A0A5K4F5H1_SCHMA Loading...

Putative anosmin

AlphaFold DB , UniProt , Accession A0A5K4F5H1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 799 aa.

						>A0A5K4F5H1_SCHMA|A0A5K4F5H1
MKMNRLLHNIRYSFKLTLLLIEVLVLLIVIVHCQLPNDISTSWMEERLFARARCKANCLRLFNNPEESKAFRRTWNNEKFNDLDWSTCFANSHERCSSDCFRTCDLPPTECLSHCSDKIIGCQIGCFLIEQTCENQPGECSNSNYLMNDLNRTPSINQNNQTQYNGRKYPVVNDCANNCQLDCKVPLQTCCKYKCPQLSTDSIYNKLVPPRPILLNSIVSSTNANIIKLSWSSQYQNITSTMNPIVFILQIRICICQVFDESYASTWKTLIMTHEFGANLEAFEPGRLYQFRIAAVSIYGTRGFGLGTNAYPRDPIRPSPPGPPRNVTDSMWRLYSSGKVNLLLKWQPPVQSDLPLTEYLITWSIDHGYLHTDGRTLEALIQFTRTINAERTECILDNLKPATSYKIQVKATSYWHGFGNLESQPNTIFLSTQSIHPAFHQQIVSPVQIYATPNTIKLPKEFTLKSKSSDCDCGNGPQPLVLKKIFYENHKLKAILQINMTIKTESTALIQWYLQVCVDSNNPILDTLPSTILLKSKDKIVILENLHFNCHYGVRVRVYPATLDAKYITMMESLVHVQNQQFDGIVYIGCFCTPSCSNVINKEGQLPDNCILPDLGSPSPPTKVQVIHIDSLNYRISWIKPMTTMDKVTRDVDKHSSLSSSVNKINGNSTKYRVMWAPRIHEPVDESMYNDEIGFSPIMDLRQIDIKVIDQDQTWIVLNQLKPNTLYIVHVQPLFISYNGMQRESDPVSVYFTTICDKQMKSSYSGKYRSRNFASPCPAAVFTHAQFFIIFSLLGIYFL
					

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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	54.7	Low	63.3	Low	226 Å²	226	148.9 Å²	148.9	100%	1.113	70%	0.695	S	S	*	*				0	-39.9	0	-102.4	175.5	161.9	0	0	115.3	M3	M1-M3 PolarHBondContact O-N 3.41Å
2	K	54.6	Low	64.4	Low	190 Å²	190	149.5 Å²	149.5	83%	0.826	69%	0.688	S	S	*	*	H	α-helix	trans	-63.4	-33.1	178.8	-84.9	179	174.2	176.7	0	114.9	N4 R5 L6	K2-N4 PolarHBondContact O-N 3.27Å; K2-R5 PolarHBondContact O-N 3.5Å; K2-L6 PolarHBondContact O-N 3.34Å
3	M	55.5	Low	65.3	Low	147 Å²	147	143.7 Å²	143.7	72%	0.724	68%	0.675	S	S	*	*	H	α-helix	trans	-68.1	-33.9	-177	-153.8	163.2	83.8	0	0	113.7	M1 L6 L7	M1-M3 PolarHBondContact O-N 3.41Å; M3-L6 PolarHBondContact O-N 3.47Å; M3-L7 PolarHBondContact O-N 3.46Å; M3-L7 VanDerWaalsContact O-N 3.17Å
4	N	60.2	Low	66	Low	126 Å²	126	143.7 Å²	143.7	67%	0.674	67%	0.672	S	S	*	*	H	α-helix	trans	-70	-31.6	176.1	-93.5	1.8	0	0	0	113.2	K2 H8	K2-N4 PolarHBondContact O-N 3.27Å; N4-H8 WeakPolarHBondContact O-CB 3.32Å; N4-H8 PolarHBondContact O-N 3.41Å; N4-H8 VanDerWaalsContact O-N 3.07Å
5	R	65.3	Low	66.9	Low	203 Å²	203	144.3 Å²	144.3	77%	0.766	67%	0.671	S	S	*	*	H	α-helix	trans	-69	-36.5	174.8	-81	-172.7	178.2	-178.3	-0	112.1	K2 H8 N9	K2-R5 PolarHBondContact O-N 3.5Å; R5-H8 PolarHBondContact O-N 3.4Å; R5-N9 PolarHBondContact O-N 3.29Å
6	L	64.3	Low	67.9	Low	113 Å²	113	141.8 Å²	141.8	59%	0.592	66%	0.664	S	S	*	*	H	α-helix	trans	-66	-45.6	175.6	-100.7	144.4	0	0	0	112.1	K2 M3 H8 N9 I10	K2-L6 PolarHBondContact O-N 3.34Å; M3-L6 PolarHBondContact O-N 3.47Å; L6-H8 VanDerWaalsContact C-N 3.31Å; L6-H8 PolarHBondContact O-N 3.07Å; L6-N9 PolarHBondContact O-N 3.05Å; L6-I10 WeakPolarHBondContact O-CG1 3.44Å; L6-I10 PolarHBondContact O-N 3.17Å
7	L	64	Low	68.7	Low	102 Å²	102	137.3 Å²	137.3	53%	0.534	65%	0.648	S	S	.	*	H	α-helix	trans	-61.8	-37.7	174.9	-83.3	157.8	0	0	0	112.4	M3 R11	M3-L7 PolarHBondContact O-N 3.46Å; M3-L7 VanDerWaalsContact O-N 3.17Å; L7-R11 PolarHBondContact O-N 3.29Å
8	H	66.7	Low	69.3	Low	116 Å²	116	135.4 Å²	135.4	54%	0.537	64%	0.642	S	S	.	*	H	α-helix	trans	-67	-40.7	176.9	-158.4	-73.9	0	0	0	112.2	N4 R5 L6 R11 Y12	N4-H8 WeakPolarHBondContact O-CB 3.32Å; N4-H8 PolarHBondContact O-N 3.41Å; N4-H8 VanDerWaalsContact O-N 3.07Å; R5-H8 PolarHBondContact O-N 3.4Å; L6-H8 VanDerWaalsContact C-N 3.31Å; L6-H8 PolarHBondContact O-N 3.07Å; H8-R11 PolarHBondContact O-N 3.27Å; H8-Y12 AromaticContact CE1-CD2 3.85Å; H8-Y12 PolarHBondContact O-N 3.41Å
9	N	70.1	Confident	70	Confident	116 Å²	116	134.2 Å²	134.2	62%	0.62	64%	0.639	S	S	*	*	H	α-helix	trans	-67.9	-37.9	176.5	-79.8	-7.1	0	0	0	112.6	R5 L6 Y12 S13	R5-N9 PolarHBondContact O-N 3.29Å; L6-N9 PolarHBondContact O-N 3.05Å; N9-Y12 PolarHBondContact O-N 3.43Å; N9-S13 PolarHBondContact O-N 3.38Å
10	I	71.6	Confident	70.7	Confident	99 Å²	99	132.9 Å²	132.9	51%	0.508	64%	0.636	S	S	.	*	H	α-helix	trans	-65.4	-43.7	175.4	-65.9	165.2	0	0	0	110.5	L6 Y12 S13 F14	L6-I10 WeakPolarHBondContact O-CG1 3.44Å; L6-I10 PolarHBondContact O-N 3.17Å; I10-Y12 VanDerWaalsContact C-N 3.32Å; I10-Y12 PolarHBondContact O-N 3.03Å; I10-S13 PolarHBondContact O-N 3.41Å; I10-F14 PolarHBondContact O-N 3Å
11	R	70.1	Confident	71.3	Confident	200 Å²	200	131.8 Å²	131.8	76%	0.755	63%	0.632	S	S	*	*	H	α-helix	trans	-61	-39.4	174.5	-104	-177.9	172.3	178.5	-1.4	112.5	L7 H8 K15	L7-R11 PolarHBondContact O-N 3.29Å; H8-R11 PolarHBondContact O-N 3.27Å; R11-K15 PolarHBondContact O-N 3.04Å; R11-K15 VanDerWaalsContact O-N 3.11Å
12	Y	75.5	Confident	72.6	Confident	156 Å²	156	127.3 Å²	127.3	61%	0.612	61%	0.609	S	S	*	*	H	α-helix	trans	-67.3	-42.2	177.4	-126.7	-90.5	0	0	0	111.8	H8 N9 I10 F14 K15 L16	H8-Y12 AromaticContact CE1-CD2 3.85Å; H8-Y12 PolarHBondContact O-N 3.41Å; N9-Y12 PolarHBondContact O-N 3.43Å; I10-Y12 VanDerWaalsContact C-N 3.32Å; I10-Y12 PolarHBondContact O-N 3.03Å; Y12-F14 PolarHBondContact O-N 3.46Å; Y12-K15 PolarHBondContact O-N 3.43Å; Y12-L16 WeakPolarHBondContact O-CB 3.24Å; Y12-L16 PolarHBondContact O-N 2.74Å
13	S	76.3	Confident	74.1	Confident	74 Å²	74	122 Å²	122	52%	0.517	59%	0.592	S	S	.	*	H	α-helix	trans	-62.8	-41.4	176.3	-172.9	0	0	0	0	112.1	N9 I10 L16 T17	N9-S13 PolarHBondContact O-N 3.38Å; I10-S13 PolarHBondContact O-N 3.41Å; S13-L16 PolarHBondContact O-N 3.29Å; S13-T17 PolarHBondContact O-N 3.45Å; S13-T17 PolarHBondContact O-OG1 3.26Å; S13-T17 VanDerWaalsContact O-OG1 3.13Å
14	F	75.9	Confident	75.4	Confident	144 Å²	144	120.1 Å²	120.1	63%	0.632	58%	0.584	S	S	*	*	H	α-helix	trans	-67	-39.3	178.4	-127.1	-88.3	0	0	0	112.1	I10 Y12 T17 L18	I10-F14 PolarHBondContact O-N 3Å; Y12-F14 PolarHBondContact O-N 3.46Å; F14-T17 WeakPolarHBondContact CA-OG1 3.42Å; F14-T17 PolarHBondContact O-N 3.17Å; F14-T17 PolarHBondContact O-OG1 3.22Å; F14-L18 PolarHBondContact O-N 3.27Å; F14-L18 VanDerWaalsContact O-N 3.07Å
15	K	79.6	Confident	76.3	Confident	152 Å²	152	118 Å²	118	66%	0.661	58%	0.576	S	S	*	*	H	α-helix	trans	-63.7	-40.9	173.4	-80.1	-172.3	173.9	-170.1	0	112.1	R11 Y12 L18 L19	R11-K15 PolarHBondContact O-N 3.04Å; R11-K15 VanDerWaalsContact O-N 3.11Å; Y12-K15 PolarHBondContact O-N 3.43Å; K15-L18 PolarHBondContact O-N 2.74Å; K15-L19 PolarHBondContact O-N 2.81Å
16	L	82.3	Confident	77	Confident	105 Å²	105	113.7 Å²	113.7	55%	0.55	57%	0.567	S	S	.	*	H	α-helix	trans	-66.7	-39.5	178.8	-161.6	76.4	0	0	0	111.9	Y12 S13 L19 L20	Y12-L16 WeakPolarHBondContact O-CB 3.24Å; Y12-L16 PolarHBondContact O-N 2.74Å; S13-L16 PolarHBondContact O-N 3.29Å; L16-L19 PolarHBondContact O-N 3.03Å; L16-L20 PolarHBondContact O-N 3.03Å
17	T	80.7	Confident	77.6	Confident	65 Å²	65	112.9 Å²	112.9	40%	0.399	56%	0.563	S	S	.	*	H	α-helix	trans	-66.4	-37.1	174.7	45.8	0	0	0	0	112.6	S13 F14 L20 I21	S13-T17 PolarHBondContact O-N 3.45Å; S13-T17 PolarHBondContact O-OG1 3.26Å; S13-T17 VanDerWaalsContact O-OG1 3.13Å; F14-T17 WeakPolarHBondContact CA-OG1 3.42Å; F14-T17 PolarHBondContact O-N 3.17Å; F14-T17 PolarHBondContact O-OG1 3.22Å; T17-L20 PolarHBondContact O-N 2.67Å; T17-I21 VanDerWaalsContact O-CG1 3.3Å; T17-I21 WeakPolarHBondContact O-CG1 3.35Å; T17-I21 PolarHBondContact O-N 3.32Å
18	L	80.3	Confident	78.2	Confident	103 Å²	103	112.2 Å²	112.2	54%	0.539	56%	0.559	S	S	.	*	H	α-helix	trans	-65.4	-44	176.5	-141	91	0	0	0	111.1	F14 K15 L20 I21 E22	F14-L18 PolarHBondContact O-N 3.27Å; F14-L18 VanDerWaalsContact O-N 3.07Å; K15-L18 PolarHBondContact O-N 2.74Å; L18-L20 PolarHBondContact O-N 3.43Å; L18-I21 PolarHBondContact O-N 2.94Å; L18-E22 PolarHBondContact O-N 2.99Å
19	L	82.9	Confident	78.4	Confident	112 Å²	112	110.3 Å²	110.3	59%	0.586	56%	0.556	S	S	*	*	H	α-helix	trans	-60.2	-41.9	174.8	-99.7	148.9	0	0	0	112.4	K15 L16 E22 V23	K15-L19 PolarHBondContact O-N 2.81Å; L16-L19 PolarHBondContact O-N 3.03Å; L19-E22 PolarHBondContact O-N 3.43Å; L19-V23 VanDerWaalsContact O-CG2 3.27Å; L19-V23 WeakPolarHBondContact O-CG2 3.41Å; L19-V23 PolarHBondContact O-N 3.34Å
20	L	83.7	Confident	78.5	Confident	108 Å²	108	108 Å²	108	57%	0.565	54%	0.543	S	S	*	.	H	α-helix	trans	-65.4	-39.1	176.2	-80.4	164.6	0	0	0	112.4	L16 T17 L18 V23 L24	L16-L20 PolarHBondContact O-N 3.03Å; T17-L20 PolarHBondContact O-N 2.67Å; L18-L20 PolarHBondContact O-N 3.43Å; L20-V23 PolarHBondContact O-N 3.45Å; L20-L24 WeakPolarHBondContact O-CB 3.35Å; L20-L24 PolarHBondContact O-N 3.47Å
21	I	84.3	Confident	78.2	Confident	110 Å²	110	107.4 Å²	107.4	56%	0.564	54%	0.543	S	S	*	.	H	α-helix	trans	-65.2	-44.9	175.6	-67.6	164.9	0	0	0	110.2	T17 L18 V23 L24 V25	T17-I21 VanDerWaalsContact O-CG1 3.3Å; T17-I21 WeakPolarHBondContact O-CG1 3.35Å; T17-I21 PolarHBondContact O-N 3.32Å; L18-I21 PolarHBondContact O-N 2.94Å; I21-V23 VanDerWaalsContact C-N 3.35Å; I21-V23 PolarHBondContact O-N 3Å; I21-L24 PolarHBondContact O-N 2.89Å; I21-V25 HydrophobicContact CG2-CG2 4.3Å; I21-V25 VanDerWaalsContact O-CG2 3.31Å; I21-V25 WeakPolarHBondContact O-CG2 3.41Å; I21-V25 PolarHBondContact O-N 2.91Å
22	E	81	Confident	77.6	Confident	133 Å²	133	104.6 Å²	104.6	62%	0.621	54%	0.538	S	S	*	.	H	α-helix	trans	-61.3	-42.1	176.4	-72.9	-143.8	167.2	0	0	112.3	L18 L19 L24 V25 L26	L18-E22 PolarHBondContact O-N 2.99Å; L19-E22 PolarHBondContact O-N 3.43Å; E22-L24 VanDerWaalsContact C-N 3.34Å; E22-L24 PolarHBondContact O-N 2.93Å; E22-V25 PolarHBondContact O-N 3.19Å; E22-L26 WeakPolarHBondContact O-CB 3.32Å; E22-L26 PolarHBondContact O-N 3.37Å
23	V	85.1	Confident	76.6	Confident	78 Å²	78	102.1 Å²	102.1	47%	0.473	54%	0.543	S	S	.	.	H	α-helix	trans	-63.7	-39.1	175.7	172	0	0	0	0	111.5	L19 L20 I21 L26 L27	L19-V23 VanDerWaalsContact O-CG2 3.27Å; L19-V23 WeakPolarHBondContact O-CG2 3.41Å; L19-V23 PolarHBondContact O-N 3.34Å; L20-V23 PolarHBondContact O-N 3.45Å; I21-V23 VanDerWaalsContact C-N 3.35Å; I21-V23 PolarHBondContact O-N 3Å; V23-L26 WeakPolarHBondContact O-CB 3.39Å; V23-L26 PolarHBondContact O-N 2.92Å; V23-L27 HydrophobicContact CG1-CD1 4.15Å; V23-L27 WeakPolarHBondContact O-CB 3.29Å; V23-L27 WeakPolarHBondContact O-CG 3.38Å; V23-L27 PolarHBondContact O-N 3.44Å
24	L	83.7	Confident	75.1	Confident	108 Å²	108	105.8 Å²	105.8	57%	0.565	55%	0.551	S	S	*	*	H	α-helix	trans	-72.2	-38	-179.4	-147.8	141.2	0	0	0	111.6	L20 I21 E22 L27 I28	L20-L24 WeakPolarHBondContact O-CB 3.35Å; L20-L24 PolarHBondContact O-N 3.47Å; I21-L24 PolarHBondContact O-N 2.89Å; E22-L24 VanDerWaalsContact C-N 3.34Å; E22-L24 PolarHBondContact O-N 2.93Å; L24-L27 PolarHBondContact O-N 3.37Å; L24-I28 HydrophobicContact CD2-CD1 3.77Å; L24-I28 HydrophobicContact CD2-CG1 4.39Å; L24-I28 VanDerWaalsContact O-CG1 3.3Å; L24-I28 WeakPolarHBondContact O-CG1 3.47Å; L24-I28 PolarHBondContact O-N 3.4Å
25	V	79.3	Confident	73.3	Confident	82 Å²	82	103.1 Å²	103.1	50%	0.497	54%	0.543	S	S	.	.	H	α-helix	trans	-62.5	-43.7	169.3	173	0	0	0	0	110.2	I21 E22 L27 I28 V29	I21-V25 HydrophobicContact CG2-CG2 4.3Å; I21-V25 VanDerWaalsContact O-CG2 3.31Å; I21-V25 WeakPolarHBondContact O-CG2 3.41Å; I21-V25 PolarHBondContact O-N 2.91Å; E22-V25 PolarHBondContact O-N 3.19Å; V25-L27 VanDerWaalsContact C-N 3.32Å; V25-L27 PolarHBondContact O-N 3.22Å; V25-I28 PolarHBondContact O-N 3.5Å; V25-V29 HydrophobicContact CG1-CG2 4.37Å; V25-V29 WeakPolarHBondContact O-CB 3.48Å; V25-V29 VanDerWaalsContact O-CG2 3.25Å; V25-V29 WeakPolarHBondContact O-CG2 3.45Å; V25-V29 PolarHBondContact O-N 2.98Å
26	L	79.2	Confident	71.1	Confident	111 Å²	111	99.2 Å²	99.2	58%	0.581	53%	0.534	S	S	*	.	H	α-helix	trans	-60.6	-41.6	175.8	-135.8	98.4	0	0	0	111.6	E22 V23 V29 I30	E22-L26 WeakPolarHBondContact O-CB 3.32Å; E22-L26 PolarHBondContact O-N 3.37Å; V23-L26 WeakPolarHBondContact O-CB 3.39Å; V23-L26 PolarHBondContact O-N 2.92Å; L26-V29 PolarHBondContact O-N 3.41Å; L26-I30 HydrophobicContact CD2-CD1 4.22Å; L26-I30 WeakPolarHBondContact O-CB 3.23Å; L26-I30 WeakPolarHBondContact O-CD1 3.35Å; L26-I30 WeakPolarHBondContact O-CG1 3.34Å; L26-I30 PolarHBondContact O-N 2.82Å
27	L	77.8	Confident	69.2	Low	97 Å²	97	100.8 Å²	100.8	51%	0.508	54%	0.543	S	S	.	.	H	α-helix	trans	-67.2	-41.4	177	-75.4	170.3	0	0	0	112.2	V23 L24 V25 V29 I30 V31	V23-L27 HydrophobicContact CG1-CD1 4.15Å; V23-L27 WeakPolarHBondContact O-CB 3.29Å; V23-L27 WeakPolarHBondContact O-CG 3.38Å; V23-L27 PolarHBondContact O-N 3.44Å; L24-L27 PolarHBondContact O-N 3.37Å; V25-L27 VanDerWaalsContact C-N 3.32Å; V25-L27 PolarHBondContact O-N 3.22Å; L27-V29 VanDerWaalsContact C-N 3.33Å; L27-I30 PolarHBondContact O-N 3.2Å; L27-V31 WeakPolarHBondContact O-CB 3.23Å; L27-V31 VanDerWaalsContact O-CG2 3.28Å; L27-V31 WeakPolarHBondContact O-CG2 3.36Å; L27-V31 PolarHBondContact O-N 3.15Å
28	I	75.5	Confident	67.3	Low	87 Å²	87	103.5 Å²	103.5	45%	0.446	56%	0.555	S	S	.	*	H	α-helix	trans	-63	-42.6	174.3	-69.2	166.4	0	0	0	110.2	L24 V25 V31 H32	L24-I28 HydrophobicContact CD2-CD1 3.77Å; L24-I28 HydrophobicContact CD2-CG1 4.39Å; L24-I28 VanDerWaalsContact O-CG1 3.3Å; L24-I28 WeakPolarHBondContact O-CG1 3.47Å; L24-I28 PolarHBondContact O-N 3.4Å; V25-I28 PolarHBondContact O-N 3.5Å; I28-V31 PolarHBondContact O-N 2.69Å; I28-H32 WeakPolarHBondContact O-CB 3.49Å; I28-H32 PolarHBondContact O-N 3.41Å
29	V	71.2	Confident	65.2	Low	77 Å²	77	103.6 Å²	103.6	47%	0.467	56%	0.555	S	S	.	*	H	α-helix	trans	-63.6	-42.3	175.2	172.3	0	0	0	0	110.5	V25 L26 L27 H32 C33	V25-V29 HydrophobicContact CG1-CG2 4.37Å; V25-V29 WeakPolarHBondContact O-CB 3.48Å; V25-V29 VanDerWaalsContact O-CG2 3.25Å; V25-V29 WeakPolarHBondContact O-CG2 3.45Å; V25-V29 PolarHBondContact O-N 2.98Å; L26-V29 PolarHBondContact O-N 3.41Å; L27-V29 VanDerWaalsContact C-N 3.33Å; V29-H32 PolarHBondContact O-N 3.12Å; V29-C33 WeakPolarHBondContact O-CB 3.5Å; V29-C33 PolarHBondContact O-N 2.95Å; V29-C33 PolarHBondContact O-SG 2.74Å
30	I	71.8	Confident	63.4	Low	68 Å²	68	101.3 Å²	101.3	35%	0.349	55%	0.548	S	S	.	.	H	α-helix	trans	-62.8	-44.6	175.2	-69.9	162.1	0	0	0	110.5	L26 L27 C33 Q34	L26-I30 HydrophobicContact CD2-CD1 4.22Å; L26-I30 WeakPolarHBondContact O-CB 3.23Å; L26-I30 WeakPolarHBondContact O-CD1 3.35Å; L26-I30 WeakPolarHBondContact O-CG1 3.34Å; L26-I30 PolarHBondContact O-N 2.82Å; L27-I30 PolarHBondContact O-N 3.2Å; I30-C33 CarbonylContact O-C 3.53Å; I30-C33 PolarHBondContact O-N 3.08Å; I30-Q34 HydrophobicContact CG2-CG 4.11Å; I30-Q34 WeakPolarHBondContact O-CB 2.84Å; I30-Q34 VanDerWaalsContact O-CG 3.22Å; I30-Q34 WeakPolarHBondContact O-CG 2.92Å; I30-Q34 PolarHBondContact O-N 2.97Å
31	V	66.6	Low	62	Low	86 Å²	86	98.4 Å²	98.4	52%	0.521	54%	0.535	S	S	.	.	H	α-helix	trans	-65.2	-42.9	178.7	172.4	0	0	0	0	111.1	L27 I28 Q34 L35	L27-V31 WeakPolarHBondContact O-CB 3.23Å; L27-V31 VanDerWaalsContact O-CG2 3.28Å; L27-V31 WeakPolarHBondContact O-CG2 3.36Å; L27-V31 PolarHBondContact O-N 3.15Å; I28-V31 PolarHBondContact O-N 2.69Å; V31-Q34 PolarHBondContact O-N 3.35Å; V31-L35 HydrophobicContact CG1-CD1 4.32Å; V31-L35 WeakPolarHBondContact O-CD1 3.49Å; V31-L35 PolarHBondContact O-N 2.94Å
32	H	56.7	Low	60.7	Low	140 Å²	140	95.1 Å²	95.1	65%	0.648	52%	0.522	S	S	*	.	H	α-helix	trans	-71.2	-30.2	176.1	-86	-44.2	0	0	0	113.7	I28 V29	I28-H32 WeakPolarHBondContact O-CB 3.49Å; I28-H32 PolarHBondContact O-N 3.41Å; V29-H32 PolarHBondContact O-N 3.12Å
33	C	53.9	Low	60	Low	104 Å²	104	97 Å²	97	70%	0.703	52%	0.523	S	S	*	.	H	α-helix	trans	-80.4	-20.5	173	-72.5	0	0	0	0	113	V29 I30	V29-C33 WeakPolarHBondContact O-CB 3.5Å; V29-C33 PolarHBondContact O-N 2.95Å; V29-C33 PolarHBondContact O-SG 2.74Å; I30-C33 CarbonylContact O-C 3.53Å; I30-C33 PolarHBondContact O-N 3.08Å
34	Q	45.3	Very low	59.2	Low	151 Å²	151	98.2 Å²	98.2	71%	0.706	53%	0.525	S	S	*	.	H	α-helix	trans	-96.1	-9.4	177.6	-72.8	-166	-18.5	0	0	114	I30 V31 P36	I30-Q34 HydrophobicContact CG2-CG 4.11Å; I30-Q34 WeakPolarHBondContact O-CB 2.84Å; I30-Q34 VanDerWaalsContact O-CG 3.22Å; I30-Q34 WeakPolarHBondContact O-CG 2.92Å; I30-Q34 PolarHBondContact O-N 2.97Å; V31-Q34 PolarHBondContact O-N 3.35Å; Q34-P36 VanDerWaalsContact O-CD 3.23Å; Q34-P36 WeakPolarHBondContact O-CD 3.18Å
35	L	38.3	Very low	58.9	Low	88 Å²	88	95.8 Å²	95.8	46%	0.461	51%	0.511	S	S	.	.	S	Bend	trans	-65.1	113.6	159.1	-99.9	114.6	0	0	0	107.1	V31 N37 I39	V31-L35 HydrophobicContact CG1-CD1 4.32Å; V31-L35 WeakPolarHBondContact O-CD1 3.49Å; V31-L35 PolarHBondContact O-N 2.94Å; L35-N37 PolarHBondContact O-N 3.48Å; L35-I39 HydrophobicContact CD2-CD1 4.31Å
36	P	34.6	Very low	58.9	Low	71 Å²	71	95.1 Å²	95.1	46%	0.461	50%	0.502	S	S	.	.			trans	-61	128.6	178.7	2.4	6.6	0	0	0	107.4	Q34 D38 I39	Q34-P36 VanDerWaalsContact O-CD 3.23Å; Q34-P36 WeakPolarHBondContact O-CD 3.18Å; P36-D38 HydrophobicContact CB-CB 4.26Å; P36-D38 PolarHBondContact O-N 3.13Å; P36-I39 HydrophobicContact CG-CD1 4.4Å; P36-I39 HydrophobicContact CG-CG1 4.47Å; P36-I39 PolarHBondContact O-N 2.99Å
37	N	41.1	Very low	59	Low	138 Å²	138	91.7 Å²	91.7	74%	0.738	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.3	-24.4	171.8	-81.2	-31.2	0	0	0	112.2	L35 I39 S40 T41	L35-N37 PolarHBondContact O-N 3.48Å; N37-I39 VanDerWaalsContact C-N 3.32Å; N37-I39 PolarHBondContact O-N 3.36Å; N37-S40 PolarHBondContact O-N 3.37Å; N37-S40 PolarHBondContact O-OG 3.11Å; N37-T41 PolarHBondContact O-N 3.44Å
38	D	41.8	Very low	59.4	Low	121 Å²	121	87.6 Å²	87.6	65%	0.647	46%	0.46	S	S	*	.	H	α-helix	trans	-56.4	-30.6	175.1	-75.3	-25.6	0	0	0	115.8	P36 S40 T41 S42	P36-D38 HydrophobicContact CB-CB 4.26Å; P36-D38 PolarHBondContact O-N 3.13Å; D38-S40 VanDerWaalsContact C-N 3.35Å; D38-T41 WeakPolarHBondContact CA-OG1 2.98Å; D38-T41 PolarHBondContact O-OG1 3Å; D38-S42 WeakPolarHBondContact O-CB 3.32Å; D38-S42 PolarHBondContact O-N 3.42Å; D38-S42 VanDerWaalsContact O-N 3.12Å
39	I	34.8	Very low	60.1	Low	105 Å²	105	84.3 Å²	84.3	54%	0.538	44%	0.443	S	S	.	.	H	α-helix	trans	-69.6	-38.4	-179.3	-62	176.9	0	0	0	110.3	L35 P36 N37 W43	L35-I39 HydrophobicContact CD2-CD1 4.31Å; P36-I39 HydrophobicContact CG-CD1 4.4Å; P36-I39 HydrophobicContact CG-CG1 4.47Å; P36-I39 PolarHBondContact O-N 2.99Å; N37-I39 VanDerWaalsContact C-N 3.32Å; N37-I39 PolarHBondContact O-N 3.36Å; I39-W43 PolarHBondContact O-N 3.02Å
40	S	45.5	Very low	60.8	Low	64 Å²	64	81.3 Å²	81.3	45%	0.448	43%	0.426	S	S	.	.	H	α-helix	trans	-69.8	-38.8	178.2	73.3	0	0	0	0	112.4	N37 D38 M44	N37-S40 PolarHBondContact O-N 3.37Å; N37-S40 PolarHBondContact O-OG 3.11Å; D38-S40 VanDerWaalsContact C-N 3.35Å; S40-M44 WeakPolarHBondContact O-CE 3.32Å; S40-M44 WeakPolarHBondContact O-CG 3.48Å; S40-M44 PolarHBondContact O-N 3.37Å
41	T	54.5	Low	61.7	Low	47 Å²	47	81.8 Å²	81.8	29%	0.288	42%	0.423	S	S	.	.	H	α-helix	trans	-69.3	-37.8	-179	56.2	0	0	0	0	111.3	N37 D38 M44 E45	N37-T41 PolarHBondContact O-N 3.44Å; D38-T41 WeakPolarHBondContact CA-OG1 2.98Å; D38-T41 PolarHBondContact O-OG1 3Å; T41-M44 HydrophobicContact CG2-CE 4.31Å; T41-M44 PolarHBondContact O-N 3.22Å; T41-E45 PolarHBondContact O-N 3.08Å; T41-E45 VanDerWaalsContact O-N 3.08Å
42	S	57.3	Low	62.8	Low	42 Å²	42	77.7 Å²	77.7	29%	0.294	40%	0.399	S	S	.	.	H	α-helix	trans	-59.4	-51.6	178.4	-177.9	0	0	0	0	112.7	D38 M44 E45 E46 P186	D38-S42 WeakPolarHBondContact O-CB 3.32Å; D38-S42 PolarHBondContact O-N 3.42Å; D38-S42 VanDerWaalsContact O-N 3.12Å; S42-M44 VanDerWaalsContact C-N 3.33Å; S42-M44 PolarHBondContact O-N 2.82Å; S42-E45 PolarHBondContact O-N 3.22Å; S42-E46 PolarHBondContact O-N 2.86Å; S42-E46 VanDerWaalsContact O-N 3.1Å; S42-P186 WeakPolarHBondContact OG-CG 3.37Å
43	W	65.8	Low	64.4	Low	171 Å²	171	72.8 Å²	72.8	65%	0.648	37%	0.374	S	S	*	.	H	α-helix	trans	-65	-36.7	-179.9	176.1	83.1	0	0	0	112.4	I39 E46 R47	I39-W43 PolarHBondContact O-N 3.02Å; W43-E46 PolarHBondContact O-N 3.17Å; W43-R47 WeakPolarHBondContact O-CB 3.3Å; W43-R47 PolarHBondContact O-N 3.01Å
44	M	68.3	Low	66.2	Low	105 Å²	105	67.8 Å²	67.8	52%	0.517	34%	0.341	S	S	.	.	H	α-helix	trans	-64.7	-39.8	176.7	-72.5	-171.8	-64.9	0	0	112.4	S40 T41 S42 L48	S40-M44 WeakPolarHBondContact O-CE 3.32Å; S40-M44 WeakPolarHBondContact O-CG 3.48Å; S40-M44 PolarHBondContact O-N 3.37Å; T41-M44 HydrophobicContact CG2-CE 4.31Å; T41-M44 PolarHBondContact O-N 3.22Å; S42-M44 VanDerWaalsContact C-N 3.33Å; S42-M44 PolarHBondContact O-N 2.82Å; M44-L48 VanDerWaalsContact O-CB 3.31Å; M44-L48 WeakPolarHBondContact O-CB 3.28Å; M44-L48 PolarHBondContact O-N 3.49Å
45	E	78.8	Confident	68.4	Low	56 Å²	56	61 Å²	61	26%	0.262	31%	0.309	S	S	.	.	H	α-helix	trans	-67.5	-42.1	175.8	-74.9	-166.9	176.7	0	0	112.1	T41 S42 R47 L48 F49 R292 F304	T41-E45 PolarHBondContact O-N 3.08Å; T41-E45 VanDerWaalsContact O-N 3.08Å; S42-E45 PolarHBondContact O-N 3.22Å; E45-R47 PolarHBondContact O-N 2.83Å; E45-L48 WeakPolarHBondContact O-CB 3.3Å; E45-L48 PolarHBondContact O-N 3.03Å; E45-L48 VanDerWaalsContact O-N 3.17Å; E45-F49 HydrophobicContact CB-CE2 4.39Å; E45-F49 VanDerWaalsContact O-CD2 3.27Å; E45-F49 WeakPolarHBondContact O-CD2 3.37Å; E45-F49 WeakPolarHBondContact O-CG 3.34Å; E45-F49 PolarHBondContact O-N 2.98Å; E45-R292 IonicContact OE1-CZ 3.73Å; E45-R292 IonicContact OE1-NH1 3.7Å; E45-R292 IonicContact OE1-NH2 2.89Å; E45-R292 PolarHBondContact OE1-NH2 2.79Å; E45-F304 HydrophobicContact CG-CE2 4.41Å
46	E	77.6	Confident	70.8	Confident	69 Å²	69	56.8 Å²	56.8	32%	0.322	29%	0.287	S	S	.	.	H	α-helix	trans	-60.8	-46.5	177	-171.2	-177.1	167.7	0	0	111.6	S42 W43 L48 F49 A50 Q136	S42-E46 PolarHBondContact O-N 2.86Å; S42-E46 VanDerWaalsContact O-N 3.1Å; W43-E46 PolarHBondContact O-N 3.17Å; E46-L48 VanDerWaalsContact C-N 3.26Å; E46-L48 PolarHBondContact O-N 3.45Å; E46-F49 PolarHBondContact O-N 3.02Å; E46-A50 PolarHBondContact O-N 3.48Å; E46-Q136 PolarHBondContact OE1-NE2 2.88Å
47	R	83	Confident	73.4	Confident	38 Å²	38	54.3 Å²	54.3	14%	0.143	27%	0.27	C	S	.	.	H	α-helix	trans	-59.9	-39.2	174.8	-179.7	60.5	-174	138.2	13.7	111.8	W43 E45 A50 R51 D105 L106	W43-R47 WeakPolarHBondContact O-CB 3.3Å; W43-R47 PolarHBondContact O-N 3.01Å; E45-R47 PolarHBondContact O-N 2.83Å; R47-A50 PolarHBondContact O-N 3.36Å; R47-R51 VanDerWaalsContact O-CG 3.3Å; R47-R51 WeakPolarHBondContact O-CG 3.02Å; R47-R51 PolarHBondContact O-N 2.94Å; R47-D105 PolarHBondContact NH2-O 3.48Å; R47-L106 PolarHBondContact NH2-O 3.42Å
48	L	86.2	Confident	75.7	Confident	11 Å²	11	47.7 Å²	47.7	6%	0.058	24%	0.235	C	C	.	.	H	α-helix	trans	-64.7	-39.8	177.7	-179.3	63	0	0	0	112.1	M44 E45 E46 R51 A52 I248 T269 M272 F304	M44-L48 VanDerWaalsContact O-CB 3.31Å; M44-L48 WeakPolarHBondContact O-CB 3.28Å; M44-L48 PolarHBondContact O-N 3.49Å; E45-L48 WeakPolarHBondContact O-CB 3.3Å; E45-L48 PolarHBondContact O-N 3.03Å; E45-L48 VanDerWaalsContact O-N 3.17Å; E46-L48 VanDerWaalsContact C-N 3.26Å; E46-L48 PolarHBondContact O-N 3.45Å; L48-R51 PolarHBondContact O-N 2.9Å; L48-A52 PolarHBondContact O-N 3.05Å; L48-A52 VanDerWaalsContact O-N 3.11Å; L48-I248 HydrophobicContact CD1-CD1 4.43Å; L48-I248 HydrophobicContact CD1-CG2 4.27Å; L48-I248 HydrophobicContact CD2-CG2 3.9Å; L48-I248 HydrophobicContact CG-CD1 3.92Å; L48-I248 HydrophobicContact CG-CG2 4.16Å; L48-T269 HydrophobicContact CD1-CG2 4.25Å; L48-T269 VanDerWaalsContact CD2-OG1 3.23Å; L48-T269 WeakPolarHBondContact CD2-OG1 3.29Å; L48-M272 HydrophobicContact CD1-CE 3.6Å; L48-F304 HydrophobicContact CD2-CZ 4.01Å
49	F	88.6	Confident	77.8	Confident	19 Å²	19	42.5 Å²	42.5	8%	0.083	21%	0.207	C	C	.	.	H	α-helix	trans	-68.4	-38.4	173.8	-63	-41.3	0	0	0	112.7	E45 E46 R51 A52 R53 L187 I248 A294 V296 T301 F304	E45-F49 HydrophobicContact CB-CE2 4.39Å; E45-F49 VanDerWaalsContact O-CD2 3.27Å; E45-F49 WeakPolarHBondContact O-CD2 3.37Å; E45-F49 WeakPolarHBondContact O-CG 3.34Å; E45-F49 PolarHBondContact O-N 2.98Å; E46-F49 PolarHBondContact O-N 3.02Å; F49-R51 VanDerWaalsContact C-N 3.34Å; F49-R51 PolarHBondContact O-N 2.97Å; F49-A52 PolarHBondContact O-N 2.83Å; F49-R53 WeakPolarHBondContact O-CB 3.27Å; F49-R53 PolarHBondContact O-N 2.79Å; F49-L187 HydrophobicContact CE2-CD1 4.05Å; F49-I248 HydrophobicContact CD1-CD1 3.84Å; F49-I248 HydrophobicContact CE1-CD1 4.22Å; F49-A294 HydrophobicContact CE1-CB 3.88Å; F49-V296 HydrophobicContact CD1-CG2 4.08Å; F49-T301 HydrophobicContact CB-CG2 4.23Å; F49-T301 HydrophobicContact CD1-CG2 3.73Å; F49-T301 HydrophobicContact CD2-CG2 3.92Å; F49-T301 HydrophobicContact CE1-CG2 4Å; F49-T301 HydrophobicContact CE2-CG2 4.18Å; F49-T301 HydrophobicContact CG-CG2 3.7Å; F49-T301 HydrophobicContact CZ-CG2 4.22Å; F49-F304 HydrophobicContact CE1-CD2 4.2Å; F49-F304 AromaticContact CE1-CE2 3.68Å; F49-F304 HydrophobicContact CE1-CE2 3.68Å; F49-F304 AromaticContact CE1-CZ 3.98Å; F49-F304 HydrophobicContact CE1-CZ 3.98Å; F49-F304 AromaticContact CZ-CD2 3.76Å; F49-F304 HydrophobicContact CZ-CD2 3.76Å; F49-F304 AromaticContact CZ-CE2 3.5Å; F49-F304 HydrophobicContact CZ-CE2 3.5Å; F49-F304 HydrophobicContact CZ-CZ 4.28Å
50	A	86.8	Confident	80.3	Confident	14 Å²	14	41.1 Å²	41.1	12%	0.116	20%	0.195	C	C	.	.	H	α-helix	trans	-60.2	-44.2	174.4	0	0	0	0	0	111.6	E46 R47 A52 R53 C54 I129 T132	E46-A50 PolarHBondContact O-N 3.48Å; R47-A50 PolarHBondContact O-N 3.36Å; A50-A52 PolarHBondContact O-N 3.47Å; A50-R53 PolarHBondContact O-N 3.07Å; A50-C54 WeakPolarHBondContact O-CB 3.45Å; A50-C54 PolarHBondContact O-N 2.83Å; A50-I129 HydrophobicContact CB-CD1 4.29Å; A50-I129 WeakPolarHBondContact O-CD1 3.28Å; A50-T132 HydrophobicContact CB-CG2 4.26Å
51	R	89.8	Confident	82.2	Confident	77 Å²	77	38.5 Å²	38.5	29%	0.291	18%	0.176	S	C	.	.	H	α-helix	trans	-57.3	-50.4	173.9	-69.6	170.9	61.9	-173.7	0	111.5	R47 L48 F49 R53 C54 K55 C104 D105 M272	R47-R51 VanDerWaalsContact O-CG 3.3Å; R47-R51 WeakPolarHBondContact O-CG 3.02Å; R47-R51 PolarHBondContact O-N 2.94Å; L48-R51 PolarHBondContact O-N 2.9Å; F49-R51 VanDerWaalsContact C-N 3.34Å; F49-R51 PolarHBondContact O-N 2.97Å; R51-R53 VanDerWaalsContact C-N 3.33Å; R51-R53 PolarHBondContact O-N 2.98Å; R51-C54 WeakPolarHBondContact O-CB 3.42Å; R51-C54 PolarHBondContact O-N 2.79Å; R51-K55 WeakPolarHBondContact O-CG 3.28Å; R51-K55 PolarHBondContact O-N 3.41Å; R51-C104 WeakPolarHBondContact CG-O 3.49Å; R51-D105 IonicContact CZ-OD1 2.88Å; R51-D105 IonicContact NE-OD1 2.79Å; R51-D105 PolarHBondContact NE-OD1 2.79Å; R51-D105 IonicContact NH2-OD1 3.65Å; R51-D105 PolarHBondContact NH2-OD1 2.9Å; R51-D105 IonicContact NH2-OD2 3.14Å; R51-M272 HydrophobicContact CB-CE 4.41Å
52	A	90.3	Very high	83.5	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63.5	-37.8	-179.8	0	0	0	0	0	112.9	L48 F49 A50 K55 A56 V246 I248 M272 V296	L48-A52 PolarHBondContact O-N 3.05Å; L48-A52 VanDerWaalsContact O-N 3.11Å; F49-A52 PolarHBondContact O-N 2.83Å; A50-A52 PolarHBondContact O-N 3.47Å; A52-K55 PolarHBondContact O-N 3.19Å; A52-A56 PolarHBondContact O-N 2.84Å; A52-V246 HydrophobicContact CB-CB 4.34Å; A52-V246 HydrophobicContact CB-CG1 3.94Å; A52-I248 HydrophobicContact CB-CD1 3.56Å; A52-I248 HydrophobicContact CB-CG1 3.99Å; A52-M272 HydrophobicContact CB-CE 3.84Å; A52-M272 HydrophobicContact CB-SD 3.81Å; A52-V296 HydrophobicContact CB-CB 3.88Å; A52-V296 HydrophobicContact CB-CG1 3.97Å; A52-V296 HydrophobicContact CB-CG2 3.83Å
53	R	89.9	Confident	84.6	Confident	37 Å²	37	41.8 Å²	41.8	14%	0.14	19%	0.186	C	C	.	.	H	α-helix	trans	-69.1	-38.2	176.3	179.3	167.2	176	-149.4	8.4	112.2	F49 A50 R51 A56 N57 T132 N135 V296 I298	F49-R53 WeakPolarHBondContact O-CB 3.27Å; F49-R53 PolarHBondContact O-N 2.79Å; A50-R53 PolarHBondContact O-N 3.07Å; R51-R53 VanDerWaalsContact C-N 3.33Å; R51-R53 PolarHBondContact O-N 2.98Å; R53-A56 WeakPolarHBondContact O-CB 3.35Å; R53-A56 PolarHBondContact O-N 2.77Å; R53-N57 PolarHBondContact O-N 2.81Å; R53-N57 PolarHBondContact O-ND2 2.78Å; R53-T132 HydrophobicContact CB-CG2 3.75Å; R53-T132 HydrophobicContact CG-CG2 3.61Å; R53-N135 PolarHBondContact NH1-O 3.17Å; R53-N135 PolarHBondContact NH2-O 3.4Å; R53-V296 HydrophobicContact CB-CG1 3.98Å; R53-I298 PolarHBondContact NE-O 2.94Å; R53-I298 PolarHBondContact NH2-O 2.87Å
54	C	91.6	Very high	85.3	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.2	-46.4	169.7	177.2	0	0	0	0	111.4	A50 R51 A56 N57 C58 C104 I129	A50-C54 WeakPolarHBondContact O-CB 3.45Å; A50-C54 PolarHBondContact O-N 2.83Å; R51-C54 WeakPolarHBondContact O-CB 3.42Å; R51-C54 PolarHBondContact O-N 2.79Å; C54-A56 VanDerWaalsContact C-N 3.31Å; C54-A56 PolarHBondContact O-N 2.81Å; C54-N57 WeakPolarHBondContact O-CA 3.29Å; C54-N57 WeakPolarHBondContact O-CB 3.43Å; C54-N57 PolarHBondContact O-N 3.45Å; C54-C58 PolarHBondContact O-N 2.97Å; C54-C104 HydrophobicContact CB-CB 3.65Å; C54-C104 WeakPolarHBondContact CB-SG 3.42Å; C54-C104 VanDerWaalsContact SG-CA 3.57Å; C54-C104 WeakPolarHBondContact SG-CB 3.26Å; C54-C104 CovalentContact SG-SG 2.04Å; C54-C104 PolarHBondContact SG-SG 3.45Å; C54-I129 HydrophobicContact CB-CB 4.2Å; C54-I129 HydrophobicContact CB-CD1 3.49Å; C54-I129 VanDerWaalsContact CB-CD1 3.49Å; C54-I129 HydrophobicContact CB-CG1 4.44Å
55	K	91	Very high	85.8	Confident	7 Å²	7	35.7 Å²	35.7	3%	0.03	17%	0.173	C	C	.	.	H	α-helix	trans	-61.5	-38.2	175.4	-67.3	-168.3	-174.3	-171.9	0	112.1	R51 A52 C58 L59 F101 C104 D105 V246 M272	R51-K55 WeakPolarHBondContact O-CG 3.28Å; R51-K55 PolarHBondContact O-N 3.41Å; A52-K55 PolarHBondContact O-N 3.19Å; K55-C58 PolarHBondContact O-N 2.91Å; K55-L59 PolarHBondContact O-N 3.32Å; K55-F101 HydrophobicContact CB-CD1 3.78Å; K55-F101 HydrophobicContact CB-CE1 3.88Å; K55-F101 HydrophobicContact CD-CD1 4.04Å; K55-F101 WeakPolarHBondContact CE-O 3.22Å; K55-F101 HydrophobicContact CG-CD1 3.76Å; K55-F101 HydrophobicContact CG-CE1 4.38Å; K55-F101 VanDerWaalsContact O-CE1 3.24Å; K55-F101 WeakPolarHBondContact O-CE1 3.22Å; K55-C104 HydrophobicContact CG-CB 3.86Å; K55-C104 PolarHBondContact N-SG 2.95Å; K55-D105 VanDerWaalsContact CE-OD1 3.23Å; K55-D105 WeakPolarHBondContact CE-OD1 3.44Å; K55-D105 IonicContact NZ-OD1 3.52Å; K55-D105 PolarHBondContact NZ-OD1 2.88Å; K55-D105 VanDerWaalsContact NZ-OD1 3.16Å; K55-D105 IonicContact NZ-OD2 3.14Å; K55-D105 PolarHBondContact NZ-OD2 3.26Å; K55-V246 HydrophobicContact CB-CG2 4.2Å; K55-M272 HydrophobicContact CD-SD 3.69Å
56	A	89.5	Confident	85.8	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.6	-41.6	172.2	0	0	0	0	0	111.7	A52 R53 C54 L59 R60 P244 V246 I298	A52-A56 PolarHBondContact O-N 2.84Å; R53-A56 WeakPolarHBondContact O-CB 3.35Å; R53-A56 PolarHBondContact O-N 2.77Å; C54-A56 VanDerWaalsContact C-N 3.31Å; C54-A56 PolarHBondContact O-N 2.81Å; A56-L59 PolarHBondContact O-N 3.05Å; A56-R60 WeakPolarHBondContact O-CB 3.34Å; A56-R60 PolarHBondContact O-N 2.96Å; A56-P244 HydrophobicContact CB-CG 4.32Å; A56-P244 WeakPolarHBondContact O-CG 3.47Å; A56-V246 HydrophobicContact CB-CG2 3.93Å; A56-I298 HydrophobicContact CB-CG2 3.99Å
57	N	89.1	Confident	85.8	Confident	19 Å²	19	37.8 Å²	37.8	10%	0.102	18%	0.183	C	C	.	.	H	α-helix	trans	-63.8	-42	174.8	-77.4	-47.4	0	0	0	112.2	R53 C54 R60 L61 L128 I298	R53-N57 PolarHBondContact O-N 2.81Å; R53-N57 PolarHBondContact O-ND2 2.78Å; C54-N57 WeakPolarHBondContact O-CA 3.29Å; C54-N57 WeakPolarHBondContact O-CB 3.43Å; C54-N57 PolarHBondContact O-N 3.45Å; N57-R60 PolarHBondContact O-N 2.97Å; N57-L61 WeakPolarHBondContact O-CB 3.46Å; N57-L61 PolarHBondContact O-N 3.11Å; N57-L128 HydrophobicContact CB-CB 4.46Å; N57-L128 HydrophobicContact CB-CD1 3.85Å; N57-L128 HydrophobicContact CB-CD2 3.95Å; N57-L128 HydrophobicContact CB-CG 4.31Å; N57-I298 WeakPolarHBondContact OD1-CB 3.34Å; N57-I298 VanDerWaalsContact OD1-CG2 3.22Å; N57-I298 WeakPolarHBondContact OD1-CG2 3.44Å
58	C	89.2	Confident	85.4	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-57.7	-52.5	172.4	-65.7	0	0	0	0	110.4	C54 K55 R60 L61 F62 C100 F101 C104	C54-C58 PolarHBondContact O-N 2.97Å; K55-C58 PolarHBondContact O-N 2.91Å; C58-R60 VanDerWaalsContact C-N 3.25Å; C58-R60 PolarHBondContact O-N 2.91Å; C58-L61 PolarHBondContact O-N 2.84Å; C58-F62 HydrophobicContact CB-CD2 4.46Å; C58-F62 WeakPolarHBondContact O-CD2 3.32Å; C58-F62 PolarHBondContact O-N 3.23Å; C58-C100 HydrophobicContact CB-CB 3.96Å; C58-C100 WeakPolarHBondContact CB-SG 3.42Å; C58-C100 WeakPolarHBondContact SG-CB 3.43Å; C58-C100 PolarHBondContact SG-O 2.86Å; C58-C100 CovalentContact SG-SG 2.05Å; C58-C100 PolarHBondContact SG-SG 2.81Å; C58-F101 HydrophobicContact CB-CD1 4.35Å; C58-F101 HydrophobicContact CB-CD2 4.46Å; C58-F101 HydrophobicContact CB-CE1 3.97Å; C58-F101 HydrophobicContact CB-CE2 4.05Å; C58-F101 HydrophobicContact CB-CZ 3.74Å; C58-C104 VanDerWaalsContact SG-SG 3.6Å
59	L	87.4	Confident	85	Confident	12 Å²	12	40.6 Å²	40.6	6%	0.063	20%	0.197	C	C	.	.	H	α-helix	trans	-53.3	-44.2	177.4	-76.7	171.7	0	0	0	111.8	K55 A56 N63 F101 P244 V246 H274 I693	K55-L59 PolarHBondContact O-N 3.32Å; A56-L59 PolarHBondContact O-N 3.05Å; L59-N63 WeakPolarHBondContact O-CB 3.3Å; L59-N63 PolarHBondContact O-N 2.6Å; L59-N63 PolarHBondContact O-ND2 2.93Å; L59-F101 HydrophobicContact CB-CZ 4.2Å; L59-F101 HydrophobicContact CD1-CE1 4.44Å; L59-F101 HydrophobicContact CD2-CE1 3.99Å; L59-F101 HydrophobicContact CD2-CE2 4.34Å; L59-F101 HydrophobicContact CD2-CZ 3.41Å; L59-F101 VanDerWaalsContact CD2-CZ 3.41Å; L59-F101 HydrophobicContact CG-CE1 3.66Å; L59-F101 HydrophobicContact CG-CZ 3.42Å; L59-F101 VanDerWaalsContact CG-CZ 3.42Å; L59-P244 HydrophobicContact CB-CB 3.65Å; L59-P244 HydrophobicContact CB-CG 3.72Å; L59-P244 HydrophobicContact CD1-CB 3.94Å; L59-P244 HydrophobicContact CG-CB 4.43Å; L59-V246 HydrophobicContact CD1-CG2 3.9Å; L59-H274 HydrophobicContact CD1-CB 3.83Å; L59-I693 HydrophobicContact CD2-CG2 4.35Å
60	R	86.1	Confident	84.4	Confident	75 Å²	75	42.1 Å²	42.1	28%	0.283	21%	0.213	S	C	.	.	H	α-helix	trans	-65	-46	-177.2	-166.7	176.6	65.1	140.5	-3.6	110.9	A56 N57 C58 N64 E67 P244 I298	A56-R60 WeakPolarHBondContact O-CB 3.34Å; A56-R60 PolarHBondContact O-N 2.96Å; N57-R60 PolarHBondContact O-N 2.97Å; C58-R60 VanDerWaalsContact C-N 3.25Å; C58-R60 PolarHBondContact O-N 2.91Å; R60-N64 VanDerWaalsContact O-CB 3.31Å; R60-N64 WeakPolarHBondContact O-CB 3.07Å; R60-N64 PolarHBondContact O-N 2.88Å; R60-E67 VanDerWaalsContact CD-OE1 3.28Å; R60-E67 WeakPolarHBondContact CD-OE1 3.29Å; R60-E67 WeakPolarHBondContact CD-OE2 3.38Å; R60-E67 WeakPolarHBondContact CG-OE2 3.36Å; R60-E67 IonicContact CZ-OE1 3.36Å; R60-E67 IonicContact CZ-OE2 2.95Å; R60-E67 IonicContact NE-OE1 3.48Å; R60-E67 PolarHBondContact NE-OE1 2.75Å; R60-E67 IonicContact NE-OE2 2.78Å; R60-E67 PolarHBondContact NE-OE2 2.93Å; R60-E67 IonicContact NH1-OE1 3.24Å; R60-E67 PolarHBondContact NH1-OE1 3.08Å; R60-E67 IonicContact NH1-OE2 3.87Å; R60-E67 PolarHBondContact NH1-OE2 2.84Å; R60-E67 IonicContact NH2-OE2 3.65Å; R60-P244 HydrophobicContact CB-CG 3.75Å; R60-I298 HydrophobicContact CB-CG2 4.45Å; R60-I298 VanDerWaalsContact NH1-CD1 3.27Å
61	L	84.9	Confident	83.9	Confident	9 Å²	9	43 Å²	43	5%	0.047	21%	0.214	C	C	.	.	H	α-helix	trans	-65.1	-40	-177.5	-177	67	0	0	0	112.2	N57 C58 S68 F71 F89 I124	N57-L61 WeakPolarHBondContact O-CB 3.46Å; N57-L61 PolarHBondContact O-N 3.11Å; C58-L61 PolarHBondContact O-N 2.84Å; L61-S68 PolarHBondContact O-OG 3.12Å; L61-F71 HydrophobicContact CD1-CB 3.42Å; L61-F71 VanDerWaalsContact CD1-CB 3.42Å; L61-F71 HydrophobicContact CD1-CD1 3.92Å; L61-F71 HydrophobicContact CD1-CD2 4.05Å; L61-F71 HydrophobicContact CD1-CG 3.52Å; L61-F71 HydrophobicContact CD2-CD1 4.04Å; L61-F71 HydrophobicContact CD2-CE1 4.11Å; L61-F71 HydrophobicContact CD2-CG 4.27Å; L61-F71 HydrophobicContact CD2-CZ 4.4Å; L61-F89 HydrophobicContact CD1-CE1 4.3Å; L61-F89 HydrophobicContact CD1-CZ 4.48Å; L61-F89 HydrophobicContact CD2-CE1 3.92Å; L61-F89 HydrophobicContact CD2-CZ 4.06Å; L61-F89 HydrophobicContact CG-CE1 3.78Å; L61-F89 HydrophobicContact CG-CZ 4.26Å; L61-I124 HydrophobicContact CD2-CD1 4.43Å; L61-I124 HydrophobicContact CD2-CG2 3.55Å
62	F	82.5	Confident	83.1	Confident	40 Å²	40	43 Å²	43	18%	0.175	21%	0.214	C	C	.	.	H	α-helix	trans	-84.7	-24.8	-178.6	-71.8	-73.5	0	0	0	113.6	C58 F89 C96 C100 I124	C58-F62 HydrophobicContact CB-CD2 4.46Å; C58-F62 WeakPolarHBondContact O-CD2 3.32Å; C58-F62 PolarHBondContact O-N 3.23Å; F62-F89 AromaticContact CD1-CD1 3.9Å; F62-F89 HydrophobicContact CD1-CD1 3.9Å; F62-F89 HydrophobicContact CD1-CE1 4.06Å; F62-F89 AromaticContact CE1-CD1 3.79Å; F62-F89 HydrophobicContact CE1-CD1 3.79Å; F62-F89 AromaticContact CE1-CE1 3.71Å; F62-F89 HydrophobicContact CE1-CE1 3.71Å; F62-F89 HydrophobicContact CZ-CE1 4.17Å; F62-C96 HydrophobicContact CE1-CB 4Å; F62-C96 HydrophobicContact CZ-CB 4.19Å; F62-C100 HydrophobicContact CE2-CB 3.69Å; F62-C100 HydrophobicContact CZ-CB 4.36Å; F62-I124 HydrophobicContact CZ-CD1 4.03Å
63	N	80.5	Confident	82.1	Confident	119 Å²	119	51.7 Å²	51.7	64%	0.636	25%	0.247	S	C	*	.	H	α-helix	trans	-93.3	-14	179.7	-65.8	-16.9	0	0	0	114.2	L59	L59-N63 WeakPolarHBondContact O-CB 3.3Å; L59-N63 PolarHBondContact O-N 2.6Å; L59-N63 PolarHBondContact O-ND2 2.93Å
64	N	80.2	Confident	81	Confident	62 Å²	62	53.8 Å²	53.8	33%	0.332	26%	0.264	S	S	.	.			trans	-116.2	101.8	-179.7	-174	-13.6	0	0	0	112	R60 E66 E67 S68	R60-N64 VanDerWaalsContact O-CB 3.31Å; R60-N64 WeakPolarHBondContact O-CB 3.07Å; R60-N64 PolarHBondContact O-N 2.88Å; N64-E66 PolarHBondContact O-N 3.29Å; N64-E66 VanDerWaalsContact O-N 3.15Å; N64-E66 PolarHBondContact OD1-N 3.19Å; N64-E66 VanDerWaalsContact OD1-N 3.13Å; N64-E67 HydrophobicContact CB-CB 4.17Å; N64-E67 HydrophobicContact CB-CG 4.37Å; N64-E67 PolarHBondContact O-N 2.83Å; N64-E67 VanDerWaalsContact O-N 3.11Å; N64-S68 PolarHBondContact O-N 2.86Å; N64-S68 PolarHBondContact O-OG 3Å
65	P	78.8	Confident	79.8	Confident	85 Å²	85	54.6 Å²	54.6	55%	0.552	27%	0.267	S	S	*	.	H	α-helix	trans	-57.2	-31.4	-178	-26	33.9	0	0	0	115	K69	P65-K69 VanDerWaalsContact O-CG 3.28Å; P65-K69 WeakPolarHBondContact O-CG 3.18Å; P65-K69 PolarHBondContact O-N 2.87Å
66	E	79.1	Confident	78.4	Confident	119 Å²	119	57.2 Å²	57.2	56%	0.556	28%	0.281	S	S	*	.	H	α-helix	trans	-72.4	-39.8	179.5	-68.3	-55.5	127.7	0	0	111.3	N64 K69 A70	N64-E66 PolarHBondContact O-N 3.29Å; N64-E66 VanDerWaalsContact O-N 3.15Å; N64-E66 PolarHBondContact OD1-N 3.19Å; N64-E66 VanDerWaalsContact OD1-N 3.13Å; E66-K69 PolarHBondContact O-N 2.83Å; E66-K69 IonicContact OE1-NZ 2.75Å; E66-K69 PolarHBondContact OE1-NZ 2.92Å; E66-A70 WeakPolarHBondContact O-CB 3.45Å; E66-A70 PolarHBondContact O-N 3.14Å
67	E	76.7	Confident	76.8	Confident	51 Å²	51	63.8 Å²	63.8	24%	0.238	32%	0.317	C	S	.	.	H	α-helix	trans	-68.2	-38.5	172.2	-73.9	-164.7	-163.7	0	0	111.7	R60 N64 K69 A70 F71	R60-E67 VanDerWaalsContact CD-OE1 3.28Å; R60-E67 WeakPolarHBondContact CD-OE1 3.29Å; R60-E67 WeakPolarHBondContact CD-OE2 3.38Å; R60-E67 WeakPolarHBondContact CG-OE2 3.36Å; R60-E67 IonicContact CZ-OE1 3.36Å; R60-E67 IonicContact CZ-OE2 2.95Å; R60-E67 IonicContact NE-OE1 3.48Å; R60-E67 PolarHBondContact NE-OE1 2.75Å; R60-E67 IonicContact NE-OE2 2.78Å; R60-E67 PolarHBondContact NE-OE2 2.93Å; R60-E67 IonicContact NH1-OE1 3.24Å; R60-E67 PolarHBondContact NH1-OE1 3.08Å; R60-E67 IonicContact NH1-OE2 3.87Å; R60-E67 PolarHBondContact NH1-OE2 2.84Å; R60-E67 IonicContact NH2-OE2 3.65Å; N64-E67 HydrophobicContact CB-CB 4.17Å; N64-E67 HydrophobicContact CB-CG 4.37Å; N64-E67 PolarHBondContact O-N 2.83Å; N64-E67 VanDerWaalsContact O-N 3.11Å; E67-K69 VanDerWaalsContact C-N 3.27Å; E67-K69 PolarHBondContact O-N 2.85Å; E67-A70 PolarHBondContact O-N 3.45Å; E67-F71 VanDerWaalsContact O-CB 3.25Å; E67-F71 WeakPolarHBondContact O-CB 3.34Å; E67-F71 PolarHBondContact O-N 3.17Å
68	S	75.5	Confident	75.3	Confident	9 Å²	9	69.6 Å²	69.6	6%	0.063	34%	0.343	C	S	.	.	H	α-helix	trans	-59.5	-39.6	174.2	-32.5	0	0	0	0	111.6	L61 N64 R72	L61-S68 PolarHBondContact O-OG 3.12Å; N64-S68 PolarHBondContact O-N 2.86Å; N64-S68 PolarHBondContact O-OG 3Å; S68-R72 VanDerWaalsContact O-CB 3.31Å; S68-R72 WeakPolarHBondContact O-CB 3.49Å; S68-R72 PolarHBondContact O-N 3.33Å
69	K	76.8	Confident	73.7	Confident	99 Å²	99	76.7 Å²	76.7	43%	0.43	37%	0.374	S	S	.	.	H	α-helix	trans	-67.1	-44	174.9	-73.1	170.3	-167.7	167.3	0	112	P65 E66 E67 R72 R73	P65-K69 VanDerWaalsContact O-CG 3.28Å; P65-K69 WeakPolarHBondContact O-CG 3.18Å; P65-K69 PolarHBondContact O-N 2.87Å; E66-K69 PolarHBondContact O-N 2.83Å; E66-K69 IonicContact OE1-NZ 2.75Å; E66-K69 PolarHBondContact OE1-NZ 2.92Å; E67-K69 VanDerWaalsContact C-N 3.27Å; E67-K69 PolarHBondContact O-N 2.85Å; K69-R72 PolarHBondContact O-N 3.1Å; K69-R73 WeakPolarHBondContact O-CG 3.38Å; K69-R73 PolarHBondContact O-N 2.85Å
