; M899-L927 HydrophobicContact SD-CD1 4.39Å
900	M	41.2	Very low	42.1	Very low	103 Å²	103	97.4 Å²	97.4	51%	0.507	50%	0.497	S	S	.	.	H	α-helix	trans	-69.9	-36.3	-178.7	-72.6	-69.3	-87.7	0	0	112.2	L896 D897 L898 L903 A904	L896-M900 VanDerWaalsContact O-CG 3.31Å; L896-M900 WeakPolarHBondContact O-CG 3.35Å; L896-M900 PolarHBondContact O-N 3.4Å; D897-M900 WeakPolarHBondContact O-CA 3.47Å; D897-M900 WeakPolarHBondContact O-CB 3.49Å; D897-M900 PolarHBondContact O-N 2.77Å; L898-M900 VanDerWaalsContact C-N 3.33Å; M900-L903 CarbonylContact O-C 3.52Å; M900-L903 PolarHBondContact O-N 2.84Å; M900-A904 PolarHBondContact O-N 2.81Å
901	D	45.7	Very low	43	Very low	106 Å²	106	97.8 Å²	97.8	57%	0.567	50%	0.504	S	S	*	.	H	α-helix	trans	-66.6	-46.1	173.2	-68.8	-26.7	0	0	0	112.3	D897 L903 A904	D897-D901 PolarHBondContact O-N 3.37Å; D897-D901 VanDerWaalsContact O-N 3.11Å; D901-L903 PolarHBondContact O-N 2.92Å; D901-A904 WeakPolarHBondContact O-CB 3.07Å; D901-A904 PolarHBondContact O-N 2.81Å
902	I	43.4	Very low	43.5	Very low	40 Å²	40	93.8 Å²	93.8	21%	0.205	48%	0.484	C	S	.	.	H	α-helix	trans	-61.8	-32.5	176	-67	168.8	0	0	0	111.2	L898 A904	L898-I902 WeakPolarHBondContact O-CG1 3.39Å; L898-I902 PolarHBondContact O-N 2.04Å; I902-A904 VanDerWaalsContact C-N 3.29Å; I902-A904 PolarHBondContact O-N 2.92Å
903	L	47.9	Very low	44.2	Very low	16 Å²	16	91.6 Å²	91.6	8%	0.084	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	11.4	176	-64.7	166	0	0	0	113.6	M899 M900 D901 L909 V928 K931	M899-L903 VanDerWaalsContact O-CB 3.28Å; M899-L903 WeakPolarHBondContact O-CB 3.33Å; M899-L903 VanDerWaalsContact O-CD1 3.29Å; M899-L903 WeakPolarHBondContact O-CD1 3.07Å; M899-L903 WeakPolarHBondContact O-CG 3.14Å; M899-L903 PolarHBondContact O-N 3.33Å; M900-L903 CarbonylContact O-C 3.52Å; M900-L903 PolarHBondContact O-N 2.84Å; D901-L903 PolarHBondContact O-N 2.92Å; L903-L909 HydrophobicContact CD2-CD1 4.42Å; L903-L909 HydrophobicContact CD2-CD2 4.4Å; L903-V928 HydrophobicContact CD2-CG2 4.4Å; L903-K931 HydrophobicContact CB-CD 3.82Å; L903-K931 HydrophobicContact CD1-CD 4.1Å; L903-K931 HydrophobicContact CD2-CD 4.3Å; L903-K931 HydrophobicContact CG-CD 4.31Å; L903-K931 PolarHBondContact O-NZ 3.35Å
904	A	53.2	Low	44.9	Very low	70 Å²	70	97.4 Å²	97.4	58%	0.579	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-21.3	171.7	0	0	0	0	0	112.9	M900 D901 I902	M900-A904 PolarHBondContact O-N 2.81Å; D901-A904 WeakPolarHBondContact O-CB 3.07Å; D901-A904 PolarHBondContact O-N 2.81Å; I902-A904 VanDerWaalsContact C-N 3.29Å; I902-A904 PolarHBondContact O-N 2.92Å