70	A	77.4	Confident	72.2	Confident	51 Å²	51	79 Å²	79	42%	0.421	38%	0.384	S	S	.	.	H	α-helix	trans	-64.3	-48.2	179	0	0	0	0	0	111.3	E66 E67 R72 R73 T74	E66-A70 WeakPolarHBondContact O-CB 3.45Å; E66-A70 PolarHBondContact O-N 3.14Å; E67-A70 PolarHBondContact O-N 3.45Å; A70-R72 VanDerWaalsContact C-N 3.31Å; A70-R72 PolarHBondContact O-N 2.67Å; A70-R73 PolarHBondContact O-N 3.4Å; A70-R73 VanDerWaalsContact O-N 3.09Å; A70-T74 PolarHBondContact O-N 2.68Å; A70-T74 VanDerWaalsContact O-N 3.11Å; A70-T74 PolarHBondContact O-OG1 3.42Å
71	F	76.3	Confident	70.6	Confident	32 Å²	32	82.3 Å²	82.3	14%	0.14	41%	0.407	C	S	.	.	H	α-helix	trans	-56.9	-44.7	176.1	-173.3	-94.5	0	0	0	111.4	L61 E67 R73 T74 W75 W85 F89 I124 F127	L61-F71 HydrophobicContact CD1-CB 3.42Å; L61-F71 VanDerWaalsContact CD1-CB 3.42Å; L61-F71 HydrophobicContact CD1-CD1 3.92Å; L61-F71 HydrophobicContact CD1-CD2 4.05Å; L61-F71 HydrophobicContact CD1-CG 3.52Å; L61-F71 HydrophobicContact CD2-CD1 4.04Å; L61-F71 HydrophobicContact CD2-CE1 4.11Å; L61-F71 HydrophobicContact CD2-CG 4.27Å; L61-F71 HydrophobicContact CD2-CZ 4.4Å; E67-F71 VanDerWaalsContact O-CB 3.25Å; E67-F71 WeakPolarHBondContact O-CB 3.34Å; E67-F71 PolarHBondContact O-N 3.17Å; F71-R73 VanDerWaalsContact C-N 3.31Å; F71-R73 PolarHBondContact O-N 3.2Å; F71-T74 PolarHBondContact O-N 2.86Å; F71-W75 HydrophobicContact CE1-CB 4.43Å; F71-W75 HydrophobicContact CE1-CD2 4.33Å; F71-W75 HydrophobicContact CE1-CE3 4.4Å; F71-W75 HydrophobicContact CE1-CG 4.37Å; F71-W75 HydrophobicContact CE2-CE3 4.24Å; F71-W75 HydrophobicContact CZ-CD2 4.15Å; F71-W75 AromaticContact CZ-CE3 3.83Å; F71-W75 HydrophobicContact CZ-CE3 3.83Å; F71-W75 HydrophobicContact CZ-CZ3 4.39Å; F71-W75 VanDerWaalsContact O-CB 3.28Å; F71-W75 WeakPolarHBondContact O-CB 3.3Å; F71-W75 PolarHBondContact O-N 3.34Å; F71-W85 HydrophobicContact CE1-CZ3 4.47Å; F71-F89 HydrophobicContact CD1-CZ 4.28Å; F71-I124 HydrophobicContact CE1-CG1 4.25Å; F71-I124 HydrophobicContact CE1-CG2 4.48Å; F71-I124 HydrophobicContact CZ-CG2 4.36Å; F71-F127 HydrophobicContact CE2-CD1 4.21Å; F71-F127 HydrophobicContact CE2-CE1 4.21Å; F71-F127 HydrophobicContact CZ-CD1 4.27Å
72	R	71.4	Confident	69.1	Low	78 Å²	78	89.9 Å²	89.9	29%	0.294	45%	0.447	S	S	.	.	H	α-helix	trans	-58.3	-40.2	175.9	-169	-174.2	-56.9	-166.9	0.1	112.8	S68 K69 A70 N76	S68-R72 VanDerWaalsContact O-CB 3.31Å; S68-R72 WeakPolarHBondContact O-CB 3.49Å; S68-R72 PolarHBondContact O-N 3.33Å; K69-R72 PolarHBondContact O-N 3.1Å; A70-R72 VanDerWaalsContact C-N 3.31Å; A70-R72 PolarHBondContact O-N 2.67Å; R72-N76 VanDerWaalsContact O-CB 3.31Å; R72-N76 WeakPolarHBondContact O-CB 3.47Å; R72-N76 PolarHBondContact O-N 2.91Å; R72-N76 VanDerWaalsContact O-N 3.14Å
73	R	70.2	Confident	67.9	Low	181 Å²	181	90.2 Å²	90.2	68%	0.683	45%	0.451	S	S	*	.	H	α-helix	trans	-68	-43.4	179	-71.5	176.4	-174.6	163.9	2.5	112	K69 A70 F71 N77	K69-R73 WeakPolarHBondContact O-CG 3.38Å; K69-R73 PolarHBondContact O-N 2.85Å; A70-R73 PolarHBondContact O-N 3.4Å; A70-R73 VanDerWaalsContact O-N 3.09Å; F71-R73 VanDerWaalsContact C-N 3.31Å; F71-R73 PolarHBondContact O-N 3.2Å; R73-N77 PolarHBondContact O-ND2 3.45Å
74	T	67.5	Low	67	Low	81 Å²	81	89.6 Å²	89.6	50%	0.497	45%	0.448	S	S	.	.	H	α-helix	trans	-67.8	-43.9	179.3	-49.9	0	0	0	0	111	A70 F71 N77	A70-T74 PolarHBondContact O-N 2.68Å; A70-T74 VanDerWaalsContact O-N 3.11Å; A70-T74 PolarHBondContact O-OG1 3.42Å; F71-T74 PolarHBondContact O-N 2.86Å; T74-N77 PolarHBondContact O-N 2.84Å
75	W	65.9	Low	66.2	Low	17 Å²	17	87.2 Å²	87.2	6%	0.064	43%	0.434	C	S	.	.	H	α-helix	trans	-71.5	-36.2	-174.5	-157.1	-93.5	0	0	0	113.9	F71 N77 E78 F80 W85 F127	F71-W75 HydrophobicContact CE1-CB 4.43Å; F71-W75 HydrophobicContact CE1-CD2 4.33Å; F71-W75 HydrophobicContact CE1-CE3 4.4Å; F71-W75 HydrophobicContact CE1-CG 4.37Å; F71-W75 HydrophobicContact CE2-CE3 4.24Å; F71-W75 HydrophobicContact CZ-CD2 4.15Å; F71-W75 AromaticContact CZ-CE3 3.83Å; F71-W75 HydrophobicContact CZ-CE3 3.83Å; F71-W75 HydrophobicContact CZ-CZ3 4.39Å; F71-W75 VanDerWaalsContact O-CB 3.28Å; F71-W75 WeakPolarHBondContact O-CB 3.3Å; F71-W75 PolarHBondContact O-N 3.34Å; W75-N77 PolarHBondContact O-N 3.32Å; W75-E78 PolarHBondContact O-N 2.87Å; W75-F80 HydrophobicContact CZ2-CD2 4.15Å; W75-F80 HydrophobicContact CZ2-CE2 4.03Å; W75-F80 AromaticContact NE1-CD2 3.5Å; W75-W85 AromaticContact CD1-CE2 3.76Å; W75-W85 AromaticContact CD1-CH2 3.44Å; W75-W85 VanDerWaalsContact CD1-CH2 3.44Å; W75-W85 AromaticContact CD1-CZ2 3.15Å; W75-W85 HydrophobicContact CG-CH2 4.25Å; W75-W85 HydrophobicContact CG-CZ2 4.27Å; W75-W85 AromaticContact NE1-CH2 3.36Å; W75-W85 AromaticContact NE1-CZ2 3.2Å; W75-F127 HydrophobicContact CE3-CD1 4.13Å; W75-F127 HydrophobicContact CE3-CE1 4.14Å; W75-F127 HydrophobicContact CE3-CG 4.43Å; W75-F127 HydrophobicContact CE3-CZ 4.45Å; W75-F127 HydrophobicContact CH2-CB 3.41Å; W75-F127 VanDerWaalsContact CH2-CB 3.41Å; W75-F127 AromaticContact CH2-CD1 3.56Å; W75-F127 HydrophobicContact CH2-CD1 3.56Å; W75-F127 AromaticContact CH2-CD2 3.17Å; W75-F127 HydrophobicContact CH2-CD2 3.17Å; W75-F127 HydrophobicContact CH2-CE1 4.09Å; W75-F127 AromaticContact CH2-CE2 3.72Å; W75-F127 HydrophobicContact CH2-CE2 3.72Å; W75-F127 AromaticContact CH2-CG 3.04Å; W75-F127 HydrophobicContact CH2-CG 3.04Å; W75-F127 HydrophobicContact CH2-CZ 4.16Å; W75-F127 HydrophobicContact CZ2-CB 4.09Å; W75-F127 HydrophobicContact CZ2-CD2 4.43Å; W75-F127 HydrophobicContact CZ2-CG 4.14Å; W75-F127 HydrophobicContact CZ3-CB 4.05Å; W75-F127 AromaticContact CZ3-CD1 3.22Å; W75-F127 HydrophobicContact CZ3-CD1 3.22Å; W75-F127 AromaticContact CZ3-CD2 3.39Å; W75-F127 HydrophobicContact CZ3-CD2 3.39Å; W75-F127 AromaticContact CZ3-CE1 3.34Å; W75-F127 HydrophobicContact CZ3-CE1 3.34Å; W75-F127 AromaticContact CZ3-CE2 3.47Å; W75-F127 HydrophobicContact CZ3-CE2 3.47Å; W75-F127 VanDerWaalsContact CZ3-CE2 3.47Å; W75-F127 AromaticContact CZ3-CG 3.23Å; W75-F127 HydrophobicContact CZ3-CG 3.23Å; W75-F127 AromaticContact CZ3-CZ 3.45Å; W75-F127 HydrophobicContact CZ3-CZ 3.45Å; W75-F127 VanDerWaalsContact CZ3-CZ 3.45Å
76	N	61.5	Low	65.3	Low	62 Å²	62	86 Å²	86	33%	0.332	43%	0.428	S	S	.	.	H	α-helix	trans	-62.5	-20.9	174.9	-78.8	-0.4	0	0	0	112.9	R72 N81	R72-N76 VanDerWaalsContact O-CB 3.31Å; R72-N76 WeakPolarHBondContact O-CB 3.47Å; R72-N76 PolarHBondContact O-N 2.91Å; R72-N76 VanDerWaalsContact O-N 3.14Å; N76-N81 PolarHBondContact O-OD1 3.21Å
77	N	56.3	Low	64.6	Low	139 Å²	139	83.7 Å²	83.7	74%	0.743	42%	0.422	S	S	*	.	H	α-helix	trans	-90	-17.9	-177.6	-72.7	-16.2	0	0	0	113.8	R73 T74 W75	R73-N77 PolarHBondContact O-ND2 3.45Å; T74-N77 PolarHBondContact O-N 2.84Å; W75-N77 PolarHBondContact O-N 3.32Å
78	E	57.4	Low	64.3	Low	140 Å²	140	81.7 Å²	81.7	65%	0.654	41%	0.413	S	S	*	.	H	α-helix	trans	-118.1	-24.7	-161.9	-71.5	-170.7	162.4	0	0	116.6	W75	W75-E78 PolarHBondContact O-N 2.87Å
79	K	56	Low	64	Low	150 Å²	150	82.6 Å²	82.6	65%	0.652	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-154.7	-16.8	-170	-115.7	170.6	-179.7	179.7	0	119.5
80	F	54.3	Low	63.3	Low	61 Å²	61	80 Å²	80	27%	0.268	41%	0.413	S	S	.	.			trans	-149.7	77.8	-174.7	-63.3	-82.2	0	0	0	113.1	W75 D82 L83	W75-F80 HydrophobicContact CZ2-CD2 4.15Å; W75-F80 HydrophobicContact CZ2-CE2 4.03Å; W75-F80 AromaticContact NE1-CD2 3.5Å; F80-D82 VanDerWaalsContact C-N 3.25Å; F80-D82 PolarHBondContact O-N 3.46Å; F80-L83 HydrophobicContact CB-CD1 4.29Å; F80-L83 HydrophobicContact CD1-CD1 4.24Å
81	N	52.6	Low	62.2	Low	144 Å²	144	85.7 Å²	85.7	77%	0.77	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-11.7	179.2	-87.2	-24.9	0	0	0	114.8	N76	N76-N81 PolarHBondContact O-OD1 3.21Å
82	D	53.7	Low	61	Low	167 Å²	167	88.4 Å²	88.4	89%	0.893	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	4.1	-168.5	-80.8	-26.1	0	0	0	115.7	F80	F80-D82 VanDerWaalsContact C-N 3.25Å; F80-D82 PolarHBondContact O-N 3.46Å
83	L	57.3	Low	60.1	Low	48 Å²	48	89.9 Å²	89.9	25%	0.251	47%	0.469	S	S	.	.	S	Bend	trans	-107.2	133.6	-178.6	-83.2	114.8	0	0	0	113.2	F80 W85 D117 I120	F80-L83 HydrophobicContact CB-CD1 4.29Å; F80-L83 HydrophobicContact CD1-CD1 4.24Å; L83-W85 VanDerWaalsContact C-N 3.33Å; L83-W85 PolarHBondContact O-N 2.6Å; L83-D117 VanDerWaalsContact CD2-O 3.25Å; L83-D117 WeakPolarHBondContact CD2-O 3.31Å; L83-I120 HydrophobicContact CD2-CD1 4.27Å; L83-I120 HydrophobicContact CD2-CG1 3.69Å
84	D	61.4	Low	59.6	Low	106 Å²	106	87 Å²	87	57%	0.567	46%	0.464	S	S	*	.			trans	-77.8	79.8	176.9	-173.2	9.1	0	0	0	111.8	S86 T87	D84-S86 PolarHBondContact O-N 2.86Å; D84-S86 VanDerWaalsContact O-N 3.12Å; D84-S86 VanDerWaalsContact OD1-CB 3.28Å; D84-S86 WeakPolarHBondContact OD1-CB 3.47Å; D84-S86 PolarHBondContact OD1-N 2.74Å; D84-S86 PolarHBondContact OD1-OG 2.81Å; D84-T87 PolarHBondContact O-OG1 3.02Å
85	W	65.3	Low	59.6	Low	11 Å²	11	90.7 Å²	90.7	4%	0.042	47%	0.468	C	S	.	.	G	3₁₀ helix	trans	-60	-15.6	177.4	-69.9	92.9	0	0	0	114.6	F71 W75 L83 T87 C88 F89 I120 I124	F71-W85 HydrophobicContact CE1-CZ3 4.47Å; W75-W85 AromaticContact CD1-CE2 3.76Å; W75-W85 AromaticContact CD1-CH2 3.44Å; W75-W85 VanDerWaalsContact CD1-CH2 3.44Å; W75-W85 AromaticContact CD1-CZ2 3.15Å; W75-W85 HydrophobicContact CG-CH2 4.25Å; W75-W85 HydrophobicContact CG-CZ2 4.27Å; W75-W85 AromaticContact NE1-CH2 3.36Å; W75-W85 AromaticContact NE1-CZ2 3.2Å; L83-W85 VanDerWaalsContact C-N 3.33Å; L83-W85 PolarHBondContact O-N 2.6Å; W85-T87 PolarHBondContact O-N 3.34Å; W85-C88 PolarHBondContact O-N 2.83Å; W85-F89 HydrophobicContact CE3-CE2 4.18Å; W85-I120 HydrophobicContact CD2-CG2 4.03Å; W85-I120 HydrophobicContact CE3-CG2 3.4Å; W85-I120 HydrophobicContact CH2-CG2 3.72Å; W85-I120 HydrophobicContact CZ2-CG2 4.27Å; W85-I120 HydrophobicContact CZ3-CG2 3.27Å; W85-I124 HydrophobicContact CH2-CG1 4Å; W85-I124 HydrophobicContact CZ3-CD1 3.76Å; W85-I124 HydrophobicContact CZ3-CG1 3.6Å
86	S	58.2	Low	60.2	Low	60 Å²	60	90.4 Å²	90.4	42%	0.42	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-62.8	-28	-171.9	71.4	0	0	0	0	112.6	D84	D84-S86 PolarHBondContact O-N 2.86Å; D84-S86 VanDerWaalsContact O-N 3.12Å; D84-S86 VanDerWaalsContact OD1-CB 3.28Å; D84-S86 WeakPolarHBondContact OD1-CB 3.47Å; D84-S86 PolarHBondContact OD1-N 2.74Å; D84-S86 PolarHBondContact OD1-OG 2.81Å
87	T	64.5	Low	61.1	Low	71 Å²	71	88.6 Å²	88.6	44%	0.436	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-85.3	-25.9	-175.8	59.4	0	0	0	0	114.3	D84 W85 F89 A90	D84-T87 PolarHBondContact O-OG1 3.02Å; W85-T87 PolarHBondContact O-N 3.34Å; T87-F89 PolarHBondContact O-N 2.83Å; T87-A90 PolarHBondContact O-N 2.96Å
88	C	71.4	Confident	62.1	Low	8 Å²	8	83.6 Å²	83.6	5%	0.054	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-35.2	-174.5	167	0	0	0	0	113.4	W85 C96 I120	W85-C88 PolarHBondContact O-N 2.83Å; C88-C96 HydrophobicContact CB-CB 3.85Å; C88-C96 WeakPolarHBondContact CB-SG 3.41Å; C88-C96 WeakPolarHBondContact O-CB 3.48Å; C88-C96 WeakPolarHBondContact SG-CB 3.32Å; C88-C96 CovalentContact SG-SG 2.02Å; C88-C96 PolarHBondContact SG-SG 3.36Å; C88-I120 HydrophobicContact CB-CB 4.41Å; C88-I120 HydrophobicContact CB-CD1 4.48Å; C88-I120 HydrophobicContact CB-CG2 3.94Å
89	F	69.4	Low	63.3	Low	29 Å²	29	78 Å²	78	13%	0.127	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	3.3	-179.9	-58.2	-72.7	0	0	0	113.2	L61 F62 F71 W85 T87 I124	L61-F89 HydrophobicContact CD1-CE1 4.3Å; L61-F89 HydrophobicContact CD1-CZ 4.48Å; L61-F89 HydrophobicContact CD2-CE1 3.92Å; L61-F89 HydrophobicContact CD2-CZ 4.06Å; L61-F89 HydrophobicContact CG-CE1 3.78Å; L61-F89 HydrophobicContact CG-CZ 4.26Å; F62-F89 AromaticContact CD1-CD1 3.9Å; F62-F89 HydrophobicContact CD1-CD1 3.9Å; F62-F89 HydrophobicContact CD1-CE1 4.06Å; F62-F89 AromaticContact CE1-CD1 3.79Å; F62-F89 HydrophobicContact CE1-CD1 3.79Å; F62-F89 AromaticContact CE1-CE1 3.71Å; F62-F89 HydrophobicContact CE1-CE1 3.71Å; F62-F89 HydrophobicContact CZ-CE1 4.17Å; F71-F89 HydrophobicContact CD1-CZ 4.28Å; W85-F89 HydrophobicContact CE3-CE2 4.18Å; T87-F89 PolarHBondContact O-N 2.83Å; F89-I124 HydrophobicContact CE1-CD1 4.41Å; F89-I124 HydrophobicContact CZ-CD1 3.9Å
90	A	62.3	Low	64.8	Low	43 Å²	43	70.9 Å²	70.9	36%	0.355	38%	0.381	S	S	.	.	S	Bend	trans	-79.6	129.1	172.2	0	0	0	0	0	108.3	T87 S92 H93	T87-A90 PolarHBondContact O-N 2.96Å; A90-S92 PolarHBondContact O-N 2.81Å; A90-H93 PolarHBondContact O-N 2.87Å
91	N	53.6	Low	66.3	Low	171 Å²	171	68.3 Å²	68.3	91%	0.914	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	3.7	-176.8	-76.1	-3.1	0	0	0	116.2
92	S	50.1	Low	67.7	Low	89 Å²	89	66.5 Å²	66.5	62%	0.622	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-3.7	-177.2	57.4	0	0	0	0	115	A90	A90-S92 PolarHBondContact O-N 2.81Å
93	H	52.8	Low	69.3	Low	109 Å²	109	58.7 Å²	58.7	51%	0.505	31%	0.31	S	S	.	.			trans	-137.4	80.3	179.8	-64.4	82.4	0	0	0	112.5	A90 R95 C96	A90-H93 PolarHBondContact O-N 2.87Å; H93-R95 PolarHBondContact O-N 3.09Å; H93-C96 PolarHBondContact O-N 2.8Å
94	E	59.2	Low	70.7	Confident	122 Å²	122	56.4 Å²	56.4	57%	0.57	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-3.2	173.1	-68.1	173	176.7	0	0	115.2	S97 S98	E94-S97 PolarHBondContact O-OG 2.9Å; E94-S97 VanDerWaalsContact O-OG 3.06Å; E94-S98 PolarHBondContact O-N 3.15Å; E94-S98 PolarHBondContact O-OG 3.14Å
95	R	69.4	Low	71.9	Confident	158 Å²	158	54 Å²	54	60%	0.596	29%	0.285	S	S	*	.	H	α-helix	trans	-62.8	-39.7	173.2	-76.5	-177.4	175.1	169.8	-3.4	112.5	H93 S97 S98 D99	H93-R95 PolarHBondContact O-N 3.09Å; R95-S97 PolarHBondContact O-N 2.76Å; R95-S98 WeakPolarHBondContact CA-OG 3.29Å; R95-S98 PolarHBondContact O-N 2.77Å; R95-S98 PolarHBondContact O-OG 2.78Å; R95-D99 VanDerWaalsContact O-CB 3.28Å; R95-D99 WeakPolarHBondContact O-CB 3.42Å; R95-D99 PolarHBondContact O-N 2.84Å; R95-D99 VanDerWaalsContact O-OD2 3.06Å
96	C	78.1	Confident	72.7	Confident	10 Å²	10	55.9 Å²	55.9	7%	0.068	30%	0.296	C	S	.	.	H	α-helix	trans	-68.8	-39.3	-173.1	-152.8	0	0	0	0	112.5	F62 C88 H93 C100 G121	F62-C96 HydrophobicContact CE1-CB 4Å; F62-C96 HydrophobicContact CZ-CB 4.19Å; C88-C96 HydrophobicContact CB-CB 3.85Å; C88-C96 WeakPolarHBondContact CB-SG 3.41Å; C88-C96 WeakPolarHBondContact O-CB 3.48Å; C88-C96 WeakPolarHBondContact SG-CB 3.32Å; C88-C96 CovalentContact SG-SG 2.02Å; C88-C96 PolarHBondContact SG-SG 3.36Å; H93-C96 PolarHBondContact O-N 2.8Å; C96-C100 PolarHBondContact O-N 3.34Å; C96-C100 VanDerWaalsContact O-N 3.13Å; C96-G121 VanDerWaalsContact O-CA 3.3Å; C96-G121 WeakPolarHBondContact O-CA 3.27Å; C96-G121 WeakPolarHBondContact SG-CA 3.21Å; C96-G121 PolarHBondContact SG-N 3.12Å
97	S	79.8	Confident	73.8	Confident	24 Å²	24	55.5 Å²	55.5	17%	0.168	29%	0.292	C	S	.	.	H	α-helix	trans	-66.5	-52.1	175.7	52	0	0	0	0	110.8	E94 R95 D99 C100 F101	E94-S97 PolarHBondContact O-OG 2.9Å; E94-S97 VanDerWaalsContact O-OG 3.06Å; R95-S97 PolarHBondContact O-N 2.76Å; S97-D99 VanDerWaalsContact C-N 3.3Å; S97-D99 PolarHBondContact O-N 2.97Å; S97-C100 WeakPolarHBondContact O-CA 3.3Å; S97-C100 VanDerWaalsContact O-CB 3.29Å; S97-C100 WeakPolarHBondContact O-CB 3.41Å; S97-C100 PolarHBondContact O-N 2.88Å; S97-F101 WeakPolarHBondContact O-CD2 3.08Å; S97-F101 PolarHBondContact O-N 2.94Å
98	S	78.4	Confident	74.5	Confident	34 Å²	34	53.9 Å²	53.9	24%	0.238	28%	0.282	C	S	.	.	H	α-helix	trans	-58	-40.3	179.1	51.6	0	0	0	0	112.7	E94 R95 F101 R102	E94-S98 PolarHBondContact O-N 3.15Å; E94-S98 PolarHBondContact O-OG 3.14Å; R95-S98 WeakPolarHBondContact CA-OG 3.29Å; R95-S98 PolarHBondContact O-N 2.77Å; R95-S98 PolarHBondContact O-OG 2.78Å; S98-F101 PolarHBondContact O-N 2.84Å; S98-R102 WeakPolarHBondContact O-CB 3.38Å; S98-R102 PolarHBondContact O-N 2.91Å
99	D	81.5	Confident	74.7	Confident	24 Å²	24	59.7 Å²	59.7	13%	0.128	32%	0.318	C	S	.	.	H	α-helix	trans	-61.2	-44.7	173.6	-74.1	-35.2	0	0	0	111.6	R95 S97 F101 R102 T103 I119	R95-D99 VanDerWaalsContact O-CB 3.28Å; R95-D99 WeakPolarHBondContact O-CB 3.42Å; R95-D99 PolarHBondContact O-N 2.84Å; R95-D99 VanDerWaalsContact O-OD2 3.06Å; S97-D99 VanDerWaalsContact C-N 3.3Å; S97-D99 PolarHBondContact O-N 2.97Å; D99-F101 VanDerWaalsContact C-N 3.35Å; D99-F101 PolarHBondContact O-N 2.78Å; D99-R102 PolarHBondContact O-N 2.94Å; D99-R102 IonicContact OD1-CZ 2.73Å; D99-R102 IonicContact OD1-NE 3.8Å; D99-R102 IonicContact OD1-NH2 3.91Å; D99-R102 PolarHBondContact OD1-NH2 3.46Å; D99-T103 VanDerWaalsContact O-CB 3.32Å; D99-T103 WeakPolarHBondContact O-CB 3.35Å; D99-T103 PolarHBondContact O-N 3.33Å; D99-T103 PolarHBondContact O-OG1 3.39Å; D99-I119 HydrophobicContact CB-CG2 4.01Å; D99-I119 WeakPolarHBondContact OD2-CG2 3.45Å
100	C	87.5	Confident	75.2	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-56.4	-47.1	174.4	-169.8	0	0	0	0	111.9	C58 F62 C96 S97 T103 C104 G121	C58-C100 HydrophobicContact CB-CB 3.96Å; C58-C100 WeakPolarHBondContact CB-SG 3.42Å; C58-C100 WeakPolarHBondContact SG-CB 3.43Å; C58-C100 PolarHBondContact SG-O 2.86Å; C58-C100 CovalentContact SG-SG 2.05Å; C58-C100 PolarHBondContact SG-SG 2.81Å; F62-C100 HydrophobicContact CE2-CB 3.69Å; F62-C100 HydrophobicContact CZ-CB 4.36Å; C96-C100 PolarHBondContact O-N 3.34Å; C96-C100 VanDerWaalsContact O-N 3.13Å; S97-C100 WeakPolarHBondContact O-CA 3.3Å; S97-C100 VanDerWaalsContact O-CB 3.29Å; S97-C100 WeakPolarHBondContact O-CB 3.41Å; S97-C100 PolarHBondContact O-N 2.88Å; C100-T103 PolarHBondContact O-N 3.33Å; C100-C104 PolarHBondContact O-N 3.38Å; C100-C104 PolarHBondContact O-SG 3.28Å; C100-G121 VanDerWaalsContact CA-O 3.23Å; C100-G121 WeakPolarHBondContact CA-O 3.35Å; C100-G121 PolarHBondContact N-O 2.8Å
101	F	85.5	Confident	76.2	Confident	7 Å²	7	60.9 Å²	60.9	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-62.1	-47.2	179.2	-76.5	-76.7	0	0	0	112.9	K55 C58 L59 S97 S98 D99 T103 C104	K55-F101 HydrophobicContact CB-CD1 3.78Å; K55-F101 HydrophobicContact CB-CE1 3.88Å; K55-F101 HydrophobicContact CD-CD1 4.04Å; K55-F101 WeakPolarHBondContact CE-O 3.22Å; K55-F101 HydrophobicContact CG-CD1 3.76Å; K55-F101 HydrophobicContact CG-CE1 4.38Å; K55-F101 VanDerWaalsContact O-CE1 3.24Å; K55-F101 WeakPolarHBondContact O-CE1 3.22Å; C58-F101 HydrophobicContact CB-CD1 4.35Å; C58-F101 HydrophobicContact CB-CD2 4.46Å; C58-F101 HydrophobicContact CB-CE1 3.97Å; C58-F101 HydrophobicContact CB-CE2 4.05Å; C58-F101 HydrophobicContact CB-CZ 3.74Å; L59-F101 HydrophobicContact CB-CZ 4.2Å; L59-F101 HydrophobicContact CD1-CE1 4.44Å; L59-F101 HydrophobicContact CD2-CE1 3.99Å; L59-F101 HydrophobicContact CD2-CE2 4.34Å; L59-F101 HydrophobicContact CD2-CZ 3.41Å; L59-F101 VanDerWaalsContact CD2-CZ 3.41Å; L59-F101 HydrophobicContact CG-CE1 3.66Å; L59-F101 HydrophobicContact CG-CZ 3.42Å; L59-F101 VanDerWaalsContact CG-CZ 3.42Å; S97-F101 WeakPolarHBondContact O-CD2 3.08Å; S97-F101 PolarHBondContact O-N 2.94Å; S98-F101 PolarHBondContact O-N 2.84Å; D99-F101 VanDerWaalsContact C-N 3.35Å; D99-F101 PolarHBondContact O-N 2.78Å; F101-T103 VanDerWaalsContact C-N 3.3Å; F101-T103 PolarHBondContact O-N 3.3Å; F101-C104 WeakPolarHBondContact O-CB 3.28Å; F101-C104 PolarHBondContact O-N 3.04Å
102	R	82.3	Confident	77.5	Confident	105 Å²	105	56.8 Å²	56.8	40%	0.396	29%	0.294	S	S	.	.	H	α-helix	trans	-63.3	-40.2	-179.4	-178.6	171.2	60.2	155.5	3.8	110.9	S98 D99 C104 D105 D746	S98-R102 WeakPolarHBondContact O-CB 3.38Å; S98-R102 PolarHBondContact O-N 2.91Å; D99-R102 PolarHBondContact O-N 2.94Å; D99-R102 IonicContact OD1-CZ 2.73Å; D99-R102 IonicContact OD1-NE 3.8Å; D99-R102 IonicContact OD1-NH2 3.91Å; D99-R102 PolarHBondContact OD1-NH2 3.46Å; R102-C104 VanDerWaalsContact C-N 3.32Å; R102-C104 PolarHBondContact O-N 2.82Å; R102-D105 WeakPolarHBondContact O-CB 3.16Å; R102-D105 PolarHBondContact O-N 2.8Å; R102-D746 IonicContact CZ-OD2 3.34Å; R102-D746 IonicContact NH1-OD2 2.87Å; R102-D746 IonicContact NH2-OD2 3.33Å; R102-D746 PolarHBondContact NH2-OD2 3.2Å
103	T	87	Confident	78.9	Confident	3 Å²	3	57.1 Å²	57.1	2%	0.018	30%	0.296	C	S	.	.	H	α-helix	trans	-66.4	-31.8	179.4	-64	0	0	0	0	113.2	D99 C100 F101 D105 L106 C111 C122 C126	D99-T103 VanDerWaalsContact O-CB 3.32Å; D99-T103 WeakPolarHBondContact O-CB 3.35Å; D99-T103 PolarHBondContact O-N 3.33Å; D99-T103 PolarHBondContact O-OG1 3.39Å; C100-T103 PolarHBondContact O-N 3.33Å; F101-T103 VanDerWaalsContact C-N 3.3Å; F101-T103 PolarHBondContact O-N 3.3Å; T103-D105 PolarHBondContact O-N 3.4Å; T103-L106 HydrophobicContact CG2-CD1 4.31Å; T103-L106 WeakPolarHBondContact O-CB 3.31Å; T103-L106 PolarHBondContact O-N 3.04Å; T103-C111 WeakPolarHBondContact CG2-SG 3.44Å; T103-C122 WeakPolarHBondContact CG2-O 3.25Å; T103-C122 WeakPolarHBondContact OG1-CA 3.45Å; T103-C122 PolarHBondContact OG1-SG 2.94Å; T103-C126 HydrophobicContact CG2-CB 4.25Å; T103-C126 WeakPolarHBondContact CG2-SG 3.33Å
104	C	87.7	Confident	80	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-21.3	174.8	-68.3	0	0	0	0	113.5	R51 C54 K55 C58 C100 F101 R102	R51-C104 WeakPolarHBondContact CG-O 3.49Å; C54-C104 HydrophobicContact CB-CB 3.65Å; C54-C104 WeakPolarHBondContact CB-SG 3.42Å; C54-C104 VanDerWaalsContact SG-CA 3.57Å; C54-C104 WeakPolarHBondContact SG-CB 3.26Å; C54-C104 CovalentContact SG-SG 2.04Å; C54-C104 PolarHBondContact SG-SG 3.45Å; K55-C104 HydrophobicContact CG-CB 3.86Å; K55-C104 PolarHBondContact N-SG 2.95Å; C58-C104 VanDerWaalsContact SG-SG 3.6Å; C100-C104 PolarHBondContact O-N 3.38Å; C100-C104 PolarHBondContact O-SG 3.28Å; F101-C104 WeakPolarHBondContact O-CB 3.28Å; F101-C104 PolarHBondContact O-N 3.04Å; R102-C104 VanDerWaalsContact C-N 3.32Å; R102-C104 PolarHBondContact O-N 2.82Å
105	D	85.1	Confident	80.9	Confident	55 Å²	55	52 Å²	52	29%	0.294	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-17.4	178.9	-64.3	-37.7	0	0	0	113.3	R47 R51 K55 R102 T103	R47-D105 PolarHBondContact NH2-O 3.48Å; R51-D105 IonicContact CZ-OD1 2.88Å; R51-D105 IonicContact NE-OD1 2.79Å; R51-D105 PolarHBondContact NE-OD1 2.79Å; R51-D105 IonicContact NH2-OD1 3.65Å; R51-D105 PolarHBondContact NH2-OD1 2.9Å; R51-D105 IonicContact NH2-OD2 3.14Å; K55-D105 VanDerWaalsContact CE-OD1 3.23Å; K55-D105 WeakPolarHBondContact CE-OD1 3.44Å; K55-D105 IonicContact NZ-OD1 3.52Å; K55-D105 PolarHBondContact NZ-OD1 2.88Å; K55-D105 VanDerWaalsContact NZ-OD1 3.16Å; K55-D105 IonicContact NZ-OD2 3.14Å; K55-D105 PolarHBondContact NZ-OD2 3.26Å; R102-D105 WeakPolarHBondContact O-CB 3.16Å; R102-D105 PolarHBondContact O-N 2.8Å; T103-D105 PolarHBondContact O-N 3.4Å
106	L	83.5	Confident	81	Confident	51 Å²	51	46.1 Å²	46.1	27%	0.267	26%	0.256	S	S	.	.	S	Bend	trans	-77.1	144.6	-179.8	-62.9	176.8	0	0	0	112.9	R47 T103 C111 H114	R47-L106 PolarHBondContact NH2-O 3.42Å; T103-L106 HydrophobicContact CG2-CD1 4.31Å; T103-L106 WeakPolarHBondContact O-CB 3.31Å; T103-L106 PolarHBondContact O-N 3.04Å; L106-C111 HydrophobicContact CB-CB 4.45Å; L106-H114 HydrophobicContact CD1-CB 3.83Å
107	P	81.5	Confident	80.4	Confident	53 Å²	53	50.6 Å²	50.6	34%	0.344	28%	0.28	S	S	.	.			trans	-54.5	133.7	175	-21	31.5	0	0	0	111.4	T109 E110 C111	P107-T109 VanDerWaalsContact C-N 3.26Å; P107-T109 PolarHBondContact O-N 2.84Å; P107-E110 HydrophobicContact CB-CB 4.48Å; P107-E110 PolarHBondContact O-N 3.3Å; P107-E110 VanDerWaalsContact O-N 3.15Å; P107-C111 WeakPolarHBondContact O-CB 3.21Å; P107-C111 PolarHBondContact O-N 2.79Å
108	P	78.6	Confident	79.7	Confident	36 Å²	36	56.6 Å²	56.6	23%	0.234	30%	0.303	C	S	.	.	H	α-helix	trans	-57.4	-38.4	-174.5	-22.8	32.5	0	0	0	113.2	E110 C111 I129	P108-E110 VanDerWaalsContact C-N 3.32Å; P108-E110 PolarHBondContact O-N 2.87Å; P108-C111 PolarHBondContact O-N 3.2Å; P108-I129 HydrophobicContact CG-CG1 4.15Å
109	T	76.4	Confident	79.4	Confident	130 Å²	130	57 Å²	57	80%	0.798	30%	0.302	S	S	*	.	H	α-helix	trans	-67.7	-28.4	-178	49.4	0	0	0	0	114	P107	P107-T109 VanDerWaalsContact C-N 3.26Å; P107-T109 PolarHBondContact O-N 2.84Å
110	E	79.4	Confident	79.3	Confident	97 Å²	97	56.8 Å²	56.8	45%	0.453	30%	0.3	S	S	.	.	H	α-helix	trans	-107.6	-7.2	-176.7	-66.7	169.9	-161.1	0	0	111.6	P107 P108 L112 S113 H114	P107-E110 HydrophobicContact CB-CB 4.48Å; P107-E110 PolarHBondContact O-N 3.3Å; P107-E110 VanDerWaalsContact O-N 3.15Å; P108-E110 VanDerWaalsContact C-N 3.32Å; P108-E110 PolarHBondContact O-N 2.87Å; E110-L112 PolarHBondContact O-N 2.93Å; E110-S113 PolarHBondContact O-N 2.93Å; E110-S113 PolarHBondContact O-OG 2.97Å; E110-H114 PolarHBondContact O-CD2 2.95Å; E110-H114 PolarHBondContact O-N 2.85Å
111	C	83	Confident	78.9	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.007	30%	0.301	C	S	.	.	H	α-helix	trans	-55.7	-51.6	-171.7	-167.1	0	0	0	0	112.4	T103 L106 P107 P108 S113 H114 C115 C126	T103-C111 WeakPolarHBondContact CG2-SG 3.44Å; L106-C111 HydrophobicContact CB-CB 4.45Å; P107-C111 WeakPolarHBondContact O-CB 3.21Å; P107-C111 PolarHBondContact O-N 2.79Å; P108-C111 PolarHBondContact O-N 3.2Å; C111-S113 VanDerWaalsContact C-N 3.26Å; C111-S113 PolarHBondContact O-N 2.91Å; C111-H114 PolarHBondContact O-N 2.93Å; C111-H114 VanDerWaalsContact O-N 3.08Å; C111-C115 PolarHBondContact O-N 3.46Å; C111-C115 VanDerWaalsContact O-N 3.15Å; C111-C126 VanDerWaalsContact CA-SG 3.58Å; C111-C126 HydrophobicContact CB-CB 3.87Å; C111-C126 WeakPolarHBondContact CB-SG 3.27Å; C111-C126 PolarHBondContact O-SG 2.75Å; C111-C126 WeakPolarHBondContact SG-CA 3.32Å; C111-C126 WeakPolarHBondContact SG-CB 3.42Å; C111-C126 CovalentContact SG-SG 2.04Å; C111-C126 PolarHBondContact SG-SG 3.2Å
112	L	80.4	Confident	78.9	Confident	84 Å²	84	57 Å²	57	44%	0.44	30%	0.303	S	S	.	.	H	α-helix	trans	-62.8	-31.9	179.3	-81.5	150.4	0	0	0	112.6	E110 H114 C115 Q123 C126	E110-L112 PolarHBondContact O-N 2.93Å; L112-H114 VanDerWaalsContact C-N 3.28Å; L112-H114 PolarHBondContact O-N 2.82Å; L112-C115 PolarHBondContact O-N 2.83Å; L112-Q123 VanDerWaalsContact CD2-OE1 3.23Å; L112-C126 HydrophobicContact CG-CB 4.19Å
113	S	80.1	Confident	78.9	Confident	96 Å²	96	52.5 Å²	52.5	67%	0.671	29%	0.286	S	S	*	.	H	α-helix	trans	-71.7	-23.1	176.6	71.3	0	0	0	0	113.5	E110 C111	E110-S113 PolarHBondContact O-N 2.93Å; E110-S113 PolarHBondContact O-OG 2.97Å; C111-S113 VanDerWaalsContact C-N 3.26Å; C111-S113 PolarHBondContact O-N 2.91Å
114	H	76.4	Confident	78.8	Confident	117 Å²	117	52.3 Å²	52.3	54%	0.542	29%	0.285	S	S	.	.	H	α-helix	trans	-90.5	-17.7	176.6	-76	-67	0	0	0	113.4	L106 E110 C111 L112	L106-H114 HydrophobicContact CD1-CB 3.83Å; E110-H114 PolarHBondContact O-CD2 2.95Å; E110-H114 PolarHBondContact O-N 2.85Å; C111-H114 PolarHBondContact O-N 2.93Å; C111-H114 VanDerWaalsContact O-N 3.08Å; L112-H114 VanDerWaalsContact C-N 3.28Å; L112-H114 PolarHBondContact O-N 2.82Å
115	C	77.6	Confident	78.8	Confident	8 Å²	8	52.3 Å²	52.3	5%	0.054	29%	0.285	C	S	.	.	S	Bend	trans	-87.6	121.6	175.9	-70.3	0	0	0	0	111.2	C111 L112 C122 C126	C111-C115 PolarHBondContact O-N 3.46Å; C111-C115 VanDerWaalsContact O-N 3.15Å; L112-C115 PolarHBondContact O-N 2.83Å; C115-C122 WeakPolarHBondContact CA-SG 3.48Å; C115-C122 HydrophobicContact CB-CB 3.76Å; C115-C122 WeakPolarHBondContact CB-SG 3.11Å; C115-C122 WeakPolarHBondContact SG-CB 3.25Å; C115-C122 PolarHBondContact SG-O 2.81Å; C115-C122 CovalentContact SG-SG 2.02Å; C115-C122 PolarHBondContact SG-SG 3.11Å; C115-C126 PolarHBondContact SG-SG 3.34Å
116	S	71.8	Confident	78.9	Confident	33 Å²	33	49.8 Å²	49.8	23%	0.231	27%	0.272	C	S	.	.			trans	-66.3	140.8	165.9	-176.7	0	0	0	0	109.9	K118 I119	S116-K118 PolarHBondContact O-N 2Å; S116-I119 PolarHBondContact O-N 3.16Å
117	D	64	Low	79	Confident	105 Å²	105	50.1 Å²	50.1	56%	0.561	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-20.5	179.3	-65.4	-25.9	0	0	0	113.9	L83	L83-D117 VanDerWaalsContact CD2-O 3.25Å; L83-D117 WeakPolarHBondContact CD2-O 3.31Å
118	K	65.3	Low	79.2	Confident	149 Å²	149	48 Å²	48	65%	0.648	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-15.7	-178.4	-61.9	-176.2	-178	-180	0	114.5	S116 I120	S116-K118 PolarHBondContact O-N 2Å; K118-I120 PolarHBondContact O-N 3.41Å
119	I	73.5	Confident	79.5	Confident	43 Å²	43	46.3 Å²	46.3	22%	0.221	25%	0.246	C	C	.	.			trans	-97.2	89.7	-174.2	-53.3	178.9	0	0	0	109	D99 S116 G121 C122 Q123	D99-I119 HydrophobicContact CB-CG2 4.01Å; D99-I119 WeakPolarHBondContact OD2-CG2 3.45Å; S116-I119 PolarHBondContact O-N 3.16Å; I119-G121 VanDerWaalsContact C-N 3.29Å; I119-G121 PolarHBondContact O-N 3.11Å; I119-C122 HydrophobicContact CB-CB 3.9Å; I119-C122 HydrophobicContact CG2-CB 3.66Å; I119-C122 VanDerWaalsContact O-CB 3.28Å; I119-C122 WeakPolarHBondContact O-CB 3.21Å; I119-C122 PolarHBondContact O-N 2.87Å; I119-Q123 PolarHBondContact O-N 2.77Å
120	I	77.8	Confident	79.8	Confident	19 Å²	19	43.3 Å²	43.3	10%	0.097	22%	0.223	C	C	.	.	H	α-helix	trans	-55	-44	-176.3	-61.4	174.8	0	0	0	111.6	L83 W85 C88 K118 C122 Q123 I124	L83-I120 HydrophobicContact CD2-CD1 4.27Å; L83-I120 HydrophobicContact CD2-CG1 3.69Å; W85-I120 HydrophobicContact CD2-CG2 4.03Å; W85-I120 HydrophobicContact CE3-CG2 3.4Å; W85-I120 HydrophobicContact CH2-CG2 3.72Å; W85-I120 HydrophobicContact CZ2-CG2 4.27Å; W85-I120 HydrophobicContact CZ3-CG2 3.27Å; C88-I120 HydrophobicContact CB-CB 4.41Å; C88-I120 HydrophobicContact CB-CD1 4.48Å; C88-I120 HydrophobicContact CB-CG2 3.94Å; K118-I120 PolarHBondContact O-N 3.41Å; I120-C122 VanDerWaalsContact C-N 3.25Å; I120-C122 PolarHBondContact O-N 3.42Å; I120-Q123 PolarHBondContact O-N 2.87Å; I120-Q123 VanDerWaalsContact O-N 3.15Å; I120-I124 HydrophobicContact CG2-CD1 4.07Å; I120-I124 HydrophobicContact CG2-CG1 4.39Å; I120-I124 WeakPolarHBondContact O-CG1 3.36Å; I120-I124 PolarHBondContact O-N 2.88Å
121	G	80.9	Confident	79.8	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-60.3	-36.3	179.8	0	0	0	0	0	113	C96 C100 I119 I124 G125	C96-G121 VanDerWaalsContact O-CA 3.3Å; C96-G121 WeakPolarHBondContact O-CA 3.27Å; C96-G121 WeakPolarHBondContact SG-CA 3.21Å; C96-G121 PolarHBondContact SG-N 3.12Å; C100-G121 VanDerWaalsContact CA-O 3.23Å; C100-G121 WeakPolarHBondContact CA-O 3.35Å; C100-G121 PolarHBondContact N-O 2.8Å; I119-G121 VanDerWaalsContact C-N 3.29Å; I119-G121 PolarHBondContact O-N 3.11Å; G121-I124 PolarHBondContact O-N 2.84Å; G121-G125 PolarHBondContact O-N 2.04Å
122	C	84.7	Confident	79.5	Confident	10 Å²	10	42.7 Å²	42.7	7%	0.068	22%	0.221	C	C	.	.	H	α-helix	trans	-66.1	-46	176.2	-159	0	0	0	0	110.7	T103 C115 I119 I120 I124 G125 C126	T103-C122 WeakPolarHBondContact CG2-O 3.25Å; T103-C122 WeakPolarHBondContact OG1-CA 3.45Å; T103-C122 PolarHBondContact OG1-SG 2.94Å; C115-C122 WeakPolarHBondContact CA-SG 3.48Å; C115-C122 HydrophobicContact CB-CB 3.76Å; C115-C122 WeakPolarHBondContact CB-SG 3.11Å; C115-C122 WeakPolarHBondContact SG-CB 3.25Å; C115-C122 PolarHBondContact SG-O 2.81Å; C115-C122 CovalentContact SG-SG 2.02Å; C115-C122 PolarHBondContact SG-SG 3.11Å; I119-C122 HydrophobicContact CB-CB 3.9Å; I119-C122 HydrophobicContact CG2-CB 3.66Å; I119-C122 VanDerWaalsContact O-CB 3.28Å; I119-C122 WeakPolarHBondContact O-CB 3.21Å; I119-C122 PolarHBondContact O-N 2.87Å; I120-C122 VanDerWaalsContact C-N 3.25Å; I120-C122 PolarHBondContact O-N 3.42Å; C122-I124 VanDerWaalsContact C-N 3.34Å; C122-I124 PolarHBondContact O-N 3.39Å; C122-G125 PolarHBondContact O-N 3.08Å; C122-G125 VanDerWaalsContact O-N 3.14Å; C122-C126 PolarHBondContact O-N 3.07Å
123	Q	82.8	Confident	79.1	Confident	11 Å²	11	40.9 Å²	40.9	5%	0.051	21%	0.214	C	C	.	.	H	α-helix	trans	-61.1	-42	176.6	-64.2	-65.8	-23	0	0	112.1	L112 I119 I120 C126 F127	L112-Q123 VanDerWaalsContact CD2-OE1 3.23Å; I119-Q123 PolarHBondContact O-N 2.77Å; I120-Q123 PolarHBondContact O-N 2.87Å; I120-Q123 VanDerWaalsContact O-N 3.15Å; Q123-C126 PolarHBondContact O-N 3.03Å; Q123-F127 PolarHBondContact O-N 3.06Å
124	I	84.7	Confident	78.3	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58.2	-50.2	173	-63.6	169.4	0	0	0	110	L61 F62 F71 W85 F89 I120 G121 C122 C126 F127 L128	L61-I124 HydrophobicContact CD2-CD1 4.43Å; L61-I124 HydrophobicContact CD2-CG2 3.55Å; F62-I124 HydrophobicContact CZ-CD1 4.03Å; F71-I124 HydrophobicContact CE1-CG1 4.25Å; F71-I124 HydrophobicContact CE1-CG2 4.48Å; F71-I124 HydrophobicContact CZ-CG2 4.36Å; W85-I124 HydrophobicContact CH2-CG1 4Å; W85-I124 HydrophobicContact CZ3-CD1 3.76Å; W85-I124 HydrophobicContact CZ3-CG1 3.6Å; F89-I124 HydrophobicContact CE1-CD1 4.41Å; F89-I124 HydrophobicContact CZ-CD1 3.9Å; I120-I124 HydrophobicContact CG2-CD1 4.07Å; I120-I124 HydrophobicContact CG2-CG1 4.39Å; I120-I124 WeakPolarHBondContact O-CG1 3.36Å; I120-I124 PolarHBondContact O-N 2.88Å; G121-I124 PolarHBondContact O-N 2.84Å; C122-I124 VanDerWaalsContact C-N 3.34Å; C122-I124 PolarHBondContact O-N 3.39Å; I124-C126 PolarHBondContact O-N 2.86Å; I124-F127 PolarHBondContact O-N 3.34Å; I124-L128 HydrophobicContact CG2-CD1 3.79Å; I124-L128 HydrophobicContact CG2-CG 4.24Å; I124-L128 WeakPolarHBondContact O-CB 3.25Å; I124-L128 VanDerWaalsContact O-CG 3.27Å; I124-L128 WeakPolarHBondContact O-CG 3.34Å; I124-L128 PolarHBondContact O-N 2.77Å
125	G	86.6	Confident	77.2	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59	-43.6	180	0	0	0	0	0	113	G121 C122 L128 I129	G121-G125 PolarHBondContact O-N 2.04Å; C122-G125 PolarHBondContact O-N 3.08Å; C122-G125 VanDerWaalsContact O-N 3.14Å; G125-L128 PolarHBondContact O-N 3Å; G125-I129 PolarHBondContact O-N 3.33Å
126	C	87.6	Confident	75.9	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.014	21%	0.213	C	C	.	.	H	α-helix	trans	-64.7	-42.2	178.1	-73.3	0	0	0	0	112.9	T103 C111 L112 C115 C122 Q123 I124 I129 E130	T103-C126 HydrophobicContact CG2-CB 4.25Å; T103-C126 WeakPolarHBondContact CG2-SG 3.33Å; C111-C126 VanDerWaalsContact CA-SG 3.58Å; C111-C126 HydrophobicContact CB-CB 3.87Å; C111-C126 WeakPolarHBondContact CB-SG 3.27Å; C111-C126 PolarHBondContact O-SG 2.75Å; C111-C126 WeakPolarHBondContact SG-CA 3.32Å; C111-C126 WeakPolarHBondContact SG-CB 3.42Å; C111-C126 CovalentContact SG-SG 2.04Å; C111-C126 PolarHBondContact SG-SG 3.2Å; L112-C126 HydrophobicContact CG-CB 4.19Å; C115-C126 PolarHBondContact SG-SG 3.34Å; C122-C126 PolarHBondContact O-N 3.07Å; Q123-C126 PolarHBondContact O-N 3.03Å; I124-C126 PolarHBondContact O-N 2.86Å; C126-I129 VanDerWaalsContact O-CG2 3.26Å; C126-I129 WeakPolarHBondContact O-CG2 2.92Å; C126-I129 PolarHBondContact O-N 3.36Å; C126-E130 WeakPolarHBondContact O-CB 3.43Å; C126-E130 PolarHBondContact O-N 2.77Å
127	F	84.8	Confident	74.6	Confident	57 Å²	57	45 Å²	45	25%	0.25	23%	0.228	C	C	.	.	H	α-helix	trans	-62.4	-45.6	174.5	175.1	-108.9	0	0	0	111.9	F71 W75 Q123 I124 I129 E130 Q131	F71-F127 HydrophobicContact CE2-CD1 4.21Å; F71-F127 HydrophobicContact CE2-CE1 4.21Å; F71-F127 HydrophobicContact CZ-CD1 4.27Å; W75-F127 HydrophobicContact CE3-CD1 4.13Å; W75-F127 HydrophobicContact CE3-CE1 4.14Å; W75-F127 HydrophobicContact CE3-CG 4.43Å; W75-F127 HydrophobicContact CE3-CZ 4.45Å; W75-F127 HydrophobicContact CH2-CB 3.41Å; W75-F127 VanDerWaalsContact CH2-CB 3.41Å; W75-F127 AromaticContact CH2-CD1 3.56Å; W75-F127 HydrophobicContact CH2-CD1 3.56Å; W75-F127 AromaticContact CH2-CD2 3.17Å; W75-F127 HydrophobicContact CH2-CD2 3.17Å; W75-F127 HydrophobicContact CH2-CE1 4.09Å; W75-F127 AromaticContact CH2-CE2 3.72Å; W75-F127 HydrophobicContact CH2-CE2 3.72Å; W75-F127 AromaticContact CH2-CG 3.04Å; W75-F127 HydrophobicContact CH2-CG 3.04Å; W75-F127 HydrophobicContact CH2-CZ 4.16Å; W75-F127 HydrophobicContact CZ2-CB 4.09Å; W75-F127 HydrophobicContact CZ2-CD2 4.43Å; W75-F127 HydrophobicContact CZ2-CG 4.14Å; W75-F127 HydrophobicContact CZ3-CB 4.05Å; W75-F127 AromaticContact CZ3-CD1 3.22Å; W75-F127 HydrophobicContact CZ3-CD1 3.22Å; W75-F127 AromaticContact CZ3-CD2 3.39Å; W75-F127 HydrophobicContact CZ3-CD2 3.39Å; W75-F127 AromaticContact CZ3-CE1 3.34Å; W75-F127 HydrophobicContact CZ3-CE1 3.34Å; W75-F127 AromaticContact CZ3-CE2 3.47Å; W75-F127 HydrophobicContact CZ3-CE2 3.47Å; W75-F127 VanDerWaalsContact CZ3-CE2 3.47Å; W75-F127 AromaticContact CZ3-CG 3.23Å; W75-F127 HydrophobicContact CZ3-CG 3.23Å; W75-F127 AromaticContact CZ3-CZ 3.45Å; W75-F127 HydrophobicContact CZ3-CZ 3.45Å; W75-F127 VanDerWaalsContact CZ3-CZ 3.45Å; Q123-F127 PolarHBondContact O-N 3.06Å; I124-F127 PolarHBondContact O-N 3.34Å; F127-I129 VanDerWaalsContact C-N 3.34Å; F127-I129 PolarHBondContact O-N 3.29Å; F127-E130 PolarHBondContact O-N 3.43Å; F127-Q131 HydrophobicContact CZ-CB 4.45Å; F127-Q131 VanDerWaalsContact O-CB 3.3Å; F127-Q131 WeakPolarHBondContact O-CB 3.44Å; F127-Q131 PolarHBondContact O-N 2.83Å
128	L	86.6	Confident	73.4	Confident	9 Å²	9	42.7 Å²	42.7	5%	0.047	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-37	-178.4	-70.4	177.8	0	0	0	112.4	N57 I124 G125 T132	N57-L128 HydrophobicContact CB-CB 4.46Å; N57-L128 HydrophobicContact CB-CD1 3.85Å; N57-L128 HydrophobicContact CB-CD2 3.95Å; N57-L128 HydrophobicContact CB-CG 4.31Å; I124-L128 HydrophobicContact CG2-CD1 3.79Å; I124-L128 HydrophobicContact CG2-CG 4.24Å; I124-L128 WeakPolarHBondContact O-CB 3.25Å; I124-L128 VanDerWaalsContact O-CG 3.27Å; I124-L128 WeakPolarHBondContact O-CG 3.34Å; I124-L128 PolarHBondContact O-N 2.77Å; G125-L128 PolarHBondContact O-N 3Å; L128-T132 VanDerWaalsContact O-CB 3.23Å; L128-T132 WeakPolarHBondContact O-CB 3.4Å; L128-T132 PolarHBondContact O-N 2.85Å; L128-T132 PolarHBondContact O-OG1 2.87Å
129	I	85.8	Confident	71.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-71.9	-40.5	177.4	-165.1	67.2	0	0	0	111.7	A50 C54 P108 G125 C126 F127 T132 C133	A50-I129 HydrophobicContact CB-CD1 4.29Å; A50-I129 WeakPolarHBondContact O-CD1 3.28Å; C54-I129 HydrophobicContact CB-CB 4.2Å; C54-I129 HydrophobicContact CB-CD1 3.49Å; C54-I129 VanDerWaalsContact CB-CD1 3.49Å; C54-I129 HydrophobicContact CB-CG1 4.44Å; P108-I129 HydrophobicContact CG-CG1 4.15Å; G125-I129 PolarHBondContact O-N 3.33Å; C126-I129 VanDerWaalsContact O-CG2 3.26Å; C126-I129 WeakPolarHBondContact O-CG2 2.92Å; C126-I129 PolarHBondContact O-N 3.36Å; F127-I129 VanDerWaalsContact C-N 3.34Å; F127-I129 PolarHBondContact O-N 3.29Å; I129-T132 PolarHBondContact O-N 2.89Å; I129-C133 PolarHBondContact O-N 2.87Å; I129-C133 PolarHBondContact O-SG 2.88Å
130	E	82.4	Confident	69.7	Low	68 Å²	68	43.7 Å²	43.7	32%	0.318	24%	0.244	S	C	.	.	H	α-helix	trans	-60.1	-51.8	174.7	-173.1	176.5	-150.8	0	0	110.3	C126 F127 T132 C133 E134	C126-E130 WeakPolarHBondContact O-CB 3.43Å; C126-E130 PolarHBondContact O-N 2.77Å; F127-E130 PolarHBondContact O-N 3.43Å; E130-T132 PolarHBondContact O-N 2.78Å; E130-C133 PolarHBondContact O-N 2.95Å; E130-E134 WeakPolarHBondContact O-CG 3.46Å; E130-E134 PolarHBondContact O-N 2.9Å
131	Q	78.4	Confident	67.4	Low	77 Å²	77	46.6 Å²	46.6	36%	0.36	27%	0.266	S	S	.	.	H	α-helix	trans	-58.8	-35.7	176.6	-171.5	-177	5.2	0	0	112.6	F127 N135	F127-Q131 HydrophobicContact CZ-CB 4.45Å; F127-Q131 VanDerWaalsContact O-CB 3.3Å; F127-Q131 WeakPolarHBondContact O-CB 3.44Å; F127-Q131 PolarHBondContact O-N 2.83Å; Q131-N135 WeakPolarHBondContact CG-ND2 3.45Å; Q131-N135 WeakPolarHBondContact O-CB 3.42Å; Q131-N135 PolarHBondContact O-N 3.23Å; Q131-N135 PolarHBondContact O-ND2 2.91Å
132	T	78	Confident	64.8	Low	8 Å²	8	54 Å²	54	5%	0.049	31%	0.306	C	S	.	.	H	α-helix	trans	-69.3	-35.7	178.5	-65.1	0	0	0	0	112	A50 R53 L128 I129 E130	A50-T132 HydrophobicContact CB-CG2 4.26Å; R53-T132 HydrophobicContact CB-CG2 3.75Å; R53-T132 HydrophobicContact CG-CG2 3.61Å; L128-T132 VanDerWaalsContact O-CB 3.23Å; L128-T132 WeakPolarHBondContact O-CB 3.4Å; L128-T132 PolarHBondContact O-N 2.85Å; L128-T132 PolarHBondContact O-OG1 2.87Å; I129-T132 PolarHBondContact O-N 2.89Å; E130-T132 PolarHBondContact O-N 2.78Å
133	C	72	Confident	62.1	Low	46 Å²	46	56.3 Å²	56.3	31%	0.311	32%	0.322	S	S	.	.	H	α-helix	trans	-74.7	-33.7	176.3	-73.4	0	0	0	0	112.4	I129 E130	I129-C133 PolarHBondContact O-N 2.87Å; I129-C133 PolarHBondContact O-SG 2.88Å; E130-C133 PolarHBondContact O-N 2.95Å
134	E	61.5	Low	59.5	Low	130 Å²	130	62.6 Å²	62.6	61%	0.607	36%	0.356	S	S	*	.	H	α-helix	trans	-77	-26.6	176.7	-69.2	-177.9	164.7	0	0	114	E130	E130-E134 WeakPolarHBondContact O-CG 3.46Å; E130-E134 PolarHBondContact O-N 2.9Å
135	N	53.5	Low	57	Low	54 Å²	54	72.8 Å²	72.8	29%	0.289	40%	0.395	S	S	.	.	S	Bend	trans	-110.4	62.1	-177.5	-65.7	-74.7	0	0	0	111.3	R53 Q131	R53-N135 PolarHBondContact NH1-O 3.17Å; R53-N135 PolarHBondContact NH2-O 3.4Å; Q131-N135 WeakPolarHBondContact CG-ND2 3.45Å; Q131-N135 WeakPolarHBondContact O-CB 3.42Å; Q131-N135 PolarHBondContact O-N 3.23Å; Q131-N135 PolarHBondContact O-ND2 2.91Å
136	Q	50.6	Low	54.5	Low	73 Å²	73	79.4 Å²	79.4	34%	0.341	43%	0.43	S	S	.	.			trans	-62.2	139.6	179.8	-60.6	-155.6	-5.4	0	0	111.4	E46 G138 E139	E46-Q136 PolarHBondContact OE1-NE2 2.88Å; Q136-G138 PolarHBondContact O-N 2.54Å; Q136-E139 HydrophobicContact CB-CG 4.2Å; Q136-E139 PolarHBondContact O-N 3.26Å
137	P	44	Very low	51.8	Low	84 Å²	84	84.4 Å²	84.4	55%	0.545	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	103	174.7	-15.5	29.4	0	0	0	109.8
138	G	40.5	Very low	49.2	Very low	56 Å²	56	88.9 Å²	88.9	58%	0.577	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	125.6	-14.2	-177.1	0	0	0	0	0	114.6	Q136	Q136-G138 PolarHBondContact O-N 2.54Å
139	E	33.5	Very low	46.7	Very low	117 Å²	117	96 Å²	96	55%	0.547	52%	0.519	S	S	.	.	S	Bend	trans	-88.2	128.8	170.1	-71.2	-179.2	149.3	0	0	109.9	Q136 S141	Q136-E139 HydrophobicContact CB-CG 4.2Å; Q136-E139 PolarHBondContact O-N 3.26Å; E139-S141 PolarHBondContact O-N 3.45Å
140	C	26.7	Very low	44.3	Very low	96 Å²	96	103.1 Å²	103.1	65%	0.649	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-66.9	118.5	171.7	-66.2	0	0	0	0	108.2	N142	C140-N142 PolarHBondContact O-N 3.37Å
141	S	28.9	Very low	41.9	Very low	80 Å²	80	106.8 Å²	106.8	56%	0.559	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-48.9	126.9	172.7	-62.2	0	0	0	0	109.9	E139 S143	E139-S141 PolarHBondContact O-N 3.45Å; S141-S143 PolarHBondContact O-N 3.22Å
142	N	26.7	Very low	39.7	Very low	157 Å²	157	114.3 Å²	114.3	84%	0.84	60%	0.603	S	S	*	*			trans	-65.2	79.8	160.5	-90.9	-21.8	0	0	0	107.8	C140 N144	C140-N142 PolarHBondContact O-N 3.37Å; N142-N144 PolarHBondContact O-N 3.14Å
143	S	28.8	Very low	37.5	Very low	57 Å²	57	120.5 Å²	120.5	40%	0.399	64%	0.641	S	S	.	*			trans	-77	72.9	179.4	74.1	0	0	0	0	110.4	S141 Y145	S141-S143 PolarHBondContact O-N 3.22Å; S143-Y145 VanDerWaalsContact C-N 3.25Å
144	N	27.1	Very low	35.5	Very low	143 Å²	143	123.9 Å²	123.9	77%	0.765	66%	0.663	S	S	*	*	S	Bend	trans	-83.5	-4	158.3	-87.4	-10.7	0	0	0	112.2	N142	N142-N144 PolarHBondContact O-N 3.14Å
145	Y	33	Very low	34	Very low	214 Å²	214	122.8 Å²	122.8	84%	0.839	67%	0.67	S	S	*	*	S	Bend	trans	-108.1	7	-176.8	-63.9	-77.7	0	0	0	115.3	S143	S143-Y145 VanDerWaalsContact C-N 3.25Å
146	L	34.4	Very low	33	Very low	139 Å²	139	128.6 Å²	128.6	73%	0.728	70%	0.699	S	S	*	*	S	Bend	trans	-118	8	176.1	-95.9	158	0	0	0	114.4
147	M	30.2	Very low	32.2	Very low	108 Å²	108	132.6 Å²	132.6	53%	0.532	72%	0.723	S	S	.	*	S	Bend	trans	-95.1	-0.9	-178.7	-86.2	-82.9	-173.5	0	0	114.9
148	N	31	Very low	31.6	Very low	151 Å²	151	137.2 Å²	137.2	81%	0.807	74%	0.737	S	S	*	*	S	Bend	trans	-89.5	-10.5	-178.2	-83.9	-9.2	0	0	0	115.6
149	D	34.1	Very low	31.2	Very low	158 Å²	158	141.6 Å²	141.6	85%	0.845	75%	0.747	S	S	*	*	S	Bend	trans	-100.3	5.2	-177.9	-82.6	-23.4	0	0	0	115.4
150	L	35.4	Very low	31.2	Very low	149 Å²	149	144 Å²	144	78%	0.78	76%	0.764	S	S	*	*	S	Bend	trans	-108.7	4.1	179	-82.8	156.7	0	0	0	114.9
151	N	31.6	Very low	31.4	Very low	146 Å²	146	148.3 Å²	148.3	78%	0.781	78%	0.775	S	S	*	*	S	Bend	trans	-102.4	20.6	-179.8	-83.4	-20.9	0	0	0	115.1
152	R	32.2	Very low	31.5	Very low	234 Å²	234	150.8 Å²	150.8	88%	0.883	79%	0.787	S	S	*	*	S	Bend	trans	-129.2	81.2	171	-86.7	-172.8	177.9	-166.2	1.1	111.9
153	T	31	Very low	31.6	Very low	138 Å²	138	151.7 Å²	151.7	85%	0.847	79%	0.786	S	S	*	*			trans	176.5	118.6	133.4	23	0	0	0	0	109.6
154	P	30.7	Very low	31.7	Very low	117 Å²	117	160 Å²	160	76%	0.76	81%	0.81	S	S	*	*			trans	-88.7	152.8	172.4	32.5	-27.2	0	0	0	111.5
155	S	29.4	Very low	31.8	Very low	108 Å²	108	161.3 Å²	161.3	76%	0.755	82%	0.817	S	S	*	*			trans	65.6	110.8	158.5	56.3	0	0	0	0	118.8
156	I	33.9	Very low	31.6	Very low	175 Å²	175	154.5 Å²	154.5	90%	0.897	81%	0.812	S	S	*	*				-161.2	136.4	125.3	-89.6	143.6	0	0	0	108.5
157	N	33.4	Very low	31.4	Very low	158 Å²	158	159.5 Å²	159.5	85%	0.845	82%	0.821	S	S	*	*			trans	-65	144.3	-164.2	-67.7	-43.2	0	0	0	115.5
158	Q	31.3	Very low	31.3	Very low	180 Å²	180	164 Å²	164	84%	0.841	84%	0.838	S	S	*	*			trans	-68.6	130.6	163.1	-64.8	173.7	-8.8	0	0	109.9
159	N	32.9	Very low	31.2	Very low	149 Å²	149	167.6 Å²	167.6	80%	0.797	84%	0.841	S	S	*	*			trans	169.7	97.9	138.4	-85.2	-16.2	0	0	0	108.7
160	N	32.5	Very low	31.2	Very low	167 Å²	167	165.7 Å²	165.7	89%	0.893	84%	0.837	S	S	*	*			trans	179.8	94.7	142.3	-88.6	-13.8	0	0	0	108.4
161	Q	31.1	Very low	30.9	Very low	187 Å²	187	165.2 Å²	165.2	87%	0.874	84%	0.84	S	S	*	*			trans	-75.5	126	162.4	-67.9	177.3	-5.7	0	0	108
162	T	31	Very low	31	Very low	132 Å²	132	164.1 Å²	164.1	81%	0.81	84%	0.839	S	S	*	*				179	134.4	123.7	32.2	0	0	0	0	109.9
163	Q	29.4	Very low	30.9	Very low	176 Å²	176	158.9 Å²	158.9	82%	0.822	83%	0.829	S	S	*	*			trans	63.4	101.3	163.5	-91.7	170.4	-27.2	0	0	117.4
164	Y	30.7	Very low	31	Very low	232 Å²	232	160 Å²	160	91%	0.91	83%	0.829	S	S	*	*				-179.8	138.9	116	-106.2	-86.3	0	0	0	109.9
165	N	28.9	Very low	31.1	Very low	169 Å²	169	159 Å²	159	90%	0.904	82%	0.824	S	S	*	*			trans	-64.7	134.7	-168.8	-68.3	-40	0	0	0	114.6
166	G	29.4	Very low	31.3	Very low	71 Å²	71	158 Å²	158	73%	0.732	82%	0.822	S	S	*	*			trans	176.9	118.1	167.1	0	0	0	0	0	111.6	K168	G166-K168 PolarHBondContact O-N 3.09Å
167	R	30.3	Very low	31.3	Very low	244 Å²	244	156.6 Å²	156.6	92%	0.921	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-54.4	128.6	-168	-75.3	175	173.9	166.4	-1	114.4
168	K	28.1	Very low	31.1	Very low	204 Å²	204	156.3 Å²	156.3	89%	0.887	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-73.8	134	166	-76.9	177.6	172.7	179	0	111.2	G166	G166-K168 PolarHBondContact O-N 3.09Å
169	Y	27.7	Very low	31.1	Very low	225 Å²	225	154 Å²	154	88%	0.882	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-86.6	132.4	160.3	-73.2	-90.3	0	0	0	109.4
170	P	34	Very low	31	Very low	118 Å²	118	155.7 Å²	155.7	77%	0.766	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-92.9	133.3	167.3	13.5	4.2	0	0	0	111.7
171	V	29.9	Very low	31.1	Very low	139 Å²	139	155.6 Å²	155.6	84%	0.842	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-68.3	134	171.4	178.5	0	0	0	0	109.6
172	V	32.7	Very low	31	Very low	124 Å²	124	154 Å²	154	75%	0.752	82%	0.817	S	S	*	*			trans	-123.8	114.9	176.2	-179.6	0	0	0	0	109.1
173	N	31.8	Very low	31	Very low	124 Å²	124	150.9 Å²	150.9	66%	0.663	80%	0.799	S	S	*	*			trans	-138.3	60.3	-176.5	-144.8	30.3	0	0	0	109.6
174	D	32.7	Very low	31.5	Very low	161 Å²	161	152.7 Å²	152.7	86%	0.861	80%	0.804	S	S	*	*			trans	-152.3	14.7	-175.4	-121.7	-7.1	0	0	0	116.3
175	C	32	Very low	32	Very low	95 Å²	95	145 Å²	145	64%	0.642	78%	0.782	S	S	*	*			trans	-98.1	13.4	-168.6	-123.6	0	0	0	0	116.4
176	A	33.6	Very low	32.4	Very low	87 Å²	87	139.9 Å²	139.9	72%	0.719	76%	0.757	S	S	*	*	S	Bend	trans	-91.1	-12.3	-161.3	0	0	0	0	0	117.6
177	N	34	Very low	33.1	Very low	147 Å²	147	139.3 Å²	139.3	79%	0.786	74%	0.737	S	S	*	*	S	Bend	trans	-123	7.6	-161.1	-78.6	-17.4	0	0	0	119.1
178	N	28.5	Very low	33.4	Very low	151 Å²	151	133 Å²	133	81%	0.807	72%	0.718	S	S	*	*			trans	-145.5	20	-170.1	-81.6	-41.8	0	0	0	119
179	C	32.2	Very low	33.7	Very low	132 Å²	132	127.2 Å²	127.2	89%	0.892	70%	0.7	S	S	*	*			trans	-105.7	97.2	-179.9	-75.9	0	0	0	0	113.1
180	Q	30.6	Very low	33.8	Very low	184 Å²	184	119.9 Å²	119.9	86%	0.86	68%	0.681	S	S	*	*			trans	-142.2	100	167.5	-167.7	165.4	-0.1	0	0	108.6
181	L	35.2	Very low	33.6	Very low	165 Å²	165	120.1 Å²	120.1	86%	0.864	68%	0.684	S	S	*	*	S	Bend	trans	170.7	115.8	155.3	-93.7	148.5	0	0	0	112.3
182	D	29.1	Very low	33.7	Very low	155 Å²	155	123 Å²	123	83%	0.829	69%	0.685	S	S	*	*			trans	5	111.5	166.2	-63.2	-20.5	0	0	0	121
183	C	30.6	Very low	33.6	Very low	65 Å²	65	126.7 Å²	126.7	44%	0.439	69%	0.687	S	S	.	*			trans	-101.4	120.6	156.8	-60	0	0	0	0	109.5	V185 C190	C183-V185 VanDerWaalsContact C-N 3.25Å; C183-V185 PolarHBondContact O-N 3.49Å; C183-C190 WeakPolarHBondContact CB-SG 3.34Å; C183-C190 WeakPolarHBondContact SG-CB 3.08Å; C183-C190 CovalentContact SG-SG 2.06Å; C183-C190 PolarHBondContact SG-SG 3.23Å
184	K	39.7	Very low	33.5	Very low	214 Å²	214	130.6 Å²	130.6	93%	0.93	70%	0.698	S	S	*	*	S	Bend	trans	-76.8	5.9	-178.1	-87.5	-176.5	174.7	-176.6	0	115.1
185	V	41.1	Very low	33.2	Very low	72 Å²	72	128.3 Å²	128.3	44%	0.436	69%	0.693	S	S	.	*	S	Bend	trans	-137.5	127.2	-178.4	-172.3	0	0	0	0	109.6	C183 L187	C183-V185 VanDerWaalsContact C-N 3.25Å; C183-V185 PolarHBondContact O-N 3.49Å; V185-L187 PolarHBondContact O-N 3.13Å
186	P	38.5	Very low	33.1	Very low	61 Å²	61	129.2 Å²	129.2	40%	0.396	70%	0.698	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67	2.3	-171.3	-23.3	35.3	0	0	0	116.7	S42	S42-P186 WeakPolarHBondContact OG-CG 3.37Å
187	L	43.2	Very low	32.6	Very low	58 Å²	58	134.5 Å²	134.5	30%	0.304	71%	0.708	S	S	.	*	T	Hydrogen-bonded Turn	trans	-134.3	15	-169.2	-68.4	170.8	0	0	0	113.8	F49 V185 T301	F49-L187 HydrophobicContact CE2-CD1 4.05Å; V185-L187 PolarHBondContact O-N 3.13Å; L187-T301 HydrophobicContact CD2-CG2 4.15Å
188	Q	37.5	Very low	32.3	Very low	111 Å²	111	134.4 Å²	134.4	52%	0.519	71%	0.707	S	S	.	*			trans	-109.4	119.4	176.8	-81.1	-176.8	-13	0	0	111.7	C190	Q188-C190 PolarHBondContact O-N 3.36Å; Q188-C190 VanDerWaalsContact O-N 3.15Å
189	T	32.9	Very low	32.1	Very low	84 Å²	84	133.4 Å²	133.4	52%	0.515	71%	0.711	S	S	.	*			trans	-73.5	95.6	164.3	39.7	0	0	0	0	109.3	C191	T189-C191 PolarHBondContact O-N 3.2Å
190	C	30.9	Very low	31.9	Very low	70 Å²	70	133.2 Å²	133.2	47%	0.473	71%	0.707	S	S	.	*			trans	-77.2	83.7	174	-52.3	0	0	0	0	110.4	C183 Q188 K192	C183-C190 WeakPolarHBondContact CB-SG 3.34Å; C183-C190 WeakPolarHBondContact SG-CB 3.08Å; C183-C190 CovalentContact SG-SG 2.06Å; C183-C190 PolarHBondContact SG-SG 3.23Å; Q188-C190 PolarHBondContact O-N 3.36Å; Q188-C190 VanDerWaalsContact O-N 3.15Å; C190-K192 PolarHBondContact O-N 2.79Å
191	C	30.4	Very low	32.1	Very low	123 Å²	123	131.7 Å²	131.7	83%	0.831	70%	0.704	S	S	*	*			trans	-87.3	102.2	166.3	-75.5	0	0	0	0	109.8	T189	T189-C191 PolarHBondContact O-N 3.2Å
192	K	31.8	Very low	32.3	Very low	200 Å²	200	126 Å²	126	87%	0.87	68%	0.678	S	S	*	*			trans	-97.4	90.4	-179.2	-151.1	179.5	-169.3	178.4	0	110.7	C190	C190-K192 PolarHBondContact O-N 2.79Å
193	Y	30.6	Very low	33.1	Very low	202 Å²	202	126.5 Å²	126.5	79%	0.792	68%	0.679	S	S	*	*			trans	-130.1	111.8	158.8	-97.8	-83.3	0	0	0	111	C195	Y193-C195 PolarHBondContact O-N 3.14Å
194	K	28.3	Very low	34.3	Very low	205 Å²	205	126.9 Å²	126.9	89%	0.891	67%	0.672	S	S	*	*	S	Bend	trans	26.8	53.5	156.1	-67.4	-175.7	175.2	179	0	118.9
195	C	27	Very low	35.4	Very low	113 Å²	113	120.9 Å²	120.9	76%	0.764	65%	0.65	S	S	*	*			trans	-114.3	133.6	158.8	-79.8	0	0	0	0	109.6	Y193	Y193-C195 PolarHBondContact O-N 3.14Å
196	P	29.1	Very low	36.7	Very low	115 Å²	115	126 Å²	126	75%	0.747	67%	0.667	S	S	*	*			trans	-60.4	145.3	172	27	-31.8	0	0	0	109.5	L198	P196-L198 PolarHBondContact O-N 2.97Å
197	Q	24.8	Very low	38.3	Very low	198 Å²	198	125.8 Å²	125.8	93%	0.925	66%	0.661	S	S	*	*			trans	-43.7	102.5	-180	-79.1	174.8	-45.3	0	0	112.6
198	L	26.5	Very low	39.9	Very low	144 Å²	144	123.4 Å²	123.4	75%	0.754	65%	0.649	S	S	*	*			trans	-127.3	126.2	143.9	-87.4	96.9	0	0	0	106.5	P196 T200	P196-L198 PolarHBondContact O-N 2.97Å; L198-T200 VanDerWaalsContact C-N 3.28Å; L198-T200 PolarHBondContact O-N 2.96Å
199	S	24.4	Very low	42.2	Very low	130 Å²	130	118.1 Å²	118.1	91%	0.909	63%	0.625	S	S	*	*			trans	-59	87.9	171.8	48.2	0	0	0	0	109.9
200	T	28.1	Very low	44.5	Very low	129 Å²	129	115.7 Å²	115.7	79%	0.791	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-90.7	127.6	169.1	33.6	0	0	0	0	109.5	L198	L198-T200 VanDerWaalsContact C-N 3.28Å; L198-T200 PolarHBondContact O-N 2.96Å
201	D	34.3	Very low	47	Very low	152 Å²	152	118 Å²	118	81%	0.813	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-47.4	140.4	175.9	-64.8	-49	0	0	0	112.1	I203	D201-I203 PolarHBondContact O-N 2.76Å; D201-I203 VanDerWaalsContact O-N 3.14Å
202	S	39	Very low	49.4	Very low	45 Å²	45	112.4 Å²	112.4	32%	0.315	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-51.5	119.7	174.6	-61.3	0	0	0	0	110.6	Y204	S202-Y204 VanDerWaalsContact C-N 3.29Å; S202-Y204 WeakPolarHBondContact O-CD2 3.43Å; S202-Y204 PolarHBondContact O-N 3.07Å
203	I	46	Very low	51.4	Low	165 Å²	165	109.4 Å²	109.4	85%	0.846	56%	0.563	S	S	*	*			trans	-75.8	84.9	177.3	-54.9	175	0	0	0	108.2	D201	D201-I203 PolarHBondContact O-N 2.76Å; D201-I203 VanDerWaalsContact O-N 3.14Å
204	Y	56.1	Low	53.4	Low	74 Å²	74	104.9 Å²	104.9	29%	0.29	55%	0.552	S	S	.	*			trans	-71.7	142	172	-64.9	-73.8	0	0	0	110.3	S202 K206 R302	S202-Y204 VanDerWaalsContact C-N 3.29Å; S202-Y204 WeakPolarHBondContact O-CD2 3.43Å; S202-Y204 PolarHBondContact O-N 3.07Å; Y204-K206 PolarHBondContact O-N 2.84Å; Y204-R302 HydrophobicContact CD1-CG 3.75Å; Y204-R302 VanDerWaalsContact CD2-CD 3.5Å; Y204-R302 HydrophobicContact CD2-CG 3.82Å; Y204-R302 HydrophobicContact CE1-CB 4.36Å; Y204-R302 HydrophobicContact CE1-CG 3.89Å; Y204-R302 HydrophobicContact CE2-CB 4.34Å; Y204-R302 HydrophobicContact CE2-CG 3.92Å; Y204-R302 HydrophobicContact CG-CG 3.72Å
205	N	63.3	Low	55.9	Low	88 Å²	88	95.9 Å²	95.9	47%	0.471	51%	0.514	S	S	.	.			trans	-52.7	132.4	165.1	-179.3	-12.9	0	0	0	108	L207 V208	N205-L207 PolarHBondContact O-N 3.47Å; N205-L207 WeakPolarHBondContact OD1-CG 3.43Å; N205-L207 PolarHBondContact OD1-N 2.86Å; N205-V208 HydrophobicContact CB-CG2 4.14Å; N205-V208 WeakPolarHBondContact O-CB 3.17Å; N205-V208 PolarHBondContact O-N 2.88Å
206	K	68.6	Low	58.2	Low	180 Å²	180	93.5 Å²	93.5	78%	0.783	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-15.8	179.2	-68.9	-174.7	178.8	-176	0	112.8	Y204 M242	Y204-K206 PolarHBondContact O-N 2.84Å; K206-M242 WeakPolarHBondContact O-CE 3.14Å
207	L	72.2	Confident	60.6	Low	55 Å²	55	91.4 Å²	91.4	29%	0.288	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-10.4	176.1	-55.2	173.8	0	0	0	114	N205 S297 Y299	N205-L207 PolarHBondContact O-N 3.47Å; N205-L207 WeakPolarHBondContact OD1-CG 3.43Å; N205-L207 PolarHBondContact OD1-N 2.86Å; L207-S297 PolarHBondContact O-OG 2.86Å; L207-Y299 HydrophobicContact CB-CD1 4.24Å; L207-Y299 HydrophobicContact CB-CD2 3.39Å; L207-Y299 HydrophobicContact CB-CE1 4.45Å; L207-Y299 HydrophobicContact CB-CE2 3.65Å; L207-Y299 HydrophobicContact CB-CG 3.7Å; L207-Y299 HydrophobicContact CD1-CD1 4.16Å; L207-Y299 HydrophobicContact CD1-CD2 4.35Å; L207-Y299 HydrophobicContact CD1-CE1 3.72Å; L207-Y299 HydrophobicContact CD1-CE2 3.93Å; L207-Y299 HydrophobicContact CD1-CG 4.44Å; L207-Y299 HydrophobicContact CG-CD2 4.42Å; L207-Y299 HydrophobicContact CG-CE2 4.23Å; L207-Y299 WeakPolarHBondContact O-CD2 3.31Å
208	V	77.2	Confident	63.1	Low	8 Å²	8	87 Å²	87	5%	0.048	46%	0.464	C	S	.	.	S	Bend	trans	-83.7	126.4	173.3	-178.1	0	0	0	0	108.6	N205 R302	N205-V208 HydrophobicContact CB-CG2 4.14Å; N205-V208 WeakPolarHBondContact O-CB 3.17Å; N205-V208 PolarHBondContact O-N 2.88Å; V208-R302 HydrophobicContact CG1-CG 3.78Å; V208-R302 PolarHBondContact O-NE 3.25Å; V208-R302 PolarHBondContact O-NH2 3.41Å
209	P	84.2	Confident	65.5	Low	0 Å²	0	83.4 Å²	83.4	0%	0	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-56.6	145.4	-177.1	23.1	-34.6	0	0	0	111.6	Y235 M242 I245 A295 S297 R302	P209-Y235 HydrophobicContact CB-CE1 4.06Å; P209-M242 VanDerWaalsContact CA-SD 3.6Å; P209-M242 HydrophobicContact CB-SD 4.39Å; P209-I245 HydrophobicContact CB-CD1 4.33Å; P209-A295 HydrophobicContact CB-CB 3.78Å; P209-A295 HydrophobicContact CG-CB 3.9Å; P209-A295 WeakPolarHBondContact CG-O 3.22Å; P209-S297 VanDerWaalsContact CD-OG 3.28Å; P209-S297 WeakPolarHBondContact CD-OG 3.15Å; P209-R302 VanDerWaalsContact O-CD 3.28Å; P209-R302 WeakPolarHBondContact O-CD 3.38Å; P209-R302 VanDerWaalsContact O-CG 3.27Å; P209-R302 WeakPolarHBondContact O-CG 3.42Å; P209-R302 PolarHBondContact O-NE 2.83Å; P209-R302 VanDerWaalsContact O-NE 3.16Å
210	P	82.1	Confident	67.9	Low	33 Å²	33	78.9 Å²	78.9	21%	0.214	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-58.5	153.3	175	26.5	-34.7	0	0	0	110.7	P212 Y235 I238	P210-P212 WeakPolarHBondContact O-CD 3.49Å; P210-Y235 HydrophobicContact CG-CE1 3.89Å; P210-Y235 PolarHBondContact O-OH 2.88Å; P210-I238 HydrophobicContact CG-CD1 3.69Å
211	R	82.8	Confident	69.7	Low	119 Å²	119	78.7 Å²	78.7	45%	0.449	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-67.9	127.2	173	-172.8	178.7	-177.2	-143.8	-0.7	107.9	I213 R302 F304	R211-I213 WeakPolarHBondContact O-CG1 3.16Å; R211-I213 PolarHBondContact O-N 3Å; R211-R302 HydrophobicContact CB-CB 3.94Å; R211-F304 PolarHBondContact NE-O 2.67Å; R211-F304 PolarHBondContact NH2-O 2.88Å
212	P	82	Confident	71.2	Confident	6 Å²	6	77.4 Å²	77.4	4%	0.039	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-55.6	125.2	177.4	-22	28.7	0	0	0	111.4	P210 Y235 I293 A295 G305	P210-P212 WeakPolarHBondContact O-CD 3.49Å; P212-Y235 WeakPolarHBondContact CD-OH 3.35Å; P212-Y235 WeakPolarHBondContact CG-OH 3.09Å; P212-I293 HydrophobicContact CB-CG2 3.36Å; P212-I293 HydrophobicContact CG-CG2 3.62Å; P212-I293 WeakPolarHBondContact CG-O 3.33Å; P212-A295 HydrophobicContact CG-CB 4.47Å; P212-G305 WeakPolarHBondContact O-CA 3.42Å
213	I	73.7	Confident	72.6	Confident	136 Å²	136	77.4 Å²	77.4	70%	0.697	41%	0.414	S	S	*	.			trans	-93.5	-46.6	-176.5	-54.7	175.7	0	0	0	110.6	R211	R211-I213 WeakPolarHBondContact O-CG1 3.16Å; R211-I213 PolarHBondContact O-N 3Å
214	L	72.1	Confident	73.8	Confident	108 Å²	108	72.7 Å²	72.7	57%	0.565	40%	0.4	S	S	*	.			trans	-134.4	131.8	-176	-171.6	66	0	0	0	111.4	N216 Q234	L214-N216 WeakPolarHBondContact CD2-OD1 3.11Å; L214-Q234 PolarHBondContact O-NE2 3.34Å
215	L	80.7	Confident	74.7	Confident	15 Å²	15	71.7 Å²	71.7	8%	0.079	40%	0.399	C	S	.	.			trans	-99.4	113.4	168.7	-88.5	158.7	0	0	0	107.6	S217 W231 F291 I293 T308	L215-S217 PolarHBondContact O-N 3.37Å; L215-W231 HydrophobicContact CD2-CB 4.4Å; L215-W231 HydrophobicContact CD2-CD2 4.38Å; L215-W231 HydrophobicContact CD2-CE3 3.56Å; L215-W231 HydrophobicContact CD2-CZ3 4.2Å; L215-F291 HydrophobicContact CD1-CB 4.47Å; L215-I293 HydrophobicContact CD1-CB 3.96Å; L215-I293 HydrophobicContact CD1-CG2 3.66Å; L215-I293 HydrophobicContact CD2-CB 4.11Å; L215-I293 HydrophobicContact CD2-CD1 4.18Å; L215-I293 HydrophobicContact CD2-CG2 3.75Å; L215-I293 HydrophobicContact CG-CB 4.31Å; L215-I293 HydrophobicContact CG-CG2 3.64Å; L215-T308 HydrophobicContact CB-CG2 3.48Å; L215-T308 VanDerWaalsContact CB-CG2 3.48Å; L215-T308 HydrophobicContact CD1-CG2 3.72Å; L215-T308 HydrophobicContact CG-CG2 4.25Å
216	N	75.8	Confident	75.5	Confident	63 Å²	63	69 Å²	69	34%	0.337	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	114.8	178.2	-70.1	-17.6	0	0	0	108.8	L214 L229 S230	L214-N216 WeakPolarHBondContact CD2-OD1 3.11Å; N216-L229 CarbonylContact O-C 3.56Å; N216-L229 WeakPolarHBondContact O-CA 3.32Å; N216-S230 WeakPolarHBondContact CB-O 3.42Å; N216-S230 PolarHBondContact N-O 2.78Å; N216-S230 PolarHBondContact O-N 3.16Å
217	S	78.3	Confident	76.4	Confident	71 Å²	71	60.5 Å²	60.5	50%	0.497	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	119.4	174.1	62.5	0	0	0	0	110.5	L215	L215-S217 PolarHBondContact O-N 3.37Å
218	I	78	Confident	77.1	Confident	107 Å²	107	63.2 Å²	63.2	55%	0.549	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	116.3	175.3	-57.9	172.4	0	0	0	107.4	K228	I218-K228 PolarHBondContact N-O 2.78Å; I218-K228 PolarHBondContact O-N 3.49Å
219	V	76.5	Confident	77.6	Confident	68 Å²	68	62.9 Å²	62.9	41%	0.412	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	133.2	171.9	-174.3	0	0	0	0	108.2	S221 Y311	V219-S221 PolarHBondContact O-N 2.9Å; V219-Y311 HydrophobicContact CG2-CE2 3.75Å
220	S	74.2	Confident	77.8	Confident	35 Å²	35	64.1 Å²	64.1	25%	0.245	36%	0.363	C	S	.	.			trans	-60.9	135.3	178	-177.8	0	0	0	0	110.5	T222 N223 I226	S220-T222 PolarHBondContact O-N 3.16Å; S220-T222 PolarHBondContact OG-N 3.44Å; S220-T222 PolarHBondContact OG-OG1 3.08Å; S220-N223 WeakPolarHBondContact CB-O 3.44Å; S220-I226 PolarHBondContact N-O 2.79Å
221	S	66.5	Low	78	Confident	125 Å²	125	62.6 Å²	62.6	87%	0.874	35%	0.353	S	S	*	.	S	Bend	trans	-67.6	-21.6	176.1	55.2	0	0	0	0	112.9	V219	V219-S221 PolarHBondContact O-N 2.9Å
222	T	65.9	Low	78	Confident	125 Å²	125	58.2 Å²	58.2	77%	0.767	34%	0.341	S	S	*	.	S	Bend	trans	-93.4	-26.6	-176.7	56.3	0	0	0	0	113.4	S220	S220-T222 PolarHBondContact O-N 3.16Å; S220-T222 PolarHBondContact OG-N 3.44Å; S220-T222 PolarHBondContact OG-OG1 3.08Å
223	N	69.2	Low	77.8	Confident	44 Å²	44	61.1 Å²	61.1	24%	0.235	36%	0.362	C	S	.	.			trans	-147.5	112	-177.9	-173	-8.6	0	0	0	109.6	S220 N225 I226	S220-N223 WeakPolarHBondContact CB-O 3.44Å; N223-N225 PolarHBondContact O-N 3.15Å; N223-N225 VanDerWaalsContact O-N 3.09Å; N223-N225 WeakPolarHBondContact OD1-CB 3.47Å; N223-N225 PolarHBondContact OD1-N 3.22Å; N223-I226 HydrophobicContact CB-CB 4.43Å; N223-I226 HydrophobicContact CB-CD1 3.85Å; N223-I226 HydrophobicContact CB-CG1 3.97Å; N223-I226 PolarHBondContact O-N 3.36Å
224	A	70.7	Confident	78	Confident	67 Å²	67	56.7 Å²	56.7	55%	0.554	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-20.5	178.8	0	0	0	0	0	112.8	I226 Y311	A224-I226 VanDerWaalsContact C-N 3.29Å; A224-I226 PolarHBondContact O-N 3.06Å; A224-Y311 PolarHBondContact O-OH 2.75Å
225	N	75.7	Confident	78.4	Confident	53 Å²	53	51.5 Å²	51.5	28%	0.283	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	1.4	177.3	-64.6	-9.9	0	0	0	113.7	N223 E281 F283	N223-N225 PolarHBondContact O-N 3.15Å; N223-N225 VanDerWaalsContact O-N 3.09Å; N223-N225 WeakPolarHBondContact OD1-CB 3.47Å; N223-N225 PolarHBondContact OD1-N 3.22Å; N225-E281 WeakPolarHBondContact O-CA 3.36Å; N225-F283 VanDerWaalsContact O-CD2 3.25Å; N225-F283 WeakPolarHBondContact O-CD2 3.37Å; N225-F283 WeakPolarHBondContact O-CE2 3.31Å
226	I	79.8	Confident	77.8	Confident	31 Å²	31	56 Å²	56	16%	0.159	33%	0.332	C	S	.	.			trans	-111.5	125.8	177.3	-59	177	0	0	0	109	S220 N223 A224 L280 E281	S220-I226 PolarHBondContact N-O 2.79Å; N223-I226 HydrophobicContact CB-CB 4.43Å; N223-I226 HydrophobicContact CB-CD1 3.85Å; N223-I226 HydrophobicContact CB-CG1 3.97Å; N223-I226 PolarHBondContact O-N 3.36Å; A224-I226 VanDerWaalsContact C-N 3.29Å; A224-I226 PolarHBondContact O-N 3.06Å; I226-L280 CarbonylContact C-O 3.57Å; I226-L280 VanDerWaalsContact CA-O 3.28Å; I226-L280 WeakPolarHBondContact CA-O 3.28Å; I226-E281 HydrophobicContact CG1-CB 4.19Å
227	I	86	Confident	77.4	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.005	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	131.4	170.9	-50.5	168.2	0	0	0	109	L229 L280 F283 Y311	I227-L229 HydrophobicContact CG2-CD2 4Å; I227-L280 PolarHBondContact N-O 2.73Å; I227-L280 PolarHBondContact O-N 3.19Å; I227-F283 HydrophobicContact CB-CZ 4.41Å; I227-F283 HydrophobicContact CD1-CE1 4.08Å; I227-F283 HydrophobicContact CD1-CE2 3.73Å; I227-F283 HydrophobicContact CD1-CZ 3.33Å; I227-F283 HydrophobicContact CG1-CE2 3.71Å; I227-F283 HydrophobicContact CG1-CZ 3.76Å; I227-Y311 HydrophobicContact CD1-CD1 3.11Å; I227-Y311 HydrophobicContact CD1-CD2 3.46Å; I227-Y311 VanDerWaalsContact CD1-CD2 3.46Å; I227-Y311 HydrophobicContact CD1-CE1 3.23Å; I227-Y311 HydrophobicContact CD1-CE2 3.54Å; I227-Y311 HydrophobicContact CD1-CG 3.23Å; I227-Y311 VanDerWaalsContact CD1-CZ 3.4Å; I227-Y311 HydrophobicContact CG1-CD1 4.09Å; I227-Y311 HydrophobicContact CG1-CD2 4.06Å; I227-Y311 HydrophobicContact CG1-CE1 3.7Å; I227-Y311 HydrophobicContact CG1-CE2 3.63Å; I227-Y311 HydrophobicContact CG1-CG 4.25Å; I227-Y311 VanDerWaalsContact CG1-CZ 3.41Å
228	K	87	Confident	76.8	Confident	113 Å²	113	58.7 Å²	58.7	49%	0.491	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	114.6	165.6	-174.4	167.3	-173.9	175.4	0	109.8	I218 N279	I218-K228 PolarHBondContact N-O 2.78Å; I218-K228 PolarHBondContact O-N 3.49Å; K228-N279 WeakPolarHBondContact CG-OD1 2.98Å
229	L	88.3	Confident	75.9	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	133.6	167.5	-62.8	-174.7	0	0	0	109.3	N216 I227 W231 L249 G277 A278 L280 F291	N216-L229 CarbonylContact O-C 3.56Å; N216-L229 WeakPolarHBondContact O-CA 3.32Å; I227-L229 HydrophobicContact CG2-CD2 4Å; L229-W231 HydrophobicContact CB-CE3 4.44Å; L229-W231 HydrophobicContact CB-CZ3 4Å; L229-L249 HydrophobicContact CD1-CD1 4.13Å; L229-L249 HydrophobicContact CD1-CD2 4.09Å; L229-G277 CarbonylContact O-C 3.49Å; L229-G277 WeakPolarHBondContact O-CA 3.2Å; L229-A278 PolarHBondContact N-O 3.14Å; L229-A278 PolarHBondContact O-N 2.64Å; L229-L280 HydrophobicContact CD1-CD1 3.49Å; L229-L280 VanDerWaalsContact CD1-CD1 3.49Å; L229-L280 HydrophobicContact CD1-CG 4.32Å; L229-L280 HydrophobicContact CG-CD1 3.89Å; L229-L280 HydrophobicContact CG-CG 4.4Å; L229-F291 HydrophobicContact CD1-CB 4.06Å; L229-F291 HydrophobicContact CD1-CD1 4.15Å; L229-F291 HydrophobicContact CD1-CD2 4.12Å; L229-F291 HydrophobicContact CD1-CG 3.83Å
230	S	88.4	Confident	75.1	Confident	25 Å²	25	57.7 Å²	57.7	18%	0.175	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	138.3	175.4	-173.6	0	0	0	0	111.4	N216 S232 F276	N216-S230 WeakPolarHBondContact CB-O 3.42Å; N216-S230 PolarHBondContact N-O 2.78Å; N216-S230 PolarHBondContact O-N 3.16Å; S230-S232 PolarHBondContact OG-OG 2.03Å; S230-F276 PolarHBondContact OG-O 2.96Å
231	W	86.4	Confident	74.4	Confident	1 Å²	1	60.6 Å²	60.6	0%	0.004	36%	0.361	C	S	.	.			trans	-129.2	12.7	177.4	49.5	90.4	0	0	0	112.3	L215 L229 S233 Q234 Y235 F247 T273 E275 F276 A278 I293	L215-W231 HydrophobicContact CD2-CB 4.4Å; L215-W231 HydrophobicContact CD2-CD2 4.38Å; L215-W231 HydrophobicContact CD2-CE3 3.56Å; L215-W231 HydrophobicContact CD2-CZ3 4.2Å; L229-W231 HydrophobicContact CB-CE3 4.44Å; L229-W231 HydrophobicContact CB-CZ3 4Å; W231-S233 VanDerWaalsContact C-N 3.29Å; W231-S233 PolarHBondContact O-N 3.23Å; W231-Q234 PolarHBondContact O-N 3.34Å; W231-Y235 WeakPolarHBondContact O-CD2 3.33Å; W231-F247 AromaticContact CD1-CD1 3.73Å; W231-F247 AromaticContact CD1-CE1 3.58Å; W231-F247 AromaticContact CD1-CE2 3.92Å; W231-F247 AromaticContact CD1-CG 3.97Å; W231-F247 AromaticContact CD1-CZ 3.68Å; W231-F247 HydrophobicContact CZ2-CB 4.28Å; W231-F247 HydrophobicContact CZ2-CG 4.44Å; W231-F247 AromaticContact NE1-CD1 3.54Å; W231-F247 AromaticContact NE1-CD2 3.24Å; W231-F247 AromaticContact NE1-CE1 3.75Å; W231-F247 AromaticContact NE1-CE2 3.46Å; W231-F247 AromaticContact NE1-CG 3.28Å; W231-F247 VanDerWaalsContact NE1-CG 3.28Å; W231-F247 AromaticContact NE1-CZ 3.72Å; W231-T273 HydrophobicContact CH2-CG2 4.33Å; W231-T273 HydrophobicContact CZ2-CG2 3.82Å; W231-E275 VanDerWaalsContact CZ2-O 3.27Å; W231-E275 WeakPolarHBondContact CZ2-O 3.44Å; W231-E275 PolarHBondContact NE1-O 3.5Å; W231-E275 VanDerWaalsContact NE1-O 3.08Å; W231-F276 VanDerWaalsContact CE2-C 3.49Å; W231-F276 PolarHBondContact N-O 3.3Å; W231-F276 VanDerWaalsContact N-O 3.09Å; W231-A278 HydrophobicContact CH2-CB 3.86Å; W231-A278 HydrophobicContact CZ3-CB 4.2Å; W231-I293 HydrophobicContact CB-CD1 4.28Å; W231-I293 HydrophobicContact CD2-CD1 3.23Å; W231-I293 HydrophobicContact CE3-CD1 3.57Å; W231-I293 HydrophobicContact CG-CD1 3.58Å; W231-I293 HydrophobicContact CH2-CD1 4.09Å; W231-I293 HydrophobicContact CZ2-CD1 3.83Å; W231-I293 HydrophobicContact CZ3-CD1 3.97Å
232	S	82.7	Confident	74.4	Confident	27 Å²	27	55.6 Å²	55.6	19%	0.189	32%	0.324	C	S	.	.	H	α-helix	trans	-56.9	-38.8	-177.2	61.1	0	0	0	0	113.4	S230 Q234 Y235 Q236 F276	S230-S232 PolarHBondContact OG-OG 2.03Å; S232-Q234 PolarHBondContact O-N 3.39Å; S232-Q234 VanDerWaalsContact O-N 3.1Å; S232-Y235 PolarHBondContact O-N 3.47Å; S232-Q236 WeakPolarHBondContact O-CB 3.14Å; S232-Q236 VanDerWaalsContact O-CG 3.27Å; S232-Q236 WeakPolarHBondContact O-CG 3.34Å; S232-Q236 PolarHBondContact O-N 3Å; S232-F276 PolarHBondContact N-O 2.75Å
233	S	78.2	Confident	74.7	Confident	68 Å²	68	53.4 Å²	53.4	48%	0.476	31%	0.307	S	S	.	.	H	α-helix	trans	-57.2	-30.3	-173.3	58.4	0	0	0	0	114.6	W231	W231-S233 VanDerWaalsContact C-N 3.29Å; W231-S233 PolarHBondContact O-N 3.23Å
234	Q	78.7	Confident	75.5	Confident	42 Å²	42	52.1 Å²	52.1	20%	0.196	30%	0.301	C	S	.	.	H	α-helix	trans	-85.3	-22.6	-179.4	-74.6	165	60.8	0	0	113.2	L214 W231 S232 I238	L214-Q234 PolarHBondContact O-NE2 3.34Å; W231-Q234 PolarHBondContact O-N 3.34Å; S232-Q234 PolarHBondContact O-N 3.39Å; S232-Q234 VanDerWaalsContact O-N 3.1Å; Q234-I238 VanDerWaalsContact O-CD1 3.27Å; Q234-I238 WeakPolarHBondContact O-CD1 3.32Å
235	Y	80.6	Confident	76.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-115.5	-19.5	-169.3	-63	-75.7	0	0	0	113.9	P209 P210 P212 W231 S232 N237 I238 T239 I245 F247 A295	P209-Y235 HydrophobicContact CB-CE1 4.06Å; P210-Y235 HydrophobicContact CG-CE1 3.89Å; P210-Y235 PolarHBondContact O-OH 2.88Å; P212-Y235 WeakPolarHBondContact CD-OH 3.35Å; P212-Y235 WeakPolarHBondContact CG-OH 3.09Å; W231-Y235 WeakPolarHBondContact O-CD2 3.33Å; S232-Y235 PolarHBondContact O-N 3.47Å; Y235-N237 VanDerWaalsContact C-N 3.26Å; Y235-N237 PolarHBondContact O-N 3.37Å; Y235-I238 PolarHBondContact O-N 2.8Å; Y235-T239 VanDerWaalsContact O-CG2 3.25Å; Y235-T239 WeakPolarHBondContact O-CG2 3.31Å; Y235-T239 PolarHBondContact O-N 3.31Å; Y235-I245 HydrophobicContact CD1-CD1 3.91Å; Y235-F247 HydrophobicContact CD1-CE1 4.27Å; Y235-F247 HydrophobicContact CD1-CZ 4.4Å; Y235-F247 AromaticContact CD2-CE1 3.59Å; Y235-F247 HydrophobicContact CD2-CE1 3.59Å; Y235-F247 AromaticContact CD2-CZ 3.82Å; Y235-F247 HydrophobicContact CD2-CZ 3.82Å; Y235-F247 HydrophobicContact CE1-CE1 4.28Å; Y235-F247 AromaticContact CE2-CE1 3.64Å; Y235-F247 HydrophobicContact CE2-CE1 3.64Å; Y235-F247 HydrophobicContact CE2-CZ 4.34Å; Y235-F247 AromaticContact CG-CE1 3.95Å; Y235-F247 HydrophobicContact CG-CE1 3.95Å; Y235-F247 AromaticContact CG-CZ 3.88Å; Y235-F247 HydrophobicContact CG-CZ 3.88Å; Y235-A295 HydrophobicContact CE1-CB 3.73Å; Y235-A295 WeakPolarHBondContact OH-CB 3.44Å
236	Q	68.1	Low	76.9	Confident	110 Å²	110	46.9 Å²	46.9	51%	0.514	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-46	178.5	-85.5	173.3	-3.1	0	0	112.5	S232 I238 T239	S232-Q236 WeakPolarHBondContact O-CB 3.14Å; S232-Q236 VanDerWaalsContact O-CG 3.27Å; S232-Q236 WeakPolarHBondContact O-CG 3.34Å; S232-Q236 PolarHBondContact O-N 3Å; Q236-I238 VanDerWaalsContact C-N 3.32Å; Q236-I238 PolarHBondContact O-N 3.3Å; Q236-T239 PolarHBondContact O-OG1 2.85Å
237	N	65.8	Low	77.5	Confident	151 Å²	151	45.4 Å²	45.4	81%	0.807	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-8.5	-177.7	-65.7	-15.3	0	0	0	114.4	Y235	Y235-N237 VanDerWaalsContact C-N 3.26Å; Y235-N237 PolarHBondContact O-N 3.37Å
238	I	65.9	Low	77.7	Confident	38 Å²	38	45.3 Å²	45.3	20%	0.195	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-13.6	-173.7	-59.1	-176.8	0	0	0	111.4	P210 Q234 Y235 Q236 S240 T241 M242	P210-I238 HydrophobicContact CG-CD1 3.69Å; Q234-I238 VanDerWaalsContact O-CD1 3.27Å; Q234-I238 WeakPolarHBondContact O-CD1 3.32Å; Y235-I238 PolarHBondContact O-N 2.8Å; Q236-I238 VanDerWaalsContact C-N 3.32Å; Q236-I238 PolarHBondContact O-N 3.3Å; I238-S240 VanDerWaalsContact C-N 3.27Å; I238-S240 PolarHBondContact O-N 3.01Å; I238-S240 VanDerWaalsContact O-N 3.11Å; I238-T241 PolarHBondContact O-N 2.79Å; I238-T241 PolarHBondContact O-OG1 3.46Å; I238-M242 HydrophobicContact CG2-CB 3.97Å; I238-M242 HydrophobicContact CG2-CE 3.4Å; I238-M242 HydrophobicContact CG2-CG 3.5Å; I238-M242 HydrophobicContact CG2-SD 3.22Å; I238-M242 WeakPolarHBondContact CG2-SD 3.4Å; I238-M242 PolarHBondContact O-N 3.5Å
239	T	59.6	Low	77.9	Confident	36 Å²	36	40 Å²	40	22%	0.221	23%	0.232	C	C	.	.	H	α-helix	trans	-54.1	-33.7	-173.4	51.1	0	0	0	0	114.6	Y235 Q236 T241 N243 F276	Y235-T239 VanDerWaalsContact O-CG2 3.25Å; Y235-T239 WeakPolarHBondContact O-CG2 3.31Å; Y235-T239 PolarHBondContact O-N 3.31Å; Q236-T239 PolarHBondContact O-OG1 2.85Å; T239-T241 VanDerWaalsContact C-N 3.33Å; T239-T241 PolarHBondContact O-N 2.91Å; T239-N243 WeakPolarHBondContact CA-OD1 3.23Å; T239-N243 VanDerWaalsContact CB-ND2 3.31Å; T239-N243 WeakPolarHBondContact CB-ND2 3.39Å; T239-N243 WeakPolarHBondContact O-CB 3.31Å; T239-N243 PolarHBondContact O-N 2.88Å; T239-N243 PolarHBondContact O-ND2 3.14Å; T239-N243 PolarHBondContact O-OD1 3.35Å; T239-F276 HydrophobicContact CG2-CE1 4.46Å; T239-F276 HydrophobicContact CG2-CZ 3.73Å
240	S	58.7	Low	78	Confident	118 Å²	118	40.2 Å²	40.2	83%	0.825	23%	0.234	S	C	*	.	H	α-helix	trans	-73.7	-19.2	-176.1	-46.7	0	0	0	0	114.8	I238	I238-S240 VanDerWaalsContact C-N 3.27Å; I238-S240 PolarHBondContact O-N 3.01Å; I238-S240 VanDerWaalsContact O-N 3.11Å
241	T	60	Low	78.1	Confident	97 Å²	97	39.6 Å²	39.6	60%	0.595	23%	0.228	S	C	*	.	H	α-helix	trans	-115.8	-21.7	-173.2	58.3	0	0	0	0	114.4	I238 T239	I238-T241 PolarHBondContact O-N 2.79Å; I238-T241 PolarHBondContact O-OG1 3.46Å; T239-T241 VanDerWaalsContact C-N 3.33Å; T239-T241 PolarHBondContact O-N 2.91Å
242	M	67	Low	78.3	Confident	20 Å²	20	40.4 Å²	40.4	10%	0.099	23%	0.231	C	C	.	.	H	α-helix	trans	-116.5	-6.2	-175.8	-54.3	-168.6	-164.7	0	0	114	K206 P209 I238 I245	K206-M242 WeakPolarHBondContact O-CE 3.14Å; P209-M242 VanDerWaalsContact CA-SD 3.6Å; P209-M242 HydrophobicContact CB-SD 4.39Å; I238-M242 HydrophobicContact CG2-CB 3.97Å; I238-M242 HydrophobicContact CG2-CE 3.4Å; I238-M242 HydrophobicContact CG2-CG 3.5Å; I238-M242 HydrophobicContact CG2-SD 3.22Å; I238-M242 WeakPolarHBondContact CG2-SD 3.4Å; I238-M242 PolarHBondContact O-N 3.5Å; M242-I245 HydrophobicContact CB-CD1 4.31Å
243	N	72.5	Confident	78.8	Confident	79 Å²	79	41.5 Å²	41.5	42%	0.422	23%	0.234	S	C	.	.			trans	-67.2	148	179.9	-82.6	-2	0	0	0	112	T239	T239-N243 WeakPolarHBondContact CA-OD1 3.23Å; T239-N243 VanDerWaalsContact CB-ND2 3.31Å; T239-N243 WeakPolarHBondContact CB-ND2 3.39Å; T239-N243 WeakPolarHBondContact O-CB 3.31Å; T239-N243 PolarHBondContact O-N 2.88Å; T239-N243 PolarHBondContact O-ND2 3.14Å; T239-N243 PolarHBondContact O-OD1 3.35Å
244	P	85.1	Confident	79.5	Confident	17 Å²	17	38.2 Å²	38.2	11%	0.11	21%	0.212	C	C	.	.	S	Bend	cis	-82	145.1	1.5	32.7	-35.7	0	0	0	113	A56 L59 R60	A56-P244 HydrophobicContact CB-CG 4.32Å; A56-P244 WeakPolarHBondContact O-CG 3.47Å; L59-P244 HydrophobicContact CB-CB 3.65Å; L59-P244 HydrophobicContact CB-CG 3.72Å; L59-P244 HydrophobicContact CD1-CB 3.94Å; L59-P244 HydrophobicContact CG-CB 4.43Å; R60-P244 HydrophobicContact CB-CG 3.75Å
245	I	87.2	Confident	80.2	Confident	6 Å²	6	38.8 Å²	38.8	3%	0.031	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	128.4	174.7	-59	174.8	0	0	0	108.3	P209 Y235 M242 F247 A295 V296	P209-I245 HydrophobicContact CB-CD1 4.33Å; Y235-I245 HydrophobicContact CD1-CD1 3.91Å; M242-I245 HydrophobicContact CB-CD1 4.31Å; I245-F247 HydrophobicContact CB-CE2 4.49Å; I245-F247 HydrophobicContact CB-CZ 4.27Å; I245-F247 HydrophobicContact CG2-CD1 4.18Å; I245-F247 HydrophobicContact CG2-CE1 3.71Å; I245-F247 HydrophobicContact CG2-CE2 4.1Å; I245-F247 HydrophobicContact CG2-CZ 3.66Å; I245-A295 HydrophobicContact CG2-CB 3.9Å; I245-V296 CarbonylContact C-O 3.59Å; I245-V296 WeakPolarHBondContact CA-O 3.2Å
246	V	89.8	Confident	80.8	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.018	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	122.4	169.7	177.3	0	0	0	0	108.2	A52 K55 A56 L59 M272 V296	A52-V246 HydrophobicContact CB-CB 4.34Å; A52-V246 HydrophobicContact CB-CG1 3.94Å; K55-V246 HydrophobicContact CB-CG2 4.2Å; A56-V246 HydrophobicContact CB-CG2 3.93Å; L59-V246 HydrophobicContact CD1-CG2 3.9Å; V246-M272 HydrophobicContact CG1-CG 3.32Å; V246-M272 HydrophobicContact CG1-SD 3.85Å; V246-V296 PolarHBondContact N-O 2.69Å; V246-V296 WeakPolarHBondContact O-CB 3.36Å; V246-V296 PolarHBondContact O-N 2.91Å
247	F	91	Very high	81.9	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	141.1	175.1	-59.1	-75.3	0	0	0	111	W231 Y235 I245 M272 T273 E275 F276 I293 A294 A295	W231-F247 AromaticContact CD1-CD1 3.73Å; W231-F247 AromaticContact CD1-CE1 3.58Å; W231-F247 AromaticContact CD1-CE2 3.92Å; W231-F247 AromaticContact CD1-CG 3.97Å; W231-F247 AromaticContact CD1-CZ 3.68Å; W231-F247 HydrophobicContact CZ2-CB 4.28Å; W231-F247 HydrophobicContact CZ2-CG 4.44Å; W231-F247 AromaticContact NE1-CD1 3.54Å; W231-F247 AromaticContact NE1-CD2 3.24Å; W231-F247 AromaticContact NE1-CE1 3.75Å; W231-F247 AromaticContact NE1-CE2 3.46Å; W231-F247 AromaticContact NE1-CG 3.28Å; W231-F247 VanDerWaalsContact NE1-CG 3.28Å; W231-F247 AromaticContact NE1-CZ 3.72Å; Y235-F247 HydrophobicContact CD1-CE1 4.27Å; Y235-F247 HydrophobicContact CD1-CZ 4.4Å; Y235-F247 AromaticContact CD2-CE1 3.59Å; Y235-F247 HydrophobicContact CD2-CE1 3.59Å; Y235-F247 AromaticContact CD2-CZ 3.82Å; Y235-F247 HydrophobicContact CD2-CZ 3.82Å; Y235-F247 HydrophobicContact CE1-CE1 4.28Å; Y235-F247 AromaticContact CE2-CE1 3.64Å; Y235-F247 HydrophobicContact CE2-CE1 3.64Å; Y235-F247 HydrophobicContact CE2-CZ 4.34Å; Y235-F247 AromaticContact CG-CE1 3.95Å; Y235-F247 HydrophobicContact CG-CE1 3.95Å; Y235-F247 AromaticContact CG-CZ 3.88Å; Y235-F247 HydrophobicContact CG-CZ 3.88Å; I245-F247 HydrophobicContact CB-CE2 4.49Å; I245-F247 HydrophobicContact CB-CZ 4.27Å; I245-F247 HydrophobicContact CG2-CD1 4.18Å; I245-F247 HydrophobicContact CG2-CE1 3.71Å; I245-F247 HydrophobicContact CG2-CE2 4.1Å; I245-F247 HydrophobicContact CG2-CZ 3.66Å; F247-M272 CarbonylContact O-C 3.56Å; F247-M272 VanDerWaalsContact O-CA 3.28Å; F247-M272 WeakPolarHBondContact O-CA 2.99Å; F247-T273 WeakPolarHBondContact CA-O 3.23Å; F247-T273 HydrophobicContact CB-CG2 4.39Å; F247-T273 WeakPolarHBondContact CB-O 3.4Å; F247-T273 PolarHBondContact N-O 3.15Å; F247-T273 PolarHBondContact O-N 3.38Å; F247-E275 VanDerWaalsContact CD2-O 3.27Å; F247-E275 WeakPolarHBondContact CD2-O 3.5Å; F247-F276 AromaticContact CE2-CD1 3.81Å; F247-F276 HydrophobicContact CE2-CD1 3.81Å; F247-F276 AromaticContact CE2-CE1 3.83Å; F247-F276 HydrophobicContact CE2-CE1 3.83Å; F247-F276 AromaticContact CZ-CD1 3.87Å; F247-F276 HydrophobicContact CZ-CD1 3.87Å; F247-F276 AromaticContact CZ-CE1 3.76Å; F247-F276 HydrophobicContact CZ-CE1 3.76Å; F247-I293 HydrophobicContact CB-CD1 4.01Å; F247-I293 HydrophobicContact CB-CG1 4.26Å; F247-I293 HydrophobicContact CD1-CD1 4Å; F247-I293 HydrophobicContact CD1-CG1 4.42Å; F247-I293 HydrophobicContact CG-CD1 4.24Å; F247-A294 CarbonylContact C-O 3.57Å; F247-A294 VanDerWaalsContact CA-O 3.26Å; F247-A294 WeakPolarHBondContact CA-O 3.41Å; F247-A295 HydrophobicContact CD1-CB 3.98Å; F247-A295 HydrophobicContact CE1-CB 3.85Å
248	I	91.1	Very high	83.1	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	109.7	174.6	-46.9	-177.3	0	0	0	107.4	L48 F49 A52 Q250 T269 M272 I293 A294 V296 F304	L48-I248 HydrophobicContact CD1-CD1 4.43Å; L48-I248 HydrophobicContact CD1-CG2 4.27Å; L48-I248 HydrophobicContact CD2-CG2 3.9Å; L48-I248 HydrophobicContact CG-CD1 3.92Å; L48-I248 HydrophobicContact CG-CG2 4.16Å; F49-I248 HydrophobicContact CD1-CD1 3.84Å; F49-I248 HydrophobicContact CE1-CD1 4.22Å; A52-I248 HydrophobicContact CB-CD1 3.56Å; A52-I248 HydrophobicContact CB-CG1 3.99Å; I248-Q250 HydrophobicContact CG2-CG 4.49Å; I248-T269 HydrophobicContact CG2-CG2 4Å; I248-M272 HydrophobicContact CD1-CE 4Å; I248-M272 HydrophobicContact CG1-CE 4.1Å; I248-M272 HydrophobicContact CG1-CG 4.43Å; I248-I293 CarbonylContact O-C 3.5Å; I248-I293 VanDerWaalsContact O-CA 3.25Å; I248-I293 WeakPolarHBondContact O-CA 3.45Å; I248-A294 HydrophobicContact CB-CB 4.39Å; I248-A294 PolarHBondContact N-O 3.32Å; I248-A294 PolarHBondContact O-N 3.15Å; I248-V296 HydrophobicContact CD1-CG2 3.86Å; I248-V296 HydrophobicContact CG1-CG2 4.14Å; I248-F304 HydrophobicContact CB-CE1 4.07Å; I248-F304 HydrophobicContact CB-CZ 4.36Å; I248-F304 HydrophobicContact CG2-CE1 3.99Å; I248-F304 HydrophobicContact CG2-CZ 4.02Å
249	L	91.1	Very high	84.3	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	126.1	175.4	-176	65.6	0	0	0	108.9	L229 L270 I271 A278 L280 F291 I293	L229-L249 HydrophobicContact CD1-CD1 4.13Å; L229-L249 HydrophobicContact CD1-CD2 4.09Å; L249-L270 HydrophobicContact CD2-CD2 3.94Å; L249-L270 HydrophobicContact CG-CD2 4.35Å; L249-L270 WeakPolarHBondContact O-CB 3.18Å; L249-L270 PolarHBondContact O-N 2.89Å; L249-I271 HydrophobicContact CB-CG2 3.65Å; L249-I271 HydrophobicContact CD2-CG2 3.82Å; L249-I271 HydrophobicContact CG-CG2 4.29Å; L249-I271 PolarHBondContact N-O 2.77Å; L249-I271 PolarHBondContact O-N 3.24Å; L249-A278 HydrophobicContact CD2-CB 4Å; L249-L280 HydrophobicContact CD2-CD2 4.48Å; L249-F291 HydrophobicContact CD1-CB 4.2Å; L249-I293 HydrophobicContact CD1-CB 4.34Å
250	Q	90.9	Very high	85.8	Confident	7 Å²	7	37.5 Å²	37.5	3%	0.033	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	152.3	175.6	-74.1	-172.2	-24.4	0	0	111.2	I248 W267 K268 F291 R292 F304	I248-Q250 HydrophobicContact CG2-CG 4.49Å; Q250-W267 HydrophobicContact CB-CE3 3.92Å; Q250-K268 CarbonylContact C-O 3.53Å; Q250-K268 WeakPolarHBondContact CA-O 3.21Å; Q250-K268 WeakPolarHBondContact CB-O 3.47Å; Q250-F291 VanDerWaalsContact O-CA 3.28Å; Q250-F291 WeakPolarHBondContact O-CA 3.36Å; Q250-R292 HydrophobicContact CB-CG 3.96Å; Q250-R292 PolarHBondContact N-O 2.06Å; Q250-R292 PolarHBondContact O-N 3.06Å; Q250-F304 HydrophobicContact CB-CE1 4.33Å; Q250-F304 VanDerWaalsContact CD-CE1 3.49Å; Q250-F304 HydrophobicContact CG-CE1 3.66Å; Q250-F304 HydrophobicContact CG-CZ 3.86Å