905	E	52.3	Low	45.1	Very low	87 Å²	87	93.9 Å²	93.9	41%	0.407	47%	0.467	S	S	.	.			trans	-109.4	104.9	-178.7	-75.3	-178.5	-126.1	0	0	112.5	E907 K908	E905-E907 PolarHBondContact O-N 2.82Å; E905-E907 VanDerWaalsContact O-N 3.15Å; E905-K908 HydrophobicContact CB-CB 4.22Å; E905-K908 HydrophobicContact CB-CD 4.05Å; E905-K908 HydrophobicContact CB-CG 4.14Å; E905-K908 VanDerWaalsContact CD-NZ 3.27Å; E905-K908 HydrophobicContact CG-CD 4.45Å; E905-K908 PolarHBondContact O-N 3.15Å; E905-K908 WeakPolarHBondContact OE1-CE 3.27Å; E905-K908 IonicContact OE1-NZ 3.64Å; E905-K908 PolarHBondContact OE1-NZ 2.86Å; E905-K908 WeakPolarHBondContact OE2-CD 3.41Å; E905-K908 WeakPolarHBondContact OE2-CE 3.41Å; E905-K908 IonicContact OE2-NZ 3.88Å; E905-K908 PolarHBondContact OE2-NZ 2.91Å; E905-K908 VanDerWaalsContact OE2-NZ 3.16Å
906	P	48.9	Very low	45.2	Very low	103 Å²	103	95 Å²	95	67%	0.669	47%	0.474	S	S	*	.	H	α-helix	trans	-65.5	-20.7	-174.4	24.3	-33.6	0	0	0	114.4
907	E	54.3	Low	45.3	Very low	171 Å²	171	93.5 Å²	93.5	80%	0.799	48%	0.476	S	S	*	.	H	α-helix	trans	-77	-35.7	175.6	-60.8	-147	151.4	0	0	112.8	E905 L909 R910	E905-E907 PolarHBondContact O-N 2.82Å; E905-E907 VanDerWaalsContact O-N 3.15Å; E907-L909 VanDerWaalsContact C-N 3.3Å; E907-L909 PolarHBondContact O-N 3.11Å; E907-R910 PolarHBondContact O-N 3.24Å
908	K	50.9	Low	45.9	Very low	68 Å²	68	96.7 Å²	96.7	30%	0.296	49%	0.488	S	S	.	.	H	α-helix	trans	-64.4	-33.8	177.6	-74	-179.2	176.1	162	0	111.9	E866 E905 R910 N911	E866-K908 IonicContact OE1-NZ 3.3Å; E866-K908 PolarHBondContact OE1-NZ 3.26Å; E905-K908 HydrophobicContact CB-CB 4.22Å; E905-K908 HydrophobicContact CB-CD 4.05Å; E905-K908 HydrophobicContact CB-CG 4.14Å; E905-K908 VanDerWaalsContact CD-NZ 3.27Å; E905-K908 HydrophobicContact CG-CD 4.45Å; E905-K908 PolarHBondContact O-N 3.15Å; E905-K908 WeakPolarHBondContact OE1-CE 3.27Å; E905-K908 IonicContact OE1-NZ 3.64Å; E905-K908 PolarHBondContact OE1-NZ 2.86Å; E905-K908 WeakPolarHBondContact OE2-CD 3.41Å; E905-K908 WeakPolarHBondContact OE2-CE 3.41Å; E905-K908 IonicContact OE2-NZ 3.88Å; E905-K908 PolarHBondContact OE2-NZ 2.91Å; E905-K908 VanDerWaalsContact OE2-NZ 3.16Å; K908-R910 VanDerWaalsContact C-N 3.27Å; K908-R910 PolarHBondContact O-N 2.81Å; K908-N911 PolarHBondContact O-N 2.85Å
909	L	45.7	Very low	46.1	Very low	39 Å²	39	94.1 Å²	94.1	20%	0.204	48%	0.477	C	S	.	.	H	α-helix	trans	-56.4	-35.2	175.6	-100.1	152.9	0	0	0	113.6	L903 E907 N911 Y912 V913	L903-L909 HydrophobicContact CD2-CD1 4.42Å; L903-L909 HydrophobicContact CD2-CD2 4.4Å; E907-L909 VanDerWaalsContact C-N 3.3Å; E907-L909 PolarHBondContact O-N 3.11Å; L909-N911 PolarHBondContact O-N 3.08Å; L909-N911 VanDerWaalsContact O-N 3.14Å; L909-Y912 PolarHBondContact O-N 3.34Å; L909-V913 PolarHBondContact O-N 3.39Å
910	R	48	Very low	46.3	Very low	210 Å²	210	94.9 Å²	94.9	79%	0.792	48%	0.48	S	S	*	.	H	α-helix	trans	-63	-24.4	-175.2	-134.1	-179.4	-156.5	-161.9	7.1	113.9	E907 K908	E907-R910 PolarHBondContact O-N 3.24Å; K908-R910 VanDerWaalsContact C-N 3.27Å; K908-R910 PolarHBondContact O-N 2.81Å
911	N	47.8	Very low	46.4	Very low	105 Å²	105	91.5 Å²	91.5	56%	0.561	47%	0.466	S	S	*	.	H	α-helix	trans	-85.8	-23.8	177.6	-75	-15.4	0	0	0	113	K908 L909	K908-N911 PolarHBondContact O-N 2.85Å; L909-N911 PolarHBondContact O-N 3.08Å; L909-N911 VanDerWaalsContact O-N 3.14Å