251	I	90.4	Very high	87.3	Confident	11 Å²	11	38 Å²	38	6%	0.056	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	146.1	178.8	-166	172.5	0	0	0	110.5	K268 L270 Y289 Q290 F291 P683	I251-K268 HydrophobicContact CG2-CB 4.4Å; I251-K268 PolarHBondContact N-O 3.33Å; I251-K268 PolarHBondContact O-N 3.1Å; I251-L270 HydrophobicContact CB-CB 4.32Å; I251-L270 HydrophobicContact CB-CD2 4.34Å; I251-L270 HydrophobicContact CD1-CD2 4.42Å; I251-L270 HydrophobicContact CG2-CB 4.12Å; I251-L270 HydrophobicContact CG2-CD1 4.26Å; I251-Y289 HydrophobicContact CD1-CD1 3.63Å; I251-Y289 HydrophobicContact CD1-CE1 4.41Å; I251-Y289 HydrophobicContact CD1-CG 4.44Å; I251-Y289 HydrophobicContact CG1-CD1 4.33Å; I251-Q290 CarbonylContact C-O 3.59Å; I251-Q290 WeakPolarHBondContact CA-O 3.43Å; I251-F291 HydrophobicContact CB-CD1 4.19Å; I251-F291 HydrophobicContact CB-CE1 4.24Å; I251-F291 HydrophobicContact CD1-CD1 4.23Å; I251-F291 HydrophobicContact CD1-CE1 3.44Å; I251-F291 VanDerWaalsContact CD1-CE1 3.44Å; I251-F291 HydrophobicContact CD1-CZ 4.1Å; I251-F291 HydrophobicContact CG1-CD1 3.93Å; I251-F291 HydrophobicContact CG1-CE1 3.63Å; I251-F291 HydrophobicContact CG1-CZ 4.42Å; I251-P683 HydrophobicContact CD1-CG 3.44Å; I251-P683 VanDerWaalsContact CD1-CG 3.44Å
252	R	90.9	Very high	88.7	Confident	19 Å²	19	37.7 Å²	37.7	7%	0.072	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	153.7	161.4	65.6	177	-178.5	-176	1	110.6	F259 E261 A264 S265 W267 Y289 Q290	R252-F259 HydrophobicContact CG-CZ 4.49Å; R252-E261 IonicContact CZ-OE1 2.7Å; R252-E261 VanDerWaalsContact CZ-OE1 3.24Å; R252-E261 IonicContact NH1-OE1 2.81Å; R252-E261 PolarHBondContact NH1-OE1 3.39Å; R252-E261 VanDerWaalsContact NH2-CD 3.29Å; R252-E261 IonicContact NH2-OE1 3.16Å; R252-E261 PolarHBondContact NH2-OE1 3.1Å; R252-E261 IonicContact NH2-OE2 3.16Å; R252-A264 HydrophobicContact CG-CB 4.5Å; R252-S265 WeakPolarHBondContact CA-OG 2.82Å; R252-S265 WeakPolarHBondContact CB-O 3.49Å; R252-W267 HydrophobicContact CB-CD2 4.18Å; R252-W267 HydrophobicContact CB-CE3 4.01Å; R252-W267 HydrophobicContact CB-CZ3 4.31Å; R252-W267 HydrophobicContact CG-CD2 4.14Å; R252-W267 HydrophobicContact CG-CE3 3.97Å; R252-W267 HydrophobicContact CG-CH2 3.85Å; R252-W267 HydrophobicContact CG-CZ2 4.01Å; R252-W267 HydrophobicContact CG-CZ3 3.82Å; R252-W267 VanDerWaalsContact NE-CZ2 3.35Å; R252-Y289 WeakPolarHBondContact O-CA 3.48Å; R252-Q290 HydrophobicContact CG-CB 3.89Å; R252-Q290 PolarHBondContact N-O 3.48Å; R252-Q290 PolarHBondContact O-N 3.48Å
253	I	91.7	Very high	89.8	Confident	49 Å²	49	42.5 Å²	42.5	25%	0.251	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	133.8	-169.5	-52.1	176.7	0	0	0	109.3	A264 S265 R287 L288 Y289	I253-A264 CarbonylContact O-C 3.52Å; I253-A264 WeakPolarHBondContact O-CA 3.12Å; I253-S265 PolarHBondContact N-OG 2.88Å; I253-S265 PolarHBondContact O-N 3.43Å; I253-R287 HydrophobicContact CG2-CB 4.01Å; I253-R287 HydrophobicContact CG2-CG 4.05Å; I253-L288 CarbonylContact C-O 3.45Å; I253-L288 WeakPolarHBondContact CA-O 3.24Å; I253-Y289 HydrophobicContact CD1-CD1 4.31Å; I253-Y289 HydrophobicContact CD1-CE1 3.97Å; I253-Y289 HydrophobicContact CG1-CD1 3.85Å; I253-Y289 HydrophobicContact CG1-CE1 3.98Å; I253-Y289 HydrophobicContact CG2-CD1 4.45Å; I253-Y289 HydrophobicContact CG2-CE1 4.25Å
254	C	93.5	Very high	90.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	125.8	173	-161.5	0	0	0	0	108.7	C256 F259 D260 A264 R287 L288	C254-C256 HydrophobicContact CB-CB 3.96Å; C254-C256 WeakPolarHBondContact CB-SG 3.45Å; C254-C256 PolarHBondContact O-N 3.24Å; C254-C256 VanDerWaalsContact O-N 3.08Å; C254-C256 WeakPolarHBondContact SG-CB 3.37Å; C254-C256 CovalentContact SG-SG 2.04Å; C254-C256 PolarHBondContact SG-SG 3.46Å; C254-F259 HydrophobicContact CB-CD2 3.73Å; C254-F259 HydrophobicContact CB-CE2 3.76Å; C254-D260 PolarHBondContact SG-N 3.39Å; C254-D260 PolarHBondContact SG-O 3.29Å; C254-A264 HydrophobicContact CB-CB 4.49Å; C254-R287 WeakPolarHBondContact O-CA 3.44Å; C254-L288 HydrophobicContact CB-CB 4.28Å; C254-L288 PolarHBondContact N-O 2.66Å; C254-L288 PolarHBondContact O-N 2.88Å
255	I	93.1	Very high	90.9	Very high	54 Å²	54	40.9 Å²	40.9	28%	0.277	22%	0.215	S	C	.	.			trans	-85.4	71.5	173	-60.6	165.9	0	0	0	108.4	G286 R287 L354 P355 H416	I255-G286 CarbonylContact C-O 3.57Å; I255-G286 WeakPolarHBondContact CA-O 3.48Å; I255-R287 HydrophobicContact CG1-CG 4.2Å; I255-L354 HydrophobicContact CG2-CD1 3.76Å; I255-L354 HydrophobicContact CG2-CD2 3.55Å; I255-L354 HydrophobicContact CG2-CG 4.2Å; I255-P355 HydrophobicContact CD1-CG 3.97Å; I255-H416 WeakPolarHBondContact O-CB 3.33Å; I255-H416 PolarHBondContact O-N 2.97Å; I255-H416 VanDerWaalsContact O-N 3.1Å
256	C	93.2	Very high	91	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.007	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-142.8	147	-160.9	-46.1	0	0	0	0	111	C254 V258 G286 L288 W415 H416	C254-C256 HydrophobicContact CB-CB 3.96Å; C254-C256 WeakPolarHBondContact CB-SG 3.45Å; C254-C256 PolarHBondContact O-N 3.24Å; C254-C256 VanDerWaalsContact O-N 3.08Å; C254-C256 WeakPolarHBondContact SG-CB 3.37Å; C254-C256 CovalentContact SG-SG 2.04Å; C254-C256 PolarHBondContact SG-SG 3.46Å; C256-V258 WeakPolarHBondContact CB-O 3.35Å; C256-G286 PolarHBondContact N-O 3.03Å; C256-L288 HydrophobicContact CB-CD1 4.35Å; C256-L288 WeakPolarHBondContact O-CD1 3.49Å; C256-W415 VanDerWaalsContact C-NE1 3.3Å; C256-W415 PolarHBondContact O-NE1 2.91Å; C256-H416 HydrophobicContact CB-CB 4.18Å
257	Q	90.9	Very high	90.9	Very high	88 Å²	88	47.8 Å²	47.8	41%	0.411	25%	0.252	S	S	.	.	S	Bend	trans	-74.2	-40.4	170.2	-176.1	-179.2	4.9	0	0	111.2	W415 H416 G417	Q257-W415 HydrophobicContact CB-CH2 3.91Å; Q257-W415 HydrophobicContact CB-CZ2 3.76Å; Q257-W415 HydrophobicContact CB-CZ3 4.44Å; Q257-W415 HydrophobicContact CG-CH2 3.86Å; Q257-W415 HydrophobicContact CG-CZ2 4.12Å; Q257-W415 HydrophobicContact CG-CZ3 4.5Å; Q257-H416 PolarHBondContact N-O 3.19Å; Q257-G417 PolarHBondContact OE1-O 3.34Å
258	V	91.6	Very high	90.8	Very high	111 Å²	111	53.9 Å²	53.9	67%	0.673	28%	0.278	S	S	*	.	S	Bend	trans	-121.4	138.7	172.7	-179.8	0	0	0	0	107.2	C256 D260	C256-V258 WeakPolarHBondContact CB-O 3.35Å; V258-D260 PolarHBondContact O-N 2.86Å
259	F	90.9	Very high	90.6	Very high	50 Å²	50	56.6 Å²	56.6	22%	0.219	30%	0.295	C	S	.	.			trans	-64.5	120.5	-176.4	-170.2	-91.4	0	0	0	110.7	R252 C254 E261 A264 L288 Q290 A310	R252-F259 HydrophobicContact CG-CZ 4.49Å; C254-F259 HydrophobicContact CB-CD2 3.73Å; C254-F259 HydrophobicContact CB-CE2 3.76Å; F259-E261 HydrophobicContact CE1-CB 4.37Å; F259-A264 HydrophobicContact CE2-CB 4.37Å; F259-A264 HydrophobicContact CZ-CB 3.91Å; F259-L288 HydrophobicContact CB-CD1 3.96Å; F259-L288 HydrophobicContact CD2-CB 3.98Å; F259-L288 VanDerWaalsContact N-CD1 3.29Å; F259-Q290 VanDerWaalsContact CE1-OE1 3.29Å; F259-Q290 HydrophobicContact CE2-CB 3.96Å; F259-Q290 HydrophobicContact CZ-CB 3.96Å; F259-A310 HydrophobicContact CB-CB 3.49Å; F259-A310 VanDerWaalsContact CB-CB 3.49Å; F259-A310 HydrophobicContact CD1-CB 4.47Å; F259-A310 HydrophobicContact CD2-CB 3.47Å; F259-A310 VanDerWaalsContact CD2-CB 3.47Å; F259-A310 HydrophobicContact CE2-CB 4.33Å; F259-A310 HydrophobicContact CG-CB 3.55Å
260	D	91	Very high	90.3	Very high	57 Å²	57	57 Å²	57	31%	0.305	30%	0.298	S	S	.	.			trans	-122.8	119.4	173.1	-173.4	-24.5	0	0	0	108.3	C254 V258 S262 Y263 A264 H416	C254-D260 PolarHBondContact SG-N 3.39Å; C254-D260 PolarHBondContact SG-O 3.29Å; V258-D260 PolarHBondContact O-N 2.86Å; D260-S262 PolarHBondContact O-N 2.99Å; D260-S262 WeakPolarHBondContact OD1-CB 3.27Å; D260-S262 PolarHBondContact OD1-N 2.78Å; D260-S262 PolarHBondContact OD1-OG 3.12Å; D260-S262 PolarHBondContact OD2-OG 2.98Å; D260-Y263 HydrophobicContact CB-CD2 4.05Å; D260-Y263 PolarHBondContact O-N 3.5Å; D260-Y263 VanDerWaalsContact O-N 3.15Å; D260-A264 PolarHBondContact O-N 3.39Å; D260-H416 IonicContact OD2-NE2 2.84Å
261	E	89.8	Confident	90.1	Very high	128 Å²	128	57.5 Å²	57.5	60%	0.598	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-61.8	-27.1	-178.6	179.4	157.4	-144.5	0	0	112.9	R252 F259 Y263 A264	R252-E261 IonicContact CZ-OE1 2.7Å; R252-E261 VanDerWaalsContact CZ-OE1 3.24Å; R252-E261 IonicContact NH1-OE1 2.81Å; R252-E261 PolarHBondContact NH1-OE1 3.39Å; R252-E261 VanDerWaalsContact NH2-CD 3.29Å; R252-E261 IonicContact NH2-OE1 3.16Å; R252-E261 PolarHBondContact NH2-OE1 3.1Å; R252-E261 IonicContact NH2-OE2 3.16Å; F259-E261 HydrophobicContact CE1-CB 4.37Å; E261-Y263 VanDerWaalsContact C-N 3.27Å; E261-Y263 PolarHBondContact O-N 3.33Å; E261-A264 WeakPolarHBondContact O-CB 3.29Å; E261-A264 PolarHBondContact O-N 3.15Å
262	S	89.8	Confident	89.9	Confident	91 Å²	91	57.7 Å²	57.7	64%	0.636	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-69.5	-23.9	178.1	67.1	0	0	0	0	113.6	D260	D260-S262 PolarHBondContact O-N 2.99Å; D260-S262 WeakPolarHBondContact OD1-CB 3.27Å; D260-S262 PolarHBondContact OD1-N 2.78Å; D260-S262 PolarHBondContact OD1-OG 3.12Å; D260-S262 PolarHBondContact OD2-OG 2.98Å
263	Y	89.8	Confident	89.7	Confident	122 Å²	122	57 Å²	57	48%	0.478	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-103.7	3.5	176.6	-67.7	-88.1	0	0	0	112.8	D260 E261 H416	D260-Y263 HydrophobicContact CB-CD2 4.05Å; D260-Y263 PolarHBondContact O-N 3.5Å; D260-Y263 VanDerWaalsContact O-N 3.15Å; E261-Y263 VanDerWaalsContact C-N 3.27Å; E261-Y263 PolarHBondContact O-N 3.33Å; Y263-H416 AromaticContact CD2-CD2 3.97Å; Y263-H416 AromaticContact CD2-CE1 3.63Å; Y263-H416 AromaticContact CD2-CG 3.98Å; Y263-H416 AromaticContact CD2-ND1 3.79Å; Y263-H416 AromaticContact CD2-NE2 3.78Å; Y263-H416 AromaticContact CE1-ND1 3.86Å; Y263-H416 AromaticContact CE2-CE1 3.13Å; Y263-H416 WeakPolarHBondContact CE2-CE1 3.37Å; Y263-H416 AromaticContact CE2-ND1 3.48Å; Y263-H416 WeakPolarHBondContact CE2-ND1 3.42Å; Y263-H416 AromaticContact CE2-NE2 3.69Å; Y263-H416 AromaticContact CZ-CE1 3.54Å; Y263-H416 AromaticContact CZ-ND1 3.5Å
264	A	90.8	Very high	89.3	Confident	21 Å²	21	57 Å²	57	17%	0.174	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-78.5	144.2	177.5	0	0	0	0	0	111	R252 I253 C254 F259 D260 E261	R252-A264 HydrophobicContact CG-CB 4.5Å; I253-A264 CarbonylContact O-C 3.52Å; I253-A264 WeakPolarHBondContact O-CA 3.12Å; C254-A264 HydrophobicContact CB-CB 4.49Å; F259-A264 HydrophobicContact CE2-CB 4.37Å; F259-A264 HydrophobicContact CZ-CB 3.91Å; D260-A264 PolarHBondContact O-N 3.39Å; E261-A264 WeakPolarHBondContact O-CB 3.29Å; E261-A264 PolarHBondContact O-N 3.15Å
265	S	91.1	Very high	88.9	Confident	40 Å²	40	61.5 Å²	61.5	28%	0.28	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-61.3	162.2	171.6	75	0	0	0	0	111.4	R252 I253	R252-S265 WeakPolarHBondContact CA-OG 2.82Å; R252-S265 WeakPolarHBondContact CB-O 3.49Å; I253-S265 PolarHBondContact N-OG 2.88Å; I253-S265 PolarHBondContact O-N 3.43Å
266	T	89	Confident	88.6	Confident	100 Å²	100	62 Å²	62	61%	0.613	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-58.5	153.7	163.5	54.8	0	0	0	0	110.6	K268	T266-K268 PolarHBondContact O-N 3.14Å
267	W	87.9	Confident	88.2	Confident	54 Å²	54	62.6 Å²	62.6	21%	0.205	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-65.1	130.9	176.1	-70	101.8	0	0	0	110.6	Q250 R252 Q290 R292	Q250-W267 HydrophobicContact CB-CE3 3.92Å; R252-W267 HydrophobicContact CB-CD2 4.18Å; R252-W267 HydrophobicContact CB-CE3 4.01Å; R252-W267 HydrophobicContact CB-CZ3 4.31Å; R252-W267 HydrophobicContact CG-CD2 4.14Å; R252-W267 HydrophobicContact CG-CE3 3.97Å; R252-W267 HydrophobicContact CG-CH2 3.85Å; R252-W267 HydrophobicContact CG-CZ2 4.01Å; R252-W267 HydrophobicContact CG-CZ3 3.82Å; R252-W267 VanDerWaalsContact NE-CZ2 3.35Å; W267-Q290 HydrophobicContact CH2-CB 4.33Å; W267-Q290 HydrophobicContact CH2-CG 4.19Å; W267-Q290 WeakPolarHBondContact CZ3-O 3.16Å; W267-R292 HydrophobicContact CD2-CG 4Å; W267-R292 VanDerWaalsContact CD2-NE 3.26Å; W267-R292 VanDerWaalsContact CE2-CD 3.45Å; W267-R292 HydrophobicContact CE3-CB 4.46Å; W267-R292 HydrophobicContact CE3-CG 3.63Å; W267-R292 HydrophobicContact CH2-CB 3.73Å; W267-R292 HydrophobicContact CH2-CG 3.74Å; W267-R292 HydrophobicContact CZ2-CB 4.3Å; W267-R292 HydrophobicContact CZ2-CG 4.11Å; W267-R292 HydrophobicContact CZ3-CB 3.83Å; W267-R292 HydrophobicContact CZ3-CG 3.49Å; W267-R292 VanDerWaalsContact CZ3-CG 3.49Å
268	K	88	Confident	88	Confident	128 Å²	128	58.4 Å²	58.4	56%	0.557	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.9	139.7	175.7	-65.2	-178.2	-179.4	-179.9	0	109.8	Q250 I251 T266 L270	Q250-K268 CarbonylContact C-O 3.53Å; Q250-K268 WeakPolarHBondContact CA-O 3.21Å; Q250-K268 WeakPolarHBondContact CB-O 3.47Å; I251-K268 HydrophobicContact CG2-CB 4.4Å; I251-K268 PolarHBondContact N-O 3.33Å; I251-K268 PolarHBondContact O-N 3.1Å; T266-K268 PolarHBondContact O-N 3.14Å; K268-L270 PolarHBondContact O-N 3.41Å
269	T	86.8	Confident	87.7	Confident	58 Å²	58	54.7 Å²	54.7	36%	0.356	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	118.9	173	-56.1	0	0	0	0	109.5	L48 I248	L48-T269 HydrophobicContact CD1-CG2 4.25Å; L48-T269 VanDerWaalsContact CD2-OG1 3.23Å; L48-T269 WeakPolarHBondContact CD2-OG1 3.29Å; I248-T269 HydrophobicContact CG2-CG2 4Å
270	L	85.8	Confident	87.5	Confident	9 Å²	9	52.3 Å²	52.3	5%	0.047	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-47.4	178.7	-177.7	61.8	0	0	0	110.6	L249 I251 K268 L280 F291 E682 P683 V684	L249-L270 HydrophobicContact CD2-CD2 3.94Å; L249-L270 HydrophobicContact CG-CD2 4.35Å; L249-L270 WeakPolarHBondContact O-CB 3.18Å; L249-L270 PolarHBondContact O-N 2.89Å; I251-L270 HydrophobicContact CB-CB 4.32Å; I251-L270 HydrophobicContact CB-CD2 4.34Å; I251-L270 HydrophobicContact CD1-CD2 4.42Å; I251-L270 HydrophobicContact CG2-CB 4.12Å; I251-L270 HydrophobicContact CG2-CD1 4.26Å; K268-L270 PolarHBondContact O-N 3.41Å; L270-L280 HydrophobicContact CD2-CD1 4.45Å; L270-L280 HydrophobicContact CD2-CD2 3.75Å; L270-F291 HydrophobicContact CD2-CD1 4.34Å; L270-F291 HydrophobicContact CD2-CE1 4.14Å; L270-E682 HydrophobicContact CD1-CB 3.86Å; L270-E682 HydrophobicContact CD1-CG 4.03Å; L270-P683 HydrophobicContact CD1-CG 4.12Å; L270-P683 HydrophobicContact CD2-CG 4.36Å; L270-V684 HydrophobicContact CD1-CG2 3.59Å; L270-V684 HydrophobicContact CD2-CG2 3.99Å; L270-V684 HydrophobicContact CG-CG2 3.56Å
271	I	85.3	Confident	87.1	Confident	16 Å²	16	52.3 Å²	52.3	8%	0.082	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	145.9	177.7	-176.4	169.1	0	0	0	109.6	L249	L249-I271 HydrophobicContact CB-CG2 3.65Å; L249-I271 HydrophobicContact CD2-CG2 3.82Å; L249-I271 HydrophobicContact CG-CG2 4.29Å; L249-I271 PolarHBondContact N-O 2.77Å; L249-I271 PolarHBondContact O-N 3.24Å
272	M	87	Confident	86.2	Confident	16 Å²	16	47.7 Å²	47.7	8%	0.079	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	124.4	163.2	-173	171.9	-64.9	0	0	105.7	L48 R51 A52 K55 V246 F247 I248 F695	L48-M272 HydrophobicContact CD1-CE 3.6Å; R51-M272 HydrophobicContact CB-CE 4.41Å; A52-M272 HydrophobicContact CB-CE 3.84Å; A52-M272 HydrophobicContact CB-SD 3.81Å; K55-M272 HydrophobicContact CD-SD 3.69Å; V246-M272 HydrophobicContact CG1-CG 3.32Å; V246-M272 HydrophobicContact CG1-SD 3.85Å; F247-M272 CarbonylContact O-C 3.56Å; F247-M272 VanDerWaalsContact O-CA 3.28Å; F247-M272 WeakPolarHBondContact O-CA 2.99Å; I248-M272 HydrophobicContact CD1-CE 4Å; I248-M272 HydrophobicContact CG1-CE 4.1Å; I248-M272 HydrophobicContact CG1-CG 4.43Å; M272-F695 WeakPolarHBondContact O-CD1 3.45Å; M272-F695 WeakPolarHBondContact O-CE1 3.33Å; M272-F695 WeakPolarHBondContact O-CG 3.37Å; M272-F695 WeakPolarHBondContact O-CZ 3.38Å
273	T	86.2	Confident	85.8	Confident	4 Å²	4	44.3 Å²	44.3	3%	0.025	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	151.8	-175.7	-173.4	0	0	0	0	112.5	W231 F247 E275 F695	W231-T273 HydrophobicContact CH2-CG2 4.33Å; W231-T273 HydrophobicContact CZ2-CG2 3.82Å; F247-T273 WeakPolarHBondContact CA-O 3.23Å; F247-T273 HydrophobicContact CB-CG2 4.39Å; F247-T273 WeakPolarHBondContact CB-O 3.4Å; F247-T273 PolarHBondContact N-O 3.15Å; F247-T273 PolarHBondContact O-N 3.38Å; T273-E275 HydrophobicContact CG2-CB 4.37Å; T273-E275 WeakPolarHBondContact OG1-CB 3.18Å; T273-E275 PolarHBondContact OG1-N 2.97Å; T273-F695 WeakPolarHBondContact OG1-CE2 3.49Å
274	H	84.6	Confident	85.6	Confident	50 Å²	50	40.6 Å²	40.6	23%	0.231	21%	0.214	C	C	.	.	S	Bend	trans	-95.8	-2.4	167.7	72.4	-61.4	0	0	0	111.8	L59 I693 F695	L59-H274 HydrophobicContact CD1-CB 3.83Å; H274-I693 WeakPolarHBondContact CE1-CD1 3.46Å; H274-I693 WeakPolarHBondContact ND1-CG2 3.47Å; H274-F695 AromaticContact CE1-CE2 3.99Å; H274-F695 AromaticContact ND1-CE2 3.34Å; H274-F695 VanDerWaalsContact ND1-CE2 3.34Å; H274-F695 WeakPolarHBondContact ND1-CE2 3.37Å; H274-F695 AromaticContact ND1-CZ 3.64Å
275	E	83.7	Confident	85.4	Confident	93 Å²	93	40.4 Å²	40.4	44%	0.435	21%	0.211	S	C	.	.	S	Bend	trans	-73.6	155	175.8	-64.9	-65	163.9	0	0	112.1	W231 F247 T273 G277	W231-E275 VanDerWaalsContact CZ2-O 3.27Å; W231-E275 WeakPolarHBondContact CZ2-O 3.44Å; W231-E275 PolarHBondContact NE1-O 3.5Å; W231-E275 VanDerWaalsContact NE1-O 3.08Å; F247-E275 VanDerWaalsContact CD2-O 3.27Å; F247-E275 WeakPolarHBondContact CD2-O 3.5Å; T273-E275 HydrophobicContact CG2-CB 4.37Å; T273-E275 WeakPolarHBondContact OG1-CB 3.18Å; T273-E275 PolarHBondContact OG1-N 2.97Å; E275-G277 VanDerWaalsContact C-N 3.3Å; E275-G277 PolarHBondContact O-N 2.9Å
276	F	86.5	Confident	85.4	Confident	65 Å²	65	38.5 Å²	38.5	29%	0.285	20%	0.198	S	C	.	.	S	Bend	trans	-89.9	17.9	-178	-65.8	-73.9	0	0	0	114.9	S230 W231 S232 T239 F247	S230-F276 PolarHBondContact OG-O 2.96Å; W231-F276 VanDerWaalsContact CE2-C 3.49Å; W231-F276 PolarHBondContact N-O 3.3Å; W231-F276 VanDerWaalsContact N-O 3.09Å; S232-F276 PolarHBondContact N-O 2.75Å; T239-F276 HydrophobicContact CG2-CE1 4.46Å; T239-F276 HydrophobicContact CG2-CZ 3.73Å; F247-F276 AromaticContact CE2-CD1 3.81Å; F247-F276 HydrophobicContact CE2-CD1 3.81Å; F247-F276 AromaticContact CE2-CE1 3.83Å; F247-F276 HydrophobicContact CE2-CE1 3.83Å; F247-F276 AromaticContact CZ-CD1 3.87Å; F247-F276 HydrophobicContact CZ-CD1 3.87Å; F247-F276 AromaticContact CZ-CE1 3.76Å; F247-F276 HydrophobicContact CZ-CE1 3.76Å
277	G	85.9	Confident	85.5	Confident	14 Å²	14	35.1 Å²	35.1	14%	0.144	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.4	169.9	177.7	0	0	0	0	0	113	L229 E275	L229-G277 CarbonylContact O-C 3.49Å; L229-G277 WeakPolarHBondContact O-CA 3.2Å; E275-G277 VanDerWaalsContact C-N 3.3Å; E275-G277 PolarHBondContact O-N 2.9Å
278	A	86.2	Confident	85.7	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	140	173.5	0	0	0	0	0	109.9	L229 W231 L249 L280	L229-A278 PolarHBondContact N-O 3.14Å; L229-A278 PolarHBondContact O-N 2.64Å; W231-A278 HydrophobicContact CH2-CB 3.86Å; W231-A278 HydrophobicContact CZ3-CB 4.2Å; L249-A278 HydrophobicContact CD2-CB 4Å; A278-L280 HydrophobicContact CB-CD2 4.32Å
279	N	86.5	Confident	85.8	Confident	33 Å²	33	26.8 Å²	26.8	18%	0.176	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	127.4	170.1	-68.5	-24.8	0	0	0	108.2	K228 D685 M688	K228-N279 WeakPolarHBondContact CG-OD1 2.98Å; N279-D685 HydrophobicContact CB-CB 3.66Å; N279-D685 WeakPolarHBondContact O-CB 3.15Å; N279-D685 PolarHBondContact O-N 3.46Å; N279-M688 HydrophobicContact CB-CE 3.81Å; N279-M688 HydrophobicContact CB-CG 4.28Å; N279-M688 VanDerWaalsContact CG-CE 3.44Å; N279-M688 WeakPolarHBondContact ND2-CE 3.28Å
280	L	86.5	Confident	86	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	137	-178	-54.8	-175.1	0	0	0	110.6	I226 I227 L229 L249 L270 A278 F283 F291 P683 V684	I226-L280 CarbonylContact C-O 3.57Å; I226-L280 VanDerWaalsContact CA-O 3.28Å; I226-L280 WeakPolarHBondContact CA-O 3.28Å; I227-L280 PolarHBondContact N-O 2.73Å; I227-L280 PolarHBondContact O-N 3.19Å; L229-L280 HydrophobicContact CD1-CD1 3.49Å; L229-L280 VanDerWaalsContact CD1-CD1 3.49Å; L229-L280 HydrophobicContact CD1-CG 4.32Å; L229-L280 HydrophobicContact CG-CD1 3.89Å; L229-L280 HydrophobicContact CG-CG 4.4Å; L249-L280 HydrophobicContact CD2-CD2 4.48Å; L270-L280 HydrophobicContact CD2-CD1 4.45Å; L270-L280 HydrophobicContact CD2-CD2 3.75Å; A278-L280 HydrophobicContact CB-CD2 4.32Å; L280-F283 HydrophobicContact CB-CZ 3.92Å; L280-F291 HydrophobicContact CD1-CD1 3.85Å; L280-F291 HydrophobicContact CD1-CE1 3.26Å; L280-F291 HydrophobicContact CD1-CE2 4.02Å; L280-F291 HydrophobicContact CD1-CG 4.43Å; L280-F291 HydrophobicContact CD1-CZ 3.37Å; L280-P683 CarbonylContact C-O 3.55Å; L280-P683 WeakPolarHBondContact CA-O 3.24Å; L280-P683 WeakPolarHBondContact CB-O 3.35Å; L280-P683 WeakPolarHBondContact CD2-O 3.03Å; L280-V684 HydrophobicContact CD2-CG2 4.09Å
281	E	81.6	Confident	86.3	Confident	56 Å²	56	24.8 Å²	24.8	26%	0.262	13%	0.126	S	C	.	.			trans	-139.8	178	-177.9	65.8	174.4	174.5	0	0	112.7	N225 I226 P683 D685	N225-E281 WeakPolarHBondContact O-CA 3.36Å; I226-E281 HydrophobicContact CG1-CB 4.19Å; E281-P683 PolarHBondContact N-O 3.3Å; E281-P683 VanDerWaalsContact N-O 3.08Å; E281-P683 CarbonylContact O-C 3.47Å; E281-P683 WeakPolarHBondContact O-CA 3.27Å; E281-P683 WeakPolarHBondContact O-CB 3.18Å; E281-D685 HydrophobicContact CG-CB 4.42Å
282	A	70.8	Confident	86.6	Confident	31 Å²	31	25.6 Å²	25.6	26%	0.256	13%	0.128	S	C	.	.			trans	62.9	48	170	0	0	0	0	0	116.5
283	F	82	Confident	86.8	Confident	20 Å²	20	24.9 Å²	24.9	9%	0.088	12%	0.124	C	C	.	.	P	Polyproline II helix	trans	-71.9	132.8	174.1	-55.5	-73.9	0	0	0	112.7	N225 I227 L280 Y289 F291 Y311 P683	N225-F283 VanDerWaalsContact O-CD2 3.25Å; N225-F283 WeakPolarHBondContact O-CD2 3.37Å; N225-F283 WeakPolarHBondContact O-CE2 3.31Å; I227-F283 HydrophobicContact CB-CZ 4.41Å; I227-F283 HydrophobicContact CD1-CE1 4.08Å; I227-F283 HydrophobicContact CD1-CE2 3.73Å; I227-F283 HydrophobicContact CD1-CZ 3.33Å; I227-F283 HydrophobicContact CG1-CE2 3.71Å; I227-F283 HydrophobicContact CG1-CZ 3.76Å; L280-F283 HydrophobicContact CB-CZ 3.92Å; F283-Y289 HydrophobicContact CB-CD2 4.49Å; F283-Y289 HydrophobicContact CB-CE2 3.9Å; F283-Y289 AromaticContact CD1-CD2 3.48Å; F283-Y289 HydrophobicContact CD1-CD2 3.48Å; F283-Y289 VanDerWaalsContact CD1-CD2 3.48Å; F283-Y289 AromaticContact CD1-CE2 3.55Å; F283-Y289 HydrophobicContact CD1-CE2 3.55Å; F283-Y289 AromaticContact CD1-CG 3.99Å; F283-Y289 HydrophobicContact CD1-CG 3.99Å; F283-Y289 HydrophobicContact CE1-CD2 4.18Å; F283-Y289 HydrophobicContact CE1-CG 4.31Å; F283-Y289 HydrophobicContact CG-CD2 4.39Å; F283-Y289 HydrophobicContact CG-CE2 4.21Å; F283-F291 HydrophobicContact CE1-CZ 4.22Å; F283-Y311 HydrophobicContact CD1-CD1 4.14Å; F283-Y311 HydrophobicContact CD1-CE1 4.07Å; F283-Y311 HydrophobicContact CD2-CD1 4.36Å; F283-Y311 AromaticContact CD2-CE1 3.52Å; F283-Y311 HydrophobicContact CD2-CE1 3.52Å; F283-Y311 HydrophobicContact CE1-CD1 4.04Å; F283-Y311 HydrophobicContact CE1-CE1 4.11Å; F283-Y311 HydrophobicContact CE2-CD1 4.27Å; F283-Y311 AromaticContact CE2-CE1 3.57Å; F283-Y311 HydrophobicContact CE2-CE1 3.57Å; F283-Y311 HydrophobicContact CG-CD1 4.3Å; F283-Y311 AromaticContact CG-CE1 3.78Å; F283-Y311 HydrophobicContact CG-CE1 3.78Å; F283-Y311 HydrophobicContact CZ-CD1 4.12Å; F283-Y311 AromaticContact CZ-CE1 3.88Å; F283-Y311 HydrophobicContact CZ-CE1 3.88Å; F283-P683 HydrophobicContact CE1-CB 4.21Å
284	E	84.4	Confident	87	Confident	44 Å²	44	24.7 Å²	24.7	21%	0.206	12%	0.123	C	C	.	.	P	Polyproline II helix	trans	-90.1	152.3	-175.4	-54	178.5	120.1	0	0	112.4	R287 Y289 H681	E284-R287 PolarHBondContact O-N 3.19Å; E284-R287 WeakPolarHBondContact OE2-CD 3.37Å; E284-R287 IonicContact OE2-CZ 2.79Å; E284-R287 IonicContact OE2-NE 2.86Å; E284-R287 PolarHBondContact OE2-NE 3.24Å; E284-R287 IonicContact OE2-NH1 3.93Å; E284-R287 PolarHBondContact OE2-NH1 2.58Å; E284-R287 IonicContact OE2-NH2 3.69Å; E284-R287 PolarHBondContact OE2-NH2 2.87Å; E284-Y289 PolarHBondContact N-OH 2.95Å; E284-H681 IonicContact OE1-CE1 3.8Å; E284-H681 IonicContact OE1-NE2 3.78Å; E284-H681 IonicContact OE2-NE2 3.89Å
285	P	88.3	Confident	87.3	Confident	17 Å²	17	22.4 Å²	22.4	11%	0.11	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	145.6	174.2	-22.3	33.2	0	0	0	113	R287 I316 P318 D353 V781	P285-R287 PolarHBondContact O-N 3.01Å; P285-R287 PolarHBondContact O-NH1 3.27Å; P285-R287 VanDerWaalsContact O-NH1 3.14Å; P285-I316 CarbonylContact C-O 3.59Å; P285-I316 HydrophobicContact CB-CB 4.35Å; P285-I316 HydrophobicContact CB-CG2 4.22Å; P285-I316 HydrophobicContact CG-CG2 4.43Å; P285-P318 HydrophobicContact CB-CB 4.38Å; P285-D353 HydrophobicContact CB-CB 4.27Å; P285-V781 HydrophobicContact CG-CG2 4.16Å
286	G	89.9	Confident	87.5	Confident	0 Å²	0	18 Å²	18	0%	0	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	6.4	177.3	0	0	0	0	0	115.7	I255 C256 I316 W415	I255-G286 CarbonylContact C-O 3.57Å; I255-G286 WeakPolarHBondContact CA-O 3.48Å; C256-G286 PolarHBondContact N-O 3.03Å; G286-I316 PolarHBondContact N-O 3.35Å; G286-W415 PolarHBondContact O-NE1 3.36Å
287	R	91.6	Very high	87.5	Confident	30 Å²	30	14.9 Å²	14.9	11%	0.113	8%	0.079	C	C	.	.			trans	-113.4	138.5	-178.8	-67.3	-178.3	-172.1	74.8	-19.3	112.1	I253 C254 I255 E284 P285 Y289 D353	I253-R287 HydrophobicContact CG2-CB 4.01Å; I253-R287 HydrophobicContact CG2-CG 4.05Å; C254-R287 WeakPolarHBondContact O-CA 3.44Å; I255-R287 HydrophobicContact CG1-CG 4.2Å; E284-R287 PolarHBondContact O-N 3.19Å; E284-R287 WeakPolarHBondContact OE2-CD 3.37Å; E284-R287 IonicContact OE2-CZ 2.79Å; E284-R287 IonicContact OE2-NE 2.86Å; E284-R287 PolarHBondContact OE2-NE 3.24Å; E284-R287 IonicContact OE2-NH1 3.93Å; E284-R287 PolarHBondContact OE2-NH1 2.58Å; E284-R287 IonicContact OE2-NH2 3.69Å; E284-R287 PolarHBondContact OE2-NH2 2.87Å; P285-R287 PolarHBondContact O-N 3.01Å; P285-R287 PolarHBondContact O-NH1 3.27Å; P285-R287 VanDerWaalsContact O-NH1 3.14Å; R287-Y289 HydrophobicContact CB-CE2 3.81Å; R287-D353 PolarHBondContact NH1-O 3.02Å; R287-D353 PolarHBondContact NH2-O 2.88Å
288	L	91.8	Very high	87.3	Confident	5 Å²	5	14.8 Å²	14.8	3%	0.026	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	134.4	172.1	-68.9	173.8	0	0	0	109.3	I253 C254 C256 F259 A310 Y311 P312 P315	I253-L288 CarbonylContact C-O 3.45Å; I253-L288 WeakPolarHBondContact CA-O 3.24Å; C254-L288 HydrophobicContact CB-CB 4.28Å; C254-L288 PolarHBondContact N-O 2.66Å; C254-L288 PolarHBondContact O-N 2.88Å; C256-L288 HydrophobicContact CB-CD1 4.35Å; C256-L288 WeakPolarHBondContact O-CD1 3.49Å; F259-L288 HydrophobicContact CB-CD1 3.96Å; F259-L288 HydrophobicContact CD2-CB 3.98Å; F259-L288 VanDerWaalsContact N-CD1 3.29Å; L288-A310 HydrophobicContact CB-CB 4.36Å; L288-Y311 CarbonylContact C-O 3.53Å; L288-P312 WeakPolarHBondContact CD2-O 3.13Å; L288-P315 HydrophobicContact CD2-CB 3.95Å; L288-P315 HydrophobicContact CD2-CG 3.89Å; L288-P315 HydrophobicContact CG-CB 4.37Å; L288-P315 HydrophobicContact CG-CG 4.21Å
289	Y	90.9	Very high	87	Confident	1 Å²	1	18.9 Å²	18.9	0%	0.004	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	134.1	-173.5	-57.6	-93	0	0	0	109.7	I251 R252 I253 F283 E284 R287 A310 Y311	I251-Y289 HydrophobicContact CD1-CD1 3.63Å; I251-Y289 HydrophobicContact CD1-CE1 4.41Å; I251-Y289 HydrophobicContact CD1-CG 4.44Å; I251-Y289 HydrophobicContact CG1-CD1 4.33Å; R252-Y289 WeakPolarHBondContact O-CA 3.48Å; I253-Y289 HydrophobicContact CD1-CD1 4.31Å; I253-Y289 HydrophobicContact CD1-CE1 3.97Å; I253-Y289 HydrophobicContact CG1-CD1 3.85Å; I253-Y289 HydrophobicContact CG1-CE1 3.98Å; I253-Y289 HydrophobicContact CG2-CD1 4.45Å; I253-Y289 HydrophobicContact CG2-CE1 4.25Å; F283-Y289 HydrophobicContact CB-CD2 4.49Å; F283-Y289 HydrophobicContact CB-CE2 3.9Å; F283-Y289 AromaticContact CD1-CD2 3.48Å; F283-Y289 HydrophobicContact CD1-CD2 3.48Å; F283-Y289 VanDerWaalsContact CD1-CD2 3.48Å; F283-Y289 AromaticContact CD1-CE2 3.55Å; F283-Y289 HydrophobicContact CD1-CE2 3.55Å; F283-Y289 AromaticContact CD1-CG 3.99Å; F283-Y289 HydrophobicContact CD1-CG 3.99Å; F283-Y289 HydrophobicContact CE1-CD2 4.18Å; F283-Y289 HydrophobicContact CE1-CG 4.31Å; F283-Y289 HydrophobicContact CG-CD2 4.39Å; F283-Y289 HydrophobicContact CG-CE2 4.21Å; E284-Y289 PolarHBondContact N-OH 2.95Å; R287-Y289 HydrophobicContact CB-CE2 3.81Å; Y289-A310 CarbonylContact O-C 3.55Å; Y289-A310 WeakPolarHBondContact O-CA 3.14Å; Y289-Y311 WeakPolarHBondContact CD2-O 3.21Å; Y289-Y311 PolarHBondContact N-O 2.96Å; Y289-Y311 PolarHBondContact O-N 2.84Å
290	Q	91.3	Very high	86.7	Confident	23 Å²	23	17.5 Å²	17.5	11%	0.107	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	139.5	172.7	-160.1	179.8	18.8	0	0	109.9	I251 R252 F259 W267 T308	I251-Q290 CarbonylContact C-O 3.59Å; I251-Q290 WeakPolarHBondContact CA-O 3.43Å; R252-Q290 HydrophobicContact CG-CB 3.89Å; R252-Q290 PolarHBondContact N-O 3.48Å; R252-Q290 PolarHBondContact O-N 3.48Å; F259-Q290 VanDerWaalsContact CE1-OE1 3.29Å; F259-Q290 HydrophobicContact CE2-CB 3.96Å; F259-Q290 HydrophobicContact CZ-CB 3.96Å; W267-Q290 HydrophobicContact CH2-CB 4.33Å; W267-Q290 HydrophobicContact CH2-CG 4.19Å; W267-Q290 WeakPolarHBondContact CZ3-O 3.16Å; Q290-T308 WeakPolarHBondContact CG-O 3.37Å; Q290-T308 PolarHBondContact NE2-O 3.17Å
291	F	91.7	Very high	86.5	Confident	3 Å²	3	18 Å²	18	1%	0.013	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	144.1	-175.7	-53	-81.1	0	0	0	110.8	L215 L229 L249 Q250 I251 L270 L280 F283 G307 T308	L215-F291 HydrophobicContact CD1-CB 4.47Å; L229-F291 HydrophobicContact CD1-CB 4.06Å; L229-F291 HydrophobicContact CD1-CD1 4.15Å; L229-F291 HydrophobicContact CD1-CD2 4.12Å; L229-F291 HydrophobicContact CD1-CG 3.83Å; L249-F291 HydrophobicContact CD1-CB 4.2Å; Q250-F291 VanDerWaalsContact O-CA 3.28Å; Q250-F291 WeakPolarHBondContact O-CA 3.36Å; I251-F291 HydrophobicContact CB-CD1 4.19Å; I251-F291 HydrophobicContact CB-CE1 4.24Å; I251-F291 HydrophobicContact CD1-CD1 4.23Å; I251-F291 HydrophobicContact CD1-CE1 3.44Å; I251-F291 VanDerWaalsContact CD1-CE1 3.44Å; I251-F291 HydrophobicContact CD1-CZ 4.1Å; I251-F291 HydrophobicContact CG1-CD1 3.93Å; I251-F291 HydrophobicContact CG1-CE1 3.63Å; I251-F291 HydrophobicContact CG1-CZ 4.42Å; L270-F291 HydrophobicContact CD2-CD1 4.34Å; L270-F291 HydrophobicContact CD2-CE1 4.14Å; L280-F291 HydrophobicContact CD1-CD1 3.85Å; L280-F291 HydrophobicContact CD1-CE1 3.26Å; L280-F291 HydrophobicContact CD1-CE2 4.02Å; L280-F291 HydrophobicContact CD1-CG 4.43Å; L280-F291 HydrophobicContact CD1-CZ 3.37Å; F283-F291 HydrophobicContact CE1-CZ 4.22Å; F291-G307 CarbonylContact O-C 3.59Å; F291-G307 VanDerWaalsContact O-CA 3.25Å; F291-G307 WeakPolarHBondContact O-CA 3.39Å; F291-T308 HydrophobicContact CB-CG2 4.03Å; F291-T308 PolarHBondContact N-OG1 2.82Å; F291-T308 PolarHBondContact O-N 2.82Å
292	R	90.9	Very high	86.5	Confident	32 Å²	32	18.6 Å²	18.6	12%	0.121	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	153.5	167.3	72.3	-178.4	-178	171.4	1.6	109.5	E45 Q250 W267 F304	E45-R292 IonicContact OE1-CZ 3.73Å; E45-R292 IonicContact OE1-NH1 3.7Å; E45-R292 IonicContact OE1-NH2 2.89Å; E45-R292 PolarHBondContact OE1-NH2 2.79Å; Q250-R292 HydrophobicContact CB-CG 3.96Å; Q250-R292 PolarHBondContact N-O 2.06Å; Q250-R292 PolarHBondContact O-N 3.06Å; W267-R292 HydrophobicContact CD2-CG 4Å; W267-R292 VanDerWaalsContact CD2-NE 3.26Å; W267-R292 VanDerWaalsContact CE2-CD 3.45Å; W267-R292 HydrophobicContact CE3-CB 4.46Å; W267-R292 HydrophobicContact CE3-CG 3.63Å; W267-R292 HydrophobicContact CH2-CB 3.73Å; W267-R292 HydrophobicContact CH2-CG 3.74Å; W267-R292 HydrophobicContact CZ2-CB 4.3Å; W267-R292 HydrophobicContact CZ2-CG 4.11Å; W267-R292 HydrophobicContact CZ3-CB 3.83Å; W267-R292 HydrophobicContact CZ3-CG 3.49Å; W267-R292 VanDerWaalsContact CZ3-CG 3.49Å; R292-F304 HydrophobicContact CG-CB 4.13Å; R292-F304 HydrophobicContact CG-CD1 3.82Å; R292-F304 HydrophobicContact CG-CG 4.16Å
293	I	91.7	Very high	87.1	Confident	2 Å²	2	17.3 Å²	17.3	1%	0.01	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	145.5	-177.2	-168.3	172.7	0	0	0	110.6	P212 L215 W231 F247 I248 L249 F304 G305	P212-I293 HydrophobicContact CB-CG2 3.36Å; P212-I293 HydrophobicContact CG-CG2 3.62Å; P212-I293 WeakPolarHBondContact CG-O 3.33Å; L215-I293 HydrophobicContact CD1-CB 3.96Å; L215-I293 HydrophobicContact CD1-CG2 3.66Å; L215-I293 HydrophobicContact CD2-CB 4.11Å; L215-I293 HydrophobicContact CD2-CD1 4.18Å; L215-I293 HydrophobicContact CD2-CG2 3.75Å; L215-I293 HydrophobicContact CG-CB 4.31Å; L215-I293 HydrophobicContact CG-CG2 3.64Å; W231-I293 HydrophobicContact CB-CD1 4.28Å; W231-I293 HydrophobicContact CD2-CD1 3.23Å; W231-I293 HydrophobicContact CE3-CD1 3.57Å; W231-I293 HydrophobicContact CG-CD1 3.58Å; W231-I293 HydrophobicContact CH2-CD1 4.09Å; W231-I293 HydrophobicContact CZ2-CD1 3.83Å; W231-I293 HydrophobicContact CZ3-CD1 3.97Å; F247-I293 HydrophobicContact CB-CD1 4.01Å; F247-I293 HydrophobicContact CB-CG1 4.26Å; F247-I293 HydrophobicContact CD1-CD1 4Å; F247-I293 HydrophobicContact CD1-CG1 4.42Å; F247-I293 HydrophobicContact CG-CD1 4.24Å; I248-I293 CarbonylContact O-C 3.5Å; I248-I293 VanDerWaalsContact O-CA 3.25Å; I248-I293 WeakPolarHBondContact O-CA 3.45Å; L249-I293 HydrophobicContact CD1-CB 4.34Å; I293-F304 CarbonylContact O-C 3.52Å; I293-F304 WeakPolarHBondContact O-CA 3.38Å; I293-G305 PolarHBondContact O-N 3.03Å
294	A	90.5	Very high	87.3	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	147.5	166	0	0	0	0	0	109.4	F49 F247 I248 F304	F49-A294 HydrophobicContact CE1-CB 3.88Å; F247-A294 CarbonylContact C-O 3.57Å; F247-A294 VanDerWaalsContact CA-O 3.26Å; F247-A294 WeakPolarHBondContact CA-O 3.41Å; I248-A294 HydrophobicContact CB-CB 4.39Å; I248-A294 PolarHBondContact N-O 3.32Å; I248-A294 PolarHBondContact O-N 3.15Å; A294-F304 HydrophobicContact CB-CD1 3.55Å; A294-F304 HydrophobicContact CB-CE1 3.67Å; A294-F304 HydrophobicContact CB-CG 3.98Å; A294-F304 HydrophobicContact CB-CZ 4.21Å
295	A	90	Very high	87.3	Confident	1 Å²	1	15 Å²	15	1%	0.008	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	130.3	170.1	0	0	0	0	0	108.8	P209 P212 Y235 I245 F247 T301	P209-A295 HydrophobicContact CB-CB 3.78Å; P209-A295 HydrophobicContact CG-CB 3.9Å; P209-A295 WeakPolarHBondContact CG-O 3.22Å; P212-A295 HydrophobicContact CG-CB 4.47Å; Y235-A295 HydrophobicContact CE1-CB 3.73Å; Y235-A295 WeakPolarHBondContact OH-CB 3.44Å; I245-A295 HydrophobicContact CG2-CB 3.9Å; F247-A295 HydrophobicContact CD1-CB 3.98Å; F247-A295 HydrophobicContact CE1-CB 3.85Å; A295-T301 VanDerWaalsContact O-CB 3.28Å; A295-T301 WeakPolarHBondContact O-CB 3.4Å; A295-T301 PolarHBondContact O-OG1 3.08Å
296	V	88.7	Confident	87.2	Confident	1 Å²	1	20 Å²	20	1%	0.006	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	121.1	-176.1	-169.6	0	0	0	0	108.9	F49 A52 R53 I245 V246 I248 T301	F49-V296 HydrophobicContact CD1-CG2 4.08Å; A52-V296 HydrophobicContact CB-CB 3.88Å; A52-V296 HydrophobicContact CB-CG1 3.97Å; A52-V296 HydrophobicContact CB-CG2 3.83Å; R53-V296 HydrophobicContact CB-CG1 3.98Å; I245-V296 CarbonylContact C-O 3.59Å; I245-V296 WeakPolarHBondContact CA-O 3.2Å; V246-V296 PolarHBondContact N-O 2.69Å; V246-V296 WeakPolarHBondContact O-CB 3.36Å; V246-V296 PolarHBondContact O-N 2.91Å; I248-V296 HydrophobicContact CD1-CG2 3.86Å; I248-V296 HydrophobicContact CG1-CG2 4.14Å; V296-T301 HydrophobicContact CG2-CG2 4.5Å
297	S	86.9	Confident	87	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	178.5	169.3	73.2	0	0	0	0	110.3	L207 P209 Y299 G300	L207-S297 PolarHBondContact O-OG 2.86Å; P209-S297 VanDerWaalsContact CD-OG 3.28Å; P209-S297 WeakPolarHBondContact CD-OG 3.15Å; S297-Y299 PolarHBondContact O-N 3.27Å; S297-Y299 PolarHBondContact OG-N 3.29Å; S297-G300 PolarHBondContact N-O 2.04Å; S297-G300 PolarHBondContact O-N 3.15Å
298	I	81.5	Confident	86.9	Confident	12 Å²	12	20.9 Å²	20.9	6%	0.062	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-19.2	170.8	67.8	167.6	0	0	0	113.3	R53 A56 N57 R60	R53-I298 PolarHBondContact NE-O 2.94Å; R53-I298 PolarHBondContact NH2-O 2.87Å; A56-I298 HydrophobicContact CB-CG2 3.99Å; N57-I298 WeakPolarHBondContact OD1-CB 3.34Å; N57-I298 VanDerWaalsContact OD1-CG2 3.22Å; N57-I298 WeakPolarHBondContact OD1-CG2 3.44Å; R60-I298 HydrophobicContact CB-CG2 4.45Å; R60-I298 VanDerWaalsContact NH1-CD1 3.27Å
299	Y	80.6	Confident	86.7	Confident	86 Å²	86	27.5 Å²	27.5	34%	0.337	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-6.3	-179.4	-56.8	-73.7	0	0	0	112.7	L207 S297	L207-Y299 HydrophobicContact CB-CD1 4.24Å; L207-Y299 HydrophobicContact CB-CD2 3.39Å; L207-Y299 HydrophobicContact CB-CE1 4.45Å; L207-Y299 HydrophobicContact CB-CE2 3.65Å; L207-Y299 HydrophobicContact CB-CG 3.7Å; L207-Y299 HydrophobicContact CD1-CD1 4.16Å; L207-Y299 HydrophobicContact CD1-CD2 4.35Å; L207-Y299 HydrophobicContact CD1-CE1 3.72Å; L207-Y299 HydrophobicContact CD1-CE2 3.93Å; L207-Y299 HydrophobicContact CD1-CG 4.44Å; L207-Y299 HydrophobicContact CG-CD2 4.42Å; L207-Y299 HydrophobicContact CG-CE2 4.23Å; L207-Y299 WeakPolarHBondContact O-CD2 3.31Å; S297-Y299 PolarHBondContact O-N 3.27Å; S297-Y299 PolarHBondContact OG-N 3.29Å
300	G	78.7	Confident	86.6	Confident	3 Å²	3	28.6 Å²	28.6	3%	0.031	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	117.2	-156.8	-179.9	0	0	0	0	0	113.3	S297	S297-G300 PolarHBondContact N-O 2.04Å; S297-G300 PolarHBondContact O-N 3.15Å
301	T	83.4	Confident	86.4	Confident	12 Å²	12	29 Å²	29	7%	0.074	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	156.6	-174.7	-174.1	0	0	0	0	111.4	F49 L187 A295 V296 G303	F49-T301 HydrophobicContact CB-CG2 4.23Å; F49-T301 HydrophobicContact CD1-CG2 3.73Å; F49-T301 HydrophobicContact CD2-CG2 3.92Å; F49-T301 HydrophobicContact CE1-CG2 4Å; F49-T301 HydrophobicContact CE2-CG2 4.18Å; F49-T301 HydrophobicContact CG-CG2 3.7Å; F49-T301 HydrophobicContact CZ-CG2 4.22Å; L187-T301 HydrophobicContact CD2-CG2 4.15Å; A295-T301 VanDerWaalsContact O-CB 3.28Å; A295-T301 WeakPolarHBondContact O-CB 3.4Å; A295-T301 PolarHBondContact O-OG1 3.08Å; V296-T301 HydrophobicContact CG2-CG2 4.5Å; T301-G303 VanDerWaalsContact C-N 3.31Å; T301-G303 PolarHBondContact OG1-N 2.98Å; T301-G303 VanDerWaalsContact OG1-N 3.11Å
302	R	80.3	Confident	86.2	Confident	67 Å²	67	30 Å²	30	25%	0.253	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	14.8	167.8	-58.4	-175.6	-164.2	-174.4	2.4	112.4	Y204 V208 P209 R211	Y204-R302 HydrophobicContact CD1-CG 3.75Å; Y204-R302 VanDerWaalsContact CD2-CD 3.5Å; Y204-R302 HydrophobicContact CD2-CG 3.82Å; Y204-R302 HydrophobicContact CE1-CB 4.36Å; Y204-R302 HydrophobicContact CE1-CG 3.89Å; Y204-R302 HydrophobicContact CE2-CB 4.34Å; Y204-R302 HydrophobicContact CE2-CG 3.92Å; Y204-R302 HydrophobicContact CG-CG 3.72Å; V208-R302 HydrophobicContact CG1-CG 3.78Å; V208-R302 PolarHBondContact O-NE 3.25Å; V208-R302 PolarHBondContact O-NH2 3.41Å; P209-R302 VanDerWaalsContact O-CD 3.28Å; P209-R302 WeakPolarHBondContact O-CD 3.38Å; P209-R302 VanDerWaalsContact O-CG 3.27Å; P209-R302 WeakPolarHBondContact O-CG 3.42Å; P209-R302 PolarHBondContact O-NE 2.83Å; P209-R302 VanDerWaalsContact O-NE 3.16Å; R211-R302 HydrophobicContact CB-CB 3.94Å
303	G	83.4	Confident	85.8	Confident	5 Å²	5	39 Å²	39	5%	0.052	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	81.6	-176.8	179.4	0	0	0	0	0	113.9	T301	T301-G303 VanDerWaalsContact C-N 3.31Å; T301-G303 PolarHBondContact OG1-N 2.98Å; T301-G303 VanDerWaalsContact OG1-N 3.11Å
304	F	87.3	Confident	85.5	Confident	10 Å²	10	45.7 Å²	45.7	4%	0.044	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	137	177.7	-69.4	-78.8	0	0	0	111.5	E45 L48 F49 R211 I248 Q250 R292 I293 A294	E45-F304 HydrophobicContact CG-CE2 4.41Å; L48-F304 HydrophobicContact CD2-CZ 4.01Å; F49-F304 HydrophobicContact CE1-CD2 4.2Å; F49-F304 AromaticContact CE1-CE2 3.68Å; F49-F304 HydrophobicContact CE1-CE2 3.68Å; F49-F304 AromaticContact CE1-CZ 3.98Å; F49-F304 HydrophobicContact CE1-CZ 3.98Å; F49-F304 AromaticContact CZ-CD2 3.76Å; F49-F304 HydrophobicContact CZ-CD2 3.76Å; F49-F304 AromaticContact CZ-CE2 3.5Å; F49-F304 HydrophobicContact CZ-CE2 3.5Å; F49-F304 HydrophobicContact CZ-CZ 4.28Å; R211-F304 PolarHBondContact NE-O 2.67Å; R211-F304 PolarHBondContact NH2-O 2.88Å; I248-F304 HydrophobicContact CB-CE1 4.07Å; I248-F304 HydrophobicContact CB-CZ 4.36Å; I248-F304 HydrophobicContact CG2-CE1 3.99Å; I248-F304 HydrophobicContact CG2-CZ 4.02Å; Q250-F304 HydrophobicContact CB-CE1 4.33Å; Q250-F304 VanDerWaalsContact CD-CE1 3.49Å; Q250-F304 HydrophobicContact CG-CE1 3.66Å; Q250-F304 HydrophobicContact CG-CZ 3.86Å; R292-F304 HydrophobicContact CG-CB 4.13Å; R292-F304 HydrophobicContact CG-CD1 3.82Å; R292-F304 HydrophobicContact CG-CG 4.16Å; I293-F304 CarbonylContact O-C 3.52Å; I293-F304 WeakPolarHBondContact O-CA 3.38Å; A294-F304 HydrophobicContact CB-CD1 3.55Å; A294-F304 HydrophobicContact CB-CE1 3.67Å; A294-F304 HydrophobicContact CB-CG 3.98Å; A294-F304 HydrophobicContact CB-CZ 4.21Å
305	G	84.8	Confident	85.3	Confident	4 Å²	4	46.7 Å²	46.7	4%	0.041	24%	0.236	C	C	.	.			trans	-62.8	-176	168.8	0	0	0	0	0	114	P212 I293	P212-G305 WeakPolarHBondContact O-CA 3.42Å; I293-G305 PolarHBondContact O-N 3.03Å
306	L	85.2	Confident	85.2	Confident	123 Å²	123	51.5 Å²	51.5	64%	0.644	26%	0.26	S	S	*	.	P	Polyproline II helix	trans	-67.7	148.6	171.2	-65.5	174.4	0	0	0	110.3
307	G	85.7	Confident	85.3	Confident	30 Å²	30	58.9 Å²	58.9	31%	0.309	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-63.8	145.8	171.6	0	0	0	0	0	111.1	F291	F291-G307 CarbonylContact O-C 3.59Å; F291-G307 VanDerWaalsContact O-CA 3.25Å; F291-G307 WeakPolarHBondContact O-CA 3.39Å
308	T	89	Confident	85.6	Confident	18 Å²	18	59.1 Å²	59.1	11%	0.11	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-59.9	170.8	170.7	58.4	0	0	0	0	111	L215 Q290 F291	L215-T308 HydrophobicContact CB-CG2 3.48Å; L215-T308 VanDerWaalsContact CB-CG2 3.48Å; L215-T308 HydrophobicContact CD1-CG2 3.72Å; L215-T308 HydrophobicContact CG-CG2 4.25Å; Q290-T308 WeakPolarHBondContact CG-O 3.37Å; Q290-T308 PolarHBondContact NE2-O 3.17Å; F291-T308 HydrophobicContact CB-CG2 4.03Å; F291-T308 PolarHBondContact N-OG1 2.82Å; F291-T308 PolarHBondContact O-N 2.82Å
309	N	87.9	Confident	86.1	Confident	144 Å²	144	61 Å²	61	77%	0.77	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-61.3	149.1	157.7	-66.4	-36.1	0	0	0	109.6
310	A	89.2	Confident	86.7	Confident	24 Å²	24	60.4 Å²	60.4	20%	0.198	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-64.2	141.9	175.7	0	0	0	0	0	110.6	F259 L288 Y289	F259-A310 HydrophobicContact CB-CB 3.49Å; F259-A310 VanDerWaalsContact CB-CB 3.49Å; F259-A310 HydrophobicContact CD1-CB 4.47Å; F259-A310 HydrophobicContact CD2-CB 3.47Å; F259-A310 VanDerWaalsContact CD2-CB 3.47Å; F259-A310 HydrophobicContact CE2-CB 4.33Å; F259-A310 HydrophobicContact CG-CB 3.55Å; L288-A310 HydrophobicContact CB-CB 4.36Å; Y289-A310 CarbonylContact O-C 3.55Å; Y289-A310 WeakPolarHBondContact O-CA 3.14Å
311	Y	87.7	Confident	87.5	Confident	33 Å²	33	60.5 Å²	60.5	13%	0.129	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-128.7	147.1	178.7	175	-79	0	0	0	110.3	V219 A224 I227 F283 L288 Y289	V219-Y311 HydrophobicContact CG2-CE2 3.75Å; A224-Y311 PolarHBondContact O-OH 2.75Å; I227-Y311 HydrophobicContact CD1-CD1 3.11Å; I227-Y311 HydrophobicContact CD1-CD2 3.46Å; I227-Y311 VanDerWaalsContact CD1-CD2 3.46Å; I227-Y311 HydrophobicContact CD1-CE1 3.23Å; I227-Y311 HydrophobicContact CD1-CE2 3.54Å; I227-Y311 HydrophobicContact CD1-CG 3.23Å; I227-Y311 VanDerWaalsContact CD1-CZ 3.4Å; I227-Y311 HydrophobicContact CG1-CD1 4.09Å; I227-Y311 HydrophobicContact CG1-CD2 4.06Å; I227-Y311 HydrophobicContact CG1-CE1 3.7Å; I227-Y311 HydrophobicContact CG1-CE2 3.63Å; I227-Y311 HydrophobicContact CG1-CG 4.25Å; I227-Y311 VanDerWaalsContact CG1-CZ 3.41Å; F283-Y311 HydrophobicContact CD1-CD1 4.14Å; F283-Y311 HydrophobicContact CD1-CE1 4.07Å; F283-Y311 HydrophobicContact CD2-CD1 4.36Å; F283-Y311 AromaticContact CD2-CE1 3.52Å; F283-Y311 HydrophobicContact CD2-CE1 3.52Å; F283-Y311 HydrophobicContact CE1-CD1 4.04Å; F283-Y311 HydrophobicContact CE1-CE1 4.11Å; F283-Y311 HydrophobicContact CE2-CD1 4.27Å; F283-Y311 AromaticContact CE2-CE1 3.57Å; F283-Y311 HydrophobicContact CE2-CE1 3.57Å; F283-Y311 HydrophobicContact CG-CD1 4.3Å; F283-Y311 AromaticContact CG-CE1 3.78Å; F283-Y311 HydrophobicContact CG-CE1 3.78Å; F283-Y311 HydrophobicContact CZ-CD1 4.12Å; F283-Y311 AromaticContact CZ-CE1 3.88Å; F283-Y311 HydrophobicContact CZ-CE1 3.88Å; L288-Y311 CarbonylContact C-O 3.53Å; Y289-Y311 WeakPolarHBondContact CD2-O 3.21Å; Y289-Y311 PolarHBondContact N-O 2.96Å; Y289-Y311 PolarHBondContact O-N 2.84Å
312	P	87.4	Confident	87.9	Confident	23 Å²	23	61 Å²	61	15%	0.149	32%	0.318	C	S	.	.	S	Bend	cis	-65.7	158.3	-9.5	29.9	-38.3	0	0	0	110.9	L288 D314 P315	L288-P312 WeakPolarHBondContact CD2-O 3.13Å; P312-D314 PolarHBondContact O-N 2.74Å; P312-P315 HydrophobicContact CG-CB 4.21Å
313	R	82.8	Confident	88.4	Confident	220 Å²	220	60.8 Å²	60.8	83%	0.83	33%	0.325	S	S	*	.	S	Bend	trans	-60.7	-38.3	175	-86.3	-168.4	-79	-111.3	0.3	111.6
314	D	84.7	Confident	88.9	Confident	143 Å²	143	60.6 Å²	60.6	77%	0.765	32%	0.323	S	S	*	.	S	Bend	trans	-119.3	99.9	176	-60.6	-50.7	0	0	0	108.8	P312	P312-D314 PolarHBondContact O-N 2.74Å
315	P	87.2	Confident	89.1	Confident	21 Å²	21	63.7 Å²	63.7	14%	0.136	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-69.1	140.7	-179.2	27.9	-32	0	0	0	111.4	L288 P312 R317 W415	L288-P315 HydrophobicContact CD2-CB 3.95Å; L288-P315 HydrophobicContact CD2-CG 3.89Å; L288-P315 HydrophobicContact CG-CB 4.37Å; L288-P315 HydrophobicContact CG-CG 4.21Å; P312-P315 HydrophobicContact CG-CB 4.21Å; P315-R317 PolarHBondContact O-N 3.1Å; P315-W415 HydrophobicContact CG-CZ2 4.13Å
316	I	87.7	Confident	89.3	Confident	102 Å²	102	68.2 Å²	68.2	52%	0.523	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-60.2	125.9	173.2	-60.9	173	0	0	0	107.7	P285 G286	P285-I316 CarbonylContact C-O 3.59Å; P285-I316 HydrophobicContact CB-CB 4.35Å; P285-I316 HydrophobicContact CB-CG2 4.22Å; P285-I316 HydrophobicContact CG-CG2 4.43Å; G286-I316 PolarHBondContact N-O 3.35Å
317	R	90.9	Very high	89.3	Confident	157 Å²	157	62.9 Å²	62.9	59%	0.592	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-60.4	124.9	179.7	-170.6	-176.3	-160.4	-175.1	6	110	P315 W415	P315-R317 PolarHBondContact O-N 3.1Å; R317-W415 HydrophobicContact CG-CH2 4.32Å; R317-W415 HydrophobicContact CG-CZ3 3.88Å
318	P	93	Very high	89.2	Confident	4 Å²	4	64.8 Å²	64.8	3%	0.026	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-68.7	142.5	177.2	27.3	-31	0	0	0	110.6	P285 D353 L354 W415 L421	P285-P318 HydrophobicContact CB-CB 4.38Å; P318-D353 HydrophobicContact CB-CB 3.88Å; P318-L354 HydrophobicContact CB-CD1 3.97Å; P318-L354 HydrophobicContact CB-CD2 4.17Å; P318-L354 HydrophobicContact CB-CG 3.74Å; P318-L354 HydrophobicContact CG-CD1 3.73Å; P318-L354 HydrophobicContact CG-CD2 4.46Å; P318-L354 HydrophobicContact CG-CG 4.06Å; P318-W415 HydrophobicContact CG-CB 4.36Å; P318-W415 HydrophobicContact CG-CD2 3.71Å; P318-W415 HydrophobicContact CG-CE3 3.99Å; P318-W415 HydrophobicContact CG-CG 3.86Å; P318-L421 HydrophobicContact CB-CD1 4.33Å; P318-L421 HydrophobicContact CG-CD1 3.86Å
319	S	92.4	Very high	88.7	Confident	53 Å²	53	67.1 Å²	67.1	37%	0.371	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-73.9	147	171.8	63.4	0	0	0	0	110.9	D353	S319-D353 WeakPolarHBondContact CB-OD2 3.32Å; S319-D353 PolarHBondContact N-OD2 3.43Å; S319-D353 VanDerWaalsContact OG-CG 3.28Å; S319-D353 PolarHBondContact OG-OD2 3.32Å
320	P	93.1	Very high	87.5	Confident	73 Å²	73	63 Å²	63	47%	0.474	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-57.7	148	170.6	-21.6	32.4	0	0	0	111.5	L421 E422	P320-L421 HydrophobicContact CB-CB 4.38Å; P320-E422 WeakPolarHBondContact CB-O 3.3Å
321	P	93.9	Very high	86.4	Confident	4 Å²	4	65.9 Å²	65.9	3%	0.026	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-57	151.1	177.9	21.9	-30	0	0	0	111.8	L356 A411 L421 S423	P321-L356 HydrophobicContact CB-CD2 3.72Å; P321-L356 HydrophobicContact CG-CD2 4.2Å; P321-A411 HydrophobicContact CB-CB 4.17Å; P321-A411 HydrophobicContact CG-CB 4.19Å; P321-A411 WeakPolarHBondContact CG-O 3.21Å; P321-L421 WeakPolarHBondContact CD-O 3.42Å; P321-L421 WeakPolarHBondContact CG-O 3.49Å; P321-S423 VanDerWaalsContact O-CA 3.24Å; P321-S423 WeakPolarHBondContact O-CA 3.44Å; P321-S423 WeakPolarHBondContact O-CB 3.04Å
322	G	91.7	Very high	85.6	Confident	23 Å²	23	67.9 Å²	67.9	24%	0.237	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-63	164.4	169.1	0	0	0	0	0	112.4	P349 Q351 S423	G322-P349 VanDerWaalsContact O-CB 3.28Å; G322-P349 WeakPolarHBondContact O-CB 3Å; G322-P349 WeakPolarHBondContact O-CG 3.48Å; G322-Q351 PolarHBondContact N-O 3.32Å; G322-Q351 VanDerWaalsContact N-O 3.1Å; G322-S423 WeakPolarHBondContact O-CB 3.07Å
323	P	92.1	Very high	84.7	Confident	62 Å²	62	73 Å²	73	40%	0.403	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-64.6	145.1	174.7	27	-34	0	0	0	111.4	Q424	P323-Q424 WeakPolarHBondContact CB-O 3.37Å
324	P	92.6	Very high	84	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.006	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-53.4	146.7	167.7	-24.8	33.9	0	0	0	111.4	V327 Y359 V409 A411 N426	P324-V327 HydrophobicContact CB-CG2 4.38Å; P324-Y359 HydrophobicContact CG-CD1 4.05Å; P324-Y359 HydrophobicContact CG-CE1 4.1Å; P324-V409 HydrophobicContact CB-CG1 4.15Å; P324-V409 HydrophobicContact CG-CB 4.37Å; P324-V409 HydrophobicContact CG-CG1 3.87Å; P324-A411 HydrophobicContact CG-CB 4.12Å; P324-N426 WeakPolarHBondContact O-CB 3.32Å; P324-N426 PolarHBondContact O-ND2 3.37Å
325	R	92.3	Very high	83.2	Confident	75 Å²	75	65 Å²	65	28%	0.283	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	160.7	-176.8	-57	-166.6	-52.3	-113.3	-0.8	111.7	V327 Q347 V350	R325-V327 PolarHBondContact O-N 3.08Å; R325-V327 VanDerWaalsContact O-N 3.16Å; R325-Q347 HydrophobicContact CB-CB 4.19Å; R325-Q347 PolarHBondContact N-O 3.2Å; R325-Q347 PolarHBondContact O-N 2.83Å; R325-V350 VanDerWaalsContact NH1-N 3.19Å
326	N	89.5	Confident	81.8	Confident	99 Å²	99	70.7 Å²	70.7	53%	0.529	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48.1	45.2	171.8	-62	-8.5	0	0	0	113.3	T328 Q347	N326-T328 PolarHBondContact O-N 2.87Å; N326-Q347 HydrophobicContact CB-CG 4.29Å; N326-Q347 VanDerWaalsContact ND2-CD 3.35Å; N326-Q347 PolarHBondContact ND2-NE2 3.48Å; N326-Q347 PolarHBondContact ND2-OE1 3.46Å; N326-Q347 VanDerWaalsContact ND2-OE1 3.08Å
327	V	85.2	Confident	80.8	Confident	12 Å²	12	70.1 Å²	70.1	7%	0.073	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	115.2	175.5	-174.8	0	0	0	0	108	P324 R325 L344 K345 W346 V409 N426 I428	P324-V327 HydrophobicContact CB-CG2 4.38Å; R325-V327 PolarHBondContact O-N 3.08Å; R325-V327 VanDerWaalsContact O-N 3.16Å; V327-L344 HydrophobicContact CG1-CD1 3.79Å; V327-L344 HydrophobicContact CG1-CD2 4.46Å; V327-L344 HydrophobicContact CG1-CG 4.25Å; V327-K345 CarbonylContact C-O 3.57Å; V327-K345 WeakPolarHBondContact CA-O 3.41Å; V327-W346 HydrophobicContact CG2-CB 3.93Å; V327-V409 HydrophobicContact CG1-CG2 3.7Å; V327-V409 HydrophobicContact CG2-CB 4.21Å; V327-V409 HydrophobicContact CG2-CG2 4.18Å; V327-N426 HydrophobicContact CG2-CB 3.72Å; V327-N426 VanDerWaalsContact CG2-CG 3.47Å; V327-I428 HydrophobicContact CB-CG2 4.08Å; V327-I428 HydrophobicContact CG1-CD1 3.91Å; V327-I428 HydrophobicContact CG1-CG1 4.2Å; V327-I428 HydrophobicContact CG1-CG2 4.13Å
328	T	84.1	Confident	79.6	Confident	69 Å²	69	63.6 Å²	63.6	42%	0.423	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	149.9	-176.2	56.4	0	0	0	0	111.6	N326 K345	N326-T328 PolarHBondContact O-N 2.87Å; T328-K345 PolarHBondContact N-O 3.25Å; T328-K345 PolarHBondContact O-N 3.38Å
329	D	76.9	Confident	78.6	Confident	67 Å²	67	67.1 Å²	67.1	36%	0.358	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	134	160.8	58.2	-42.8	0	0	0	110.2	W332 L342 L430	D329-W332 HydrophobicContact CB-CZ2 4.41Å; D329-W332 PolarHBondContact OD2-NE1 2.85Å; D329-L342 HydrophobicContact CB-CD1 3.3Å; D329-L342 HydrophobicContact CB-CD2 4.49Å; D329-L342 HydrophobicContact CB-CG 4.46Å; D329-L430 HydrophobicContact CB-CD1 4.26Å; D329-L430 HydrophobicContact CB-CD2 3.9Å; D329-L430 VanDerWaalsContact CG-CD2 3.46Å
330	S	63.4	Low	77.6	Confident	58 Å²	58	64.6 Å²	64.6	41%	0.406	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	-41.4	-175.6	60.7	0	0	0	0	113.8	L343 K345	S330-L343 PolarHBondContact N-O 3.44Å; S330-L343 WeakPolarHBondContact OG-CD2 3.49Å; S330-L343 VanDerWaalsContact OG-CG 3.25Å; S330-L343 WeakPolarHBondContact OG-CG 3.39Å; S330-L343 PolarHBondContact OG-O 2.63Å; S330-K345 WeakPolarHBondContact OG-CE 3.09Å
331	M	65.9	Low	77	Confident	84 Å²	84	61.9 Å²	61.9	41%	0.414	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	135.1	-177.4	-169.6	178.4	72.7	0	0	111.1	R333 L343	M331-R333 HydrophobicContact CE-CG 4.28Å; M331-L343 HydrophobicContact CB-CB 4.08Å; M331-L343 HydrophobicContact CB-CD2 4.26Å; M331-L343 PolarHBondContact O-N 3.15Å
332	W	70.4	Confident	76.4	Confident	75 Å²	75	61.7 Å²	61.7	28%	0.284	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	133	179.1	-66.8	74.7	0	0	0	109.5	D329 V340 N341 L342 L430 T432	D329-W332 HydrophobicContact CB-CZ2 4.41Å; D329-W332 PolarHBondContact OD2-NE1 2.85Å; W332-V340 HydrophobicContact CE3-CG1 3.35Å; W332-V340 HydrophobicContact CZ3-CG1 3.65Å; W332-N341 CarbonylContact C-O 3.51Å; W332-N341 WeakPolarHBondContact CA-O 3.1Å; W332-L342 HydrophobicContact CD2-CD1 4.13Å; W332-L342 HydrophobicContact CG-CD1 4.48Å; W332-L342 HydrophobicContact CH2-CD2 4.49Å; W332-L342 HydrophobicContact CZ2-CD1 3.97Å; W332-L342 HydrophobicContact CZ2-CD2 4.4Å; W332-L430 HydrophobicContact CH2-CB 4.49Å; W332-L430 HydrophobicContact CZ2-CD2 4.37Å; W332-T432 HydrophobicContact CH2-CG2 4.15Å; W332-T432 HydrophobicContact CZ3-CG2 3.75Å
333	R	69	Low	76.1	Confident	130 Å²	130	61.8 Å²	61.8	49%	0.491	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	117.5	171.5	-74.9	-176.1	177.7	153.8	-0.2	109.2	M331 Y335 N341	M331-R333 HydrophobicContact CE-CG 4.28Å; R333-Y335 HydrophobicContact CB-CE2 4.23Å; R333-N341 HydrophobicContact CB-CB 4.35Å; R333-N341 PolarHBondContact N-O 3.05Å; R333-N341 PolarHBondContact O-N 2.99Å
334	L	68.7	Low	75.9	Confident	88 Å²	88	58.8 Å²	58.8	46%	0.461	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	122.6	177.7	-65.5	147.9	0	0	0	107.8	V340 I435	L334-V340 HydrophobicContact CD2-CG1 4.13Å; L334-V340 HydrophobicContact CD2-CG2 3.84Å; L334-I435 HydrophobicContact CB-CD1 4.32Å; L334-I435 HydrophobicContact CD2-CD1 3.7Å; L334-I435 HydrophobicContact CD2-CG1 4.05Å
335	Y	67	Low	75.8	Confident	108 Å²	108	62.5 Å²	62.5	42%	0.424	33%	0.327	S	S	.	.			trans	-94.3	151.4	175.9	-69.5	-89.7	0	0	0	110.5	R333 S337 G338 K339 N341	R333-Y335 HydrophobicContact CB-CE2 4.23Å; Y335-S337 WeakPolarHBondContact CB-OG 3.44Å; Y335-S337 PolarHBondContact O-N 2.78Å; Y335-G338 PolarHBondContact O-N 3.48Å; Y335-K339 PolarHBondContact N-O 2.62Å; Y335-N341 HydrophobicContact CE2-CB 4.1Å; Y335-N341 VanDerWaalsContact CE2-CG 3.49Å; Y335-N341 WeakPolarHBondContact CE2-ND2 3.36Å
336	S	58.2	Low	75.8	Confident	140 Å²	140	59.3 Å²	59.3	98%	0.979	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-17.3	173.6	-46.4	0	0	0	0	113.3	G338	S336-G338 PolarHBondContact O-N 3.2Å
337	S	65.9	Low	76	Confident	90 Å²	90	58.5 Å²	58.5	63%	0.629	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-4.2	172.8	59.8	0	0	0	0	114.4	Y335 K339	Y335-S337 WeakPolarHBondContact CB-OG 3.44Å; Y335-S337 PolarHBondContact O-N 2.78Å; S337-K339 PolarHBondContact O-N 3.27Å; S337-K339 PolarHBondContact OG-N 3.41Å
338	G	67	Low	76.3	Confident	21 Å²	21	60.9 Å²	60.9	22%	0.216	32%	0.323	C	S	.	.	S	Bend	trans	82.5	-3.4	-172.7	0	0	0	0	0	114	Y335 S336 P401	Y335-G338 PolarHBondContact O-N 3.48Å; S336-G338 PolarHBondContact O-N 3.2Å; G338-P401 VanDerWaalsContact O-CD 3.28Å; G338-P401 WeakPolarHBondContact O-CD 3.23Å; G338-P401 VanDerWaalsContact O-CG 3.3Å; G338-P401 WeakPolarHBondContact O-CG 3.3Å
339	K	71.3	Confident	76.7	Confident	78 Å²	78	58.3 Å²	58.3	34%	0.339	31%	0.308	S	S	.	.			trans	-81.4	144.7	178.9	-65.3	-63.2	-174.3	175.4	0	111.4	Y335 S337 N398	Y335-K339 PolarHBondContact N-O 2.62Å; S337-K339 PolarHBondContact O-N 3.27Å; S337-K339 PolarHBondContact OG-N 3.41Å; K339-N398 HydrophobicContact CD-CB 4.46Å
340	V	72	Confident	77.2	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	128	-178.1	-166.9	0	0	0	0	109.4	W332 L334 L399 P401	W332-V340 HydrophobicContact CE3-CG1 3.35Å; W332-V340 HydrophobicContact CZ3-CG1 3.65Å; L334-V340 HydrophobicContact CD2-CG1 4.13Å; L334-V340 HydrophobicContact CD2-CG2 3.84Å; V340-L399 HydrophobicContact CB-CB 4.36Å; V340-L399 PolarHBondContact N-O 2.97Å; V340-L399 VanDerWaalsContact N-O 3.11Å; V340-L399 WeakPolarHBondContact O-CB 3.4Å; V340-L399 PolarHBondContact O-N 3.2Å; V340-P401 HydrophobicContact CG2-CB 4.3Å
341	N	80.3	Confident	78.2	Confident	15 Å²	15	61.1 Å²	61.1	8%	0.08	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	140	170.3	-65.1	14.2	0	0	0	109.5	W332 R333 Y335 I395 L396 D397 N398	W332-N341 CarbonylContact C-O 3.51Å; W332-N341 WeakPolarHBondContact CA-O 3.1Å; R333-N341 HydrophobicContact CB-CB 4.35Å; R333-N341 PolarHBondContact N-O 3.05Å; R333-N341 PolarHBondContact O-N 2.99Å; Y335-N341 HydrophobicContact CE2-CB 4.1Å; Y335-N341 VanDerWaalsContact CE2-CG 3.49Å; Y335-N341 WeakPolarHBondContact CE2-ND2 3.36Å; N341-I395 HydrophobicContact CB-CG2 4.1Å; N341-L396 CarbonylContact C-O 3.56Å; N341-L396 VanDerWaalsContact CA-O 3.26Å; N341-L396 WeakPolarHBondContact CA-O 3.2Å; N341-D397 PolarHBondContact ND2-OD1 3.28Å; N341-D397 WeakPolarHBondContact OD1-CA 3.37Å; N341-N398 PolarHBondContact OD1-N 3.25Å
342	L	80.1	Confident	79.3	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.5	-173.2	161	63.9	0	0	0	110.2	D329 W332 I395 L396 L399 I407 L430	D329-L342 HydrophobicContact CB-CD1 3.3Å; D329-L342 HydrophobicContact CB-CD2 4.49Å; D329-L342 HydrophobicContact CB-CG 4.46Å; W332-L342 HydrophobicContact CD2-CD1 4.13Å; W332-L342 HydrophobicContact CG-CD1 4.48Å; W332-L342 HydrophobicContact CH2-CD2 4.49Å; W332-L342 HydrophobicContact CZ2-CD1 3.97Å; W332-L342 HydrophobicContact CZ2-CD2 4.4Å; L342-I395 CarbonylContact O-C 3.55Å; L342-I395 VanDerWaalsContact O-CA 3.29Å; L342-I395 WeakPolarHBondContact O-CA 3.23Å; L342-L396 HydrophobicContact CB-CB 4.46Å; L342-L396 HydrophobicContact CD2-CD1 4.35Å; L342-L396 PolarHBondContact N-O 3.14Å; L342-L396 PolarHBondContact O-N 2.79Å; L342-L399 HydrophobicContact CB-CD1 4Å; L342-L399 HydrophobicContact CD2-CD1 4.38Å; L342-I407 HydrophobicContact CD2-CD1 4.15Å; L342-L430 HydrophobicContact CD2-CD1 3.35Å
343	L	86	Confident	80.3	Confident	25 Å²	25	54.8 Å²	54.8	13%	0.131	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	108.1	169.9	-179.2	63.7	0	0	0	110.5	S330 M331 K345 E393 I395	S330-L343 PolarHBondContact N-O 3.44Å; S330-L343 WeakPolarHBondContact OG-CD2 3.49Å; S330-L343 VanDerWaalsContact OG-CG 3.25Å; S330-L343 WeakPolarHBondContact OG-CG 3.39Å; S330-L343 PolarHBondContact OG-O 2.63Å; M331-L343 HydrophobicContact CB-CB 4.08Å; M331-L343 HydrophobicContact CB-CD2 4.26Å; M331-L343 PolarHBondContact O-N 3.15Å; L343-K345 VanDerWaalsContact CD2-CE 3.44Å; L343-K345 HydrophobicContact CG-CG 4.37Å; L343-E393 HydrophobicContact CD1-CB 4.31Å; L343-I395 HydrophobicContact CD1-CG1 3.82Å
344	L	87.5	Confident	81.4	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	134	173.9	-168.7	71.2	0	0	0	109.9	V327 W346 I361 E393 C394 I407 V409 I428	V327-L344 HydrophobicContact CG1-CD1 3.79Å; V327-L344 HydrophobicContact CG1-CD2 4.46Å; V327-L344 HydrophobicContact CG1-CG 4.25Å; L344-W346 HydrophobicContact CB-CZ3 4.26Å; L344-W346 HydrophobicContact CD2-CE3 4.16Å; L344-W346 HydrophobicContact CD2-CZ3 3.93Å; L344-W346 HydrophobicContact CG-CE3 4.05Å; L344-W346 HydrophobicContact CG-CZ3 4.04Å; L344-I361 HydrophobicContact CD2-CG2 4Å; L344-E393 CarbonylContact O-C 3.52Å; L344-E393 WeakPolarHBondContact O-CA 3.37Å; L344-E393 WeakPolarHBondContact O-CB 3.45Å; L344-C394 PolarHBondContact N-O 3.2Å; L344-C394 PolarHBondContact O-N 2.76Å; L344-I407 HydrophobicContact CD1-CG2 4.46Å; L344-I407 HydrophobicContact CD2-CG2 3.94Å; L344-V409 HydrophobicContact CD2-CG2 3.75Å; L344-I428 HydrophobicContact CD1-CD1 3.66Å
345	K	91.8	Very high	82.5	Confident	78 Å²	78	48.1 Å²	48.1	34%	0.339	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	149.4	175.7	-62.2	-165.2	178.4	-146.8	0	110.7	V327 T328 S330 L343 E393	V327-K345 CarbonylContact C-O 3.57Å; V327-K345 WeakPolarHBondContact CA-O 3.41Å; T328-K345 PolarHBondContact N-O 3.25Å; T328-K345 PolarHBondContact O-N 3.38Å; S330-K345 WeakPolarHBondContact OG-CE 3.09Å; L343-K345 VanDerWaalsContact CD2-CE 3.44Å; L343-K345 HydrophobicContact CG-CG 4.37Å; K345-E393 WeakPolarHBondContact CE-OE2 3.37Å; K345-E393 HydrophobicContact CG-CB 3.93Å; K345-E393 IonicContact NZ-OE2 3.27Å; K345-E393 PolarHBondContact NZ-OE2 2.95Å
346	W	91.8	Very high	83.7	Confident	9 Å²	9	45 Å²	45	3%	0.034	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	173.9	175.2	57.9	93.9	0	0	0	111.3	V327 L344 Y359 I361 I387 T392 C394 V409	V327-W346 HydrophobicContact CG2-CB 3.93Å; L344-W346 HydrophobicContact CB-CZ3 4.26Å; L344-W346 HydrophobicContact CD2-CE3 4.16Å; L344-W346 HydrophobicContact CD2-CZ3 3.93Å; L344-W346 HydrophobicContact CG-CE3 4.05Å; L344-W346 HydrophobicContact CG-CZ3 4.04Å; W346-Y359 AromaticContact CD1-CE1 3.98Å; W346-Y359 HydrophobicContact CZ2-CD2 4.07Å; W346-Y359 HydrophobicContact CZ2-CG 4.1Å; W346-Y359 AromaticContact NE1-CD1 3.55Å; W346-Y359 AromaticContact NE1-CD2 3.48Å; W346-Y359 AromaticContact NE1-CE1 3.61Å; W346-Y359 AromaticContact NE1-CE2 3.54Å; W346-Y359 AromaticContact NE1-CG 3.49Å; W346-Y359 AromaticContact NE1-CZ 3.62Å; W346-I361 HydrophobicContact CH2-CD1 3.93Å; W346-I361 HydrophobicContact CH2-CG1 4.19Å; W346-I361 HydrophobicContact CZ2-CD1 4.31Å; W346-I361 HydrophobicContact CZ3-CG1 4.46Å; W346-I387 HydrophobicContact CH2-CG1 4.43Å; W346-I387 HydrophobicContact CZ2-CG2 4.35Å; W346-T392 PolarHBondContact N-O 2.89Å; W346-T392 VanDerWaalsContact O-CB 3.29Å; W346-T392 WeakPolarHBondContact O-CB 3.44Å; W346-T392 PolarHBondContact O-OG1 2.93Å; W346-C394 HydrophobicContact CH2-CB 3.9Å; W346-C394 HydrophobicContact CZ3-CB 4.21Å; W346-V409 HydrophobicContact CD2-CG1 4.16Å; W346-V409 HydrophobicContact CE3-CG1 4.49Å; W346-V409 HydrophobicContact CG-CG1 4.39Å
347	Q	92.8	Very high	85.3	Confident	82 Å²	82	41 Å²	41	38%	0.383	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	152.5	169.6	-68	-179.8	-7.3	0	0	110	R325 N326	R325-Q347 HydrophobicContact CB-CB 4.19Å; R325-Q347 PolarHBondContact N-O 3.2Å; R325-Q347 PolarHBondContact O-N 2.83Å; N326-Q347 HydrophobicContact CB-CG 4.29Å; N326-Q347 VanDerWaalsContact ND2-CD 3.35Å; N326-Q347 PolarHBondContact ND2-NE2 3.48Å; N326-Q347 PolarHBondContact ND2-OE1 3.46Å; N326-Q347 VanDerWaalsContact ND2-OE1 3.08Å
348	P	93	Very high	86.7	Confident	61 Å²	61	39.4 Å²	39.4	40%	0.396	21%	0.214	S	C	.	.			trans	-59.2	157.2	174.5	-23.4	34.3	0	0	0	113.2	Y359 T392	P348-Y359 WeakPolarHBondContact CA-OH 3.39Å; P348-Y359 WeakPolarHBondContact CB-OH 3.06Å; P348-T392 HydrophobicContact CG-CG2 4.11Å
349	P	91.8	Very high	88	Confident	15 Å²	15	38.5 Å²	38.5	10%	0.097	20%	0.204	C	C	.	.			trans	-54.5	154.5	171.1	-24.1	35.2	0	0	0	113.4	G322 L356 A411	G322-P349 VanDerWaalsContact O-CB 3.28Å; G322-P349 WeakPolarHBondContact O-CB 3Å; G322-P349 WeakPolarHBondContact O-CG 3.48Å; P349-L356 HydrophobicContact CG-CD1 4.3Å; P349-A411 HydrophobicContact CG-CB 3.72Å
350	V	88.3	Confident	89.1	Confident	89 Å²	89	36 Å²	36	54%	0.539	20%	0.195	S	C	.	.	S	Bend	trans	-65	-42.2	174.7	-167.9	0	0	0	0	111.6	R325 T783	R325-V350 VanDerWaalsContact NH1-N 3.19Å; V350-T783 PolarHBondContact O-OG1 2.75Å
351	Q	83.1	Confident	90	Very high	95 Å²	95	36 Å²	36	44%	0.444	20%	0.195	S	C	.	.			trans	-136.3	136.6	-170.6	-168.4	174.8	20.5	0	0	109.5	G322 V781	G322-Q351 PolarHBondContact N-O 3.32Å; G322-Q351 VanDerWaalsContact N-O 3.1Å; Q351-V781 PolarHBondContact NE2-O 2.93Å; Q351-V781 VanDerWaalsContact NE2-O 3.15Å
352	S	89.6	Confident	90.4	Very high	12 Å²	12	35.9 Å²	35.9	8%	0.084	19%	0.194	C	C	.	.			trans	-150.9	134.5	164.8	-169.2	0	0	0	0	108.7	L354 T783	S352-L354 VanDerWaalsContact C-N 3.26Å; S352-L354 WeakPolarHBondContact CB-O 3.4Å; S352-L354 PolarHBondContact O-N 3.04Å; S352-L354 PolarHBondContact OG-O 3.35Å; S352-T783 WeakPolarHBondContact O-CG2 3.31Å
353	D	90.8	Very high	90.6	Very high	15 Å²	15	36.7 Å²	36.7	8%	0.08	20%	0.197	C	C	.	.	S	Bend	trans	-70.6	-28.2	178	-68.2	-22.3	0	0	0	111.8	P285 R287 P318 S319	P285-D353 HydrophobicContact CB-CB 4.27Å; R287-D353 PolarHBondContact NH1-O 3.02Å; R287-D353 PolarHBondContact NH2-O 2.88Å; P318-D353 HydrophobicContact CB-CB 3.88Å; S319-D353 WeakPolarHBondContact CB-OD2 3.32Å; S319-D353 PolarHBondContact N-OD2 3.43Å; S319-D353 VanDerWaalsContact OG-CG 3.28Å; S319-D353 PolarHBondContact OG-OD2 3.32Å
354	L	91.7	Very high	90.5	Very high	5 Å²	5	37.1 Å²	37.1	3%	0.026	20%	0.202	C	C	.	.	S	Bend	trans	-118.7	154.7	-178.1	-62.9	-172.6	0	0	0	111.6	I255 P318 S352 L356 W415 L421	I255-L354 HydrophobicContact CG2-CD1 3.76Å; I255-L354 HydrophobicContact CG2-CD2 3.55Å; I255-L354 HydrophobicContact CG2-CG 4.2Å; P318-L354 HydrophobicContact CB-CD1 3.97Å; P318-L354 HydrophobicContact CB-CD2 4.17Å; P318-L354 HydrophobicContact CB-CG 3.74Å; P318-L354 HydrophobicContact CG-CD1 3.73Å; P318-L354 HydrophobicContact CG-CD2 4.46Å; P318-L354 HydrophobicContact CG-CG 4.06Å; S352-L354 VanDerWaalsContact C-N 3.26Å; S352-L354 WeakPolarHBondContact CB-O 3.4Å; S352-L354 PolarHBondContact O-N 3.04Å; S352-L354 PolarHBondContact OG-O 3.35Å; L354-L356 PolarHBondContact O-N 3.28Å; L354-W415 HydrophobicContact CD1-CB 3.7Å; L354-W415 HydrophobicContact CD1-CG 4.03Å; L354-L421 HydrophobicContact CD1-CD1 4.13Å
355	P	92.3	Very high	90	Very high	73 Å²	73	38.9 Å²	38.9	47%	0.474	21%	0.211	S	C	.	.			trans	-55.7	138.3	170	-22.2	33.3	0	0	0	111.7	I255 S413	I255-P355 HydrophobicContact CD1-CG 3.97Å; P355-S413 WeakPolarHBondContact O-CB 3.42Å
356	L	92.5	Very high	88.9	Confident	42 Å²	42	37.9 Å²	37.9	22%	0.22	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	137.5	173.6	-60.8	178.4	0	0	0	109.7	P321 P349 L354 Y359 A389 A411	P321-L356 HydrophobicContact CB-CD2 3.72Å; P321-L356 HydrophobicContact CG-CD2 4.2Å; P349-L356 HydrophobicContact CG-CD1 4.3Å; L354-L356 PolarHBondContact O-N 3.28Å; L356-Y359 HydrophobicContact CD1-CE1 4.29Å; L356-Y359 WeakPolarHBondContact CD1-OH 3.37Å; L356-A389 HydrophobicContact CB-CB 3.64Å; L356-A389 WeakPolarHBondContact O-CB 3.42Å; L356-A411 HydrophobicContact CD2-CB 4.02Å
357	T	92.6	Very high	87.4	Confident	57 Å²	57	42.1 Å²	42.1	35%	0.35	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-44.1	175.7	49.1	0	0	0	0	111	A389 T412	T357-A389 WeakPolarHBondContact O-CB 3.27Å; T357-A389 PolarHBondContact O-N 2.75Å; T357-A389 VanDerWaalsContact O-N 3.14Å; T357-T412 PolarHBondContact N-O 3.15Å; T357-T412 PolarHBondContact OG1-O 3.08Å; T357-T412 VanDerWaalsContact OG1-O 3.14Å
358	E	94.7	Very high	85.3	Confident	56 Å²	56	40.9 Å²	40.9	26%	0.262	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	163.7	-174.4	61.2	-174.1	-159.4	0	0	113	T386 I387 T412	E358-T386 HydrophobicContact CB-CG2 3.83Å; E358-T386 HydrophobicContact CG-CG2 4.09Å; E358-T386 WeakPolarHBondContact OE2-CG2 3.38Å; E358-I387 CarbonylContact C-O 3.56Å; E358-I387 WeakPolarHBondContact CA-O 3.49Å; E358-I387 WeakPolarHBondContact CB-O 3.31Å; E358-T412 HydrophobicContact CG-CG2 4.19Å; E358-T412 PolarHBondContact N-O 3.22Å; E358-T412 PolarHBondContact O-N 3.2Å
359	Y	93.9	Very high	82.7	Confident	1 Å²	1	48.6 Å²	48.6	0%	0.004	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	134.2	165	-64.9	-77.6	0	0	0	109.7	P324 W346 P348 L356 T386 I387 R391 T392 K410 A411	P324-Y359 HydrophobicContact CG-CD1 4.05Å; P324-Y359 HydrophobicContact CG-CE1 4.1Å; W346-Y359 AromaticContact CD1-CE1 3.98Å; W346-Y359 HydrophobicContact CZ2-CD2 4.07Å; W346-Y359 HydrophobicContact CZ2-CG 4.1Å; W346-Y359 AromaticContact NE1-CD1 3.55Å; W346-Y359 AromaticContact NE1-CD2 3.48Å; W346-Y359 AromaticContact NE1-CE1 3.61Å; W346-Y359 AromaticContact NE1-CE2 3.54Å; W346-Y359 AromaticContact NE1-CG 3.49Å; W346-Y359 AromaticContact NE1-CZ 3.62Å; P348-Y359 WeakPolarHBondContact CA-OH 3.39Å; P348-Y359 WeakPolarHBondContact CB-OH 3.06Å; L356-Y359 HydrophobicContact CD1-CE1 4.29Å; L356-Y359 WeakPolarHBondContact CD1-OH 3.37Å; Y359-T386 WeakPolarHBondContact O-CA 3.35Å; Y359-I387 PolarHBondContact N-O 2.86Å; Y359-I387 PolarHBondContact O-N 3.14Å; Y359-R391 WeakPolarHBondContact CD2-O 3.47Å; Y359-T392 HydrophobicContact CE2-CG2 4.42Å; Y359-K410 CarbonylContact C-O 3.54Å; Y359-K410 VanDerWaalsContact CA-O 3.24Å; Y359-K410 WeakPolarHBondContact CA-O 3.22Å; Y359-A411 HydrophobicContact CD1-CB 3.99Å; Y359-A411 HydrophobicContact CE1-CB 3.85Å
360	L	93.9	Very high	80	Confident	27 Å²	27	56.2 Å²	56.2	14%	0.141	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	116.4	176	-172.3	69.9	0	0	0	109.4	T362 T384 V409 K410	L360-T362 HydrophobicContact CG-CG2 4.35Å; L360-T384 HydrophobicContact CD1-CG2 3.32Å; L360-T384 HydrophobicContact CG-CG2 4.12Å; L360-V409 WeakPolarHBondContact O-CA 3.4Å; L360-K410 HydrophobicContact CB-CB 4.33Å; L360-K410 HydrophobicContact CD2-CD 4.43Å; L360-K410 PolarHBondContact N-O 3.48Å; L360-K410 PolarHBondContact O-N 3.04Å
361	I	91.3	Very high	77.6	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	121.2	178	-56.3	88.4	0	0	0	108.4	L344 W346 W363 T384 R385 I387 L396 I407 Q408 V409	L344-I361 HydrophobicContact CD2-CG2 4Å; W346-I361 HydrophobicContact CH2-CD1 3.93Å; W346-I361 HydrophobicContact CH2-CG1 4.19Å; W346-I361 HydrophobicContact CZ2-CD1 4.31Å; W346-I361 HydrophobicContact CZ3-CG1 4.46Å; I361-W363 HydrophobicContact CG2-CE3 4.21Å; I361-T384 CarbonylContact O-C 3.53Å; I361-T384 VanDerWaalsContact O-CA 3.31Å; I361-T384 WeakPolarHBondContact O-CA 3.1Å; I361-R385 WeakPolarHBondContact CD1-O 2.94Å; I361-R385 PolarHBondContact N-O 2.71Å; I361-R385 PolarHBondContact O-N 2.77Å; I361-I387 HydrophobicContact CD1-CB 4.08Å; I361-I387 HydrophobicContact CD1-CG1 3.42Å; I361-I387 VanDerWaalsContact CD1-CG1 3.42Å; I361-L396 HydrophobicContact CG2-CD2 4.22Å; I361-I407 HydrophobicContact CG2-CG2 4.23Å; I361-Q408 CarbonylContact C-O 3.59Å; I361-Q408 WeakPolarHBondContact CA-O 3.48Å; I361-V409 HydrophobicContact CG1-CG1 4.23Å; I361-V409 HydrophobicContact CG1-CG2 4.33Å; I361-V409 HydrophobicContact CG2-CG2 4.5Å
362	T	89	Confident	75.5	Confident	11 Å²	11	61.4 Å²	61.4	7%	0.067	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.2	175.6	58.5	0	0	0	0	110.6	L360 F383 T384 I407 Q408	L360-T362 HydrophobicContact CG-CG2 4.35Å; T362-F383 CarbonylContact C-O 3.52Å; T362-F383 WeakPolarHBondContact CA-O 3.31Å; T362-T384 HydrophobicContact CG2-CG2 4.04Å; T362-I407 CarbonylContact O-C 3.54Å; T362-I407 WeakPolarHBondContact O-CA 3.45Å; T362-Q408 PolarHBondContact N-O 2.89Å; T362-Q408 PolarHBondContact O-N 3.06Å; T362-Q408 WeakPolarHBondContact OG1-CB 3.31Å
363	W	85.5	Confident	73.4	Confident	18 Å²	18	65.8 Å²	65.8	7%	0.068	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	142.8	176.5	69.8	99	0	0	0	112.4	I361 F383 R385 L396 K406 I407	I361-W363 HydrophobicContact CG2-CE3 4.21Å; W363-F383 AromaticContact CD1-CD2 3.89Å; W363-F383 HydrophobicContact CD2-CB 3.56Å; W363-F383 HydrophobicContact CD2-CG 4.47Å; W363-F383 AromaticContact CE2-CG 3.75Å; W363-F383 HydrophobicContact CE3-CB 3.94Å; W363-F383 HydrophobicContact CG-CB 4.16Å; W363-F383 HydrophobicContact CH2-CB 3.66Å; W363-F383 HydrophobicContact CZ2-CB 3.27Å; W363-F383 HydrophobicContact CZ2-CD1 4.38Å; W363-F383 AromaticContact CZ2-CG 3.87Å; W363-F383 HydrophobicContact CZ2-CG 3.87Å; W363-F383 HydrophobicContact CZ3-CB 3.98Å; W363-F383 PolarHBondContact N-O 2.86Å; W363-F383 AromaticContact NE1-CD2 3.5Å; W363-F383 AromaticContact NE1-CG 3.67Å; W363-F383 PolarHBondContact O-N 2.75Å; W363-R385 HydrophobicContact CH2-CB 4.03Å; W363-R385 HydrophobicContact CZ3-CB 3.67Å; W363-L396 HydrophobicContact CD2-CD1 4.38Å; W363-L396 HydrophobicContact CD2-CD2 3.94Å; W363-L396 HydrophobicContact CE3-CD2 3.65Å; W363-L396 HydrophobicContact CG-CD1 4.39Å; W363-L396 HydrophobicContact CH2-CD2 4.02Å; W363-L396 HydrophobicContact CZ2-CD2 4.25Å; W363-L396 HydrophobicContact CZ3-CD2 3.7Å; W363-K406 VanDerWaalsContact CA-O 3.27Å; W363-K406 WeakPolarHBondContact CA-O 3.45Å; W363-I407 HydrophobicContact CB-CB 4.4Å; W363-I407 HydrophobicContact CB-CG1 3.56Å
364	S	82.3	Confident	71.2	Confident	34 Å²	34	69 Å²	69	24%	0.238	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	161.4	177.8	65.2	0	0	0	0	109.8	D366 Y405 K406	S364-D366 PolarHBondContact O-N 3.45Å; S364-Y405 CarbonylContact O-C 3.59Å; S364-Y405 VanDerWaalsContact O-CA 3.27Å; S364-Y405 WeakPolarHBondContact O-CA 3.23Å; S364-Y405 WeakPolarHBondContact O-CD1 3.36Å; S364-K406 PolarHBondContact N-O 3.43Å; S364-K406 PolarHBondContact O-N 2.74Å
365	I	78.7	Confident	68.5	Low	37 Å²	37	79.9 Å²	79.9	19%	0.19	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	132.8	173.1	-62.6	175.3	0	0	0	108.5	K400 T403 S404 Y405	I365-K400 HydrophobicContact CD1-CD 4.39Å; I365-T403 HydrophobicContact CB-CG2 4.45Å; I365-T403 HydrophobicContact CD1-CG2 4.1Å; I365-T403 HydrophobicContact CG1-CG2 3.92Å; I365-T403 HydrophobicContact CG2-CG2 3.83Å; I365-S404 CarbonylContact C-O 3.5Å; I365-S404 WeakPolarHBondContact CA-O 3.32Å; I365-Y405 HydrophobicContact CG1-CD1 4.27Å; I365-Y405 HydrophobicContact CG1-CE1 3.76Å
366	D	68.2	Low	65.8	Low	57 Å²	57	81.1 Å²	81.1	31%	0.305	43%	0.434	S	S	.	.			trans	-89.7	103.3	178.2	-174.1	34.4	0	0	0	110.1	S364 G368 S404 K406 F429	S364-D366 PolarHBondContact O-N 3.45Å; D366-G368 VanDerWaalsContact C-N 3.33Å; D366-G368 PolarHBondContact O-N 2.93Å; D366-S404 PolarHBondContact N-O 2.88Å; D366-K406 HydrophobicContact CB-CB 4.2Å; D366-F429 HydrophobicContact CB-CD1 4.23Å; D366-F429 WeakPolarHBondContact OD2-CD1 3.43Å
367	H	60.4	Low	63.2	Low	98 Å²	98	86.4 Å²	86.4	45%	0.454	46%	0.462	S	S	.	.			trans	-87.9	76.4	175.1	-60.5	-70.7	0	0	0	108.7	Y369	H367-Y369 VanDerWaalsContact C-N 3.27Å; H367-Y369 PolarHBondContact O-N 3.36Å
368	G	47.8	Very low	60.8	Low	56 Å²	56	88.8 Å²	88.8	58%	0.577	47%	0.469	S	S	*	.			trans	-63.2	85.7	174.8	0	0	0	0	0	111.3	D366	D366-G368 VanDerWaalsContact C-N 3.33Å; D366-G368 PolarHBondContact O-N 2.93Å
369	Y	39.3	Very low	58.2	Low	223 Å²	223	88.7 Å²	88.7	88%	0.875	48%	0.478	S	S	*	.	S	Bend	trans	98.5	124.6	-178.6	-61.3	-84.2	0	0	0	115.8	H367 H371	H367-Y369 VanDerWaalsContact C-N 3.27Å; H367-Y369 PolarHBondContact O-N 3.36Å; Y369-H371 PolarHBondContact O-N 3.37Å
370	L	34.1	Very low	56.1	Low	174 Å²	174	95.7 Å²	95.7	91%	0.911	52%	0.515	S	S	*	.			trans	-51.3	113.3	174.8	-69.6	158.6	0	0	0	110.6
371	H	37.4	Very low	54.5	Low	158 Å²	158	98.7 Å²	98.7	73%	0.731	53%	0.53	S	S	*	.			trans	-73.9	134	157.7	-130.8	64	0	0	0	107.7	Y369 D373	Y369-H371 PolarHBondContact O-N 3.37Å; H371-D373 IonicContact CD2-OD2 3.66Å; H371-D373 PolarHBondContact O-N 2.84Å
372	T	40.4	Very low	53.6	Low	135 Å²	135	104.1 Å²	104.1	83%	0.828	56%	0.555	S	S	*	*	S	Bend	trans	-66	14.4	-172.5	40.8	0	0	0	0	115.4
373	D	43.8	Very low	53.3	Low	105 Å²	105	108.1 Å²	108.1	56%	0.561	57%	0.572	S	S	*	*			trans	-124.8	78.2	-162.7	-51.6	11.6	0	0	0	105.9	H371 R375	H371-D373 IonicContact CD2-OD2 3.66Å; H371-D373 PolarHBondContact O-N 2.84Å; D373-R375 PolarHBondContact O-N 2.75Å
374	G	44.9	Very low	53.4	Low	82 Å²	82	111 Å²	111	85%	0.845	59%	0.592	S	S	*	*			trans	-65.1	45.9	-162.4	0	0	0	0	0	117.8
375	R	35	Very low	53.7	Low	234 Å²	234	113 Å²	113	88%	0.883	59%	0.594	S	S	*	*			trans	-149.3	83.9	177	-67.9	-173.5	177.7	176.3	-0.6	111.9	D373	D373-R375 PolarHBondContact O-N 2.75Å
376	T	35.9	Very low	54.3	Low	98 Å²	98	114.8 Å²	114.8	60%	0.601	61%	0.607	S	S	*	*			trans	-134.9	103.4	157.8	47.5	0	0	0	0	110	E378 A379	T376-E378 PolarHBondContact O-N 2.8Å; T376-E378 VanDerWaalsContact O-N 3.1Å; T376-A379 WeakPolarHBondContact O-CB 3.31Å; T376-A379 PolarHBondContact O-N 2.76Å; T376-A379 VanDerWaalsContact O-N 3.17Å
377	L	38.5	Very low	55.5	Low	154 Å²	154	113.3 Å²	113.3	81%	0.806	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-60.6	-17.6	179.7	-151.5	79.6	0	0	0	112.9	A379	L377-A379 VanDerWaalsContact C-N 3.26Å; L377-A379 PolarHBondContact O-N 2.79Å
378	E	41.5	Very low	57	Low	106 Å²	106	113 Å²	113	50%	0.495	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-69.8	-20.4	177.5	-62.6	-162.6	143	0	0	113.4	T376 L380 I381 K400	T376-E378 PolarHBondContact O-N 2.8Å; T376-E378 VanDerWaalsContact O-N 3.1Å; E378-L380 PolarHBondContact O-N 2.83Å; E378-I381 PolarHBondContact O-N 2.82Å; E378-K400 IonicContact OE1-NZ 2.86Å; E378-K400 PolarHBondContact OE1-NZ 2.77Å; E378-K400 IonicContact OE2-NZ 3.17Å; E378-K400 PolarHBondContact OE2-NZ 2.83Å
379	A	40.7	Very low	59	Low	55 Å²	55	111.4 Å²	111.4	46%	0.455	58%	0.581	S	S	.	*	G	3₁₀ helix	trans	-70	-9.9	-179.2	0	0	0	0	0	114.3	T376 L377	T376-A379 WeakPolarHBondContact O-CB 3.31Å; T376-A379 PolarHBondContact O-N 2.76Å; T376-A379 VanDerWaalsContact O-N 3.17Å; L377-A379 VanDerWaalsContact C-N 3.26Å; L377-A379 PolarHBondContact O-N 2.79Å
380	L	48.9	Very low	61.4	Low	148 Å²	148	109.1 Å²	109.1	78%	0.775	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-99.4	-6.4	179.5	-84.2	139	0	0	0	113.8	E378 Q382	E378-L380 PolarHBondContact O-N 2.83Å; L380-Q382 PolarHBondContact O-N 2.75Å
381	I	60.8	Low	64.1	Low	90 Å²	90	109.3 Å²	109.3	46%	0.462	57%	0.567	S	S	.	*			trans	-85.1	90.2	-173.2	-50.8	177.7	0	0	0	109.3	E378 F383	E378-I381 PolarHBondContact O-N 2.82Å; I381-F383 HydrophobicContact CG2-CD2 4.35Å; I381-F383 HydrophobicContact CG2-CE1 4.01Å; I381-F383 HydrophobicContact CG2-CE2 3.68Å; I381-F383 HydrophobicContact CG2-CZ 3.49Å; I381-F383 VanDerWaalsContact CG2-CZ 3.49Å
382	Q	73.4	Confident	66.7	Low	113 Å²	113	104.1 Å²	104.1	53%	0.528	55%	0.547	S	S	.	.			trans	-90.4	128.3	167.6	-179.1	176.8	-22.8	0	0	109.4	L380	L380-Q382 PolarHBondContact O-N 2.75Å
383	F	81.6	Confident	69.1	Low	95 Å²	95	102.3 Å²	102.3	42%	0.417	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	145.3	172.8	-60.2	-86.5	0	0	0	109.8	T362 W363 I381	T362-F383 CarbonylContact C-O 3.52Å; T362-F383 WeakPolarHBondContact CA-O 3.31Å; W363-F383 AromaticContact CD1-CD2 3.89Å; W363-F383 HydrophobicContact CD2-CB 3.56Å; W363-F383 HydrophobicContact CD2-CG 4.47Å; W363-F383 AromaticContact CE2-CG 3.75Å; W363-F383 HydrophobicContact CE3-CB 3.94Å; W363-F383 HydrophobicContact CG-CB 4.16Å; W363-F383 HydrophobicContact CH2-CB 3.66Å; W363-F383 HydrophobicContact CZ2-CB 3.27Å; W363-F383 HydrophobicContact CZ2-CD1 4.38Å; W363-F383 AromaticContact CZ2-CG 3.87Å; W363-F383 HydrophobicContact CZ2-CG 3.87Å; W363-F383 HydrophobicContact CZ3-CB 3.98Å; W363-F383 PolarHBondContact N-O 2.86Å; W363-F383 AromaticContact NE1-CD2 3.5Å; W363-F383 AromaticContact NE1-CG 3.67Å; W363-F383 PolarHBondContact O-N 2.75Å; I381-F383 HydrophobicContact CG2-CD2 4.35Å; I381-F383 HydrophobicContact CG2-CE1 4.01Å; I381-F383 HydrophobicContact CG2-CE2 3.68Å; I381-F383 HydrophobicContact CG2-CZ 3.49Å; I381-F383 VanDerWaalsContact CG2-CZ 3.49Å
384	T	87.7	Confident	71.3	Confident	79 Å²	79	97.7 Å²	97.7	49%	0.485	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	139.6	-178.7	-57.1	0	0	0	0	109.6	L360 I361 T362	L360-T384 HydrophobicContact CD1-CG2 3.32Å; L360-T384 HydrophobicContact CG-CG2 4.12Å; I361-T384 CarbonylContact O-C 3.53Å; I361-T384 VanDerWaalsContact O-CA 3.31Å; I361-T384 WeakPolarHBondContact O-CA 3.1Å; T362-T384 HydrophobicContact CG2-CG2 4.04Å
385	R	89.5	Confident	73.3	Confident	75 Å²	75	96.9 Å²	96.9	28%	0.283	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	133.5	174.4	-172.8	177.5	-70	-161.9	6.1	109.8	I361 W363 I387 I395 D397	I361-R385 WeakPolarHBondContact CD1-O 2.94Å; I361-R385 PolarHBondContact N-O 2.71Å; I361-R385 PolarHBondContact O-N 2.77Å; W363-R385 HydrophobicContact CH2-CB 4.03Å; W363-R385 HydrophobicContact CZ3-CB 3.67Å; R385-I387 HydrophobicContact CG-CD1 4.15Å; R385-I395 PolarHBondContact NH1-O 3.18Å; R385-I395 PolarHBondContact NH2-O 3.49Å; R385-D397 IonicContact CZ-OD2 2.67Å; R385-D397 IonicContact NH1-OD2 3.82Å; R385-D397 IonicContact NH2-OD2 2.85Å; R385-D397 PolarHBondContact NH2-OD2 2.78Å