912	Y	41	Very low	46.8	Very low	97 Å²	97	94 Å²	94	38%	0.38	47%	0.472	S	S	.	.	H	α-helix	trans	-81.5	-31.6	178.6	-89.6	-92.9	0	0	0	113.8	L909 R914 L915	L909-Y912 PolarHBondContact O-N 3.34Å; Y912-R914 PolarHBondContact O-N 2.74Å; Y912-L915 HydrophobicContact CD1-CD1 3.92Å; Y912-L915 HydrophobicContact CE1-CD1 4.41Å; Y912-L915 PolarHBondContact O-N 2.95Å; Y912-L915 VanDerWaalsContact O-N 3.09Å
913	V	46.3	Very low	47.3	Very low	74 Å²	74	100 Å²	100	45%	0.448	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-11.9	179.9	176.3	0	0	0	0	113.4	L909	L909-V913 PolarHBondContact O-N 3.39Å
914	R	49.8	Very low	47.6	Very low	223 Å²	223	100.5 Å²	100.5	84%	0.842	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-0.1	175.2	-70.5	-173.8	173.9	178.4	0.2	115.1	Y912	Y912-R914 PolarHBondContact O-N 2.74Å
915	L	39.9	Very low	47.7	Very low	76 Å²	76	101.2 Å²	101.2	40%	0.398	49%	0.491	S	S	.	.	S	Bend	trans	-76.2	133.8	175.1	-72.6	167.6	0	0	0	110.7	Y912 M920	Y912-L915 HydrophobicContact CD1-CD1 3.92Å; Y912-L915 HydrophobicContact CE1-CD1 4.41Å; Y912-L915 PolarHBondContact O-N 2.95Å; Y912-L915 VanDerWaalsContact O-N 3.09Å; L915-M920 HydrophobicContact CB-CE 4.23Å; L915-M920 HydrophobicContact CB-CG 4.46Å; L915-M920 WeakPolarHBondContact O-CE 3.29Å
916	P	41.3	Very low	48.1	Very low	64 Å²	64	101.6 Å²	101.6	42%	0.416	49%	0.492	S	S	.	.			trans	-60.8	141.3	175.8	-19.6	30.6	0	0	0	111.2	H918 V919	P916-H918 WeakPolarHBondContact CB-CE1 3.47Å; P916-H918 PolarHBondContact O-N 3.25Å; P916-V919 HydrophobicContact CB-CG2 4.11Å; P916-V919 HydrophobicContact CG-CG2 4.22Å; P916-V919 WeakPolarHBondContact O-CB 3.41Å; P916-V919 PolarHBondContact O-N 3.35Å
917	A	40.7	Very low	48.4	Very low	71 Å²	71	99.5 Å²	99.5	59%	0.587	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-55.6	-27.6	-175.2	0	0	0	0	0	114.5	V919 M920	A917-V919 PolarHBondContact O-N 3.41Å; A917-M920 PolarHBondContact O-N 3.34Å
918	H	50.7	Low	48.6	Very low	167 Å²	167	92.4 Å²	92.4	77%	0.773	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-73.5	-1.3	175.3	62	-101.9	0	0	0	114.6	P916	P916-H918 WeakPolarHBondContact CB-CE1 3.47Å; P916-H918 PolarHBondContact O-N 3.25Å
919	V	41.4	Very low	49.2	Very low	62 Å²	62	94.4 Å²	94.4	38%	0.376	45%	0.449	S	S	.	.	G	3₁₀ helix	trans	-108.8	-6.6	177.6	-161.4	0	0	0	0	111.4	P888 P916 A917	P888-V919 WeakPolarHBondContact CB-O 3.26Å; P888-V919 WeakPolarHBondContact CG-O 3.24Å; P916-V919 HydrophobicContact CB-CG2 4.11Å; P916-V919 HydrophobicContact CG-CG2 4.22Å; P916-V919 WeakPolarHBondContact O-CB 3.41Å; P916-V919 PolarHBondContact O-N 3.35Å; A917-V919 PolarHBondContact O-N 3.41Å