386	T	91.5	Very high	75.7	Confident	75 Å²	75	85.8 Å²	85.8	46%	0.46	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.9	177.4	-52.8	0	0	0	0	109.7	E358 Y359	E358-T386 HydrophobicContact CB-CG2 3.83Å; E358-T386 HydrophobicContact CG-CG2 4.09Å; E358-T386 WeakPolarHBondContact OE2-CG2 3.38Å; Y359-T386 WeakPolarHBondContact O-CA 3.35Å
387	I	91.8	Very high	78	Confident	27 Å²	27	83.7 Å²	83.7	14%	0.138	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	137	-178.4	-59.6	-66.8	0	0	0	108.5	W346 E358 Y359 I361 R385 R391 C394	W346-I387 HydrophobicContact CH2-CG1 4.43Å; W346-I387 HydrophobicContact CZ2-CG2 4.35Å; E358-I387 CarbonylContact C-O 3.56Å; E358-I387 WeakPolarHBondContact CA-O 3.49Å; E358-I387 WeakPolarHBondContact CB-O 3.31Å; Y359-I387 PolarHBondContact N-O 2.86Å; Y359-I387 PolarHBondContact O-N 3.14Å; I361-I387 HydrophobicContact CD1-CB 4.08Å; I361-I387 HydrophobicContact CD1-CG1 3.42Å; I361-I387 VanDerWaalsContact CD1-CG1 3.42Å; R385-I387 HydrophobicContact CG-CD1 4.15Å; I387-R391 HydrophobicContact CG2-CB 3.65Å; I387-C394 HydrophobicContact CD1-CB 3.82Å; I387-C394 HydrophobicContact CG1-CB 4.01Å
388	N	93.1	Very high	80	Confident	92 Å²	92	81.5 Å²	81.5	49%	0.492	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	142.9	175.7	-176.7	-54.6	0	0	0	110.8	E390 R391	N388-E390 PolarHBondContact O-N 2.93Å; N388-E390 VanDerWaalsContact O-N 3.07Å; N388-E390 PolarHBondContact OD1-N 2.72Å; N388-R391 PolarHBondContact O-N 2.83Å
389	A	89.7	Confident	81.8	Confident	21 Å²	21	76.7 Å²	76.7	17%	0.174	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-24.1	-179.5	0	0	0	0	0	115.7	L356 T357 R391	L356-A389 HydrophobicContact CB-CB 3.64Å; L356-A389 WeakPolarHBondContact O-CB 3.42Å; T357-A389 WeakPolarHBondContact O-CB 3.27Å; T357-A389 PolarHBondContact O-N 2.75Å; T357-A389 VanDerWaalsContact O-N 3.14Å; A389-R391 PolarHBondContact O-N 3.25Å
390	E	89.4	Confident	83.4	Confident	176 Å²	176	77.3 Å²	77.3	82%	0.822	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-20.4	175.3	-67.2	-179.7	179.8	0	0	113.4	N388	N388-E390 PolarHBondContact O-N 2.93Å; N388-E390 VanDerWaalsContact O-N 3.07Å; N388-E390 PolarHBondContact OD1-N 2.72Å
391	R	90.6	Very high	84.6	Confident	177 Å²	177	72.5 Å²	72.5	67%	0.668	36%	0.361	S	S	*	.			trans	-106.9	130.8	-178.2	-62.5	-175.3	-175.8	-168.2	1.2	110.7	Y359 I387 N388 A389	Y359-R391 WeakPolarHBondContact CD2-O 3.47Å; I387-R391 HydrophobicContact CG2-CB 3.65Å; N388-R391 PolarHBondContact O-N 2.83Å; A389-R391 PolarHBondContact O-N 3.25Å
392	T	91.4	Very high	85	Confident	50 Å²	50	71.6 Å²	71.6	31%	0.307	37%	0.366	S	S	.	.			trans	-116.3	23.5	180	64.6	0	0	0	0	113	W346 P348 Y359	W346-T392 PolarHBondContact N-O 2.89Å; W346-T392 VanDerWaalsContact O-CB 3.29Å; W346-T392 WeakPolarHBondContact O-CB 3.44Å; W346-T392 PolarHBondContact O-OG1 2.93Å; P348-T392 HydrophobicContact CG-CG2 4.11Å; Y359-T392 HydrophobicContact CE2-CG2 4.42Å
393	E	91.6	Very high	84.9	Confident	96 Å²	96	67.3 Å²	67.3	45%	0.449	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	148.4	175.4	60.8	178.4	-150.2	0	0	111.9	L343 L344 K345	L343-E393 HydrophobicContact CD1-CB 4.31Å; L344-E393 CarbonylContact O-C 3.52Å; L344-E393 WeakPolarHBondContact O-CA 3.37Å; L344-E393 WeakPolarHBondContact O-CB 3.45Å; K345-E393 WeakPolarHBondContact CE-OE2 3.37Å; K345-E393 HydrophobicContact CG-CB 3.93Å; K345-E393 IonicContact NZ-OE2 3.27Å; K345-E393 PolarHBondContact NZ-OE2 2.95Å
394	C	89.4	Confident	84.7	Confident	8 Å²	8	65 Å²	65	5%	0.054	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	151.9	174	77.1	0	0	0	0	112.3	L344 W346 I387	L344-C394 PolarHBondContact N-O 3.2Å; L344-C394 PolarHBondContact O-N 2.76Å; W346-C394 HydrophobicContact CH2-CB 3.9Å; W346-C394 HydrophobicContact CZ3-CB 4.21Å; I387-C394 HydrophobicContact CD1-CB 3.82Å; I387-C394 HydrophobicContact CG1-CB 4.01Å
395	I	88	Confident	84.2	Confident	66 Å²	66	61.8 Å²	61.8	34%	0.338	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	116.4	177.2	-54.3	174.7	0	0	0	109.2	N341 L342 L343 R385 D397	N341-I395 HydrophobicContact CB-CG2 4.1Å; L342-I395 CarbonylContact O-C 3.55Å; L342-I395 VanDerWaalsContact O-CA 3.29Å; L342-I395 WeakPolarHBondContact O-CA 3.23Å; L343-I395 HydrophobicContact CD1-CG1 3.82Å; R385-I395 PolarHBondContact NH1-O 3.18Å; R385-I395 PolarHBondContact NH2-O 3.49Å; I395-D397 WeakPolarHBondContact CG2-OD1 3.14Å
396	L	85.9	Confident	83.8	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	115.1	168.6	-59.4	-176.7	0	0	0	109	N341 L342 I361 W363 L399 I407	N341-L396 CarbonylContact C-O 3.56Å; N341-L396 VanDerWaalsContact CA-O 3.26Å; N341-L396 WeakPolarHBondContact CA-O 3.2Å; L342-L396 HydrophobicContact CB-CB 4.46Å; L342-L396 HydrophobicContact CD2-CD1 4.35Å; L342-L396 PolarHBondContact N-O 3.14Å; L342-L396 PolarHBondContact O-N 2.79Å; I361-L396 HydrophobicContact CG2-CD2 4.22Å; W363-L396 HydrophobicContact CD2-CD1 4.38Å; W363-L396 HydrophobicContact CD2-CD2 3.94Å; W363-L396 HydrophobicContact CE3-CD2 3.65Å; W363-L396 HydrophobicContact CG-CD1 4.39Å; W363-L396 HydrophobicContact CH2-CD2 4.02Å; W363-L396 HydrophobicContact CZ2-CD2 4.25Å; W363-L396 HydrophobicContact CZ3-CD2 3.7Å; L396-L399 HydrophobicContact CB-CD1 4.28Å; L396-I407 HydrophobicContact CD1-CD1 3.74Å; L396-I407 HydrophobicContact CD1-CG1 4.01Å; L396-I407 HydrophobicContact CD1-CG2 4.38Å
397	D	84.1	Confident	83.5	Confident	55 Å²	55	58 Å²	58	29%	0.294	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	156.4	-172.1	-50.2	-69.2	0	0	0	112.4	N341 R385 I395 L399	N341-D397 PolarHBondContact ND2-OD1 3.28Å; N341-D397 WeakPolarHBondContact OD1-CA 3.37Å; R385-D397 IonicContact CZ-OD2 2.67Å; R385-D397 IonicContact NH1-OD2 3.82Å; R385-D397 IonicContact NH2-OD2 2.85Å; R385-D397 PolarHBondContact NH2-OD2 2.78Å; I395-D397 WeakPolarHBondContact CG2-OD1 3.14Å; D397-L399 VanDerWaalsContact C-N 3.31Å; D397-L399 PolarHBondContact O-N 3.06Å
398	N	78.9	Confident	83.4	Confident	108 Å²	108	58.8 Å²	58.8	58%	0.578	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	62.1	28.3	170.6	-61.6	-44.8	0	0	0	115.8	K339 N341	K339-N398 HydrophobicContact CD-CB 4.46Å; N341-N398 PolarHBondContact OD1-N 3.25Å
399	L	81.1	Confident	83.3	Confident	4 Å²	4	54.4 Å²	54.4	2%	0.021	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	144.4	174.2	-55.5	177.5	0	0	0	110.5	V340 L342 L396 D397 Y405 T432	V340-L399 HydrophobicContact CB-CB 4.36Å; V340-L399 PolarHBondContact N-O 2.97Å; V340-L399 VanDerWaalsContact N-O 3.11Å; V340-L399 WeakPolarHBondContact O-CB 3.4Å; V340-L399 PolarHBondContact O-N 3.2Å; L342-L399 HydrophobicContact CB-CD1 4Å; L342-L399 HydrophobicContact CD2-CD1 4.38Å; L396-L399 HydrophobicContact CB-CD1 4.28Å; D397-L399 VanDerWaalsContact C-N 3.31Å; D397-L399 PolarHBondContact O-N 3.06Å; L399-Y405 HydrophobicContact CB-CE2 3.9Å; L399-Y405 HydrophobicContact CD2-CD1 4.33Å; L399-Y405 HydrophobicContact CD2-CE1 3.96Å; L399-Y405 HydrophobicContact CD2-CE2 4.18Å; L399-Y405 HydrophobicContact CG-CE2 4.47Å; L399-T432 HydrophobicContact CB-CG2 4.14Å; L399-T432 HydrophobicContact CD1-CG2 4.43Å
400	K	73.9	Confident	83.5	Confident	68 Å²	68	55.7 Å²	55.7	30%	0.296	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-69.5	138.8	175.5	-68.5	-176.4	179.8	-176.3	0	108.6	I365 E378 T403 Y405 T432	I365-K400 HydrophobicContact CD1-CD 4.39Å; E378-K400 IonicContact OE1-NZ 2.86Å; E378-K400 PolarHBondContact OE1-NZ 2.77Å; E378-K400 IonicContact OE2-NZ 3.17Å; E378-K400 PolarHBondContact OE2-NZ 2.83Å; K400-T403 HydrophobicContact CB-CG2 4.43Å; K400-T403 VanDerWaalsContact CB-OG1 3.29Å; K400-T403 WeakPolarHBondContact CB-OG1 3.38Å; K400-Y405 PolarHBondContact N-OH 3.17Å; K400-T432 WeakPolarHBondContact O-CB 3.47Å; K400-T432 WeakPolarHBondContact O-CG2 3.41Å; K400-T432 PolarHBondContact O-OG1 3.49Å
401	P	73	Confident	83.7	Confident	48 Å²	48	47.3 Å²	47.3	31%	0.312	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	161.3	173.1	31.5	-34.2	0	0	0	110.5	G338 V340 T403 T432	G338-P401 VanDerWaalsContact O-CD 3.28Å; G338-P401 WeakPolarHBondContact O-CD 3.23Å; G338-P401 VanDerWaalsContact O-CG 3.3Å; G338-P401 WeakPolarHBondContact O-CG 3.3Å; V340-P401 HydrophobicContact CG2-CB 4.3Å; P401-T403 PolarHBondContact O-N 3.28Å; P401-T403 VanDerWaalsContact O-N 3.08Å; P401-T403 PolarHBondContact O-OG1 3Å; P401-T432 VanDerWaalsContact CA-OG1 3.28Å; P401-T432 WeakPolarHBondContact CA-OG1 3.19Å
402	A	69.2	Low	83.9	Confident	70 Å²	70	38.9 Å²	38.9	58%	0.579	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.1	33.8	-179.7	0	0	0	0	0	114.5	T432 Q433	A402-T432 VanDerWaalsContact CA-O 3.22Å; A402-T432 WeakPolarHBondContact CA-O 3.32Å; A402-T432 PolarHBondContact N-O 2.7Å; A402-T432 PolarHBondContact N-OG1 2.81Å; A402-Q433 PolarHBondContact N-O 3.33Å; A402-Q433 VanDerWaalsContact N-O 3.12Å
403	T	72.3	Confident	84	Confident	24 Å²	24	36.5 Å²	36.5	15%	0.147	20%	0.198	C	C	.	.			trans	-127.2	132.9	-173.7	-55.5	0	0	0	0	110	I365 K400 P401 Y405 T432	I365-T403 HydrophobicContact CB-CG2 4.45Å; I365-T403 HydrophobicContact CD1-CG2 4.1Å; I365-T403 HydrophobicContact CG1-CG2 3.92Å; I365-T403 HydrophobicContact CG2-CG2 3.83Å; K400-T403 HydrophobicContact CB-CG2 4.43Å; K400-T403 VanDerWaalsContact CB-OG1 3.29Å; K400-T403 WeakPolarHBondContact CB-OG1 3.38Å; P401-T403 PolarHBondContact O-N 3.28Å; P401-T403 VanDerWaalsContact O-N 3.08Å; P401-T403 PolarHBondContact O-OG1 3Å; T403-Y405 HydrophobicContact CG2-CD2 4.3Å; T403-Y405 HydrophobicContact CG2-CE2 3.76Å; T403-T432 PolarHBondContact N-OG1 3.16Å; T403-T432 PolarHBondContact O-N 3.42Å; T403-T432 PolarHBondContact O-OG1 2.84Å
404	S	76.5	Confident	84.1	Confident	47 Å²	47	36.2 Å²	36.2	33%	0.329	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	136.4	173.2	-63.8	0	0	0	0	110.6	I365 D366 L430 S431	I365-S404 CarbonylContact C-O 3.5Å; I365-S404 WeakPolarHBondContact CA-O 3.32Å; D366-S404 PolarHBondContact N-O 2.88Å; S404-L430 CarbonylContact C-O 3.58Å; S404-L430 WeakPolarHBondContact CA-O 3.39Å; S404-S431 PolarHBondContact OG-OG 3.49Å
405	Y	78.5	Confident	84.3	Confident	10 Å²	10	36.3 Å²	36.3	4%	0.039	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	137.7	179.8	-73.9	-88	0	0	0	110.6	S364 I365 L399 K400 T403 F429 L430 T432	S364-Y405 CarbonylContact O-C 3.59Å; S364-Y405 VanDerWaalsContact O-CA 3.27Å; S364-Y405 WeakPolarHBondContact O-CA 3.23Å; S364-Y405 WeakPolarHBondContact O-CD1 3.36Å; I365-Y405 HydrophobicContact CG1-CD1 4.27Å; I365-Y405 HydrophobicContact CG1-CE1 3.76Å; L399-Y405 HydrophobicContact CB-CE2 3.9Å; L399-Y405 HydrophobicContact CD2-CD1 4.33Å; L399-Y405 HydrophobicContact CD2-CE1 3.96Å; L399-Y405 HydrophobicContact CD2-CE2 4.18Å; L399-Y405 HydrophobicContact CG-CE2 4.47Å; K400-Y405 PolarHBondContact N-OH 3.17Å; T403-Y405 HydrophobicContact CG2-CD2 4.3Å; T403-Y405 HydrophobicContact CG2-CE2 3.76Å; Y405-F429 WeakPolarHBondContact O-CA 3.26Å; Y405-L430 PolarHBondContact N-O 2.92Å; Y405-L430 PolarHBondContact O-N 3.32Å; Y405-T432 HydrophobicContact CD2-CG2 3.98Å; Y405-T432 HydrophobicContact CE2-CG2 3.9Å
406	K	80.7	Confident	84.5	Confident	71 Å²	71	34.9 Å²	34.9	31%	0.309	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	120.6	165	180	-177.5	179.6	-175.9	0	107.9	W363 S364 D366 Q408 T427 F429	W363-K406 VanDerWaalsContact CA-O 3.27Å; W363-K406 WeakPolarHBondContact CA-O 3.45Å; S364-K406 PolarHBondContact N-O 3.43Å; S364-K406 PolarHBondContact O-N 2.74Å; D366-K406 HydrophobicContact CB-CB 4.2Å; K406-Q408 HydrophobicContact CG-CG 4.49Å; K406-T427 HydrophobicContact CD-CG2 4.42Å; K406-T427 HydrophobicContact CG-CG2 3.88Å; K406-F429 HydrophobicContact CB-CD1 3.98Å; K406-F429 HydrophobicContact CB-CE1 3.8Å; K406-F429 HydrophobicContact CD-CE1 3.98Å; K406-F429 HydrophobicContact CD-CZ 4.28Å; K406-F429 HydrophobicContact CG-CD1 4.19Å; K406-F429 HydrophobicContact CG-CE1 3.66Å; K406-F429 HydrophobicContact CG-CZ 4.12Å
407	I	85.1	Confident	84.6	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	132.8	179.8	-67.6	152	0	0	0	108.5	L342 L344 I361 T362 W363 L396 T427 I428 L430	L342-I407 HydrophobicContact CD2-CD1 4.15Å; L344-I407 HydrophobicContact CD1-CG2 4.46Å; L344-I407 HydrophobicContact CD2-CG2 3.94Å; I361-I407 HydrophobicContact CG2-CG2 4.23Å; T362-I407 CarbonylContact O-C 3.54Å; T362-I407 WeakPolarHBondContact O-CA 3.45Å; W363-I407 HydrophobicContact CB-CB 4.4Å; W363-I407 HydrophobicContact CB-CG1 3.56Å; L396-I407 HydrophobicContact CD1-CD1 3.74Å; L396-I407 HydrophobicContact CD1-CG1 4.01Å; L396-I407 HydrophobicContact CD1-CG2 4.38Å; I407-T427 CarbonylContact O-C 3.43Å; I407-T427 VanDerWaalsContact O-CA 3.31Å; I407-T427 WeakPolarHBondContact O-CA 3.26Å; I407-I428 HydrophobicContact CB-CG1 3.99Å; I407-I428 HydrophobicContact CG2-CG1 4.31Å; I407-I428 PolarHBondContact N-O 3.05Å; I407-I428 PolarHBondContact O-N 2.97Å; I407-L430 HydrophobicContact CD1-CB 4.28Å; I407-L430 HydrophobicContact CD1-CD1 3.23Å; I407-L430 HydrophobicContact CD1-CG 4.16Å
408	Q	88.8	Confident	84.9	Confident	43 Å²	43	39.2 Å²	39.2	20%	0.201	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	132.8	177.7	-50.4	-169.7	-74.2	0	0	109.8	I361 T362 K406 P425 N426 T427	I361-Q408 CarbonylContact C-O 3.59Å; I361-Q408 WeakPolarHBondContact CA-O 3.48Å; T362-Q408 PolarHBondContact N-O 2.89Å; T362-Q408 PolarHBondContact O-N 3.06Å; T362-Q408 WeakPolarHBondContact OG1-CB 3.31Å; K406-Q408 HydrophobicContact CG-CG 4.49Å; Q408-P425 HydrophobicContact CB-CB 3.94Å; Q408-P425 HydrophobicContact CG-CB 4.5Å; Q408-N426 CarbonylContact C-O 3.48Å; Q408-N426 WeakPolarHBondContact CA-O 3.28Å; Q408-T427 HydrophobicContact CG-CG2 4.04Å; Q408-T427 PolarHBondContact NE2-OG1 2.96Å
409	V	91	Very high	85.5	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	123.3	176.1	-170.4	0	0	0	0	108.1	P324 V327 L344 W346 L360 I361 N426	P324-V409 HydrophobicContact CB-CG1 4.15Å; P324-V409 HydrophobicContact CG-CB 4.37Å; P324-V409 HydrophobicContact CG-CG1 3.87Å; V327-V409 HydrophobicContact CG1-CG2 3.7Å; V327-V409 HydrophobicContact CG2-CB 4.21Å; V327-V409 HydrophobicContact CG2-CG2 4.18Å; L344-V409 HydrophobicContact CD2-CG2 3.75Å; W346-V409 HydrophobicContact CD2-CG1 4.16Å; W346-V409 HydrophobicContact CE3-CG1 4.49Å; W346-V409 HydrophobicContact CG-CG1 4.39Å; L360-V409 WeakPolarHBondContact O-CA 3.4Å; I361-V409 HydrophobicContact CG1-CG1 4.23Å; I361-V409 HydrophobicContact CG1-CG2 4.33Å; I361-V409 HydrophobicContact CG2-CG2 4.5Å; V409-N426 PolarHBondContact N-O 3.07Å; V409-N426 PolarHBondContact O-N 2.89Å
410	K	93.5	Very high	86.1	Confident	48 Å²	48	38.9 Å²	38.9	21%	0.209	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	149.7	173.5	-63	174.8	174.3	-178.3	0	110.1	Y359 L360 E422 S423 P425	Y359-K410 CarbonylContact C-O 3.54Å; Y359-K410 VanDerWaalsContact CA-O 3.24Å; Y359-K410 WeakPolarHBondContact CA-O 3.22Å; L360-K410 HydrophobicContact CB-CB 4.33Å; L360-K410 HydrophobicContact CD2-CD 4.43Å; L360-K410 PolarHBondContact N-O 3.48Å; L360-K410 PolarHBondContact O-N 3.04Å; K410-E422 IonicContact NZ-OE2 2.79Å; K410-E422 PolarHBondContact NZ-OE2 3.02Å; K410-S423 WeakPolarHBondContact CA-OG 3.07Å; K410-P425 HydrophobicContact CG-CB 3.81Å
411	A	94.3	Very high	87	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	144.3	167	0	0	0	0	0	109.3	P321 P324 P349 L356 Y359 S423	P321-A411 HydrophobicContact CB-CB 4.17Å; P321-A411 HydrophobicContact CG-CB 4.19Å; P321-A411 WeakPolarHBondContact CG-O 3.21Å; P324-A411 HydrophobicContact CG-CB 4.12Å; P349-A411 HydrophobicContact CG-CB 3.72Å; L356-A411 HydrophobicContact CD2-CB 4.02Å; Y359-A411 HydrophobicContact CD1-CB 3.99Å; Y359-A411 HydrophobicContact CE1-CB 3.85Å; A411-S423 PolarHBondContact N-OG 3Å; A411-S423 WeakPolarHBondContact O-CB 3.39Å; A411-S423 PolarHBondContact O-N 3.22Å; A411-S423 PolarHBondContact O-OG 3.27Å
412	T	94.8	Very high	87.9	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	138.2	178	-53.1	0	0	0	0	109.7	T357 E358 N420 L421 E422	T357-T412 PolarHBondContact N-O 3.15Å; T357-T412 PolarHBondContact OG1-O 3.08Å; T357-T412 VanDerWaalsContact OG1-O 3.14Å; E358-T412 HydrophobicContact CG-CG2 4.19Å; E358-T412 PolarHBondContact N-O 3.22Å; E358-T412 PolarHBondContact O-N 3.2Å; T412-N420 HydrophobicContact CG2-CB 3.73Å; T412-L421 WeakPolarHBondContact CA-O 3.46Å; T412-E422 HydrophobicContact CG2-CG 4.46Å
413	S	93.8	Very high	89.1	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	156.6	164.2	63	0	0	0	0	110.2	P355 N420 L421	P355-S413 WeakPolarHBondContact O-CB 3.42Å; S413-N420 CarbonylContact O-C 3.58Å; S413-N420 WeakPolarHBondContact O-CA 3.47Å; S413-L421 PolarHBondContact N-O 3.48Å; S413-L421 PolarHBondContact O-N 3.47Å
414	Y	93	Very high	90	Very high	90 Å²	90	40.7 Å²	40.7	35%	0.353	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	130.1	-179.7	179.5	-103.9	0	0	0	110.8	H416 N420	Y414-H416 HydrophobicContact CE1-CB 3.99Å; Y414-H416 PolarHBondContact OH-ND1 3.34Å; Y414-N420 WeakPolarHBondContact CD2-OD1 3.41Å
415	W	93.8	Very high	90.6	Very high	9 Å²	9	40.4 Å²	40.4	3%	0.034	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	113.6	173.9	-169.6	39.2	0	0	0	110.1	C256 Q257 G286 P315 R317 P318 L354 G417 F418 G419 L421	C256-W415 VanDerWaalsContact C-NE1 3.3Å; C256-W415 PolarHBondContact O-NE1 2.91Å; Q257-W415 HydrophobicContact CB-CH2 3.91Å; Q257-W415 HydrophobicContact CB-CZ2 3.76Å; Q257-W415 HydrophobicContact CB-CZ3 4.44Å; Q257-W415 HydrophobicContact CG-CH2 3.86Å; Q257-W415 HydrophobicContact CG-CZ2 4.12Å; Q257-W415 HydrophobicContact CG-CZ3 4.5Å; G286-W415 PolarHBondContact O-NE1 3.36Å; P315-W415 HydrophobicContact CG-CZ2 4.13Å; R317-W415 HydrophobicContact CG-CH2 4.32Å; R317-W415 HydrophobicContact CG-CZ3 3.88Å; P318-W415 HydrophobicContact CG-CB 4.36Å; P318-W415 HydrophobicContact CG-CD2 3.71Å; P318-W415 HydrophobicContact CG-CE3 3.99Å; P318-W415 HydrophobicContact CG-CG 3.86Å; L354-W415 HydrophobicContact CD1-CB 3.7Å; L354-W415 HydrophobicContact CD1-CG 4.03Å; W415-G417 PolarHBondContact O-N 3.11Å; W415-F418 HydrophobicContact CB-CB 4.38Å; W415-F418 HydrophobicContact CD2-CB 4Å; W415-F418 HydrophobicContact CE3-CB 3.22Å; W415-F418 HydrophobicContact CE3-CD1 4.14Å; W415-F418 HydrophobicContact CE3-CD2 4.42Å; W415-F418 AromaticContact CE3-CG 3.65Å; W415-F418 HydrophobicContact CE3-CG 3.65Å; W415-F418 HydrophobicContact CG-CB 4.5Å; W415-F418 HydrophobicContact CZ3-CB 3.75Å; W415-F418 HydrophobicContact CZ3-CD2 4.32Å; W415-F418 HydrophobicContact CZ3-CG 4Å; W415-F418 PolarHBondContact O-N 2.87Å; W415-G419 PolarHBondContact N-O 3.5Å; W415-G419 PolarHBondContact O-N 3.1Å; W415-L421 HydrophobicContact CB-CD1 4.19Å
416	H	91.4	Very high	91	Very high	37 Å²	37	42 Å²	42	17%	0.171	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-63.7	132	-173	-176.4	73	0	0	0	111.5	I255 C256 Q257 D260 Y263 Y414 F418	I255-H416 WeakPolarHBondContact O-CB 3.33Å; I255-H416 PolarHBondContact O-N 2.97Å; I255-H416 VanDerWaalsContact O-N 3.1Å; C256-H416 HydrophobicContact CB-CB 4.18Å; Q257-H416 PolarHBondContact N-O 3.19Å; D260-H416 IonicContact OD2-NE2 2.84Å; Y263-H416 AromaticContact CD2-CD2 3.97Å; Y263-H416 AromaticContact CD2-CE1 3.63Å; Y263-H416 AromaticContact CD2-CG 3.98Å; Y263-H416 AromaticContact CD2-ND1 3.79Å; Y263-H416 AromaticContact CD2-NE2 3.78Å; Y263-H416 AromaticContact CE1-ND1 3.86Å; Y263-H416 AromaticContact CE2-CE1 3.13Å; Y263-H416 WeakPolarHBondContact CE2-CE1 3.37Å; Y263-H416 AromaticContact CE2-ND1 3.48Å; Y263-H416 WeakPolarHBondContact CE2-ND1 3.42Å; Y263-H416 AromaticContact CE2-NE2 3.69Å; Y263-H416 AromaticContact CZ-CE1 3.54Å; Y263-H416 AromaticContact CZ-ND1 3.5Å; Y414-H416 HydrophobicContact CE1-CB 3.99Å; Y414-H416 PolarHBondContact OH-ND1 3.34Å; H416-F418 VanDerWaalsContact C-N 3.33Å
417	G	88.4	Confident	91.2	Very high	56 Å²	56	40.9 Å²	40.9	58%	0.577	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.6	-24.9	-172.3	0	0	0	0	0	114.6	Q257 W415	Q257-G417 PolarHBondContact OE1-O 3.34Å; W415-G417 PolarHBondContact O-N 3.11Å
418	F	90.8	Very high	91	Very high	89 Å²	89	42.1 Å²	42.1	39%	0.39	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-38.9	177.2	-174.2	-97	0	0	0	113.4	W415 H416 L421	W415-F418 HydrophobicContact CB-CB 4.38Å; W415-F418 HydrophobicContact CD2-CB 4Å; W415-F418 HydrophobicContact CE3-CB 3.22Å; W415-F418 HydrophobicContact CE3-CD1 4.14Å; W415-F418 HydrophobicContact CE3-CD2 4.42Å; W415-F418 AromaticContact CE3-CG 3.65Å; W415-F418 HydrophobicContact CE3-CG 3.65Å; W415-F418 HydrophobicContact CG-CB 4.5Å; W415-F418 HydrophobicContact CZ3-CB 3.75Å; W415-F418 HydrophobicContact CZ3-CD2 4.32Å; W415-F418 HydrophobicContact CZ3-CG 4Å; W415-F418 PolarHBondContact O-N 2.87Å; H416-F418 VanDerWaalsContact C-N 3.33Å; F418-L421 HydrophobicContact CD1-CD2 3.68Å; F418-L421 HydrophobicContact CD1-CG 4.4Å; F418-L421 HydrophobicContact CE1-CD2 3.5Å
419	G	91.8	Very high	90.6	Very high	21 Å²	21	45.7 Å²	45.7	22%	0.216	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	108.1	-155.9	-178.8	0	0	0	0	0	113.8	W415	W415-G419 PolarHBondContact N-O 3.5Å; W415-G419 PolarHBondContact O-N 3.1Å
420	N	92.4	Very high	89.6	Confident	85 Å²	85	46.5 Å²	46.5	46%	0.455	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	135.7	-177.2	-73.9	-16.5	0	0	0	111.9	T412 S413 Y414	T412-N420 HydrophobicContact CG2-CB 3.73Å; S413-N420 CarbonylContact O-C 3.58Å; S413-N420 WeakPolarHBondContact O-CA 3.47Å; Y414-N420 WeakPolarHBondContact CD2-OD1 3.41Å
421	L	93	Very high	88.6	Confident	11 Å²	11	48 Å²	48	6%	0.058	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	104.9	172.9	-61.8	169.3	0	0	0	108.4	P318 P320 P321 L354 T412 S413 W415 F418	P318-L421 HydrophobicContact CB-CD1 4.33Å; P318-L421 HydrophobicContact CG-CD1 3.86Å; P320-L421 HydrophobicContact CB-CB 4.38Å; P321-L421 WeakPolarHBondContact CD-O 3.42Å; P321-L421 WeakPolarHBondContact CG-O 3.49Å; L354-L421 HydrophobicContact CD1-CD1 4.13Å; T412-L421 WeakPolarHBondContact CA-O 3.46Å; S413-L421 PolarHBondContact N-O 3.48Å; S413-L421 PolarHBondContact O-N 3.47Å; W415-L421 HydrophobicContact CB-CD1 4.19Å; F418-L421 HydrophobicContact CD1-CD2 3.68Å; F418-L421 HydrophobicContact CD1-CG 4.4Å; F418-L421 HydrophobicContact CE1-CD2 3.5Å
422	E	93.6	Very high	87.5	Confident	86 Å²	86	48.3 Å²	48.3	40%	0.402	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	139.5	-179.9	-65	-174.1	-172.4	0	0	112	P320 K410 T412	P320-E422 WeakPolarHBondContact CB-O 3.3Å; K410-E422 IonicContact NZ-OE2 2.79Å; K410-E422 PolarHBondContact NZ-OE2 3.02Å; T412-E422 HydrophobicContact CG2-CG 4.46Å
423	S	92.9	Very high	86.1	Confident	4 Å²	4	54.9 Å²	54.9	3%	0.028	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-70	164.5	171.5	77.8	0	0	0	0	112	P321 G322 K410 A411	P321-S423 VanDerWaalsContact O-CA 3.24Å; P321-S423 WeakPolarHBondContact O-CA 3.44Å; P321-S423 WeakPolarHBondContact O-CB 3.04Å; G322-S423 WeakPolarHBondContact O-CB 3.07Å; K410-S423 WeakPolarHBondContact CA-OG 3.07Å; A411-S423 PolarHBondContact N-OG 3Å; A411-S423 WeakPolarHBondContact O-CB 3.39Å; A411-S423 PolarHBondContact O-N 3.22Å; A411-S423 PolarHBondContact O-OG 3.27Å
424	Q	91.8	Very high	84.4	Confident	146 Å²	146	58.4 Å²	58.4	68%	0.682	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-58.2	143.9	156.8	-65.6	-59.4	-41.7	0	0	109.8	P323	P323-Q424 WeakPolarHBondContact CB-O 3.37Å
425	P	89.4	Confident	82.5	Confident	41 Å²	41	57.9 Å²	57.9	27%	0.266	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-75.3	136.3	-179.8	27.8	-31.9	0	0	0	111.8	Q408 K410	Q408-P425 HydrophobicContact CB-CB 3.94Å; Q408-P425 HydrophobicContact CG-CB 4.5Å; K410-P425 HydrophobicContact CG-CB 3.81Å
426	N	87.4	Confident	80.1	Confident	44 Å²	44	65.2 Å²	65.2	24%	0.235	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	120.7	158.6	-169.2	-39.9	0	0	0	108.3	P324 V327 Q408 V409	P324-N426 WeakPolarHBondContact O-CB 3.32Å; P324-N426 PolarHBondContact O-ND2 3.37Å; V327-N426 HydrophobicContact CG2-CB 3.72Å; V327-N426 VanDerWaalsContact CG2-CG 3.47Å; Q408-N426 CarbonylContact C-O 3.48Å; Q408-N426 WeakPolarHBondContact CA-O 3.28Å; V409-N426 PolarHBondContact N-O 3.07Å; V409-N426 PolarHBondContact O-N 2.89Å
427	T	84.6	Confident	77.6	Confident	47 Å²	47	68.6 Å²	68.6	29%	0.288	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	127.9	-172.5	-56.9	0	0	0	0	110.2	K406 I407 Q408 F429	K406-T427 HydrophobicContact CD-CG2 4.42Å; K406-T427 HydrophobicContact CG-CG2 3.88Å; I407-T427 CarbonylContact O-C 3.43Å; I407-T427 VanDerWaalsContact O-CA 3.31Å; I407-T427 WeakPolarHBondContact O-CA 3.26Å; Q408-T427 HydrophobicContact CG-CG2 4.04Å; Q408-T427 PolarHBondContact NE2-OG1 2.96Å; T427-F429 HydrophobicContact CG2-CE2 3.97Å; T427-F429 HydrophobicContact CG2-CZ 4.1Å
428	I	81.2	Confident	74.7	Confident	28 Å²	28	70.7 Å²	70.7	14%	0.144	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	155.8	170.9	66.3	165.6	0	0	0	110.4	V327 L344 I407 L430	V327-I428 HydrophobicContact CB-CG2 4.08Å; V327-I428 HydrophobicContact CG1-CD1 3.91Å; V327-I428 HydrophobicContact CG1-CG1 4.2Å; V327-I428 HydrophobicContact CG1-CG2 4.13Å; L344-I428 HydrophobicContact CD1-CD1 3.66Å; I407-I428 HydrophobicContact CB-CG1 3.99Å; I407-I428 HydrophobicContact CG2-CG1 4.31Å; I407-I428 PolarHBondContact N-O 3.05Å; I407-I428 PolarHBondContact O-N 2.97Å; I428-L430 HydrophobicContact CD1-CD1 3.51Å; I428-L430 HydrophobicContact CD1-CD2 4.37Å; I428-L430 HydrophobicContact CD1-CG 3.97Å; I428-L430 HydrophobicContact CG1-CD1 4.21Å; I428-L430 HydrophobicContact CG1-CG 4.42Å
429	F	79.1	Confident	71.8	Confident	117 Å²	117	75.7 Å²	75.7	51%	0.513	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	132	176.7	-63.4	-91.2	0	0	0	108.9	D366 Y405 K406 T427	D366-F429 HydrophobicContact CB-CD1 4.23Å; D366-F429 WeakPolarHBondContact OD2-CD1 3.43Å; Y405-F429 WeakPolarHBondContact O-CA 3.26Å; K406-F429 HydrophobicContact CB-CD1 3.98Å; K406-F429 HydrophobicContact CB-CE1 3.8Å; K406-F429 HydrophobicContact CD-CE1 3.98Å; K406-F429 HydrophobicContact CD-CZ 4.28Å; K406-F429 HydrophobicContact CG-CD1 4.19Å; K406-F429 HydrophobicContact CG-CE1 3.66Å; K406-F429 HydrophobicContact CG-CZ 4.12Å; T427-F429 HydrophobicContact CG2-CE2 3.97Å; T427-F429 HydrophobicContact CG2-CZ 4.1Å
430	L	71.1	Confident	69.1	Low	17 Å²	17	83.8 Å²	83.8	9%	0.089	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	131.4	-174.2	-67.5	165.6	0	0	0	110.1	D329 W332 L342 S404 Y405 I407 I428	D329-L430 HydrophobicContact CB-CD1 4.26Å; D329-L430 HydrophobicContact CB-CD2 3.9Å; D329-L430 VanDerWaalsContact CG-CD2 3.46Å; W332-L430 HydrophobicContact CH2-CB 4.49Å; W332-L430 HydrophobicContact CZ2-CD2 4.37Å; L342-L430 HydrophobicContact CD2-CD1 3.35Å; S404-L430 CarbonylContact C-O 3.58Å; S404-L430 WeakPolarHBondContact CA-O 3.39Å; Y405-L430 PolarHBondContact N-O 2.92Å; Y405-L430 PolarHBondContact O-N 3.32Å; I407-L430 HydrophobicContact CD1-CB 4.28Å; I407-L430 HydrophobicContact CD1-CD1 3.23Å; I407-L430 HydrophobicContact CD1-CG 4.16Å; I428-L430 HydrophobicContact CD1-CD1 3.51Å; I428-L430 HydrophobicContact CD1-CD2 4.37Å; I428-L430 HydrophobicContact CD1-CG 3.97Å; I428-L430 HydrophobicContact CG1-CD1 4.21Å; I428-L430 HydrophobicContact CG1-CG 4.42Å
431	S	72.3	Confident	66.1	Low	80 Å²	80	88.4 Å²	88.4	56%	0.559	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.4	122.6	176.7	-58.4	0	0	0	0	109.6	S404	S404-S431 PolarHBondContact OG-OG 3.49Å
432	T	71.7	Confident	63.2	Low	7 Å²	7	97 Å²	97	4%	0.043	50%	0.503	C	S	.	.	P	Polyproline II helix	trans	-76.1	143.7	178.4	65.9	0	0	0	0	110.9	W332 L399 K400 P401 A402 T403 Y405	W332-T432 HydrophobicContact CH2-CG2 4.15Å; W332-T432 HydrophobicContact CZ3-CG2 3.75Å; L399-T432 HydrophobicContact CB-CG2 4.14Å; L399-T432 HydrophobicContact CD1-CG2 4.43Å; K400-T432 WeakPolarHBondContact O-CB 3.47Å; K400-T432 WeakPolarHBondContact O-CG2 3.41Å; K400-T432 PolarHBondContact O-OG1 3.49Å; P401-T432 VanDerWaalsContact CA-OG1 3.28Å; P401-T432 WeakPolarHBondContact CA-OG1 3.19Å; A402-T432 VanDerWaalsContact CA-O 3.22Å; A402-T432 WeakPolarHBondContact CA-O 3.32Å; A402-T432 PolarHBondContact N-O 2.7Å; A402-T432 PolarHBondContact N-OG1 2.81Å; T403-T432 PolarHBondContact N-OG1 3.16Å; T403-T432 PolarHBondContact O-N 3.42Å; T403-T432 PolarHBondContact O-OG1 2.84Å; Y405-T432 HydrophobicContact CD2-CG2 3.98Å; Y405-T432 HydrophobicContact CE2-CG2 3.9Å
433	Q	64.1	Low	60	Low	138 Å²	138	100.7 Å²	100.7	65%	0.645	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-67.1	150.4	-179.9	-65.5	-173.8	3.3	0	0	112.1	A402	A402-Q433 PolarHBondContact N-O 3.33Å; A402-Q433 VanDerWaalsContact N-O 3.12Å
434	S	58.5	Low	57.1	Low	74 Å²	74	106.4 Å²	106.4	52%	0.517	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-79.6	135.7	167.6	66.7	0	0	0	0	109.7
435	I	53.1	Low	54	Low	79 Å²	79	103.8 Å²	103.8	41%	0.405	56%	0.557	S	S	.	*			trans	-102.4	90.4	172.4	-52.4	178.7	0	0	0	106.6	L334	L334-I435 HydrophobicContact CB-CD1 4.32Å; L334-I435 HydrophobicContact CD2-CD1 3.7Å; L334-I435 HydrophobicContact CD2-CG1 4.05Å
436	H	44.4	Very low	51.1	Low	163 Å²	163	108.1 Å²	108.1	76%	0.755	59%	0.585	S	S	*	*			trans	-85.4	123.8	161.9	-79	-20.6	0	0	0	108.4	A438	H436-A438 PolarHBondContact O-N 3.03Å
437	P	38.1	Very low	48.3	Very low	107 Å²	107	112 Å²	112	70%	0.695	61%	0.61	S	S	*	*			trans	-67.8	105.6	176.6	26.3	-30.2	0	0	0	108.9	F439	P437-F439 HydrophobicContact CB-CD2 4.44Å; P437-F439 PolarHBondContact O-N 3.43Å
438	A	28.4	Very low	45.6	Very low	100 Å²	100	116.5 Å²	116.5	83%	0.826	63%	0.628	S	S	*	*			trans	-73.4	76.8	165.5	0	0	0	0	0	109.1	H436	H436-A438 PolarHBondContact O-N 3.03Å
439	F	30	Very low	43.1	Very low	195 Å²	195	122.5 Å²	122.5	86%	0.855	66%	0.658	S	S	*	*			trans	-106.3	75	162	-90.4	-80.4	0	0	0	108.5	P437	P437-F439 HydrophobicContact CB-CD2 4.44Å; P437-F439 PolarHBondContact O-N 3.43Å
440	H	34.8	Very low	40.6	Very low	191 Å²	191	125.6 Å²	125.6	88%	0.884	67%	0.668	S	S	*	*			trans	-85.1	115.8	156.8	-98.4	-65.1	0	0	0	108.5	Q442	H440-Q442 PolarHBondContact O-N 3.41Å
441	Q	29.2	Very low	38.6	Very low	182 Å²	182	129 Å²	129	85%	0.85	70%	0.698	S	S	*	*			trans	-55.9	123.1	172.9	-64.9	167.5	-31.5	0	0	110.4
442	Q	32.4	Very low	36.5	Very low	190 Å²	190	130.8 Å²	130.8	89%	0.888	71%	0.706	S	S	*	*			trans	-142	105.7	147.2	-103.2	176.4	1.1	0	0	109.1	H440 V444	H440-Q442 PolarHBondContact O-N 3.41Å; Q442-V444 PolarHBondContact O-N 2.9Å
443	I	26.3	Very low	34.4	Very low	164 Å²	164	136.3 Å²	136.3	84%	0.841	74%	0.742	S	S	*	*			trans	-67.4	110.9	168.7	-64.9	162	0	0	0	107
444	V	31	Very low	32.9	Very low	124 Å²	124	136.6 Å²	136.6	75%	0.752	75%	0.748	S	S	*	*			trans	-142.7	104.6	156.4	-173.3	0	0	0	0	109.2	Q442	Q442-V444 PolarHBondContact O-N 2.9Å
445	S	27.4	Very low	31.5	Very low	92 Å²	92	138.7 Å²	138.7	64%	0.643	76%	0.758	S	S	*	*			trans	26	122.3	148.4	-47.8	0	0	0	0	120.4	V447	S445-V447 PolarHBondContact O-N 2.04Å
446	P	29.2	Very low	30.3	Very low	132 Å²	132	142.5 Å²	142.5	86%	0.857	78%	0.777	S	S	*	*			trans	-78.9	109.7	168.7	31.5	-27.9	0	0	0	110	Q448	P446-Q448 PolarHBondContact O-N 2.98Å
447	V	28.3	Very low	29.5	Very low	126 Å²	126	144.7 Å²	144.7	76%	0.764	79%	0.785	S	S	*	*			trans	-79.2	116	166	175.9	0	0	0	0	108.3	S445 I449	S445-V447 PolarHBondContact O-N 2.04Å; V447-I449 HydrophobicContact CG1-CG1 4.46Å
448	Q	27.1	Very low	29	Very low	140 Å²	140	146.8 Å²	146.8	65%	0.654	79%	0.789	S	S	*	*			trans	-67.1	125.8	170.9	-67.2	-178.3	-37.2	0	0	110	P446 Y450	P446-Q448 PolarHBondContact O-N 2.98Å; Q448-Y450 HydrophobicContact CB-CD2 4.3Å; Q448-Y450 HydrophobicContact CB-CE2 3.89Å; Q448-Y450 HydrophobicContact CG-CE2 4.39Å; Q448-Y450 PolarHBondContact NE2-OH 3Å; Q448-Y450 PolarHBondContact OE1-OH 3.19Å
449	I	29.3	Very low	29	Very low	154 Å²	154	147.1 Å²	147.1	79%	0.79	78%	0.783	S	S	*	*			trans	-122	104.3	160.9	-59.6	-179.9	0	0	0	107.3	V447	V447-I449 HydrophobicContact CG1-CG1 4.46Å
450	Y	25.7	Very low	28.9	Very low	183 Å²	183	147.4 Å²	147.4	72%	0.718	78%	0.784	S	S	*	*			trans	-73.8	124.5	165.6	-64.5	-91.9	0	0	0	108.3	Q448	Q448-Y450 HydrophobicContact CB-CD2 4.3Å; Q448-Y450 HydrophobicContact CB-CE2 3.89Å; Q448-Y450 HydrophobicContact CG-CE2 4.39Å; Q448-Y450 PolarHBondContact NE2-OH 3Å; Q448-Y450 PolarHBondContact OE1-OH 3.19Å
451	A	29.9	Very low	28.5	Very low	87 Å²	87	144.2 Å²	144.2	72%	0.719	77%	0.769	S	S	*	*			trans	-133.5	96.5	161.9	0	0	0	0	0	108.6
452	T	28.7	Very low	28.4	Very low	119 Å²	119	141.6 Å²	141.6	73%	0.73	76%	0.756	S	S	*	*			trans	-4.1	126.8	158.9	46.1	0	0	0	0	118.6
453	P	27.3	Very low	27.9	Very low	122 Å²	122	139.1 Å²	139.1	79%	0.792	75%	0.753	S	S	*	*			trans	-88	105.8	168.1	32.9	-26.1	0	0	0	110.3	T455	P453-T455 PolarHBondContact O-N 3.21Å
454	N	32.4	Very low	28	Very low	144 Å²	144	137.5 Å²	137.5	77%	0.77	75%	0.746	S	S	*	*			trans	-86.3	93.9	166	-77.5	-7.7	0	0	0	109.8	I456	N454-I456 PolarHBondContact O-N 3.33Å
455	T	28.2	Very low	27.7	Very low	118 Å²	118	141.3 Å²	141.3	72%	0.724	75%	0.752	S	S	*	*			trans	13.3	100.4	133.4	40.3	0	0	0	0	117.8	P453	P453-T455 PolarHBondContact O-N 3.21Å
456	I	28.4	Very low	27.8	Very low	159 Å²	159	140.2 Å²	140.2	82%	0.815	74%	0.744	S	S	*	*				-139.5	103.6	127.1	-57.3	-176.7	0	0	0	106.7	N454	N454-I456 PolarHBondContact O-N 3.33Å
457	K	28.1	Very low	27.7	Very low	209 Å²	209	144.1 Å²	144.1	91%	0.909	75%	0.748	S	S	*	*			trans	-86.4	110	167.6	-76.3	-178.5	178.7	177.2	0	107.3
458	L	27.2	Very low	27.9	Very low	151 Å²	151	141 Å²	141	79%	0.791	73%	0.731	S	S	*	*			trans	-96.2	141.5	162.8	-145.2	71.3	0	0	0	108.2	K460	L458-K460 PolarHBondContact O-N 3.41Å
459	P	28.7	Very low	28.7	Very low	107 Å²	107	140.4 Å²	140.4	70%	0.695	74%	0.743	S	S	*	*			trans	-64.9	128.7	-158.5	-18.7	31.4	0	0	0	113.4
460	K	27.9	Very low	29.7	Very low	202 Å²	202	139.8 Å²	139.8	88%	0.878	74%	0.741	S	S	*	*			trans	-86.1	94.6	154.8	-84	-176.4	175.7	179.6	0	107.7	L458	L458-K460 PolarHBondContact O-N 3.41Å
461	E	26.7	Very low	31.2	Very low	124 Å²	124	132.1 Å²	132.1	58%	0.579	71%	0.714	S	S	*	*			trans	173.3	110.5	161	-101	159.6	178	0	0	103.7	N579	E461-N579 PolarHBondContact OE1-ND2 2.87Å; E461-N579 PolarHBondContact OE2-ND2 2.98Å
462	F	25.9	Very low	32.7	Very low	127 Å²	127	132.7 Å²	132.7	56%	0.557	71%	0.705	S	S	*	*				-148.4	117.2	87.2	-97.6	-96.3	0	0	0	109.9	L464 V575	F462-L464 PolarHBondContact O-N 3.46Å; F462-V575 HydrophobicContact CZ-CG1 4.3Å
463	T	23.2	Very low	34.6	Very low	137 Å²	137	130.3 Å²	130.3	84%	0.84	69%	0.692	S	S	*	*			trans	-86.4	89.4	161.7	29.8	0	0	0	0	108
464	L	26.5	Very low	35.9	Very low	130 Å²	130	127.9 Å²	127.9	68%	0.681	69%	0.689	S	S	*	*			trans	-92.6	96.5	162.8	-156.2	79.3	0	0	0	108.5	F462 S466	F462-L464 PolarHBondContact O-N 3.46Å; L464-S466 PolarHBondContact O-N 2.9Å
465	K	25.4	Very low	36.8	Very low	205 Å²	205	127.6 Å²	127.6	89%	0.891	69%	0.688	S	S	*	*			trans	-64	96	165.5	-69.6	177.8	178	177.8	0	108.7
466	S	28.9	Very low	37.6	Very low	68 Å²	68	124.7 Å²	124.7	48%	0.476	68%	0.681	S	S	.	*			trans	-141.7	115.6	153.1	73.8	0	0	0	0	109.5	L464 S468	L464-S466 PolarHBondContact O-N 2.9Å; S466-S468 PolarHBondContact O-N 2.76Å
467	K	27.9	Very low	38.4	Very low	215 Å²	215	123.2 Å²	123.2	94%	0.935	68%	0.682	S	S	*	*			trans	-53.3	114.5	172.2	-65.8	173.8	172.7	-176.9	0	109.9
468	S	33.2	Very low	39.9	Very low	59 Å²	59	118.8 Å²	118.8	41%	0.413	67%	0.665	S	S	.	*			trans	-169.2	67	157.3	178.5	0	0	0	0	107.4	S466 D470	S466-S468 PolarHBondContact O-N 2.76Å; S468-D470 VanDerWaalsContact C-N 3.25Å
469	S	42.4	Very low	41.6	Very low	128 Å²	128	113.1 Å²	113.1	90%	0.895	64%	0.637	S	S	*	*	S	Bend	trans	-89.4	0.7	161.2	56.2	0	0	0	0	111.4
470	D	52	Low	43.5	Very low	141 Å²	141	109.2 Å²	109.2	75%	0.754	61%	0.61	S	S	*	*			trans	-123.3	96.4	-177.5	-141.2	8	0	0	0	106.7	S468	S468-D470 VanDerWaalsContact C-N 3.25Å
471	C	57.4	Low	45.5	Very low	22 Å²	22	102.6 Å²	102.6	15%	0.149	59%	0.586	C	S	.	*			trans	-125.7	94.9	-171.2	141.4	0	0	0	0	101.5	Q515 H551 C590	C471-Q515 PolarHBondContact SG-NE2 3.11Å; C471-Q515 PolarHBondContact SG-OE1 2.66Å; C471-H551 PolarHBondContact O-CE1 3.23Å; C471-H551 PolarHBondContact SG-CE1 3.15Å; C471-H551 PolarHBondContact SG-ND1 2.02Å; C471-C590 HydrophobicContact CB-CB 4.23Å; C471-C590 WeakPolarHBondContact CB-SG 3.19Å; C471-C590 VanDerWaalsContact SG-CB 3.51Å; C471-C590 PolarHBondContact SG-SG 2.93Å
472	D	60.5	Low	47.8	Very low	100 Å²	100	99.3 Å²	99.3	54%	0.535	57%	0.573	S	S	.	*			trans	-118.3	145	-168.6	-159	8.5	0	0	0	110.1	G474	D472-G474 PolarHBondContact O-N 3.46Å
473	C	67.9	Low	50.2	Low	68 Å²	68	99.8 Å²	99.8	46%	0.459	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.1	104.5	-177.9	-68.3	0	0	0	0	110.5	H551 C592	C473-H551 PolarHBondContact SG-CD2 3.31Å; C473-H551 PolarHBondContact SG-NE2 2.95Å; C473-H551 VanDerWaalsContact SG-NE2 3.41Å; C473-C592 WeakPolarHBondContact CA-SG 3.48Å; C473-C592 HydrophobicContact CB-CB 4.04Å; C473-C592 WeakPolarHBondContact CB-SG 3.18Å; C473-C592 WeakPolarHBondContact SG-CB 3.22Å; C473-C592 CovalentContact SG-SG 2Å; C473-C592 PolarHBondContact SG-SG 3.32Å
474	G	56	Low	52.9	Low	71 Å²	71	96.6 Å²	96.6	73%	0.732	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.4	7.4	166.7	0	0	0	0	0	117.4	D472	D472-G474 PolarHBondContact O-N 3.46Å
475	N	50	Low	55.5	Low	138 Å²	138	91.4 Å²	91.4	74%	0.738	52%	0.522	S	S	*	.			trans	-120.7	44.1	-178.1	-87.1	-21.7	0	0	0	115.3
476	G	45	Very low	58.2	Low	57 Å²	57	81.9 Å²	81.9	59%	0.588	48%	0.48	S	S	*	.			trans	-117.7	114.3	175.1	0	0	0	0	0	113.9	Q478	G476-Q478 PolarHBondContact O-N 2.91Å; G476-Q478 VanDerWaalsContact O-N 3.09Å
477	P	45.3	Very low	60.6	Low	128 Å²	128	79.3 Å²	79.3	83%	0.831	46%	0.46	S	S	*	.			trans	-81.3	84.1	171	32.6	-29.8	0	0	0	109.1
478	Q	59	Low	63.1	Low	117 Å²	117	71.4 Å²	71.4	55%	0.547	43%	0.427	S	S	.	.	S	Bend	trans	-153	155.3	-175	-99.7	151.8	29.7	0	0	110.6	G476 L480 I588	G476-Q478 PolarHBondContact O-N 2.91Å; G476-Q478 VanDerWaalsContact O-N 3.09Å; Q478-L480 PolarHBondContact O-N 2.99Å; Q478-I588 PolarHBondContact OE1-O 2.76Å
479	P	63.5	Low	65	Low	31 Å²	31	74.1 Å²	74.1	20%	0.201	44%	0.436	C	S	.	.	S	Bend	trans	-70.5	13.8	-157.8	28.1	-36.1	0	0	0	116.7	N499 M500 Y587	P479-N499 WeakPolarHBondContact CB-O 3.04Å; P479-N499 PolarHBondContact O-N 2.82Å; P479-M500 HydrophobicContact CB-CG 3.66Å; P479-M500 HydrophobicContact CG-CG 3.92Å; P479-M500 HydrophobicContact CG-SD 4.47Å; P479-Y587 HydrophobicContact CG-CD1 3.26Å; P479-Y587 HydrophobicContact CG-CE1 3.49Å; P479-Y587 VanDerWaalsContact CG-CE1 3.49Å; P479-Y587 HydrophobicContact CG-CG 3.96Å
480	L	68	Low	66.4	Low	26 Å²	26	74.5 Å²	74.5	14%	0.136	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	105.9	-177.1	-60.2	176.5	0	0	0	108.6	Q478 L496 I498 M500 V554 V556	Q478-L480 PolarHBondContact O-N 2.99Å; L480-L496 HydrophobicContact CB-CD1 4.18Å; L480-L496 HydrophobicContact CD2-CD2 4.36Å; L480-I498 HydrophobicContact CD2-CD1 4.48Å; L480-I498 HydrophobicContact CD2-CG1 3.87Å; L480-M500 HydrophobicContact CD2-CE 4.08Å; L480-V554 HydrophobicContact CD1-CG1 4.22Å; L480-V556 HydrophobicContact CD1-CG2 3.84Å; L480-V556 HydrophobicContact CD2-CG2 3.7Å; L480-V556 HydrophobicContact CG-CG2 4.42Å
481	V	71.9	Confident	67.7	Low	62 Å²	62	72.2 Å²	72.2	38%	0.376	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	114.6	-177.9	-178.7	0	0	0	0	109.1	K483 Q497	V481-K483 PolarHBondContact O-N 2.82Å; V481-Q497 HydrophobicContact CB-CB 4.45Å; V481-Q497 PolarHBondContact N-O 3.15Å; V481-Q497 PolarHBondContact O-N 3.18Å
482	L	74.8	Confident	68.8	Low	56 Å²	56	71.3 Å²	71.3	29%	0.293	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	115.7	171.5	-152.6	85.8	0	0	0	109.3	I485 A494 L496 F591	L482-I485 HydrophobicContact CD2-CD1 3.57Å; L482-I485 HydrophobicContact CD2-CG1 3.59Å; L482-A494 HydrophobicContact CD1-CB 4.02Å; L482-L496 HydrophobicContact CD1-CD1 3.92Å; L482-F591 HydrophobicContact CD1-CB 4.13Å; L482-F591 HydrophobicContact CD1-CD1 4.1Å; L482-F591 HydrophobicContact CD1-CD2 4.04Å; L482-F591 HydrophobicContact CD1-CG 3.82Å; L482-F591 HydrophobicContact CD2-CB 3.9Å; L482-F591 HydrophobicContact CD2-CD2 3.82Å; L482-F591 HydrophobicContact CD2-CG 4.04Å; L482-F591 HydrophobicContact CG-CB 4.45Å
483	K	76.1	Confident	70	Confident	136 Å²	136	67.5 Å²	67.5	59%	0.591	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	-53.2	-176.6	-88.1	-91	-172.1	175.3	0	112.5	V481 I495 Q497	V481-K483 PolarHBondContact O-N 2.82Å; K483-I495 HydrophobicContact CB-CB 3.97Å; K483-I495 HydrophobicContact CB-CG2 3.93Å; K483-I495 HydrophobicContact CG-CG2 4.44Å; K483-I495 PolarHBondContact N-O 3.15Å; K483-Q497 HydrophobicContact CG-CB 4.14Å
484	K	78.5	Confident	70.8	Confident	71 Å²	71	64.2 Å²	64.2	31%	0.309	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	140.7	-172.4	-179.4	166.8	173.6	165	0	110.7	A494 I495 I600	K484-A494 CarbonylContact O-C 3.52Å; K484-A494 WeakPolarHBondContact O-CA 3.32Å; K484-I495 HydrophobicContact CB-CD1 4.49Å; K484-I495 PolarHBondContact O-N 3.24Å; K484-I600 HydrophobicContact CD-CD1 4.25Å; K484-I600 VanDerWaalsContact CE-CD1 3.48Å; K484-I600 HydrophobicContact CG-CD1 4.49Å
485	I	81.9	Confident	72.1	Confident	21 Å²	21	62.5 Å²	62.5	11%	0.108	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	134.1	168.8	-55	173.2	0	0	0	107.5	L482 L492 K493 A494 F591 C592 T593	L482-I485 HydrophobicContact CD2-CD1 3.57Å; L482-I485 HydrophobicContact CD2-CG1 3.59Å; I485-L492 HydrophobicContact CG2-CD1 3.65Å; I485-L492 HydrophobicContact CG2-CD2 4.23Å; I485-L492 HydrophobicContact CG2-CG 3.88Å; I485-K493 CarbonylContact C-O 3.52Å; I485-K493 WeakPolarHBondContact CA-O 3.48Å; I485-K493 WeakPolarHBondContact CG2-O 3.18Å; I485-A494 HydrophobicContact CG1-CB 3.85Å; I485-F591 HydrophobicContact CD1-CD2 4.47Å; I485-C592 WeakPolarHBondContact CD1-O 3.4Å; I485-T593 HydrophobicContact CD1-CG2 4.38Å
486	F	83.1	Confident	73.6	Confident	5 Å²	5	56.1 Å²	56.1	2%	0.022	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	153.2	-175.3	62.8	-80.3	0	0	0	111.2	E488 K493 I495 I542 I600 K602	F486-E488 HydrophobicContact CD2-CB 3.87Å; F486-E488 HydrophobicContact CE2-CB 3.88Å; F486-K493 HydrophobicContact CD1-CB 4.45Å; F486-K493 HydrophobicContact CD2-CB 4.48Å; F486-K493 HydrophobicContact CE1-CB 3.94Å; F486-K493 HydrophobicContact CE2-CB 4.01Å; F486-K493 HydrophobicContact CE2-CD 4.01Å; F486-K493 HydrophobicContact CZ-CB 3.72Å; F486-K493 HydrophobicContact CZ-CD 4.06Å; F486-K493 PolarHBondContact N-O 3Å; F486-K493 PolarHBondContact O-N 2.97Å; F486-I495 HydrophobicContact CD1-CD1 4.44Å; F486-I495 HydrophobicContact CD1-CG1 4.17Å; F486-I495 HydrophobicContact CE1-CD1 3.94Å; F486-I495 HydrophobicContact CE1-CG1 3.54Å; F486-I542 HydrophobicContact CZ-CG2 4.36Å; F486-I600 VanDerWaalsContact CA-O 3.31Å; F486-I600 WeakPolarHBondContact CA-O 3.48Å; F486-I600 WeakPolarHBondContact CB-O 3.42Å; F486-K602 HydrophobicContact CB-CD 4.43Å; F486-K602 HydrophobicContact CB-CG 4.36Å; F486-K602 HydrophobicContact CD2-CB 4.35Å; F486-K602 HydrophobicContact CD2-CD 3.84Å; F486-K602 HydrophobicContact CD2-CG 4.32Å; F486-K602 HydrophobicContact CE2-CD 4.31Å; F486-K602 HydrophobicContact CG-CD 4.17Å
487	Y	79.4	Confident	75.3	Confident	13 Å²	13	55.2 Å²	55.2	5%	0.051	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	125.6	174.6	-165	-107.8	0	0	0	109.1	H490 L492 F548 I600 N601 K602 L606 P607	Y487-H490 VanDerWaalsContact CZ-C 3.5Å; Y487-H490 VanDerWaalsContact CZ-CA 3.5Å; Y487-H490 VanDerWaalsContact OH-CA 3.23Å; Y487-H490 WeakPolarHBondContact OH-CA 3.32Å; Y487-H490 PolarHBondContact OH-O 2.88Å; Y487-L492 HydrophobicContact CD2-CB 4.39Å; Y487-L492 HydrophobicContact CD2-CD1 4.46Å; Y487-F548 HydrophobicContact CD2-CE1 4.21Å; Y487-F548 HydrophobicContact CD2-CE2 4.39Å; Y487-F548 AromaticContact CD2-CZ 3.52Å; Y487-F548 HydrophobicContact CD2-CZ 3.52Å; Y487-F548 HydrophobicContact CE2-CE2 4.07Å; Y487-F548 AromaticContact CE2-CZ 3.6Å; Y487-F548 HydrophobicContact CE2-CZ 3.6Å; Y487-F548 HydrophobicContact CG-CZ 4.34Å; Y487-I600 PolarHBondContact N-O 3.27Å; Y487-N601 PolarHBondContact O-OD1 2.94Å; Y487-K602 PolarHBondContact O-N 3Å; Y487-K602 VanDerWaalsContact O-N 3.09Å; Y487-L606 HydrophobicContact CD1-CD2 4.45Å; Y487-P607 WeakPolarHBondContact OH-CG 3.3Å
488	E	78.6	Confident	76.7	Confident	50 Å²	50	49.2 Å²	49.2	23%	0.234	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	135.4	-178.8	-178.4	-170.8	-102.7	0	0	108.6	F486 H490 K491 K493	F486-E488 HydrophobicContact CD2-CB 3.87Å; F486-E488 HydrophobicContact CE2-CB 3.88Å; E488-H490 PolarHBondContact O-N 3.34Å; E488-K491 PolarHBondContact N-O 3.05Å; E488-K491 VanDerWaalsContact N-O 3.14Å; E488-K491 PolarHBondContact O-N 3.01Å; E488-K491 VanDerWaalsContact O-N 3.13Å; E488-K491 VanDerWaalsContact O-O 3.05Å; E488-K493 IonicContact OE2-NZ 3.41Å; E488-K493 PolarHBondContact OE2-NZ 2.9Å
489	N	74.1	Confident	77.2	Confident	115 Å²	115	47.9 Å²	47.9	62%	0.615	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.6	48	178.3	-62.2	-22.6	0	0	0	113.9	K491	N489-K491 PolarHBondContact O-N 2.86Å
490	H	71.5	Confident	77.3	Confident	137 Å²	137	47.5 Å²	47.5	63%	0.634	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	60	12.2	-178.9	-56.8	-70.8	0	0	0	116.1	Y487 E488	Y487-H490 VanDerWaalsContact CZ-C 3.5Å; Y487-H490 VanDerWaalsContact CZ-CA 3.5Å; Y487-H490 VanDerWaalsContact OH-CA 3.23Å; Y487-H490 WeakPolarHBondContact OH-CA 3.32Å; Y487-H490 PolarHBondContact OH-O 2.88Å; E488-H490 PolarHBondContact O-N 3.34Å
491	K	78.5	Confident	76.9	Confident	93 Å²	93	53.4 Å²	53.4	40%	0.404	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	139.6	179.8	-65.8	-171.9	178.6	-166.5	0	110.8	E488 N489 N545	E488-K491 PolarHBondContact N-O 3.05Å; E488-K491 VanDerWaalsContact N-O 3.14Å; E488-K491 PolarHBondContact O-N 3.01Å; E488-K491 VanDerWaalsContact O-N 3.13Å; E488-K491 VanDerWaalsContact O-O 3.05Å; N489-K491 PolarHBondContact O-N 2.86Å; K491-N545 PolarHBondContact NZ-OD1 3.39Å
492	L	81.3	Confident	76.3	Confident	3 Å²	3	52.5 Å²	52.5	2%	0.016	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	127.9	168.6	-169.9	69.3	0	0	0	108.9	I485 Y487 L546 H547 F548 T593 V599	I485-L492 HydrophobicContact CG2-CD1 3.65Å; I485-L492 HydrophobicContact CG2-CD2 4.23Å; I485-L492 HydrophobicContact CG2-CG 3.88Å; Y487-L492 HydrophobicContact CD2-CB 4.39Å; Y487-L492 HydrophobicContact CD2-CD1 4.46Å; L492-L546 HydrophobicContact CB-CB 4Å; L492-L546 WeakPolarHBondContact CB-O 3.28Å; L492-L546 HydrophobicContact CD2-CB 3.99Å; L492-L546 HydrophobicContact CG-CB 4.07Å; L492-L546 WeakPolarHBondContact O-CB 3.28Å; L492-L546 PolarHBondContact O-N 2.79Å; L492-H547 WeakPolarHBondContact CD2-O 3.34Å; L492-F548 HydrophobicContact CD1-CD1 4.11Å; L492-F548 HydrophobicContact CD1-CE1 3.75Å; L492-F548 HydrophobicContact CD1-CZ 4.43Å; L492-F548 HydrophobicContact CD2-CD1 3.99Å; L492-F548 HydrophobicContact CD2-CE1 4.38Å; L492-F548 HydrophobicContact CD2-CG 4.37Å; L492-T593 HydrophobicContact CD2-CG2 3.74Å; L492-V599 HydrophobicContact CD1-CB 4.44Å; L492-V599 HydrophobicContact CD1-CG1 3.82Å; L492-V599 HydrophobicContact CD1-CG2 3.71Å
493	K	85.7	Confident	75.5	Confident	19 Å²	19	58.4 Å²	58.4	8%	0.083	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	149.5	-178.7	-58.4	-175.4	-173.7	178.4	0	110.7	I485 F486 E488 I542 L543 E544	I485-K493 CarbonylContact C-O 3.52Å; I485-K493 WeakPolarHBondContact CA-O 3.48Å; I485-K493 WeakPolarHBondContact CG2-O 3.18Å; F486-K493 HydrophobicContact CD1-CB 4.45Å; F486-K493 HydrophobicContact CD2-CB 4.48Å; F486-K493 HydrophobicContact CE1-CB 3.94Å; F486-K493 HydrophobicContact CE2-CB 4.01Å; F486-K493 HydrophobicContact CE2-CD 4.01Å; F486-K493 HydrophobicContact CZ-CB 3.72Å; F486-K493 HydrophobicContact CZ-CD 4.06Å; F486-K493 PolarHBondContact N-O 3Å; F486-K493 PolarHBondContact O-N 2.97Å; E488-K493 IonicContact OE2-NZ 3.41Å; E488-K493 PolarHBondContact OE2-NZ 2.9Å; K493-I542 HydrophobicContact CB-CG2 3.96Å; K493-I542 HydrophobicContact CD-CG2 3.95Å; K493-I542 HydrophobicContact CG-CG2 4.38Å; K493-L543 CarbonylContact C-O 3.53Å; K493-L543 WeakPolarHBondContact CA-O 3.36Å; K493-E544 HydrophobicContact CD-CG 4.28Å; K493-E544 VanDerWaalsContact CE-OE1 3.25Å; K493-E544 WeakPolarHBondContact CE-OE1 3.25Å; K493-E544 HydrophobicContact CG-CG 4.25Å; K493-E544 IonicContact NZ-OE1 2.9Å; K493-E544 PolarHBondContact NZ-OE1 3.06Å
494	A	84.2	Confident	74.6	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	138.4	175.8	0	0	0	0	0	111.6	L482 K484 I485 I542 L543 L546 F591	L482-A494 HydrophobicContact CD1-CB 4.02Å; K484-A494 CarbonylContact O-C 3.52Å; K484-A494 WeakPolarHBondContact O-CA 3.32Å; I485-A494 HydrophobicContact CG1-CB 3.85Å; A494-I542 CarbonylContact O-C 3.47Å; A494-I542 WeakPolarHBondContact O-CA 3.41Å; A494-L543 HydrophobicContact CB-CB 4.37Å; A494-L543 PolarHBondContact N-O 3.08Å; A494-L543 PolarHBondContact O-N 2.91Å; A494-L546 HydrophobicContact CB-CD1 3.47Å; A494-L546 VanDerWaalsContact CB-CD1 3.47Å; A494-F591 HydrophobicContact CB-CE2 4.32Å
495	I	84.2	Confident	73.9	Confident	34 Å²	34	61.4 Å²	61.4	17%	0.174	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	112.2	175.4	-53.2	-174.6	0	0	0	108.3	K483 K484 F486 I540	K483-I495 HydrophobicContact CB-CB 3.97Å; K483-I495 HydrophobicContact CB-CG2 3.93Å; K483-I495 HydrophobicContact CG-CG2 4.44Å; K483-I495 PolarHBondContact N-O 3.15Å; K484-I495 HydrophobicContact CB-CD1 4.49Å; K484-I495 PolarHBondContact O-N 3.24Å; F486-I495 HydrophobicContact CD1-CD1 4.44Å; F486-I495 HydrophobicContact CD1-CG1 4.17Å; F486-I495 HydrophobicContact CE1-CD1 3.94Å; F486-I495 HydrophobicContact CE1-CG1 3.54Å; I495-I540 HydrophobicContact CG2-CG2 3.42Å; I495-I540 VanDerWaalsContact CG2-CG2 3.42Å
496	L	82.1	Confident	73.3	Confident	4 Å²	4	60.7 Å²	60.7	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	120.3	173.7	-171.4	71.1	0	0	0	109.6	L480 L482 I510 I540 V541 L543 V554	L480-L496 HydrophobicContact CB-CD1 4.18Å; L480-L496 HydrophobicContact CD2-CD2 4.36Å; L482-L496 HydrophobicContact CD1-CD1 3.92Å; L496-I510 HydrophobicContact CD2-CG2 4.29Å; L496-I540 WeakPolarHBondContact O-CA 3.35Å; L496-V541 PolarHBondContact N-O 3.29Å; L496-V541 PolarHBondContact O-N 3.34Å; L496-L543 HydrophobicContact CB-CD1 4.11Å; L496-L543 HydrophobicContact CB-CG 4.14Å; L496-L543 HydrophobicContact CD2-CD1 4.32Å; L496-L543 HydrophobicContact CD2-CD2 4.38Å; L496-V554 HydrophobicContact CD2-CG1 3.98Å
497	Q	79.8	Confident	72.9	Confident	39 Å²	39	60.6 Å²	60.6	18%	0.182	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	129.1	171.9	179.6	174.1	-31.9	0	0	110.1	V481 K483 N499 K539 I540	V481-Q497 HydrophobicContact CB-CB 4.45Å; V481-Q497 PolarHBondContact N-O 3.15Å; V481-Q497 PolarHBondContact O-N 3.18Å; K483-Q497 HydrophobicContact CG-CB 4.14Å; Q497-N499 PolarHBondContact NE2-OD1 2.81Å; Q497-K539 WeakPolarHBondContact CA-O 3.25Å; Q497-I540 HydrophobicContact CB-CG1 4.47Å; Q497-I540 HydrophobicContact CG-CG1 4.39Å
498	I	75.7	Confident	72.8	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.01	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	103.9	-179.7	-63.3	-178.3	0	0	0	108.8	L480 M500 I502 I510 L534 K539	L480-I498 HydrophobicContact CD2-CD1 4.48Å; L480-I498 HydrophobicContact CD2-CG1 3.87Å; I498-M500 VanDerWaalsContact C-N 3.35Å; I498-M500 HydrophobicContact CG2-CB 3.96Å; I498-M500 HydrophobicContact CG2-CE 3.24Å; I498-M500 HydrophobicContact CG2-CG 3.67Å; I498-M500 HydrophobicContact CG2-SD 4.06Å; I498-M500 PolarHBondContact O-N 3.3Å; I498-I502 HydrophobicContact CG2-CD1 4.31Å; I498-I510 HydrophobicContact CD1-CD1 3.45Å; I498-I510 VanDerWaalsContact CD1-CD1 3.45Å; I498-I510 HydrophobicContact CD1-CG1 4.02Å; I498-L534 HydrophobicContact CD1-CD2 3.88Å; I498-K539 PolarHBondContact N-O 2.87Å
499	N	69.3	Low	72.9	Confident	89 Å²	89	58.1 Å²	58.1	48%	0.476	30%	0.297	S	S	.	.			trans	-93.3	65.2	176.4	-78.4	-9.4	0	0	0	110.5	P479 Q497	P479-N499 WeakPolarHBondContact CB-O 3.04Å; P479-N499 PolarHBondContact O-N 2.82Å; Q497-N499 PolarHBondContact NE2-OD1 2.81Å
500	M	64.3	Low	73.3	Confident	23 Å²	23	52.7 Å²	52.7	11%	0.113	27%	0.268	C	S	.	.			trans	-115.6	143.4	177.5	-65.6	-169.3	-119	0	0	111.4	P479 L480 I498 I502 V556 V558 Y587	P479-M500 HydrophobicContact CB-CG 3.66Å; P479-M500 HydrophobicContact CG-CG 3.92Å; P479-M500 HydrophobicContact CG-SD 4.47Å; L480-M500 HydrophobicContact CD2-CE 4.08Å; I498-M500 VanDerWaalsContact C-N 3.35Å; I498-M500 HydrophobicContact CG2-CB 3.96Å; I498-M500 HydrophobicContact CG2-CE 3.24Å; I498-M500 HydrophobicContact CG2-CG 3.67Å; I498-M500 HydrophobicContact CG2-SD 4.06Å; I498-M500 PolarHBondContact O-N 3.3Å; M500-I502 HydrophobicContact CB-CD1 4.28Å; M500-I502 HydrophobicContact CB-CG1 3.68Å; M500-I502 PolarHBondContact O-N 2.81Å; M500-V556 HydrophobicContact CE-CB 4.05Å; M500-V556 HydrophobicContact CE-CG1 3.6Å; M500-V558 HydrophobicContact CE-CG2 4.37Å; M500-V558 HydrophobicContact SD-CG2 4.16Å; M500-Y587 HydrophobicContact CE-CD2 3.65Å; M500-Y587 HydrophobicContact CE-CE2 4.03Å; M500-Y587 HydrophobicContact CE-CG 4.16Å; M500-Y587 HydrophobicContact CG-CE2 4.34Å; M500-Y587 HydrophobicContact SD-CD1 4.43Å; M500-Y587 HydrophobicContact SD-CD2 3.29Å; M500-Y587 WeakPolarHBondContact SD-CD2 3.32Å; M500-Y587 HydrophobicContact SD-CE1 4.22Å; M500-Y587 HydrophobicContact SD-CE2 3.02Å; M500-Y587 WeakPolarHBondContact SD-CE2 3.34Å; M500-Y587 HydrophobicContact SD-CG 3.98Å; M500-Y587 VanDerWaalsContact SD-CZ 3.51Å
501	T	59.7	Low	73.8	Confident	149 Å²	149	47.3 Å²	47.3	91%	0.914	24%	0.243	S	C	*	.			trans	-75.7	73.8	164.2	28	0	0	0	0	109.4	K503	T501-K503 PolarHBondContact O-N 3.48Å
502	I	60.1	Low	74.2	Confident	43 Å²	43	43.6 Å²	43.6	22%	0.221	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-73.6	118.9	175.7	-60.1	-176.6	0	0	0	107.7	I498 M500 S506	I498-I502 HydrophobicContact CG2-CD1 4.31Å; M500-I502 HydrophobicContact CB-CD1 4.28Å; M500-I502 HydrophobicContact CB-CG1 3.68Å; M500-I502 PolarHBondContact O-N 2.81Å; I502-S506 WeakPolarHBondContact CG2-OG 3.13Å
503	K	57.2	Low	74.2	Confident	181 Å²	181	46.7 Å²	46.7	79%	0.787	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-60.3	139.2	172.3	-73	-175.8	179.5	179.2	0	109	T501 E505 S506	T501-K503 PolarHBondContact O-N 3.48Å; K503-E505 PolarHBondContact O-N 3.07Å; K503-S506 PolarHBondContact O-N 3.13Å; K503-S506 PolarHBondContact O-OG 3.03Å
504	T	56.7	Low	73.9	Confident	131 Å²	131	47.6 Å²	47.6	80%	0.804	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.3	123.9	176.6	44.4	0	0	0	0	109.6
505	E	65.4	Low	73.3	Confident	139 Å²	139	51.4 Å²	51.4	65%	0.65	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.2	42.6	-177.7	-50.3	-168.7	168.7	0	0	118	K503 A561 T562	K503-E505 PolarHBondContact O-N 3.07Å; E505-A561 CarbonylContact O-C 3.41Å; E505-A561 VanDerWaalsContact O-CA 3.32Å; E505-A561 WeakPolarHBondContact O-CA 3.34Å; E505-T562 HydrophobicContact CB-CG2 4.45Å
506	S	68.5	Low	72.9	Confident	6 Å²	6	53.9 Å²	53.9	4%	0.042	28%	0.278	C	S	.	.			trans	-116.1	150	168.3	35.1	0	0	0	0	113.5	I502 K503 S536 Y559	I502-S506 WeakPolarHBondContact CG2-OG 3.13Å; K503-S506 PolarHBondContact O-N 3.13Å; K503-S506 PolarHBondContact O-OG 3.03Å; S506-S536 WeakPolarHBondContact O-CA 3.44Å; S506-S536 WeakPolarHBondContact O-CB 3.27Å; S506-S536 PolarHBondContact O-N 3.14Å; S506-Y559 WeakPolarHBondContact CA-O 3.07Å; S506-Y559 WeakPolarHBondContact CB-O 3.07Å
507	T	75.1	Confident	72.4	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.018	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128	174	-65	0	0	0	0	108.8	L533 L534 Y559 A561 T562 L563 I568	T507-L533 HydrophobicContact CG2-CD1 4.31Å; T507-L533 HydrophobicContact CG2-CD2 3.51Å; T507-L533 HydrophobicContact CG2-CG 3.57Å; T507-L534 WeakPolarHBondContact CA-O 3.5Å; T507-Y559 PolarHBondContact N-O 3.36Å; T507-Y559 VanDerWaalsContact N-O 3.08Å; T507-Y559 PolarHBondContact O-N 2.96Å; T507-A561 PolarHBondContact N-O 2.87Å; T507-A561 PolarHBondContact OG1-O 3.42Å; T507-T562 WeakPolarHBondContact OG1-CA 3.43Å; T507-L563 PolarHBondContact OG1-N 3.28Å; T507-I568 HydrophobicContact CG2-CD1 4.11Å
508	A	76.3	Confident	71.8	Confident	4 Å²	4	58.6 Å²	58.6	3%	0.033	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	124.9	175.1	0	0	0	0	0	110.7	L534 V556 R557 V558	A508-L534 HydrophobicContact CB-CB 4.33Å; A508-L534 PolarHBondContact N-O 2.89Å; A508-L534 PolarHBondContact O-N 2.79Å; A508-V556 HydrophobicContact CB-CG1 4.05Å; A508-R557 CarbonylContact C-O 3.51Å; A508-R557 WeakPolarHBondContact CA-O 3.43Å; A508-V558 HydrophobicContact CB-CG2 4.26Å
509	L	82.3	Confident	70.9	Confident	7 Å²	7	64.6 Å²	64.6	4%	0.037	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	112.9	170.3	176.2	69.7	0	0	0	108.5	Q511 L533 V556 R557 Y559 I568	L509-Q511 HydrophobicContact CD2-CG 4.29Å; L509-Q511 HydrophobicContact CG-CG 4.03Å; L509-L533 HydrophobicContact CB-CD1 4.41Å; L509-L533 HydrophobicContact CD1-CD1 3.72Å; L509-V556 CarbonylContact O-C 3.46Å; L509-V556 WeakPolarHBondContact O-CA 3.42Å; L509-R557 HydrophobicContact CB-CB 4.45Å; L509-R557 PolarHBondContact N-O 3.29Å; L509-R557 PolarHBondContact O-N 3.4Å; L509-Y559 HydrophobicContact CB-CE2 3.98Å; L509-I568 HydrophobicContact CD2-CG2 4.22Å
510	I	81.9	Confident	70	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	123	178.2	-58.1	152.6	0	0	0	107.5	L496 I498 W512 T531 I532 L534 V541 L543 V554 R555 V556	L496-I510 HydrophobicContact CD2-CG2 4.29Å; I498-I510 HydrophobicContact CD1-CD1 3.45Å; I498-I510 VanDerWaalsContact CD1-CD1 3.45Å; I498-I510 HydrophobicContact CD1-CG1 4.02Å; I510-W512 HydrophobicContact CG2-CE3 4.45Å; I510-T531 CarbonylContact O-C 3.58Å; I510-T531 VanDerWaalsContact O-CA 3.28Å; I510-T531 WeakPolarHBondContact O-CA 3.2Å; I510-I532 HydrophobicContact CB-CG2 3.84Å; I510-I532 HydrophobicContact CD1-CG2 4.1Å; I510-I532 HydrophobicContact CG2-CG2 4.38Å; I510-I532 PolarHBondContact N-O 2.7Å; I510-I532 PolarHBondContact O-N 3.29Å; I510-L534 HydrophobicContact CD1-CB 4.09Å; I510-L534 HydrophobicContact CD1-CD2 4.09Å; I510-V541 HydrophobicContact CD1-CB 4.19Å; I510-V541 HydrophobicContact CD1-CG1 4.24Å; I510-V541 HydrophobicContact CD1-CG2 3.61Å; I510-L543 HydrophobicContact CG2-CD2 4.28Å; I510-V554 HydrophobicContact CG2-CG1 3.93Å; I510-R555 CarbonylContact C-O 3.56Å; I510-R555 WeakPolarHBondContact CA-O 3.06Å; I510-V556 HydrophobicContact CB-CG2 4.32Å; I510-V556 HydrophobicContact CG1-CB 4.35Å; I510-V556 HydrophobicContact CG1-CG1 3.83Å; I510-V556 HydrophobicContact CG1-CG2 3.82Å; I510-V556 HydrophobicContact CG2-CG2 4.13Å
511	Q	82.5	Confident	69.1	Low	25 Å²	25	70 Å²	70	12%	0.117	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	127.6	177.9	-49.8	-173.7	-61.7	0	0	108.5	L509 S530 T531 V554 R555	L509-Q511 HydrophobicContact CD2-CG 4.29Å; L509-Q511 HydrophobicContact CG-CG 4.03Å; Q511-S530 CarbonylContact C-O 3.58Å; Q511-S530 VanDerWaalsContact CA-O 3.29Å; Q511-S530 WeakPolarHBondContact CA-O 3.2Å; Q511-T531 HydrophobicContact CB-CG2 4.07Å; Q511-T531 HydrophobicContact CG-CG2 3.66Å; Q511-V554 CarbonylContact O-C 3.52Å; Q511-V554 WeakPolarHBondContact O-CA 3.3Å; Q511-R555 PolarHBondContact N-O 3.48Å; Q511-R555 PolarHBondContact O-N 2.96Å
512	W	85.9	Confident	68.1	Low	15 Å²	15	68.6 Å²	68.6	6%	0.057	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	140.3	172.1	66.5	101.2	0	0	0	110.9	I510 P529 S530 I532 L543 E544 G553 V554	I510-W512 HydrophobicContact CG2-CE3 4.45Å; W512-P529 CarbonylContact O-C 3.54Å; W512-P529 WeakPolarHBondContact O-CA 3.13Å; W512-S530 PolarHBondContact N-O 3.05Å; W512-S530 PolarHBondContact O-N 2.92Å; W512-I532 HydrophobicContact CH2-CB 4.33Å; W512-I532 HydrophobicContact CH2-CG2 4.41Å; W512-I532 HydrophobicContact CZ3-CB 4Å; W512-I532 HydrophobicContact CZ3-CG2 3.74Å; W512-L543 HydrophobicContact CD2-CB 4.39Å; W512-L543 HydrophobicContact CD2-CD2 3.86Å; W512-L543 HydrophobicContact CE3-CD2 3.58Å; W512-L543 HydrophobicContact CG-CD2 4.46Å; W512-L543 HydrophobicContact CH2-CD2 4.38Å; W512-L543 HydrophobicContact CZ2-CB 4.43Å; W512-L543 HydrophobicContact CZ3-CD2 3.87Å; W512-E544 WeakPolarHBondContact CZ2-O 3.32Å; W512-E544 PolarHBondContact NE1-O 2.77Å; W512-G553 CarbonylContact C-O 3.57Å; W512-G553 WeakPolarHBondContact CA-O 3.13Å; W512-V554 HydrophobicContact CB-CG2 4.09Å
513	Y	81.3	Confident	67.3	Low	68 Å²	68	71.8 Å²	71.8	27%	0.267	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	145.2	-176.7	55.7	-86.3	0	0	0	110.4	Q515 Y552 G553	Y513-Q515 HydrophobicContact CD2-CG 4.2Å; Y513-Q515 HydrophobicContact CE2-CG 3.88Å; Y513-Y552 WeakPolarHBondContact O-CA 3.28Å; Y513-G553 PolarHBondContact N-O 3.39Å; Y513-G553 PolarHBondContact O-N 3.43Å
514	L	79.8	Confident	66.8	Low	37 Å²	37	69.8 Å²	69.8	19%	0.194	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	131.2	175.1	-178.4	65.5	0	0	0	109.3	C517 T527 C550 Y552	L514-C517 VanDerWaalsContact CD1-SG 3.54Å; L514-T527 WeakPolarHBondContact CB-OG1 3.01Å; L514-T527 HydrophobicContact CD2-CG2 4.46Å; L514-C550 HydrophobicContact CD1-CB 3.49Å; L514-C550 VanDerWaalsContact CD1-CB 3.49Å; L514-Y552 HydrophobicContact CB-CD1 4.5Å; L514-Y552 HydrophobicContact CB-CE1 4.03Å; L514-Y552 HydrophobicContact CD1-CE1 4.08Å; L514-Y552 HydrophobicContact CD1-CE2 4Å
515	Q	72	Confident	66.3	Low	80 Å²	80	69.9 Å²	69.9	37%	0.374	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-50.7	172.3	-75.6	-175.8	-16.4	0	0	112	C471 Y513 H551	C471-Q515 PolarHBondContact SG-NE2 3.11Å; C471-Q515 PolarHBondContact SG-OE1 2.66Å; Y513-Q515 HydrophobicContact CD2-CG 4.2Å; Y513-Q515 HydrophobicContact CE2-CG 3.88Å; Q515-H551 HydrophobicContact CB-CB 4.37Å; Q515-H551 PolarHBondContact N-O 2.86Å; Q515-H551 PolarHBondContact OE1-ND1 2.93Å
516	V	74.1	Confident	65.4	Low	87 Å²	87	70.5 Å²	70.5	53%	0.527	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	152.3	-177.4	64.4	0	0	0	0	110	C550 H551	V516-C550 CarbonylContact O-C 3.6Å; V516-C550 WeakPolarHBondContact O-CA 3.47Å; V516-H551 HydrophobicContact CG1-CB 3.72Å; V516-H551 PolarHBondContact O-N 3.5Å
517	C	73.6	Confident	64.9	Low	23 Å²	23	72.6 Å²	72.6	16%	0.155	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	146.1	167	-60.2	0	0	0	0	109.7	L514 D519 S520 N549 C550	L514-C517 VanDerWaalsContact CD1-SG 3.54Å; C517-D519 PolarHBondContact O-N 2.83Å; C517-S520 PolarHBondContact O-N 2.95Å; C517-S520 PolarHBondContact O-OG 3.03Å; C517-S520 VanDerWaalsContact O-OG 3.07Å; C517-N549 CarbonylContact C-O 3.55Å; C517-N549 VanDerWaalsContact CA-O 3.32Å; C517-N549 WeakPolarHBondContact CA-O 3.46Å; C517-C550 HydrophobicContact CB-CB 4.11Å; C517-C550 WeakPolarHBondContact CB-SG 3.48Å; C517-C550 WeakPolarHBondContact SG-CB 3.25Å; C517-C550 CovalentContact SG-SG 2.04Å; C517-C550 PolarHBondContact SG-SG 2.89Å
518	V	67.1	Low	64.3	Low	119 Å²	119	80 Å²	80	72%	0.721	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-30	-177.7	-179.2	0	0	0	0	111.5	N549	V518-N549 HydrophobicContact CB-CB 4.23Å; V518-N549 HydrophobicContact CG2-CB 4.35Å; V518-N549 PolarHBondContact N-O 2.04Å
519	D	55.3	Low	64.1	Low	128 Å²	128	82.9 Å²	82.9	68%	0.684	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	8.5	-174.2	-58.8	-47.2	0	0	0	114.4	C517 N521 N549	C517-D519 PolarHBondContact O-N 2.83Å; D519-N521 PolarHBondContact O-N 3Å; D519-N549 PolarHBondContact OD2-ND2 3.28Å
520	S	51.8	Low	64	Low	56 Å²	56	83.9 Å²	83.9	39%	0.392	46%	0.463	S	S	.	.			trans	-92.8	101.1	178.9	58.7	0	0	0	0	111.5	C517 N522	C517-S520 PolarHBondContact O-N 2.95Å; C517-S520 PolarHBondContact O-OG 3.03Å; C517-S520 VanDerWaalsContact O-OG 3.07Å; S520-N522 PolarHBondContact O-N 2.9Å
521	N	45.3	Very low	63.9	Low	169 Å²	169	87.6 Å²	87.6	90%	0.904	49%	0.486	S	S	*	.	S	Bend	trans	-64.3	2.7	165.7	-83.2	-16.7	0	0	0	114	D519	D519-N521 PolarHBondContact O-N 3Å
522	N	38	Very low	63.8	Low	119 Å²	119	89.2 Å²	89.2	64%	0.636	50%	0.495	S	S	*	.	S	Bend	trans	-113.2	118.4	173	-82.7	-23.8	0	0	0	109.6	S520 I524	S520-N522 PolarHBondContact O-N 2.9Å; N522-I524 PolarHBondContact O-N 3.24Å
523	P	42.9	Very low	63.5	Low	111 Å²	111	91.6 Å²	91.6	72%	0.721	51%	0.508	S	S	*	.	S	Bend	trans	-68.8	123.9	166.8	29.2	-28.2	0	0	0	107.6
524	I	47.1	Very low	63.2	Low	138 Å²	138	88.9 Å²	88.9	71%	0.708	50%	0.498	S	S	*	.			trans	70	78.3	165.8	-42.6	160.4	0	0	0	113.1	N522 D526	N522-I524 PolarHBondContact O-N 3.24Å; I524-D526 PolarHBondContact O-N 2.83Å
525	L	46.5	Very low	62.8	Low	133 Å²	133	94.3 Å²	94.3	70%	0.696	52%	0.52	S	S	*	.			trans	-72.3	114.6	149.1	-158.2	78.8	0	0	0	105.8	T527	L525-T527 HydrophobicContact CD2-CG2 4.38Å; L525-T527 PolarHBondContact O-N 2.85Å; L525-T527 PolarHBondContact O-OG1 3.27Å
526	D	47	Very low	62.3	Low	152 Å²	152	92.1 Å²	92.1	81%	0.813	51%	0.514	S	S	*	.			trans	-58.3	79.5	175.6	-84.8	-28.4	0	0	0	110.1	I524 L528	I524-D526 PolarHBondContact O-N 2.83Å; D526-L528 PolarHBondContact O-N 2.73Å
527	T	57.3	Low	61.9	Low	51 Å²	51	97.2 Å²	97.2	31%	0.313	53%	0.529	S	S	.	.			trans	-86	109.7	171.6	44	0	0	0	0	106.5	L514 L525	L514-T527 WeakPolarHBondContact CB-OG1 3.01Å; L514-T527 HydrophobicContact CD2-CG2 4.46Å; L525-T527 HydrophobicContact CD2-CG2 4.38Å; L525-T527 PolarHBondContact O-N 2.85Å; L525-T527 PolarHBondContact O-OG1 3.27Å
528	L	62.7	Low	61.7	Low	158 Å²	158	100.2 Å²	100.2	83%	0.827	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-48	131.5	173	-86.6	142.6	0	0	0	109.2	D526 S530	D526-L528 PolarHBondContact O-N 2.73Å; L528-S530 PolarHBondContact O-N 3.24Å; L528-S530 VanDerWaalsContact O-N 3.14Å
529	P	71.6	Confident	62	Low	64 Å²	64	101.3 Å²	101.3	42%	0.416	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-55.1	125.4	176	21.4	-31.3	0	0	0	108.6	W512	W512-P529 CarbonylContact O-C 3.54Å; W512-P529 WeakPolarHBondContact O-CA 3.13Å
530	S	80.5	Confident	63.1	Low	29 Å²	29	99.9 Å²	99.9	20%	0.203	53%	0.53	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	138.6	172.3	-70.8	0	0	0	0	108.3	Q511 W512 L528	Q511-S530 CarbonylContact C-O 3.58Å; Q511-S530 VanDerWaalsContact CA-O 3.29Å; Q511-S530 WeakPolarHBondContact CA-O 3.2Å; W512-S530 PolarHBondContact N-O 3.05Å; W512-S530 PolarHBondContact O-N 2.92Å; L528-S530 PolarHBondContact O-N 3.24Å; L528-S530 VanDerWaalsContact O-N 3.14Å
531	T	79.8	Confident	64.6	Low	78 Å²	78	97.5 Å²	97.5	48%	0.479	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	144.7	-174.4	67.6	0	0	0	0	110.7	I510 Q511	I510-T531 CarbonylContact O-C 3.58Å; I510-T531 VanDerWaalsContact O-CA 3.28Å; I510-T531 WeakPolarHBondContact O-CA 3.2Å; Q511-T531 HydrophobicContact CB-CG2 4.07Å; Q511-T531 HydrophobicContact CG-CG2 3.66Å
532	I	80.8	Confident	66.5	Low	59 Å²	59	93.2 Å²	93.2	30%	0.303	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	140.3	173	-166.1	170.8	0	0	0	109.9	I510 W512 V541	I510-I532 HydrophobicContact CB-CG2 3.84Å; I510-I532 HydrophobicContact CD1-CG2 4.1Å; I510-I532 HydrophobicContact CG2-CG2 4.38Å; I510-I532 PolarHBondContact N-O 2.7Å; I510-I532 PolarHBondContact O-N 3.29Å; W512-I532 HydrophobicContact CH2-CB 4.33Å; W512-I532 HydrophobicContact CH2-CG2 4.41Å; W512-I532 HydrophobicContact CZ3-CB 4Å; W512-I532 HydrophobicContact CZ3-CG2 3.74Å; I532-V541 HydrophobicContact CD1-CG1 4.16Å; I532-V541 HydrophobicContact CG2-CG1 3.7Å
533	L	79.3	Confident	68.8	Low	64 Å²	64	87.6 Å²	87.6	34%	0.335	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	124	175.6	-137	84.3	0	0	0	109.7	T507 L509 I568	T507-L533 HydrophobicContact CG2-CD1 4.31Å; T507-L533 HydrophobicContact CG2-CD2 3.51Å; T507-L533 HydrophobicContact CG2-CG 3.57Å; L509-L533 HydrophobicContact CB-CD1 4.41Å; L509-L533 HydrophobicContact CD1-CD1 3.72Å; L533-I568 HydrophobicContact CD1-CD1 3.36Å; L533-I568 HydrophobicContact CD2-CD1 3.94Å; L533-I568 HydrophobicContact CG-CD1 4.08Å
534	L	75.2	Confident	70.7	Confident	11 Å²	11	85.7 Å²	85.7	6%	0.058	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	127.5	178.1	-157.9	67.4	0	0	0	110.5	I498 T507 A508 I510 D538 V541	I498-L534 HydrophobicContact CD1-CD2 3.88Å; T507-L534 WeakPolarHBondContact CA-O 3.5Å; A508-L534 HydrophobicContact CB-CB 4.33Å; A508-L534 PolarHBondContact N-O 2.89Å; A508-L534 PolarHBondContact O-N 2.79Å; I510-L534 HydrophobicContact CD1-CB 4.09Å; I510-L534 HydrophobicContact CD1-CD2 4.09Å; L534-D538 HydrophobicContact CD1-CB 3.43Å; L534-D538 VanDerWaalsContact CD1-CB 3.43Å; L534-D538 HydrophobicContact CD2-CB 4.23Å; L534-D538 WeakPolarHBondContact CD2-O 3.12Å; L534-D538 HydrophobicContact CG-CB 3.78Å; L534-V541 HydrophobicContact CB-CG2 4.43Å; L534-V541 HydrophobicContact CD1-CG2 3.26Å; L534-V541 HydrophobicContact CD2-CG2 3.52Å; L534-V541 HydrophobicContact CG-CG2 3.9Å
535	K	71.1	Confident	72.4	Confident	151 Å²	151	83.1 Å²	83.1	66%	0.657	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	146.8	171	-66	-178.9	-179	178.6	0	108.8	K537 D538	K535-K537 PolarHBondContact O-N 2.89Å; K535-D538 PolarHBondContact O-N 3.42Å
536	S	62.2	Low	74.1	Confident	35 Å²	35	77.2 Å²	77.2	25%	0.245	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-16.3	-174.1	128.2	0	0	0	0	117	S506	S506-S536 WeakPolarHBondContact O-CA 3.44Å; S506-S536 WeakPolarHBondContact O-CB 3.27Å; S506-S536 PolarHBondContact O-N 3.14Å
537	K	65.7	Low	75.8	Confident	193 Å²	193	74.6 Å²	74.6	84%	0.839	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-26.3	179.2	-66.7	-172.1	178.1	-177.4	0	113.3	K535	K535-K537 PolarHBondContact O-N 2.89Å
538	D	68.9	Low	76.8	Confident	86 Å²	86	74.7 Å²	74.7	46%	0.46	38%	0.376	S	S	.	.			trans	-90.2	125	-175	-59.4	-39.2	0	0	0	109.5	L534 K535	L534-D538 HydrophobicContact CD1-CB 3.43Å; L534-D538 VanDerWaalsContact CD1-CB 3.43Å; L534-D538 HydrophobicContact CD2-CB 4.23Å; L534-D538 WeakPolarHBondContact CD2-O 3.12Å; L534-D538 HydrophobicContact CG-CB 3.78Å; K535-D538 PolarHBondContact O-N 3.42Å
539	K	73.1	Confident	77.6	Confident	142 Å²	142	69.5 Å²	69.5	62%	0.617	35%	0.349	S	S	*	.			trans	-101.9	-7.6	177.5	-65.8	-171.7	180	-177.1	0	113.3	Q497 I498	Q497-K539 WeakPolarHBondContact CA-O 3.25Å; I498-K539 PolarHBondContact N-O 2.87Å
540	I	78.8	Confident	78	Confident	99 Å²	99	66.7 Å²	66.7	51%	0.508	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	133.6	-173.7	-64	164.3	0	0	0	108.1	I495 L496 Q497	I495-I540 HydrophobicContact CG2-CG2 3.42Å; I495-I540 VanDerWaalsContact CG2-CG2 3.42Å; L496-I540 WeakPolarHBondContact O-CA 3.35Å; Q497-I540 HydrophobicContact CB-CG1 4.47Å; Q497-I540 HydrophobicContact CG-CG1 4.39Å
541	V	83.4	Confident	78.2	Confident	5 Å²	5	66.4 Å²	66.4	3%	0.03	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	140.3	177.9	165.2	0	0	0	0	109.7	L496 I510 I532 L534 L543	L496-V541 PolarHBondContact N-O 3.29Å; L496-V541 PolarHBondContact O-N 3.34Å; I510-V541 HydrophobicContact CD1-CB 4.19Å; I510-V541 HydrophobicContact CD1-CG1 4.24Å; I510-V541 HydrophobicContact CD1-CG2 3.61Å; I532-V541 HydrophobicContact CD1-CG1 4.16Å; I532-V541 HydrophobicContact CG2-CG1 3.7Å; L534-V541 HydrophobicContact CB-CG2 4.43Å; L534-V541 HydrophobicContact CD1-CG2 3.26Å; L534-V541 HydrophobicContact CD2-CG2 3.52Å; L534-V541 HydrophobicContact CG-CG2 3.9Å; V541-L543 HydrophobicContact CG1-CD2 3.87Å
542	I	84.9	Confident	78.3	Confident	80 Å²	80	63 Å²	63	41%	0.41	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	113.2	171.3	-58	176.1	0	0	0	107.4	F486 K493 A494 E544	F486-I542 HydrophobicContact CZ-CG2 4.36Å; K493-I542 HydrophobicContact CB-CG2 3.96Å; K493-I542 HydrophobicContact CD-CG2 3.95Å; K493-I542 HydrophobicContact CG-CG2 4.38Å; A494-I542 CarbonylContact O-C 3.47Å; A494-I542 WeakPolarHBondContact O-CA 3.41Å; I542-E544 HydrophobicContact CG2-CG 4.28Å
543	L	85.2	Confident	78.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	126.4	171.8	-52.1	178.6	0	0	0	108.1	K493 A494 L496 I510 W512 V541 L546 V554 F591	K493-L543 CarbonylContact C-O 3.53Å; K493-L543 WeakPolarHBondContact CA-O 3.36Å; A494-L543 HydrophobicContact CB-CB 4.37Å; A494-L543 PolarHBondContact N-O 3.08Å; A494-L543 PolarHBondContact O-N 2.91Å; L496-L543 HydrophobicContact CB-CD1 4.11Å; L496-L543 HydrophobicContact CB-CG 4.14Å; L496-L543 HydrophobicContact CD2-CD1 4.32Å; L496-L543 HydrophobicContact CD2-CD2 4.38Å; I510-L543 HydrophobicContact CG2-CD2 4.28Å; W512-L543 HydrophobicContact CD2-CB 4.39Å; W512-L543 HydrophobicContact CD2-CD2 3.86Å; W512-L543 HydrophobicContact CE3-CD2 3.58Å; W512-L543 HydrophobicContact CG-CD2 4.46Å; W512-L543 HydrophobicContact CH2-CD2 4.38Å; W512-L543 HydrophobicContact CZ2-CB 4.43Å; W512-L543 HydrophobicContact CZ3-CD2 3.87Å; V541-L543 HydrophobicContact CG1-CD2 3.87Å; L543-L546 HydrophobicContact CB-CD1 4.38Å; L543-V554 HydrophobicContact CD1-CG2 4.41Å; L543-F591 HydrophobicContact CD1-CD1 4.45Å; L543-F591 HydrophobicContact CD1-CE1 3.57Å; L543-F591 HydrophobicContact CD1-CZ 3.74Å
544	E	84.3	Confident	78.3	Confident	72 Å²	72	57.2 Å²	57.2	34%	0.336	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	178.4	179.5	-57.5	-162.3	146.5	0	0	111.5	K493 W512 I542 L546	K493-E544 HydrophobicContact CD-CG 4.28Å; K493-E544 VanDerWaalsContact CE-OE1 3.25Å; K493-E544 WeakPolarHBondContact CE-OE1 3.25Å; K493-E544 HydrophobicContact CG-CG 4.25Å; K493-E544 IonicContact NZ-OE1 2.9Å; K493-E544 PolarHBondContact NZ-OE1 3.06Å; W512-E544 WeakPolarHBondContact CZ2-O 3.32Å; W512-E544 PolarHBondContact NE1-O 2.77Å; I542-E544 HydrophobicContact CG2-CG 4.28Å; E544-L546 VanDerWaalsContact C-N 3.29Å; E544-L546 PolarHBondContact O-N 2.8Å
545	N	81.6	Confident	78.5	Confident	84 Å²	84	60.5 Å²	60.5	45%	0.449	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	57.2	41.8	179.8	-52.8	-34.4	0	0	0	112.8	K491	K491-N545 PolarHBondContact NZ-OD1 3.39Å
546	L	83.5	Confident	78.9	Confident	9 Å²	9	53.3 Å²	53.3	5%	0.047	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	153.6	175.4	-52	176.8	0	0	0	110.8	L492 A494 L543 E544 Y552 F591 T593	L492-L546 HydrophobicContact CB-CB 4Å; L492-L546 WeakPolarHBondContact CB-O 3.28Å; L492-L546 HydrophobicContact CD2-CB 3.99Å; L492-L546 HydrophobicContact CG-CB 4.07Å; L492-L546 WeakPolarHBondContact O-CB 3.28Å; L492-L546 PolarHBondContact O-N 2.79Å; A494-L546 HydrophobicContact CB-CD1 3.47Å; A494-L546 VanDerWaalsContact CB-CD1 3.47Å; L543-L546 HydrophobicContact CB-CD1 4.38Å; E544-L546 VanDerWaalsContact C-N 3.29Å; E544-L546 PolarHBondContact O-N 2.8Å; L546-Y552 WeakPolarHBondContact CA-OH 3.14Å; L546-Y552 HydrophobicContact CB-CE2 4.32Å; L546-Y552 HydrophobicContact CD2-CD1 4Å; L546-Y552 HydrophobicContact CD2-CD2 4.31Å; L546-Y552 HydrophobicContact CD2-CE1 3.74Å; L546-Y552 HydrophobicContact CD2-CE2 4.05Å; L546-Y552 HydrophobicContact CD2-CG 4.29Å; L546-F591 HydrophobicContact CD1-CE2 4.04Å; L546-F591 HydrophobicContact CD1-CZ 4.19Å; L546-F591 HydrophobicContact CD2-CE2 4.3Å; L546-F591 HydrophobicContact CD2-CZ 3.85Å; L546-T593 HydrophobicContact CB-CG2 4.15Å; L546-T593 HydrophobicContact CD1-CG2 4.31Å
547	H	82	Confident	79.7	Confident	97 Å²	97	54.7 Å²	54.7	45%	0.449	26%	0.256	S	S	.	.			trans	-111.9	152	174.9	-66.9	-71.7	0	0	0	109.8	L492 C550 Y552 T593	L492-H547 WeakPolarHBondContact CD2-O 3.34Å; H547-C550 HydrophobicContact CB-CB 4.42Å; H547-C550 WeakPolarHBondContact CB-SG 3.36Å; H547-Y552 PolarHBondContact CD2-OH 3.3Å; H547-Y552 PolarHBondContact N-OH 2.95Å; H547-T593 WeakPolarHBondContact O-CB 3.27Å; H547-T593 WeakPolarHBondContact O-CG2 3.45Å; H547-T593 PolarHBondContact O-OG1 2.99Å
548	F	79.1	Confident	80.1	Confident	53 Å²	53	46.4 Å²	46.4	23%	0.232	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	152.1	175.9	-57.9	-82.3	0	0	0	111	Y487 L492 C550 C596 V599	Y487-F548 HydrophobicContact CD2-CE1 4.21Å; Y487-F548 HydrophobicContact CD2-CE2 4.39Å; Y487-F548 AromaticContact CD2-CZ 3.52Å; Y487-F548 HydrophobicContact CD2-CZ 3.52Å; Y487-F548 HydrophobicContact CE2-CE2 4.07Å; Y487-F548 AromaticContact CE2-CZ 3.6Å; Y487-F548 HydrophobicContact CE2-CZ 3.6Å; Y487-F548 HydrophobicContact CG-CZ 4.34Å; L492-F548 HydrophobicContact CD1-CD1 4.11Å; L492-F548 HydrophobicContact CD1-CE1 3.75Å; L492-F548 HydrophobicContact CD1-CZ 4.43Å; L492-F548 HydrophobicContact CD2-CD1 3.99Å; L492-F548 HydrophobicContact CD2-CE1 4.38Å; L492-F548 HydrophobicContact CD2-CG 4.37Å; F548-C550 PolarHBondContact O-N 3.48Å; F548-C550 PolarHBondContact O-SG 2.98Å; F548-C596 HydrophobicContact CD1-CB 3.65Å; F548-C596 HydrophobicContact CD2-CB 4.1Å; F548-C596 HydrophobicContact CE1-CB 3.56Å; F548-C596 HydrophobicContact CE2-CB 4.04Å; F548-C596 HydrophobicContact CG-CB 3.91Å; F548-C596 HydrophobicContact CZ-CB 3.77Å; F548-V599 HydrophobicContact CD1-CG2 3.85Å; F548-V599 HydrophobicContact CE1-CB 4.2Å; F548-V599 HydrophobicContact CE1-CG2 3.7Å
549	N	79.1	Confident	80.3	Confident	48 Å²	48	43.4 Å²	43.4	26%	0.257	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	42.9	178.2	-77.3	-8.8	0	0	0	114.5	C517 V518 D519 T593 P594 S595	C517-N549 CarbonylContact C-O 3.55Å; C517-N549 VanDerWaalsContact CA-O 3.32Å; C517-N549 WeakPolarHBondContact CA-O 3.46Å; V518-N549 HydrophobicContact CB-CB 4.23Å; V518-N549 HydrophobicContact CG2-CB 4.35Å; V518-N549 PolarHBondContact N-O 2.04Å; D519-N549 PolarHBondContact OD2-ND2 3.28Å; N549-T593 WeakPolarHBondContact CA-O 3.46Å; N549-T593 PolarHBondContact N-O 3.32Å; N549-P594 PolarHBondContact N-O 2.64Å; N549-S595 WeakPolarHBondContact OD1-CA 3.44Å; N549-S595 VanDerWaalsContact OD1-CB 3.27Å; N549-S595 WeakPolarHBondContact OD1-CB 3.08Å; N549-S595 PolarHBondContact OD1-N 2.96Å
550	C	80.4	Confident	80	Confident	6 Å²	6	42.2 Å²	42.2	4%	0.041	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	150.3	-174.6	-61.4	0	0	0	0	113.3	L514 V516 C517 H547 F548 Y552 C592 T593	L514-C550 HydrophobicContact CD1-CB 3.49Å; L514-C550 VanDerWaalsContact CD1-CB 3.49Å; V516-C550 CarbonylContact O-C 3.6Å; V516-C550 WeakPolarHBondContact O-CA 3.47Å; C517-C550 HydrophobicContact CB-CB 4.11Å; C517-C550 WeakPolarHBondContact CB-SG 3.48Å; C517-C550 WeakPolarHBondContact SG-CB 3.25Å; C517-C550 CovalentContact SG-SG 2.04Å; C517-C550 PolarHBondContact SG-SG 2.89Å; H547-C550 HydrophobicContact CB-CB 4.42Å; H547-C550 WeakPolarHBondContact CB-SG 3.36Å; F548-C550 PolarHBondContact O-N 3.48Å; F548-C550 PolarHBondContact O-SG 2.98Å; C550-Y552 HydrophobicContact CB-CD2 4.25Å; C550-Y552 HydrophobicContact CB-CE2 3.66Å; C550-C592 WeakPolarHBondContact O-CA 3.23Å; C550-T593 PolarHBondContact N-OG1 3.38Å; C550-T593 PolarHBondContact O-N 2.89Å; C550-T593 PolarHBondContact O-OG1 3.06Å; C550-T593 VanDerWaalsContact O-OG1 3.11Å
551	H	83.1	Confident	79.5	Confident	22 Å²	22	39.7 Å²	39.7	10%	0.102	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	124.4	175.7	-147.3	-108.2	0	0	0	110.3	C471 C473 Q515 V516 C592	C471-H551 PolarHBondContact O-CE1 3.23Å; C471-H551 PolarHBondContact SG-CE1 3.15Å; C471-H551 PolarHBondContact SG-ND1 2.02Å; C473-H551 PolarHBondContact SG-CD2 3.31Å; C473-H551 PolarHBondContact SG-NE2 2.95Å; C473-H551 VanDerWaalsContact SG-NE2 3.41Å; Q515-H551 HydrophobicContact CB-CB 4.37Å; Q515-H551 PolarHBondContact N-O 2.86Å; Q515-H551 PolarHBondContact OE1-ND1 2.93Å; V516-H551 HydrophobicContact CG1-CB 3.72Å; V516-H551 PolarHBondContact O-N 3.5Å; H551-C592 PolarHBondContact CD2-SG 3.42Å; H551-C592 PolarHBondContact NE2-SG 3Å
552	Y	82.1	Confident	78.5	Confident	6 Å²	6	44.1 Å²	44.1	2%	0.024	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.1	-179.1	-77.3	-89.7	0	0	0	111.4	Y513 L514 L546 H547 C550 C590 F591 T593	Y513-Y552 WeakPolarHBondContact O-CA 3.28Å; L514-Y552 HydrophobicContact CB-CD1 4.5Å; L514-Y552 HydrophobicContact CB-CE1 4.03Å; L514-Y552 HydrophobicContact CD1-CE1 4.08Å; L514-Y552 HydrophobicContact CD1-CE2 4Å; L546-Y552 WeakPolarHBondContact CA-OH 3.14Å; L546-Y552 HydrophobicContact CB-CE2 4.32Å; L546-Y552 HydrophobicContact CD2-CD1 4Å; L546-Y552 HydrophobicContact CD2-CD2 4.31Å; L546-Y552 HydrophobicContact CD2-CE1 3.74Å; L546-Y552 HydrophobicContact CD2-CE2 4.05Å; L546-Y552 HydrophobicContact CD2-CG 4.29Å; H547-Y552 PolarHBondContact CD2-OH 3.3Å; H547-Y552 PolarHBondContact N-OH 2.95Å; C550-Y552 HydrophobicContact CB-CD2 4.25Å; C550-Y552 HydrophobicContact CB-CE2 3.66Å; Y552-C590 WeakPolarHBondContact O-CA 3.27Å; Y552-F591 VanDerWaalsContact CB-CE1 3.45Å; Y552-F591 VanDerWaalsContact CB-CZ 3.45Å; Y552-F591 HydrophobicContact CD1-CZ 4.4Å; Y552-F591 AromaticContact CD2-CE2 3.98Å; Y552-F591 HydrophobicContact CD2-CE2 3.98Å; Y552-F591 HydrophobicContact CD2-CZ 4.09Å; Y552-F591 HydrophobicContact CG-CE1 4.22Å; Y552-F591 HydrophobicContact CG-CE2 4.09Å; Y552-F591 AromaticContact CG-CZ 3.73Å; Y552-F591 HydrophobicContact CG-CZ 3.73Å; Y552-F591 PolarHBondContact N-O 3.4Å; Y552-F591 PolarHBondContact O-N 3.14Å; Y552-T593 HydrophobicContact CD2-CG2 3.92Å; Y552-T593 HydrophobicContact CE2-CG2 3.81Å
553	G	79.4	Confident	77.5	Confident	1 Å²	1	42 Å²	42	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	139.8	165.3	0	0	0	0	0	110.5	W512 Y513	W512-G553 CarbonylContact C-O 3.57Å; W512-G553 WeakPolarHBondContact CA-O 3.13Å; Y513-G553 PolarHBondContact N-O 3.39Å; Y513-G553 PolarHBondContact O-N 3.43Å