920	M	40.9	Very low	50	Low	40 Å²	40	99.3 Å²	99.3	20%	0.197	47%	0.471	C	S	.	.	S	Bend	trans	-99.2	130.9	178	-68.3	-161.7	-112.4	0	0	111.1	L915 A917 F924 M925	L915-M920 HydrophobicContact CB-CE 4.23Å; L915-M920 HydrophobicContact CB-CG 4.46Å; L915-M920 WeakPolarHBondContact O-CE 3.29Å; A917-M920 PolarHBondContact O-N 3.34Å; M920-F924 HydrophobicContact CB-CD1 4.36Å; M920-F924 HydrophobicContact CG-CD1 4.33Å; M920-F924 HydrophobicContact SD-CD1 3.9Å; M920-F924 HydrophobicContact SD-CE1 3.75Å; M920-M925 HydrophobicContact CB-CG 3.99Å; M920-M925 HydrophobicContact CB-SD 4.04Å; M920-M925 HydrophobicContact CE-SD 4.2Å; M920-M925 HydrophobicContact SD-SD 3.91Å
921	P	44.5	Very low	50.4	Low	32 Å²	32	92.5 Å²	92.5	21%	0.208	45%	0.447	C	S	.	.			trans	-67.5	141.1	175.8	5.4	1.8	0	0	0	110.6	P888 F890 K923 F924 M925	P888-P921 HydrophobicContact CB-CG 4.04Å; P888-P921 HydrophobicContact CG-CB 4.09Å; P888-P921 HydrophobicContact CG-CG 3.71Å; F890-P921 HydrophobicContact CD2-CB 4.34Å; F890-P921 HydrophobicContact CD2-CG 3.33Å; F890-P921 HydrophobicContact CE2-CG 3.42Å; F890-P921 VanDerWaalsContact CE2-CG 3.42Å; F890-P921 HydrophobicContact CG-CG 4.48Å; P921-K923 PolarHBondContact O-N 2.75Å; P921-K923 VanDerWaalsContact O-N 3.11Å; P921-F924 HydrophobicContact CG-CB 4.09Å; P921-F924 WeakPolarHBondContact O-CA 3.31Å; P921-F924 WeakPolarHBondContact O-CB 3.3Å; P921-F924 PolarHBondContact O-N 3.14Å; P921-M925 PolarHBondContact O-N 2.88Å; P921-M925 VanDerWaalsContact O-N 3.09Å
922	K	54	Low	50.8	Low	160 Å²	160	88.4 Å²	88.4	70%	0.696	43%	0.425	S	S	*	.	H	α-helix	trans	-52.9	-39.3	-176.6	-165.4	-172.4	178.7	-154.5	0	113.4	F924 M925 E926	K922-F924 VanDerWaalsContact C-N 3.32Å; K922-F924 PolarHBondContact O-N 2.82Å; K922-M925 WeakPolarHBondContact O-CB 3.41Å; K922-M925 PolarHBondContact O-N 3.1Å; K922-E926 WeakPolarHBondContact CE-OE1 3.5Å; K922-E926 IonicContact NZ-OE1 3.48Å; K922-E926 PolarHBondContact NZ-OE1 2.05Å; K922-E926 WeakPolarHBondContact O-CG 3.44Å; K922-E926 PolarHBondContact O-N 2.79Å
923	K	54.6	Low	51.7	Low	164 Å²	164	86.3 Å²	86.3	71%	0.713	42%	0.419	S	S	*	.	H	α-helix	trans	-68.5	-27.8	178.8	-150.7	178.2	-172.2	-176.8	0	113.5	P921 L927	P921-K923 PolarHBondContact O-N 2.75Å; P921-K923 VanDerWaalsContact O-N 3.11Å; K923-L927 PolarHBondContact O-N 2.75Å; K923-L927 VanDerWaalsContact O-N 3.11Å
924	F	52.7	Low	52.3	Low	27 Å²	27	86 Å²	86	12%	0.118	43%	0.431	C	S	.	.	H	α-helix	trans	-74.2	-42.3	170.9	179.5	-115	0	0	0	110.7	M899 M920 P921 K922 E926 L927 V928	M899-F924 HydrophobicContact CE-CB 3.94Å; M899-F924 HydrophobicContact CE-CD2 3.42Å; M899-F924 VanDerWaalsContact CE-CD2 3.42Å; M899-F924 HydrophobicContact CE-CE2 4.27Å; M899-F924 HydrophobicContact CE-CG 4.03Å; M899-F924 HydrophobicContact SD-CD2 4.24Å; M920-F924 HydrophobicContact CB-CD1 4.36Å; M920-F924 HydrophobicContact CG-CD1 4.33Å; M920-F924 HydrophobicContact SD-CD1 3.9Å; M920-F924 HydrophobicContact SD-CE1 3.75Å; P921-F924 HydrophobicContact CG-CB 4.09Å; P921-F924 WeakPolarHBondContact O-CA 3.31Å; P921-F924 WeakPolarHBondContact O-CB 3.3Å; P921-F924 PolarHBondContact O-N 3.14Å; K922-F924 VanDerWaalsContact C-N 3.32Å; K922-F924 PolarHBondContact O-N 2.82Å; F924-E926 VanDerWaalsContact C-N 3.29Å; F924-E926 PolarHBondContact O-N 2.86Å; F924-L927 PolarHBondContact O-N 3.43Å; F924-V928 HydrophobicContact CD1-CG2 4.09Å; F924-V928 HydrophobicContact CD2-CG2 3.84Å; F924-V928 HydrophobicContact CE1-CG2 3.78Å; F924-V928 HydrophobicContact CE2-CG2 3.54Å; F924-V928 HydrophobicContact CG-CG2 4.14Å; F924-V928 HydrophobicContact CZ-CG2 3.51Å; F924-V928 VanDerWaalsContact O-CB 3.29Å; F924-V928 WeakPolarHBondContact O-CB 3.48Å; F924-V928 VanDerWaalsContact O-CG2 3.22Å; F924-V928 WeakPolarHBondContact O-CG2 3.48Å; F924-V928 PolarHBondContact O-N 3.13Å
925	M	55.7	Low	52.3	Low	86 Å²	86	83.9 Å²	83.9	42%	0.424	42%	0.424	S	S	.	.	H	α-helix	trans	-57.8	-41.9	172.5	-69.4	-74	-70.5	0	0	111.4	M920 P921 K922 W929	M920-M925 HydrophobicContact CB-CG 3.99Å; M920-M925 HydrophobicContact CB-SD 4.04Å; M920-M925 HydrophobicContact CE-SD 4.2Å; M920-M925 HydrophobicContact SD-SD 3.91Å; P921-M925 PolarHBondContact O-N 2.88Å; P921-M925 VanDerWaalsContact O-N 3.09Å; K922-M925 WeakPolarHBondContact O-CB 3.41Å; K922-M925 PolarHBondContact O-N 3.1Å; M925-W929 WeakPolarHBondContact O-CB 3.23Å; M925-W929 PolarHBondContact O-N 3.26Å
926	E	60.6	Low	53	Low	95 Å²	95	84.9 Å²	84.9	44%	0.444	43%	0.426	S	S	.	.	H	α-helix	trans	-64.3	-45.9	175.8	-72.3	164.2	-179.1	0	0	112.1	K922 F924 W929 E930	K922-E926 WeakPolarHBondContact CE-OE1 3.5Å; K922-E926 IonicContact NZ-OE1 3.48Å; K922-E926 PolarHBondContact NZ-OE1 2.05Å; K922-E926 WeakPolarHBondContact O-CG 3.44Å; K922-E926 PolarHBondContact O-N 2.79Å; F924-E926 VanDerWaalsContact C-N 3.29Å; F924-E926 PolarHBondContact O-N 2.86Å; E926-W929 PolarHBondContact O-N 3.23Å; E926-E930 PolarHBondContact O-N 2.89Å
927	L	55.9	Low	53.4	Low	59 Å²	59	83.3 Å²	83.3	31%	0.309	42%	0.421	S	S	.	.	H	α-helix	trans	-65.7	-40.4	176.2	-88.6	161.2	0	0	0	113.8	M899 K923 F924 K931	M899-L927 HydrophobicContact SD-CD1 4.39Å; K923-L927 PolarHBondContact O-N 2.75Å; K923-L927 VanDerWaalsContact O-N 3.11Å; F924-L927 PolarHBondContact O-N 3.43Å; L927-K931 PolarHBondContact O-N 2.83Å
928	V	58.3	Low	53.9	Low	22 Å²	22	87.2 Å²	87.2	13%	0.133	43%	0.425	C	S	.	.	H	α-helix	trans	-66.3	-41.8	174.8	169.8	0	0	0	0	109.7	L903 F924 K931 L932	L903-V928 HydrophobicContact CD2-CG2 4.4Å; F924-V928 HydrophobicContact CD1-CG2 4.09Å; F924-V928 HydrophobicContact CD2-CG2 3.84Å; F924-V928 HydrophobicContact CE1-CG2 3.78Å; F924-V928 HydrophobicContact CE2-CG2 3.54Å; F924-V928 HydrophobicContact CG-CG2 4.14Å; F924-V928 HydrophobicContact CZ-CG2 3.51Å; F924-V928 VanDerWaalsContact O-CB 3.29Å; F924-V928 WeakPolarHBondContact O-CB 3.48Å; F924-V928 VanDerWaalsContact O-CG2 3.22Å; F924-V928 WeakPolarHBondContact O-CG2 3.48Å; F924-V928 PolarHBondContact O-N 3.13Å; V928-K931 PolarHBondContact O-N 3.31Å; V928-L932 HydrophobicContact CG1-CD1 3.6Å; V928-L932 HydrophobicContact CG1-CG 4.04Å; V928-L932 VanDerWaalsContact O-CB 3.26Å; V928-L932 WeakPolarHBondContact O-CB 3.1Å; V928-L932 VanDerWaalsContact O-CG 3.23Å; V928-L932 WeakPolarHBondContact O-CG 3.25Å; V928-L932 PolarHBondContact O-N 2.7Å
929	W	62.7	Low	53.8	Low	109 Å²	109	82.2 Å²	82.2	41%	0.413	42%	0.418	S	S	.	.	H	α-helix	trans	-61.5	-46	175.7	-173.9	-95.3	0	0	0	112	M925 E926 L932 H933 F938 A941 A942	M925-W929 WeakPolarHBondContact O-CB 3.23Å; M925-W929 PolarHBondContact O-N 3.26Å; E926-W929 PolarHBondContact O-N 3.23Å; W929-L932 PolarHBondContact O-N 3.26Å; W929-H933 AromaticContact CE2-CD2 3.62Å; W929-H933 AromaticContact CE2-NE2 3.27Å; W929-H933 VanDerWaalsContact CE2-NE2 3.27Å; W929-H933 AromaticContact CZ2-CD2 3.89Å; W929-H933 AromaticContact CZ2-NE2 3.18Å; W929-H933 WeakPolarHBondContact CZ2-NE2 3.49Å; W929-H933 AromaticContact NE1-CD2 3.59Å; W929-H933 AromaticContact NE1-CE1 3.65Å; W929-H933 AromaticContact NE1-NE2 3.29Å; W929-H933 PolarHBondContact NE1-NE2 3.38Å; W929-H933 VanDerWaalsContact O-CB 3.3Å; W929-H933 WeakPolarHBondContact O-CB 3.36Å; W929-H933 PolarHBondContact O-N 3.28Å; W929-F938 HydrophobicContact CZ2-CE1 4.45Å; W929-A941 HydrophobicContact CZ3-CB 4.48Å; W929-A941 WeakPolarHBondContact CZ3-O 3.33Å; W929-A942 HydrophobicContact CH2-CB 4.22Å
930	E	62.8	Low	54.3	Low	142 Å²	142	85 Å²	85	66%	0.664	43%	0.427	S	S	*	.	H	α-helix	trans	-61.9	-45.5	175.9	-75.2	-168.1	156.3	0	0	112.6	E926 H933 G934	E926-E930 PolarHBondContact O-N 2.89Å; E930-H933 PolarHBondContact O-N 3.32Å; E930-G934 PolarHBondContact O-N 3.08Å
931	K	56.8	Low	54.5	Low	67 Å²	67	83 Å²	83	29%	0.291	42%	0.418	S	S	.	.	H	α-helix	trans	-69.1	-37.3	176.3	-89	-165.2	178.8	-178.1	0	113.1	L903 L927 V928 G934 Y935	L903-K931 HydrophobicContact CB-CD 3.82Å; L903-K931 HydrophobicContact CD1-CD 4.1Å; L903-K931 HydrophobicContact CD2-CD 4.3Å; L903-K931 HydrophobicContact CG-CD 4.31Å; L903-K931 PolarHBondContact O-NZ 3.35Å; L927-K931 PolarHBondContact O-N 2.83Å; V928-K931 PolarHBondContact O-N 3.31Å; K931-G934 PolarHBondContact O-N 2.69Å; K931-Y935 WeakPolarHBondContact O-CB 3.42Å; K931-Y935 PolarHBondContact O-N 3.2Å
932	L	57.2	Low	54.9	Low	20 Å²	20	84.9 Å²	84.9	11%	0.105	44%	0.435	C	S	.	.	H	α-helix	trans	-68.6	-36.9	175.4	-72.1	177.7	0	0	0	111.7	V928 W929 G934 Y935 F936 G937 A941 M944	V928-L932 HydrophobicContact CG1-CD1 3.6Å; V928-L932 HydrophobicContact CG1-CG 4.04Å; V928-L932 VanDerWaalsContact O-CB 3.26Å; V928-L932 WeakPolarHBondContact O-CB 3.1Å; V928-L932 VanDerWaalsContact O-CG 3.23Å; V928-L932 WeakPolarHBondContact O-CG 3.25Å; V928-L932 PolarHBondContact O-N 2.7Å; W929-L932 PolarHBondContact O-N 3.26Å; L932-G934 VanDerWaalsContact C-N 3.31Å; L932-G934 PolarHBondContact O-N 2.87Å; L932-Y935 PolarHBondContact O-N 3.42Å; L932-F936 HydrophobicContact CD2-CD2 3.6Å; L932-F936 HydrophobicContact CD2-CE2 3.73Å; L932-F936 PolarHBondContact O-N 2.92Å; L932-G937 PolarHBondContact O-N 3.42Å; L932-A941 HydrophobicContact CB-CB 3.92Å; L932-M944 HydrophobicContact CD1-CB 4.47Å; L932-M944 HydrophobicContact CD2-SD 4.13Å
933	H	59.5	Low	54.7	Low	52 Å²	52	81.3 Å²	81.3	24%	0.241	44%	0.436	C	S	.	.	H	α-helix	trans	-58.7	-43.6	168.2	-99.5	-136.2	0	0	0	111.6	W929 E930 G937 F938	W929-H933 AromaticContact CE2-CD2 3.62Å; W929-H933 AromaticContact CE2-NE2 3.27Å; W929-H933 VanDerWaalsContact CE2-NE2 3.27Å; W929-H933 AromaticContact CZ2-CD2 3.89Å; W929-H933 AromaticContact CZ2-NE2 3.18Å; W929-H933 WeakPolarHBondContact CZ2-NE2 3.49Å; W929-H933 AromaticContact NE1-CD2 3.59Å; W929-H933 AromaticContact NE1-CE1 3.65Å; W929-H933 AromaticContact NE1-NE2 3.29Å; W929-H933 PolarHBondContact NE1-NE2 3.38Å; W929-H933 VanDerWaalsContact O-CB 3.3Å; W929-H933 WeakPolarHBondContact O-CB 3.36Å; W929-H933 PolarHBondContact O-N 3.28Å; E930-H933 PolarHBondContact O-N 3.32Å; H933-G937 WeakPolarHBondContact O-CA 3.37Å; H933-G937 PolarHBondContact O-N 3.22Å; H933-F938 AromaticContact CE1-CD1 3.74Å; H933-F938 AromaticContact CE1-CD2 3.3Å; H933-F938 WeakPolarHBondContact CE1-CD2 3.47Å; H933-F938 AromaticContact CE1-CE1 3.81Å; H933-F938 AromaticContact CE1-CE2 3.41Å; H933-F938 VanDerWaalsContact CE1-CE2 3.41Å; H933-F938 WeakPolarHBondContact CE1-CE2 3.1Å; H933-F938 AromaticContact CE1-CG 3.49Å; H933-F938 VanDerWaalsContact CE1-CG 3.49Å; H933-F938 WeakPolarHBondContact CE1-CG 3.42Å; H933-F938 AromaticContact CE1-CZ 3.66Å; H933-F938 AromaticContact NE2-CD1 3.65Å; H933-F938 AromaticContact NE2-CD2 4Å; H933-F938 AromaticContact NE2-CE1 3.91Å; H933-F938 AromaticContact NE2-CG 3.69Å
934	G	57.4	Low	54	Low	69 Å²	69	79.7 Å²	79.7	71%	0.711	43%	0.432	S	S	*	.	H	α-helix	trans	-65.9	-36.9	176.6	0	0	0	0	0	114.4	E930 K931 L932	E930-G934 PolarHBondContact O-N 3.08Å; K931-G934 PolarHBondContact O-N 2.69Å; L932-G934 VanDerWaalsContact C-N 3.31Å; L932-G934 PolarHBondContact O-N 2.87Å
935	Y	49.8	Very low	54.1	Low	177 Å²	177	82.3 Å²	82.3	69%	0.694	45%	0.448	S	S	*	.	H	α-helix	trans	-91.3	-36.8	-175.1	-95.7	-81.8	0	0	0	115.2	K931 L932	K931-Y935 WeakPolarHBondContact O-CB 3.42Å; K931-Y935 PolarHBondContact O-N 3.2Å; L932-Y935 PolarHBondContact O-N 3.42Å
936	F	55.8	Low	54	Low	98 Å²	98	82.1 Å²	82.1	43%	0.43	45%	0.449	S	S	.	.	H	α-helix	trans	-122.6	-8.8	-171.2	-61.3	-75.3	0	0	0	113.9	L932 H940 M944	L932-F936 HydrophobicContact CD2-CD2 3.6Å; L932-F936 HydrophobicContact CD2-CE2 3.73Å; L932-F936 PolarHBondContact O-N 2.92Å; F936-H940 HydrophobicContact CB-CB 3.66Å; F936-M944 HydrophobicContact CD2-SD 4.33Å; F936-M944 HydrophobicContact CE2-SD 4.34Å; F936-M944 HydrophobicContact CZ-CE 4.43Å
937	G	49.8	Very low	53.7	Low	30 Å²	30	81.4 Å²	81.4	31%	0.309	45%	0.449	S	S	.	.	H	α-helix	trans	72.7	164.9	-176.8	0	0	0	0	0	113.8	L932 H933 G939 H940 A941	L932-G937 PolarHBondContact O-N 3.42Å; H933-G937 WeakPolarHBondContact O-CA 3.37Å; H933-G937 PolarHBondContact O-N 3.22Å; G937-G939 PolarHBondContact O-N 3.02Å; G937-H940 PolarHBondContact O-N 2.82Å; G937-A941 WeakPolarHBondContact O-CB 3.25Å; G937-A941 PolarHBondContact O-N 2.93Å; G937-A941 VanDerWaalsContact O-N 3.07Å
938	F	50	Low	53.5	Low	153 Å²	153	82.7 Å²	82.7	67%	0.671	46%	0.458	S	S	*	.	H	α-helix	trans	-49.3	-39.4	-171.1	-134.1	-61.3	0	0	0	114.1	W929 H933 A942	W929-F938 HydrophobicContact CZ2-CE1 4.45Å; H933-F938 AromaticContact CE1-CD1 3.74Å; H933-F938 AromaticContact CE1-CD2 3.3Å; H933-F938 WeakPolarHBondContact CE1-CD2 3.47Å; H933-F938 AromaticContact CE1-CE1 3.81Å; H933-F938 AromaticContact CE1-CE2 3.41Å; H933-F938 VanDerWaalsContact CE1-CE2 3.41Å; H933-F938 WeakPolarHBondContact CE1-CE2 3.1Å; H933-F938 AromaticContact CE1-CG 3.49Å; H933-F938 VanDerWaalsContact CE1-CG 3.49Å; H933-F938 WeakPolarHBondContact CE1-CG 3.42Å; H933-F938 AromaticContact CE1-CZ 3.66Å; H933-F938 AromaticContact NE2-CD1 3.65Å; H933-F938 AromaticContact NE2-CD2 4Å; H933-F938 AromaticContact NE2-CE1 3.91Å; H933-F938 AromaticContact NE2-CG 3.69Å; F938-A942 PolarHBondContact O-N 3.16Å
939	G	48.7	Very low	53.2	Low	62 Å²	62	86.5 Å²	86.5	64%	0.639	48%	0.478	S	S	*	.	H	α-helix	trans	-75.7	-35.7	-174.3	0	0	0	0	0	115	G937	G937-G939 PolarHBondContact O-N 3.02Å
940	H	52.1	Low	52.6	Low	120 Å²	120	85 Å²	85	56%	0.556	48%	0.482	S	S	*	.	H	α-helix	trans	-84.5	-34.3	176.3	-95.4	-148.3	0	0	0	111.8	F936 G937 A942 A943 M944	F936-H940 HydrophobicContact CB-CB 3.66Å; G937-H940 PolarHBondContact O-N 2.82Å; H940-A942 PolarHBondContact O-N 3.34Å; H940-A943 PolarHBondContact O-N 2.97Å; H940-M944 PolarHBondContact O-N 3.14Å
941	A	46.7	Very low	51.9	Low	0 Å²	0	80.9 Å²	80.9	0%	0	47%	0.469	C	S	.	.	H	α-helix	trans	-62.3	-28	176.1	0	0	0	0	0	113	W929 L932 G937 A943	W929-A941 HydrophobicContact CZ3-CB 4.48Å; W929-A941 WeakPolarHBondContact CZ3-O 3.33Å; L932-A941 HydrophobicContact CB-CB 3.92Å; G937-A941 WeakPolarHBondContact O-CB 3.25Å; G937-A941 PolarHBondContact O-N 2.93Å; G937-A941 VanDerWaalsContact O-N 3.07Å; A941-A943 VanDerWaalsContact C-N 3.34Å
942	A	51.1	Low	51.5	Low	70 Å²	70	82 Å²	82	58%	0.579	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-8.3	173.8	0	0	0	0	0	114.6	W929 F938 H940	W929-A942 HydrophobicContact CH2-CB 4.22Å; F938-A942 PolarHBondContact O-N 3.16Å; H940-A942 PolarHBondContact O-N 3.34Å
943	A	49.7	Very low	51	Low	85 Å²	85	87.2 Å²	87.2	70%	0.702	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	-8.7	179.7	0	0	0	0	0	113.4	H940 A941	H940-A943 PolarHBondContact O-N 2.97Å; A941-A943 VanDerWaalsContact C-N 3.34Å
944	M	41.5	Very low	50.2	Low	130 Å²	130	90.4 Å²	90.4	64%	0.64	54%	0.539	S	S	*	.			trans	-97.5	0	172.3	-73.3	-173.1	165.1	0	0	111.2	L932 F936 H940	L932-M944 HydrophobicContact CD1-CB 4.47Å; L932-M944 HydrophobicContact CD2-SD 4.13Å; F936-M944 HydrophobicContact CD2-SD 4.33Å; F936-M944 HydrophobicContact CE2-SD 4.34Å; F936-M944 HydrophobicContact CZ-CE 4.43Å; H940-M944 PolarHBondContact O-N 3.14Å

Retrieved 944 of 944 residues in 203.1 ms (Link to these results)

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