554	V	81.6	Confident	76.5	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.012	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	130.8	175.6	-176.4	0	0	0	0	109	L480 L496 I510 Q511 W512 L543 V556 I588 G589 F591	L480-V554 HydrophobicContact CD1-CG1 4.22Å; L496-V554 HydrophobicContact CD2-CG1 3.98Å; I510-V554 HydrophobicContact CG2-CG1 3.93Å; Q511-V554 CarbonylContact O-C 3.52Å; Q511-V554 WeakPolarHBondContact O-CA 3.3Å; W512-V554 HydrophobicContact CB-CG2 4.09Å; L543-V554 HydrophobicContact CD1-CG2 4.41Å; V554-V556 HydrophobicContact CG1-CG2 4.16Å; V554-I588 CarbonylContact O-C 3.5Å; V554-I588 VanDerWaalsContact O-CA 3.3Å; V554-I588 WeakPolarHBondContact O-CA 3.13Å; V554-G589 PolarHBondContact N-O 3.45Å; V554-G589 PolarHBondContact O-N 2.99Å; V554-F591 HydrophobicContact CG2-CD1 3.53Å; V554-F591 HydrophobicContact CG2-CE1 3.38Å
555	R	79.3	Confident	75.4	Confident	80 Å²	80	46.3 Å²	46.3	30%	0.302	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	125.2	174.4	-175.1	-177.8	-71.2	160.3	-2.2	109.2	I510 Q511 V586 Y587	I510-R555 CarbonylContact C-O 3.56Å; I510-R555 WeakPolarHBondContact CA-O 3.06Å; Q511-R555 PolarHBondContact N-O 3.48Å; Q511-R555 PolarHBondContact O-N 2.96Å; R555-V586 HydrophobicContact CG-CG1 3.62Å; R555-Y587 CarbonylContact C-O 3.53Å; R555-Y587 WeakPolarHBondContact CA-O 3.41Å
556	V	79.3	Confident	74.5	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	118.8	176.3	-172.7	0	0	0	0	109.4	L480 M500 A508 L509 I510 V554 V558 V586 Y587	L480-V556 HydrophobicContact CD1-CG2 3.84Å; L480-V556 HydrophobicContact CD2-CG2 3.7Å; L480-V556 HydrophobicContact CG-CG2 4.42Å; M500-V556 HydrophobicContact CE-CB 4.05Å; M500-V556 HydrophobicContact CE-CG1 3.6Å; A508-V556 HydrophobicContact CB-CG1 4.05Å; L509-V556 CarbonylContact O-C 3.46Å; L509-V556 WeakPolarHBondContact O-CA 3.42Å; I510-V556 HydrophobicContact CB-CG2 4.32Å; I510-V556 HydrophobicContact CG1-CB 4.35Å; I510-V556 HydrophobicContact CG1-CG1 3.83Å; I510-V556 HydrophobicContact CG1-CG2 3.82Å; I510-V556 HydrophobicContact CG2-CG2 4.13Å; V554-V556 HydrophobicContact CG1-CG2 4.16Å; V556-V558 HydrophobicContact CG1-CG2 4.39Å; V556-V586 CarbonylContact O-C 3.56Å; V556-V586 WeakPolarHBondContact O-CA 3.28Å; V556-Y587 PolarHBondContact N-O 3.03Å; V556-Y587 PolarHBondContact O-N 2.87Å
557	R	78.7	Confident	73.6	Confident	64 Å²	64	55.5 Å²	55.5	24%	0.242	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	122.1	172.8	-62.6	-171.1	176.4	127.8	-1.7	109.3	A508 L509 Y559 E572 V586	A508-R557 CarbonylContact C-O 3.51Å; A508-R557 WeakPolarHBondContact CA-O 3.43Å; L509-R557 HydrophobicContact CB-CB 4.45Å; L509-R557 PolarHBondContact N-O 3.29Å; L509-R557 PolarHBondContact O-N 3.4Å; R557-Y559 HydrophobicContact CB-CE2 4.21Å; R557-E572 IonicContact NH1-OE1 2.69Å; R557-E572 PolarHBondContact NH1-OE1 3.01Å; R557-V586 HydrophobicContact CG-CG1 4.35Å; R557-V586 HydrophobicContact CG-CG2 4.12Å
558	V	75	Confident	72.6	Confident	19 Å²	19	51.2 Å²	51.2	12%	0.115	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	124.4	177.5	-174.5	0	0	0	0	109.5	M500 A508 V556 I585 Y587	M500-V558 HydrophobicContact CE-CG2 4.37Å; M500-V558 HydrophobicContact SD-CG2 4.16Å; A508-V558 HydrophobicContact CB-CG2 4.26Å; V556-V558 HydrophobicContact CG1-CG2 4.39Å; V558-I585 PolarHBondContact N-O 3.48Å; V558-Y587 HydrophobicContact CG2-CD2 4.47Å; V558-Y587 HydrophobicContact CG2-CE2 4.23Å
559	Y	72.7	Confident	71.6	Confident	23 Å²	23	52.8 Å²	52.8	9%	0.09	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	132.5	175.8	-62	-79.2	0	0	0	110.4	S506 T507 L509 R557 A561 L563 I568	S506-Y559 WeakPolarHBondContact CA-O 3.07Å; S506-Y559 WeakPolarHBondContact CB-O 3.07Å; T507-Y559 PolarHBondContact N-O 3.36Å; T507-Y559 VanDerWaalsContact N-O 3.08Å; T507-Y559 PolarHBondContact O-N 2.96Å; L509-Y559 HydrophobicContact CB-CE2 3.98Å; R557-Y559 HydrophobicContact CB-CE2 4.21Å; Y559-A561 PolarHBondContact O-N 2.53Å; Y559-L563 HydrophobicContact CD1-CD1 3.99Å; Y559-L563 HydrophobicContact CD2-CD1 4.26Å; Y559-L563 HydrophobicContact CG-CD1 3.71Å; Y559-I568 HydrophobicContact CD2-CD1 4.32Å; Y559-I568 HydrophobicContact CE2-CD1 4.32Å
560	P	66.9	Low	70.4	Confident	116 Å²	116	55.8 Å²	55.8	75%	0.753	30%	0.297	S	S	*	.	S	Bend	trans	-73.4	17.7	-174.2	29.8	-35.3	0	0	0	115.2
561	A	67.7	Low	69.2	Low	47 Å²	47	57.6 Å²	57.6	39%	0.388	31%	0.305	S	S	.	.	S	Bend	trans	-144.9	156	176.5	0	0	0	0	0	110.5	E505 T507 Y559 L563	E505-A561 CarbonylContact O-C 3.41Å; E505-A561 VanDerWaalsContact O-CA 3.32Å; E505-A561 WeakPolarHBondContact O-CA 3.34Å; T507-A561 PolarHBondContact N-O 2.87Å; T507-A561 PolarHBondContact OG1-O 3.42Å; Y559-A561 PolarHBondContact O-N 2.53Å; A561-L563 VanDerWaalsContact C-N 3.32Å; A561-L563 HydrophobicContact CB-CD2 4.4Å; A561-L563 PolarHBondContact O-N 2.88Å
562	T	63.8	Low	68	Low	97 Å²	97	60.3 Å²	60.3	60%	0.595	32%	0.317	S	S	*	.			trans	-70.2	88.1	169.4	50.1	0	0	0	0	110.3	E505 T507	E505-T562 HydrophobicContact CB-CG2 4.45Å; T507-T562 WeakPolarHBondContact OG1-CA 3.43Å
563	L	63.8	Low	66.4	Low	37 Å²	37	63.8 Å²	63.8	19%	0.194	34%	0.343	C	S	.	.			trans	-86.8	138.3	176	-62	177.2	0	0	0	110.6	T507 Y559 A561 Y567 I568	T507-L563 PolarHBondContact OG1-N 3.28Å; Y559-L563 HydrophobicContact CD1-CD1 3.99Å; Y559-L563 HydrophobicContact CD2-CD1 4.26Å; Y559-L563 HydrophobicContact CG-CD1 3.71Å; A561-L563 VanDerWaalsContact C-N 3.32Å; A561-L563 HydrophobicContact CB-CD2 4.4Å; A561-L563 PolarHBondContact O-N 2.88Å; L563-Y567 HydrophobicContact CD2-CD1 3.49Å; L563-Y567 VanDerWaalsContact CD2-CD1 3.49Å; L563-Y567 HydrophobicContact CD2-CE1 3.99Å; L563-Y567 HydrophobicContact CD2-CG 4.19Å; L563-I568 HydrophobicContact CB-CD1 3.91Å; L563-I568 HydrophobicContact CB-CG1 3.7Å; L563-I568 HydrophobicContact CD1-CG1 3.94Å; L563-I568 HydrophobicContact CG-CG1 4.49Å
564	D	63.7	Low	64.8	Low	96 Å²	96	68.1 Å²	68.1	51%	0.513	37%	0.365	S	S	.	.			trans	-79.2	163.2	167.3	79.7	15	0	0	0	110.8	K566 Y567 I568	D564-K566 PolarHBondContact O-N 2.95Å; D564-K566 WeakPolarHBondContact OD1-CA 3.49Å; D564-K566 VanDerWaalsContact OD1-CB 3.23Å; D564-K566 WeakPolarHBondContact OD1-CB 3.07Å; D564-K566 PolarHBondContact OD1-N 3.12Å; D564-Y567 PolarHBondContact O-N 3.08Å; D564-Y567 WeakPolarHBondContact OD1-CB 3.36Å; D564-Y567 PolarHBondContact OD1-N 3.26Å; D564-I568 PolarHBondContact O-N 3.09Å; D564-I568 VanDerWaalsContact O-N 3.15Å
565	A	60.9	Low	63.1	Low	65 Å²	65	70.5 Å²	70.5	54%	0.537	38%	0.38	S	S	.	.	H	α-helix	trans	-61.4	-26.2	-179.4	0	0	0	0	0	112.9	T569	A565-T569 PolarHBondContact O-N 3.2Å; A565-T569 VanDerWaalsContact O-N 3.12Å; A565-T569 PolarHBondContact O-OG1 3.41Å
566	K	63.2	Low	61.2	Low	172 Å²	172	74.6 Å²	74.6	75%	0.748	40%	0.402	S	S	*	.	H	α-helix	trans	-72.7	-38.7	179.1	-120.6	-178.6	-179.3	-178.5	0	111.4	D564 T569 M570	D564-K566 PolarHBondContact O-N 2.95Å; D564-K566 WeakPolarHBondContact OD1-CA 3.49Å; D564-K566 VanDerWaalsContact OD1-CB 3.23Å; D564-K566 WeakPolarHBondContact OD1-CB 3.07Å; D564-K566 PolarHBondContact OD1-N 3.12Å; K566-T569 WeakPolarHBondContact CA-OG1 3.49Å; K566-T569 PolarHBondContact O-OG1 3.44Å; K566-M570 WeakPolarHBondContact O-CB 3.5Å; K566-M570 PolarHBondContact O-N 2.97Å
567	Y	63.2	Low	59.5	Low	115 Å²	115	80.4 Å²	80.4	45%	0.451	44%	0.437	S	S	.	.	H	α-helix	trans	-74.2	-35.7	179	-149.8	-90.8	0	0	0	111.1	L563 D564 M570 M571	L563-Y567 HydrophobicContact CD2-CD1 3.49Å; L563-Y567 VanDerWaalsContact CD2-CD1 3.49Å; L563-Y567 HydrophobicContact CD2-CE1 3.99Å; L563-Y567 HydrophobicContact CD2-CG 4.19Å; D564-Y567 PolarHBondContact O-N 3.08Å; D564-Y567 WeakPolarHBondContact OD1-CB 3.36Å; D564-Y567 PolarHBondContact OD1-N 3.26Å; Y567-M570 PolarHBondContact O-N 3.15Å; Y567-M571 HydrophobicContact CD1-CE 4.25Å; Y567-M571 HydrophobicContact CD1-CG 3.91Å; Y567-M571 HydrophobicContact CE1-CE 3.42Å; Y567-M571 VanDerWaalsContact CE1-CE 3.42Å; Y567-M571 HydrophobicContact CE1-CG 4.06Å; Y567-M571 VanDerWaalsContact O-CB 3.29Å; Y567-M571 WeakPolarHBondContact O-CB 3.23Å; Y567-M571 VanDerWaalsContact O-CG 3.24Å; Y567-M571 WeakPolarHBondContact O-CG 3.2Å; Y567-M571 PolarHBondContact O-N 3.3Å
568	I	61.3	Low	57.4	Low	6 Å²	6	83 Å²	83	3%	0.031	45%	0.452	C	S	.	.	H	α-helix	trans	-68.5	-41.5	174.5	-65.5	174.9	0	0	0	110.9	T507 L509 L533 Y559 L563 D564 M570 M571 E572	T507-I568 HydrophobicContact CG2-CD1 4.11Å; L509-I568 HydrophobicContact CD2-CG2 4.22Å; L533-I568 HydrophobicContact CD1-CD1 3.36Å; L533-I568 HydrophobicContact CD2-CD1 3.94Å; L533-I568 HydrophobicContact CG-CD1 4.08Å; Y559-I568 HydrophobicContact CD2-CD1 4.32Å; Y559-I568 HydrophobicContact CE2-CD1 4.32Å; L563-I568 HydrophobicContact CB-CD1 3.91Å; L563-I568 HydrophobicContact CB-CG1 3.7Å; L563-I568 HydrophobicContact CD1-CG1 3.94Å; L563-I568 HydrophobicContact CG-CG1 4.49Å; D564-I568 PolarHBondContact O-N 3.09Å; D564-I568 VanDerWaalsContact O-N 3.15Å; I568-M570 VanDerWaalsContact C-N 3.34Å; I568-M570 PolarHBondContact O-N 3.19Å; I568-M571 PolarHBondContact O-N 3.06Å; I568-E572 HydrophobicContact CG2-CG 4.48Å; I568-E572 WeakPolarHBondContact O-CB 3.13Å; I568-E572 WeakPolarHBondContact O-CG 3.27Å; I568-E572 PolarHBondContact O-N 3.36Å
569	T	57.9	Low	55.5	Low	86 Å²	86	87 Å²	87	53%	0.528	47%	0.472	S	S	.	.	H	α-helix	trans	-66	-35.7	173.9	38.3	0	0	0	0	112.4	A565 K566 S573	A565-T569 PolarHBondContact O-N 3.2Å; A565-T569 VanDerWaalsContact O-N 3.12Å; A565-T569 PolarHBondContact O-OG1 3.41Å; K566-T569 WeakPolarHBondContact CA-OG1 3.49Å; K566-T569 PolarHBondContact O-OG1 3.44Å; T569-S573 WeakPolarHBondContact O-CB 3.3Å; T569-S573 PolarHBondContact O-N 3.34Å; T569-S573 VanDerWaalsContact O-N 3.08Å; T569-S573 PolarHBondContact O-OG 3.39Å
570	M	55.1	Low	53.9	Low	112 Å²	112	92.1 Å²	92.1	55%	0.552	50%	0.498	S	S	*	.	H	α-helix	trans	-66.4	-41.1	171.6	-171.1	175.1	175.6	0	0	112.1	K566 Y567 I568 S573 L574	K566-M570 WeakPolarHBondContact O-CB 3.5Å; K566-M570 PolarHBondContact O-N 2.97Å; Y567-M570 PolarHBondContact O-N 3.15Å; I568-M570 VanDerWaalsContact C-N 3.34Å; I568-M570 PolarHBondContact O-N 3.19Å; M570-S573 WeakPolarHBondContact CA-OG 3.49Å; M570-S573 PolarHBondContact O-N 3.38Å; M570-S573 PolarHBondContact O-OG 3.28Å; M570-L574 HydrophobicContact CE-CD1 4.19Å; M570-L574 HydrophobicContact CG-CD1 3.96Å; M570-L574 WeakPolarHBondContact O-CB 3.5Å; M570-L574 WeakPolarHBondContact O-CD1 3.5Å; M570-L574 WeakPolarHBondContact O-CG 3.34Å; M570-L574 PolarHBondContact O-N 2.88Å
571	M	54.8	Low	52.6	Low	43 Å²	43	95.3 Å²	95.3	21%	0.212	50%	0.502	C	S	.	.	H	α-helix	trans	-67.6	-41.8	176.6	-78.5	-73.2	167.9	0	0	111.9	Y567 I568 S573 L574 V575 F582	Y567-M571 HydrophobicContact CD1-CE 4.25Å; Y567-M571 HydrophobicContact CD1-CG 3.91Å; Y567-M571 HydrophobicContact CE1-CE 3.42Å; Y567-M571 VanDerWaalsContact CE1-CE 3.42Å; Y567-M571 HydrophobicContact CE1-CG 4.06Å; Y567-M571 VanDerWaalsContact O-CB 3.29Å; Y567-M571 WeakPolarHBondContact O-CB 3.23Å; Y567-M571 VanDerWaalsContact O-CG 3.24Å; Y567-M571 WeakPolarHBondContact O-CG 3.2Å; Y567-M571 PolarHBondContact O-N 3.3Å; I568-M571 PolarHBondContact O-N 3.06Å; M571-S573 VanDerWaalsContact C-N 3.31Å; M571-S573 PolarHBondContact O-N 3.13Å; M571-L574 PolarHBondContact O-N 2.78Å; M571-V575 VanDerWaalsContact O-CG2 3.23Å; M571-V575 WeakPolarHBondContact O-CG2 3.46Å; M571-V575 PolarHBondContact O-N 2.79Å; M571-F582 HydrophobicContact CE-CZ 4.03Å; M571-F582 HydrophobicContact SD-CE1 4.37Å; M571-F582 HydrophobicContact SD-CE2 3.68Å; M571-F582 HydrophobicContact SD-CZ 3.42Å; M571-F582 WeakPolarHBondContact SD-CZ 3.35Å
572	E	56.8	Low	51.6	Low	79 Å²	79	98.6 Å²	98.6	37%	0.369	51%	0.508	S	S	.	.	H	α-helix	trans	-68.2	-29	176.4	-74.3	-166.3	151.2	0	0	112.6	R557 I568	R557-E572 IonicContact NH1-OE1 2.69Å; R557-E572 PolarHBondContact NH1-OE1 3.01Å; I568-E572 HydrophobicContact CG2-CG 4.48Å; I568-E572 WeakPolarHBondContact O-CB 3.13Å; I568-E572 WeakPolarHBondContact O-CG 3.27Å; I568-E572 PolarHBondContact O-N 3.36Å
573	S	50.2	Low	50.9	Low	80 Å²	80	101.7 Å²	101.7	56%	0.559	52%	0.521	S	S	*	.	H	α-helix	trans	-79.9	-27.7	174.9	44.7	0	0	0	0	113.8	T569 M570 M571	T569-S573 WeakPolarHBondContact O-CB 3.3Å; T569-S573 PolarHBondContact O-N 3.34Å; T569-S573 VanDerWaalsContact O-N 3.08Å; T569-S573 PolarHBondContact O-OG 3.39Å; M570-S573 WeakPolarHBondContact CA-OG 3.49Å; M570-S573 PolarHBondContact O-N 3.38Å; M570-S573 PolarHBondContact O-OG 3.28Å; M571-S573 VanDerWaalsContact C-N 3.31Å; M571-S573 PolarHBondContact O-N 3.13Å
574	L	45.9	Very low	50.5	Low	91 Å²	91	100.9 Å²	100.9	48%	0.476	52%	0.521	S	S	.	.	H	α-helix	trans	-75	-26.3	175.1	-81.2	158.5	0	0	0	113.4	M570 M571 H576 V577	M570-L574 HydrophobicContact CE-CD1 4.19Å; M570-L574 HydrophobicContact CG-CD1 3.96Å; M570-L574 WeakPolarHBondContact O-CB 3.5Å; M570-L574 WeakPolarHBondContact O-CD1 3.5Å; M570-L574 WeakPolarHBondContact O-CG 3.34Å; M570-L574 PolarHBondContact O-N 2.88Å; M571-L574 PolarHBondContact O-N 2.78Å; L574-H576 PolarHBondContact O-N 2.92Å; L574-V577 PolarHBondContact O-N 2.88Å; L574-V577 VanDerWaalsContact O-N 3.17Å
575	V	45.5	Very low	50.4	Low	53 Å²	53	101 Å²	101	32%	0.321	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-14	-178	171.4	0	0	0	0	113.2	F462 M571 V577	F462-V575 HydrophobicContact CZ-CG1 4.3Å; M571-V575 VanDerWaalsContact O-CG2 3.23Å; M571-V575 WeakPolarHBondContact O-CG2 3.46Å; M571-V575 PolarHBondContact O-N 2.79Å; V575-V577 VanDerWaalsContact C-N 3.3Å; V575-V577 PolarHBondContact O-N 3.46Å
576	H	40	Very low	50.7	Low	166 Å²	166	100.9 Å²	100.9	77%	0.769	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-4.3	172.3	-97.2	-13.4	0	0	0	115.2	L574	L574-H576 PolarHBondContact O-N 2.92Å
577	V	42.5	Very low	51.1	Low	121 Å²	121	95.8 Å²	95.8	73%	0.733	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121	-17	-174.1	-175.5	0	0	0	0	113.3	L574 V575	L574-V577 PolarHBondContact O-N 2.88Å; L574-V577 VanDerWaalsContact O-N 3.17Å; V575-V577 VanDerWaalsContact C-N 3.3Å; V575-V577 PolarHBondContact O-N 3.46Å
578	Q	35.7	Very low	51.4	Low	119 Å²	119	91.8 Å²	91.8	56%	0.556	48%	0.476	S	S	*	.			trans	-138.7	126.7	178.3	-67.1	-176	-12.8	0	0	110.6	Q580	Q578-Q580 PolarHBondContact O-N 2.9Å
579	N	34.1	Very low	52.1	Low	102 Å²	102	92.1 Å²	92.1	55%	0.545	48%	0.481	S	S	.	.			trans	-63.8	35.7	174.8	-86	-25.6	0	0	0	114.2	E461 Q581	E461-N579 PolarHBondContact OE1-ND2 2.87Å; E461-N579 PolarHBondContact OE2-ND2 2.98Å; N579-Q581 PolarHBondContact O-N 2.79Å
580	Q	38.7	Very low	53.1	Low	132 Å²	132	90 Å²	90	62%	0.617	47%	0.47	S	S	*	.			trans	-81.4	105.2	173.7	-77	-173.1	-19.2	0	0	109.7	Q578 F582	Q578-Q580 PolarHBondContact O-N 2.9Å; Q580-F582 PolarHBondContact O-N 2.83Å
581	Q	39.5	Very low	54.5	Low	183 Å²	183	85.2 Å²	85.2	86%	0.855	45%	0.446	S	S	*	.			trans	-63.1	99.4	173.5	-166.2	169.2	-2.1	0	0	109	N579 D583	N579-Q581 PolarHBondContact O-N 2.79Å; Q581-D583 PolarHBondContact O-N 3.27Å
582	F	46.4	Very low	55.9	Low	116 Å²	116	85 Å²	85	51%	0.509	45%	0.448	S	S	.	.			trans	-70.1	125.7	173.1	-108.7	-88.3	0	0	0	109.8	M571 Q580 G584	M571-F582 HydrophobicContact CE-CZ 4.03Å; M571-F582 HydrophobicContact SD-CE1 4.37Å; M571-F582 HydrophobicContact SD-CE2 3.68Å; M571-F582 HydrophobicContact SD-CZ 3.42Å; M571-F582 WeakPolarHBondContact SD-CZ 3.35Å; Q580-F582 PolarHBondContact O-N 2.83Å; F582-G584 PolarHBondContact O-N 2.81Å
583	D	49	Very low	57.1	Low	161 Å²	161	81.6 Å²	81.6	86%	0.861	43%	0.432	S	S	*	.			trans	-77.7	44.8	-178.4	-153.6	21.9	0	0	0	112	Q581	Q581-D583 PolarHBondContact O-N 3.27Å
584	G	57.1	Low	58.5	Low	20 Å²	20	79.7 Å²	79.7	21%	0.206	42%	0.418	C	S	.	.			trans	-83.9	127	174.8	0	0	0	0	0	110	F582 V586	F582-G584 PolarHBondContact O-N 2.81Å; G584-V586 WeakPolarHBondContact O-CG2 3.28Å; G584-V586 PolarHBondContact O-N 2.95Å
585	I	60.1	Low	59.9	Low	98 Å²	98	76.4 Å²	76.4	50%	0.503	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	120.1	176.2	-50.8	176.9	0	0	0	108	V558 Y587	V558-I585 PolarHBondContact N-O 3.48Å; I585-Y587 HydrophobicContact CB-CE2 3.94Å; I585-Y587 HydrophobicContact CG2-CD2 4.02Å; I585-Y587 HydrophobicContact CG2-CE1 4.16Å; I585-Y587 HydrophobicContact CG2-CE2 3.28Å; I585-Y587 VanDerWaalsContact CG2-CZ 3.41Å
586	V	67.9	Low	61.2	Low	64 Å²	64	75.3 Å²	75.3	39%	0.388	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	116.9	178.7	-170.5	0	0	0	0	109.3	R555 V556 R557 G584 I588	R555-V586 HydrophobicContact CG-CG1 3.62Å; V556-V586 CarbonylContact O-C 3.56Å; V556-V586 WeakPolarHBondContact O-CA 3.28Å; R557-V586 HydrophobicContact CG-CG1 4.35Å; R557-V586 HydrophobicContact CG-CG2 4.12Å; G584-V586 WeakPolarHBondContact O-CG2 3.28Å; G584-V586 PolarHBondContact O-N 2.95Å; V586-I588 HydrophobicContact CG1-CG1 4.28Å
587	Y	70.8	Confident	62.3	Low	64 Å²	64	71.7 Å²	71.7	25%	0.251	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	139.5	169.6	-59.3	-86.8	0	0	0	109.2	P479 M500 R555 V556 V558 I585	P479-Y587 HydrophobicContact CG-CD1 3.26Å; P479-Y587 HydrophobicContact CG-CE1 3.49Å; P479-Y587 VanDerWaalsContact CG-CE1 3.49Å; P479-Y587 HydrophobicContact CG-CG 3.96Å; M500-Y587 HydrophobicContact CE-CD2 3.65Å; M500-Y587 HydrophobicContact CE-CE2 4.03Å; M500-Y587 HydrophobicContact CE-CG 4.16Å; M500-Y587 HydrophobicContact CG-CE2 4.34Å; M500-Y587 HydrophobicContact SD-CD1 4.43Å; M500-Y587 HydrophobicContact SD-CD2 3.29Å; M500-Y587 WeakPolarHBondContact SD-CD2 3.32Å; M500-Y587 HydrophobicContact SD-CE1 4.22Å; M500-Y587 HydrophobicContact SD-CE2 3.02Å; M500-Y587 WeakPolarHBondContact SD-CE2 3.34Å; M500-Y587 HydrophobicContact SD-CG 3.98Å; M500-Y587 VanDerWaalsContact SD-CZ 3.51Å; R555-Y587 CarbonylContact C-O 3.53Å; R555-Y587 WeakPolarHBondContact CA-O 3.41Å; V556-Y587 PolarHBondContact N-O 3.03Å; V556-Y587 PolarHBondContact O-N 2.87Å; V558-Y587 HydrophobicContact CG2-CD2 4.47Å; V558-Y587 HydrophobicContact CG2-CE2 4.23Å; I585-Y587 HydrophobicContact CB-CE2 3.94Å; I585-Y587 HydrophobicContact CG2-CD2 4.02Å; I585-Y587 HydrophobicContact CG2-CE1 4.16Å; I585-Y587 HydrophobicContact CG2-CE2 3.28Å; I585-Y587 VanDerWaalsContact CG2-CZ 3.41Å
588	I	71.3	Confident	63.5	Low	32 Å²	32	71.6 Å²	71.6	16%	0.164	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	139.2	177.1	-56.1	174.8	0	0	0	106.6	Q478 V554 V586	Q478-I588 PolarHBondContact OE1-O 2.76Å; V554-I588 CarbonylContact O-C 3.5Å; V554-I588 VanDerWaalsContact O-CA 3.3Å; V554-I588 WeakPolarHBondContact O-CA 3.13Å; V586-I588 HydrophobicContact CG1-CG1 4.28Å
589	G	74.8	Confident	65.2	Low	13 Å²	13	66.6 Å²	66.6	13%	0.134	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	167.5	176.9	0	0	0	0	0	110.3	V554	V554-G589 PolarHBondContact N-O 3.45Å; V554-G589 PolarHBondContact O-N 2.99Å
590	C	79.7	Confident	66.8	Low	42 Å²	42	66.1 Å²	66.1	28%	0.284	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	141.4	-170.9	-50.3	0	0	0	0	108.7	C471 Y552	C471-C590 HydrophobicContact CB-CB 4.23Å; C471-C590 WeakPolarHBondContact CB-SG 3.19Å; C471-C590 VanDerWaalsContact SG-CB 3.51Å; C471-C590 PolarHBondContact SG-SG 2.93Å; Y552-C590 WeakPolarHBondContact O-CA 3.27Å
591	F	83.1	Confident	68.1	Low	11 Å²	11	62.7 Å²	62.7	5%	0.048	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	160.8	174.9	74.7	-89	0	0	0	112.2	L482 I485 A494 L543 L546 Y552 V554 T593	L482-F591 HydrophobicContact CD1-CB 4.13Å; L482-F591 HydrophobicContact CD1-CD1 4.1Å; L482-F591 HydrophobicContact CD1-CD2 4.04Å; L482-F591 HydrophobicContact CD1-CG 3.82Å; L482-F591 HydrophobicContact CD2-CB 3.9Å; L482-F591 HydrophobicContact CD2-CD2 3.82Å; L482-F591 HydrophobicContact CD2-CG 4.04Å; L482-F591 HydrophobicContact CG-CB 4.45Å; I485-F591 HydrophobicContact CD1-CD2 4.47Å; A494-F591 HydrophobicContact CB-CE2 4.32Å; L543-F591 HydrophobicContact CD1-CD1 4.45Å; L543-F591 HydrophobicContact CD1-CE1 3.57Å; L543-F591 HydrophobicContact CD1-CZ 3.74Å; L546-F591 HydrophobicContact CD1-CE2 4.04Å; L546-F591 HydrophobicContact CD1-CZ 4.19Å; L546-F591 HydrophobicContact CD2-CE2 4.3Å; L546-F591 HydrophobicContact CD2-CZ 3.85Å; Y552-F591 VanDerWaalsContact CB-CE1 3.45Å; Y552-F591 VanDerWaalsContact CB-CZ 3.45Å; Y552-F591 HydrophobicContact CD1-CZ 4.4Å; Y552-F591 AromaticContact CD2-CE2 3.98Å; Y552-F591 HydrophobicContact CD2-CE2 3.98Å; Y552-F591 HydrophobicContact CD2-CZ 4.09Å; Y552-F591 HydrophobicContact CG-CE1 4.22Å; Y552-F591 HydrophobicContact CG-CE2 4.09Å; Y552-F591 AromaticContact CG-CZ 3.73Å; Y552-F591 HydrophobicContact CG-CZ 3.73Å; Y552-F591 PolarHBondContact N-O 3.4Å; Y552-F591 PolarHBondContact O-N 3.14Å; V554-F591 HydrophobicContact CG2-CD1 3.53Å; V554-F591 HydrophobicContact CG2-CE1 3.38Å; F591-T593 HydrophobicContact CD2-CG2 4.49Å; F591-T593 HydrophobicContact CE2-CG2 3.98Å
592	C	84.6	Confident	69.1	Low	38 Å²	38	58.9 Å²	58.9	26%	0.257	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	134.8	-172.4	-48.1	0	0	0	0	109.8	C473 I485 C550 H551	C473-C592 WeakPolarHBondContact CA-SG 3.48Å; C473-C592 HydrophobicContact CB-CB 4.04Å; C473-C592 WeakPolarHBondContact CB-SG 3.18Å; C473-C592 WeakPolarHBondContact SG-CB 3.22Å; C473-C592 CovalentContact SG-SG 2Å; C473-C592 PolarHBondContact SG-SG 3.32Å; I485-C592 WeakPolarHBondContact CD1-O 3.4Å; C550-C592 WeakPolarHBondContact O-CA 3.23Å; H551-C592 PolarHBondContact CD2-SG 3.42Å; H551-C592 PolarHBondContact NE2-SG 3Å
593	T	82.6	Confident	69.5	Low	7 Å²	7	60.5 Å²	60.5	4%	0.043	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-91.6	131.2	175.8	52.1	0	0	0	0	110.3	I485 L492 L546 H547 N549 C550 Y552 F591	I485-T593 HydrophobicContact CD1-CG2 4.38Å; L492-T593 HydrophobicContact CD2-CG2 3.74Å; L546-T593 HydrophobicContact CB-CG2 4.15Å; L546-T593 HydrophobicContact CD1-CG2 4.31Å; H547-T593 WeakPolarHBondContact O-CB 3.27Å; H547-T593 WeakPolarHBondContact O-CG2 3.45Å; H547-T593 PolarHBondContact O-OG1 2.99Å; N549-T593 WeakPolarHBondContact CA-O 3.46Å; N549-T593 PolarHBondContact N-O 3.32Å; C550-T593 PolarHBondContact N-OG1 3.38Å; C550-T593 PolarHBondContact O-N 2.89Å; C550-T593 PolarHBondContact O-OG1 3.06Å; C550-T593 VanDerWaalsContact O-OG1 3.11Å; Y552-T593 HydrophobicContact CD2-CG2 3.92Å; Y552-T593 HydrophobicContact CE2-CG2 3.81Å; F591-T593 HydrophobicContact CD2-CG2 4.49Å; F591-T593 HydrophobicContact CE2-CG2 3.98Å
594	P	79.6	Confident	69.7	Low	40 Å²	40	54.8 Å²	54.8	26%	0.26	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-71.1	168.4	179.3	29.1	-34.7	0	0	0	111.4	N549 N598 V599	N549-P594 PolarHBondContact N-O 2.64Å; P594-N598 HydrophobicContact CB-CB 4.06Å; P594-V599 HydrophobicContact CB-CG2 4.41Å; P594-V599 HydrophobicContact CG-CG2 3.56Å
595	S	74.5	Confident	69.5	Low	23 Å²	23	60.9 Å²	60.9	16%	0.161	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-63.9	159	171.4	64.4	0	0	0	0	110.7	N549 S597 N598 V599	N549-S595 WeakPolarHBondContact OD1-CA 3.44Å; N549-S595 VanDerWaalsContact OD1-CB 3.27Å; N549-S595 WeakPolarHBondContact OD1-CB 3.08Å; N549-S595 PolarHBondContact OD1-N 2.96Å; S595-S597 PolarHBondContact O-N 3.25Å; S595-S597 VanDerWaalsContact O-N 3.16Å; S595-S597 PolarHBondContact OG-OG 3.11Å; S595-N598 PolarHBondContact O-N 3.36Å; S595-V599 WeakPolarHBondContact O-CG2 3.49Å; S595-V599 PolarHBondContact O-N 2.8Å
596	C	72.6	Confident	69.5	Low	29 Å²	29	58.3 Å²	58.3	20%	0.196	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-16.2	179	68.2	0	0	0	0	114.5	F548 N598 L606 C610	F548-C596 HydrophobicContact CD1-CB 3.65Å; F548-C596 HydrophobicContact CD2-CB 4.1Å; F548-C596 HydrophobicContact CE1-CB 3.56Å; F548-C596 HydrophobicContact CE2-CB 4.04Å; F548-C596 HydrophobicContact CG-CB 3.91Å; F548-C596 HydrophobicContact CZ-CB 3.77Å; C596-N598 VanDerWaalsContact C-N 3.33Å; C596-L606 HydrophobicContact CB-CD2 4.48Å; C596-C610 HydrophobicContact CB-CB 3.79Å; C596-C610 WeakPolarHBondContact CB-SG 3.41Å; C596-C610 VanDerWaalsContact SG-CA 3.58Å; C596-C610 WeakPolarHBondContact SG-CB 3.25Å; C596-C610 CovalentContact SG-SG 2.03Å; C596-C610 PolarHBondContact SG-SG 3.49Å
597	S	64.9	Low	69.1	Low	90 Å²	90	57.3 Å²	57.3	63%	0.629	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-25.1	170	61.8	0	0	0	0	113.2	S595	S595-S597 PolarHBondContact O-N 3.25Å; S595-S597 VanDerWaalsContact O-N 3.16Å; S595-S597 PolarHBondContact OG-OG 3.11Å
598	N	66.8	Low	68.2	Low	119 Å²	119	60.3 Å²	60.3	64%	0.636	34%	0.34	S	S	*	.	S	Bend	trans	-108.1	3.3	-171.5	-65.4	-0.1	0	0	0	112.9	P594 S595 C596	P594-N598 HydrophobicContact CB-CB 4.06Å; S595-N598 PolarHBondContact O-N 3.36Å; C596-N598 VanDerWaalsContact C-N 3.33Å
599	V	70.8	Confident	67.3	Low	14 Å²	14	66 Å²	66	9%	0.085	37%	0.371	C	S	.	.	S	Bend	trans	-85.2	134.1	179.7	171.9	0	0	0	0	111.6	L492 F548 P594 S595 N601	L492-V599 HydrophobicContact CD1-CB 4.44Å; L492-V599 HydrophobicContact CD1-CG1 3.82Å; L492-V599 HydrophobicContact CD1-CG2 3.71Å; F548-V599 HydrophobicContact CD1-CG2 3.85Å; F548-V599 HydrophobicContact CE1-CB 4.2Å; F548-V599 HydrophobicContact CE1-CG2 3.7Å; P594-V599 HydrophobicContact CB-CG2 4.41Å; P594-V599 HydrophobicContact CG-CG2 3.56Å; S595-V599 WeakPolarHBondContact O-CG2 3.49Å; S595-V599 PolarHBondContact O-N 2.8Å; V599-N601 PolarHBondContact O-N 2.99Å; V599-N601 VanDerWaalsContact O-N 3.15Å
600	I	68.8	Low	66.4	Low	93 Å²	93	66.5 Å²	66.5	48%	0.477	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	108.7	171.8	-56.3	164.3	0	0	0	108.7	K484 F486 Y487	K484-I600 HydrophobicContact CD-CD1 4.25Å; K484-I600 VanDerWaalsContact CE-CD1 3.48Å; K484-I600 HydrophobicContact CG-CD1 4.49Å; F486-I600 VanDerWaalsContact CA-O 3.31Å; F486-I600 WeakPolarHBondContact CA-O 3.48Å; F486-I600 WeakPolarHBondContact CB-O 3.42Å; Y487-I600 PolarHBondContact N-O 3.27Å
601	N	66.2	Low	64.6	Low	59 Å²	59	69.7 Å²	69.7	32%	0.316	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	122.7	174.5	-169.1	-11.3	0	0	0	109.8	Y487 V599 E603 G604 L606	Y487-N601 PolarHBondContact O-OD1 2.94Å; V599-N601 PolarHBondContact O-N 2.99Å; V599-N601 VanDerWaalsContact O-N 3.15Å; N601-E603 PolarHBondContact OD1-N 3.24Å; N601-G604 PolarHBondContact ND2-O 3.38Å; N601-G604 PolarHBondContact OD1-O 3.16Å; N601-L606 HydrophobicContact CB-CD1 4.49Å
602	K	59.1	Low	62.6	Low	103 Å²	103	72.6 Å²	72.6	45%	0.448	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-26.6	179	-90.7	-168.3	173.7	-174.7	0	113.6	F486 Y487	F486-K602 HydrophobicContact CB-CD 4.43Å; F486-K602 HydrophobicContact CB-CG 4.36Å; F486-K602 HydrophobicContact CD2-CB 4.35Å; F486-K602 HydrophobicContact CD2-CD 3.84Å; F486-K602 HydrophobicContact CD2-CG 4.32Å; F486-K602 HydrophobicContact CE2-CD 4.31Å; F486-K602 HydrophobicContact CG-CD 4.17Å; Y487-K602 PolarHBondContact O-N 3Å; Y487-K602 VanDerWaalsContact O-N 3.09Å
603	E	54.8	Low	60.5	Low	150 Å²	150	74 Å²	74	70%	0.701	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	176.3	134.8	172.5	-107.8	164.6	-176.1	0	0	108.3	N601	N601-E603 PolarHBondContact OD1-N 3.24Å
604	G	53.4	Low	58.5	Low	41 Å²	41	80.7 Å²	80.7	42%	0.423	45%	0.445	S	S	.	.	S	Bend	trans	119.2	149.5	-179	0	0	0	0	0	113.5	N601 L606	N601-G604 PolarHBondContact ND2-O 3.38Å; N601-G604 PolarHBondContact OD1-O 3.16Å; G604-L606 PolarHBondContact O-N 3.32Å
605	Q	53.9	Low	56.9	Low	148 Å²	148	83.4 Å²	83.4	69%	0.692	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-67.9	126.3	175.1	-131.4	162.4	-16.6	0	0	108.7
606	L	58.6	Low	55.7	Low	45 Å²	45	83.5 Å²	83.5	24%	0.236	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-56.3	149.6	166.9	-85.3	146.8	0	0	0	108.4	Y487 C596 N601 G604 D608 C610	Y487-L606 HydrophobicContact CD1-CD2 4.45Å; C596-L606 HydrophobicContact CB-CD2 4.48Å; N601-L606 HydrophobicContact CB-CD1 4.49Å; G604-L606 PolarHBondContact O-N 3.32Å; L606-D608 PolarHBondContact O-N 3.03Å; L606-C610 HydrophobicContact CB-CB 4.2Å; L606-C610 HydrophobicContact CD2-CB 4.29Å
607	P	60	Low	54.8	Low	43 Å²	43	85.8 Å²	85.8	28%	0.279	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-49.8	137.5	175.2	-22.8	31.8	0	0	0	109.7	Y487 N609 C610	Y487-P607 WeakPolarHBondContact OH-CG 3.3Å; P607-N609 PolarHBondContact O-N 2.96Å; P607-C610 VanDerWaalsContact O-CB 3.31Å; P607-C610 WeakPolarHBondContact O-CB 3.29Å; P607-C610 PolarHBondContact O-N 2.88Å
608	D	51.4	Low	54.8	Low	127 Å²	127	82.5 Å²	82.5	68%	0.679	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-52.1	-26.5	-175.9	-67	-40.2	0	0	0	112.8	L606 C610	L606-D608 PolarHBondContact O-N 3.03Å; D608-C610 VanDerWaalsContact C-N 3.25Å; D608-C610 PolarHBondContact O-N 2.92Å
609	N	52.6	Low	54.8	Low	150 Å²	150	79.2 Å²	79.2	80%	0.802	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-72.8	-8.1	176.7	-60.7	-15	0	0	0	114.8	P607	P607-N609 PolarHBondContact O-N 2.96Å
610	C	56	Low	55.3	Low	25 Å²	25	80.5 Å²	80.5	17%	0.169	45%	0.449	C	S	.	.	G	3₁₀ helix	trans	-98.3	-5.7	-177.8	-70.5	0	0	0	0	113.8	C596 L606 P607 D608 L612	C596-C610 HydrophobicContact CB-CB 3.79Å; C596-C610 WeakPolarHBondContact CB-SG 3.41Å; C596-C610 VanDerWaalsContact SG-CA 3.58Å; C596-C610 WeakPolarHBondContact SG-CB 3.25Å; C596-C610 CovalentContact SG-SG 2.03Å; C596-C610 PolarHBondContact SG-SG 3.49Å; L606-C610 HydrophobicContact CB-CB 4.2Å; L606-C610 HydrophobicContact CD2-CB 4.29Å; P607-C610 VanDerWaalsContact O-CB 3.31Å; P607-C610 WeakPolarHBondContact O-CB 3.29Å; P607-C610 PolarHBondContact O-N 2.88Å; D608-C610 VanDerWaalsContact C-N 3.25Å; D608-C610 PolarHBondContact O-N 2.92Å; C610-L612 PolarHBondContact O-N 2.65Å
611	I	42.1	Very low	55.9	Low	109 Å²	109	76.2 Å²	76.2	56%	0.559	43%	0.428	S	S	*	.			trans	-90.3	92.8	172.9	-53.2	174.1	0	0	0	107.5	P613	I611-P613 WeakPolarHBondContact O-CD 3.11Å
612	L	41.7	Very low	56.6	Low	72 Å²	72	76.1 Å²	76.1	38%	0.377	43%	0.429	S	S	.	.			trans	-92.8	113.2	166.7	-107.9	136.8	0	0	0	108.7	C610 D614 M741 R743	C610-L612 PolarHBondContact O-N 2.65Å; L612-D614 PolarHBondContact O-N 3.2Å; L612-M741 HydrophobicContact CD1-CE 3.59Å; L612-M741 HydrophobicContact CD1-CG 3.94Å; L612-M741 HydrophobicContact CD1-SD 3.31Å; L612-M741 WeakPolarHBondContact CD1-SD 3.4Å; L612-M741 HydrophobicContact CD2-CE 3.22Å; L612-M741 HydrophobicContact CD2-CG 4.07Å; L612-M741 HydrophobicContact CD2-SD 3.97Å; L612-M741 HydrophobicContact CG-CE 3.99Å; L612-M741 HydrophobicContact CG-SD 4.23Å; L612-R743 VanDerWaalsContact CD2-NH2 3.3Å
613	P	41	Very low	57.8	Low	67 Å²	67	78.2 Å²	78.2	44%	0.435	44%	0.438	S	S	.	.			trans	-62	132.2	168.6	-7.7	20.9	0	0	0	107.7	I611 L615 R743	I611-P613 WeakPolarHBondContact O-CD 3.11Å; P613-L615 HydrophobicContact CB-CD1 4.07Å; P613-L615 HydrophobicContact CG-CD1 4.27Å; P613-L615 PolarHBondContact O-N 3.23Å; P613-R743 PolarHBondContact O-NH2 3.06Å
614	D	39.8	Very low	59.4	Low	147 Å²	147	72.1 Å²	72.1	79%	0.786	41%	0.411	S	S	*	.			trans	-65.8	72.6	172.3	-165.3	14	0	0	0	110.1	L612 G616	L612-D614 PolarHBondContact O-N 3.2Å; D614-G616 PolarHBondContact O-N 2.83Å
615	L	46.8	Very low	61.1	Low	98 Å²	98	75.4 Å²	75.4	51%	0.513	42%	0.416	S	S	.	.			trans	-86.6	92.1	175.8	-97.6	145	0	0	0	105	P613 R743	P613-L615 HydrophobicContact CB-CD1 4.07Å; P613-L615 HydrophobicContact CG-CD1 4.27Å; P613-L615 PolarHBondContact O-N 3.23Å; L615-R743 VanDerWaalsContact O-CZ 3.28Å; L615-R743 PolarHBondContact O-NH1 2.8Å
616	G	48.3	Very low	62.9	Low	25 Å²	25	70.4 Å²	70.4	26%	0.258	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-49.1	162.3	-173.1	0	0	0	0	0	115.7	D614	D614-G616 PolarHBondContact O-N 2.83Å
617	S	54.7	Low	64.4	Low	76 Å²	76	71.8 Å²	71.8	53%	0.531	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-48.3	135.1	-171.7	-56	0	0	0	0	112.7
618	P	63.7	Low	65.8	Low	22 Å²	22	74.1 Å²	74.1	14%	0.143	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-62.9	154.3	-179.9	17.5	-23.8	0	0	0	112.5	F735 R743 S745	P618-F735 HydrophobicContact CB-CD1 4.27Å; P618-F735 HydrophobicContact CB-CD2 3.11Å; P618-F735 HydrophobicContact CB-CE1 4.19Å; P618-F735 HydrophobicContact CB-CE2 3.01Å; P618-F735 HydrophobicContact CB-CG 3.76Å; P618-F735 HydrophobicContact CB-CZ 3.58Å; P618-F735 HydrophobicContact CG-CB 4.29Å; P618-F735 HydrophobicContact CG-CD2 3.15Å; P618-F735 HydrophobicContact CG-CE2 3.57Å; P618-F735 HydrophobicContact CG-CG 3.86Å; P618-R743 HydrophobicContact CG-CB 4.36Å; P618-S745 WeakPolarHBondContact O-CB 3.22Å
619	S	68.4	Low	67.5	Low	50 Å²	50	72.2 Å²	72.2	35%	0.35	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-69.8	140.8	179.5	41.2	0	0	0	0	112.1	P641 M642	S619-P641 VanDerWaalsContact O-CB 3.3Å; S619-P641 WeakPolarHBondContact O-CB 3.28Å; S619-P641 WeakPolarHBondContact O-CG 3.48Å; S619-P641 WeakPolarHBondContact OG-CB 3.39Å; S619-M642 PolarHBondContact OG-O 2.76Å
620	P	79.3	Confident	68.8	Low	40 Å²	40	68.2 Å²	68.2	26%	0.26	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-64.8	159	174.2	25.6	-33.2	0	0	0	111.6	V748	P620-V748 HydrophobicContact CB-CG2 3.74Å
621	P	82	Confident	69.6	Low	4 Å²	4	69.4 Å²	69.4	3%	0.026	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-69.7	153.3	178.6	32.1	-28.3	0	0	0	109.7	V624 W638 V731 P733 V748	P621-V624 HydrophobicContact CG-CG2 4.26Å; P621-W638 HydrophobicContact CB-CB 4.19Å; P621-W638 HydrophobicContact CB-CG 4.28Å; P621-V731 HydrophobicContact CG-CB 4.21Å; P621-V731 HydrophobicContact CG-CG1 3.92Å; P621-P733 HydrophobicContact CB-CG 4.15Å; P621-P733 HydrophobicContact CG-CG 4.02Å; P621-V748 HydrophobicContact CG-CB 4.2Å; P621-V748 HydrophobicContact CG-CG2 4.13Å
622	T	82.3	Confident	71.7	Confident	57 Å²	57	65.1 Å²	65.1	35%	0.35	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	153.1	-178.2	48.2	0	0	0	0	111.4	V624 I639	T622-V624 PolarHBondContact O-N 2.83Å; T622-I639 PolarHBondContact N-O 3.16Å; T622-I639 VanDerWaalsContact N-O 3.16Å; T622-I639 WeakPolarHBondContact O-CB 3.44Å; T622-I639 PolarHBondContact O-N 3.08Å
623	K	83.7	Confident	73.9	Confident	147 Å²	147	62.7 Å²	62.7	64%	0.639	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.2	51.6	179.2	-54.5	-168.6	-170.7	173.8	0	113.3	Q625 I639	K623-Q625 PolarHBondContact O-N 3Å; K623-I639 HydrophobicContact CB-CD1 4.09Å; K623-I639 HydrophobicContact CB-CG1 4.31Å; K623-I639 HydrophobicContact CD-CD1 3.7Å; K623-I639 HydrophobicContact CG-CD1 4.13Å
624	V	87	Confident	76.3	Confident	22 Å²	22	59.9 Å²	59.9	13%	0.133	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	123.8	168.8	-175.9	0	0	0	0	108.1	P621 T622 I636 S637 W638 V731 V748 V750	P621-V624 HydrophobicContact CG-CG2 4.26Å; T622-V624 PolarHBondContact O-N 2.83Å; V624-I636 HydrophobicContact CG1-CG2 4.02Å; V624-S637 CarbonylContact C-O 3.57Å; V624-S637 WeakPolarHBondContact CA-O 3.5Å; V624-W638 HydrophobicContact CG2-CB 4.02Å; V624-V731 HydrophobicContact CG1-CG2 3.96Å; V624-V731 HydrophobicContact CG2-CB 4.4Å; V624-V731 HydrophobicContact CG2-CG2 4.44Å; V624-V748 HydrophobicContact CB-CG1 4.06Å; V624-V748 HydrophobicContact CG2-CB 3.94Å; V624-V748 HydrophobicContact CG2-CG1 3.49Å; V624-V748 VanDerWaalsContact CG2-CG1 3.49Å; V624-V750 HydrophobicContact CG1-CB 4.23Å; V624-V750 HydrophobicContact CG1-CG1 3.78Å
625	Q	90.7	Very high	78.8	Confident	109 Å²	109	57.2 Å²	57.2	51%	0.509	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	148.9	-175.6	-68.4	179.3	1.7	0	0	110.9	K623 I636 S637	K623-Q625 PolarHBondContact O-N 3Å; Q625-I636 WeakPolarHBondContact O-CA 3.26Å; Q625-S637 PolarHBondContact N-O 3.29Å; Q625-S637 PolarHBondContact O-N 2.92Å
626	V	90.7	Very high	81	Confident	43 Å²	43	52.5 Å²	52.5	26%	0.261	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	127.4	176.4	-174.6	0	0	0	0	108.9	Y634 I636 V750 F752	V626-Y634 HydrophobicContact CG1-CD1 3.86Å; V626-I636 HydrophobicContact CB-CD1 4.26Å; V626-I636 HydrophobicContact CG1-CD1 4Å; V626-I636 HydrophobicContact CG2-CD1 3.8Å; V626-V750 HydrophobicContact CG2-CB 4.36Å; V626-V750 HydrophobicContact CG2-CG1 3.72Å; V626-V750 HydrophobicContact CG2-CG2 3.65Å; V626-F752 HydrophobicContact CB-CD1 4.3Å; V626-F752 HydrophobicContact CB-CG 4.46Å; V626-F752 HydrophobicContact CG1-CB 4.23Å; V626-F752 HydrophobicContact CG1-CD1 3.72Å; V626-F752 HydrophobicContact CG1-CD2 4.02Å; V626-F752 HydrophobicContact CG1-CE1 3.99Å; V626-F752 HydrophobicContact CG1-CE2 4.29Å; V626-F752 HydrophobicContact CG1-CG 3.72Å; V626-F752 HydrophobicContact CG1-CZ 4.27Å; V626-F752 HydrophobicContact CG2-CB 4.4Å; V626-F752 HydrophobicContact CG2-CD1 3.67Å; V626-F752 HydrophobicContact CG2-CE1 4.24Å; V626-F752 HydrophobicContact CG2-CG 4.23Å
627	I	90.8	Very high	83.1	Confident	75 Å²	75	52.5 Å²	52.5	39%	0.385	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	115.6	179.3	-56.1	167.4	0	0	0	107.6	I629 R635	I627-I629 PolarHBondContact O-N 2.97Å; I627-R635 HydrophobicContact CB-CB 4.23Å; I627-R635 PolarHBondContact N-O 2.94Å; I627-R635 PolarHBondContact O-N 3.29Å
628	H	89	Confident	84.8	Confident	92 Å²	92	49.2 Å²	49.2	43%	0.426	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	126.7	173.3	174	-113	0	0	0	110.3	D630 Y634	H628-D630 PolarHBondContact NE2-O 3.09Å; H628-Y634 HydrophobicContact CB-CD1 4.07Å; H628-Y634 HydrophobicContact CB-CE1 3.8Å; H628-Y634 AromaticContact CD2-CE1 3.61Å; H628-Y634 AromaticContact CD2-CE2 3.97Å; H628-Y634 AromaticContact CD2-CZ 3.44Å; H628-Y634 VanDerWaalsContact CD2-CZ 3.44Å; H628-Y634 PolarHBondContact CD2-OH 3.34Å
629	I	86.7	Confident	85.8	Confident	86 Å²	86	52 Å²	52	44%	0.441	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-61.1	-179.4	-62.2	164.7	0	0	0	110.4	I627 N633 R635 V717	I627-I629 PolarHBondContact O-N 2.97Å; I629-N633 HydrophobicContact CB-CB 4.46Å; I629-N633 WeakPolarHBondContact CB-O 3.48Å; I629-N633 PolarHBondContact N-O 3.01Å; I629-R635 HydrophobicContact CD1-CB 3.65Å; I629-R635 HydrophobicContact CG1-CB 4.02Å; I629-V717 HydrophobicContact CD1-CB 4.33Å; I629-V717 HydrophobicContact CD1-CG1 3.69Å; I629-V717 HydrophobicContact CD1-CG2 3.63Å
630	D	80.1	Confident	86.2	Confident	66 Å²	66	53.5 Å²	53.5	35%	0.353	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	179.5	-177.7	72.1	52.9	0	0	0	109.9	H628 L632 N633	H628-D630 PolarHBondContact NE2-O 3.09Å; D630-L632 VanDerWaalsContact C-N 3.33Å; D630-L632 PolarHBondContact O-N 2.82Å; D630-N633 VanDerWaalsContact CG-ND2 3.26Å; D630-N633 PolarHBondContact N-O 3.08Å; D630-N633 PolarHBondContact O-N 3.04Å; D630-N633 WeakPolarHBondContact OD1-CB 3.3Å; D630-N633 VanDerWaalsContact OD1-CG 3.29Å; D630-N633 PolarHBondContact OD1-ND2 2.69Å; D630-N633 PolarHBondContact OD2-ND2 3.29Å
631	S	73.4	Confident	85.7	Confident	51 Å²	51	51.8 Å²	51.8	36%	0.357	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	4.9	-72.5	175.3	59	0	0	0	0	117.3	I755 M760	S631-I755 VanDerWaalsContact O-CD1 3.23Å; S631-I755 WeakPolarHBondContact O-CD1 3.12Å; S631-I755 WeakPolarHBondContact O-CG1 3.14Å; S631-M760 VanDerWaalsContact CA-CE 3.47Å
632	L	85.5	Confident	84.5	Confident	19 Å²	19	57.6 Å²	57.6	10%	0.099	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-140.3	26.2	178.5	-66.3	167.6	0	0	0	111.4	D630 Q720 L721 P723	D630-L632 VanDerWaalsContact C-N 3.33Å; D630-L632 PolarHBondContact O-N 2.82Å; L632-Q720 PolarHBondContact O-N 3.38Å; L632-L721 WeakPolarHBondContact CB-O 3.11Å; L632-L721 WeakPolarHBondContact CD1-O 3.08Å; L632-L721 WeakPolarHBondContact CD2-O 3.42Å; L632-L721 PolarHBondContact O-N 2.92Å; L632-P723 HydrophobicContact CD2-CB 3.99Å
633	N	88.3	Confident	83.1	Confident	20 Å²	20	56.8 Å²	56.8	11%	0.107	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122.9	-177.8	-62.6	-27.2	0	0	0	110.5	I629 D630 V717 L718 N719 Q720	I629-N633 HydrophobicContact CB-CB 4.46Å; I629-N633 WeakPolarHBondContact CB-O 3.48Å; I629-N633 PolarHBondContact N-O 3.01Å; D630-N633 VanDerWaalsContact CG-ND2 3.26Å; D630-N633 PolarHBondContact N-O 3.08Å; D630-N633 PolarHBondContact O-N 3.04Å; D630-N633 WeakPolarHBondContact OD1-CB 3.3Å; D630-N633 VanDerWaalsContact OD1-CG 3.29Å; D630-N633 PolarHBondContact OD1-ND2 2.69Å; D630-N633 PolarHBondContact OD2-ND2 3.29Å; N633-V717 HydrophobicContact CB-CG1 4.37Å; N633-L718 WeakPolarHBondContact CA-O 3.28Å; N633-N719 WeakPolarHBondContact OD1-CA 3.39Å; N633-Q720 PolarHBondContact OD1-N 3.08Å
634	Y	91.3	Very high	81.2	Confident	9 Å²	9	54.9 Å²	54.9	4%	0.035	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	130.4	-175.8	-70.8	-101.2	0	0	0	110.4	V626 H628 V717 L718 L721 F752 T754 I755	V626-Y634 HydrophobicContact CG1-CD1 3.86Å; H628-Y634 HydrophobicContact CB-CD1 4.07Å; H628-Y634 HydrophobicContact CB-CE1 3.8Å; H628-Y634 AromaticContact CD2-CE1 3.61Å; H628-Y634 AromaticContact CD2-CE2 3.97Å; H628-Y634 AromaticContact CD2-CZ 3.44Å; H628-Y634 VanDerWaalsContact CD2-CZ 3.44Å; H628-Y634 PolarHBondContact CD2-OH 3.34Å; Y634-V717 WeakPolarHBondContact O-CA 3.35Å; Y634-L718 PolarHBondContact N-O 3.46Å; Y634-L718 PolarHBondContact O-N 3.35Å; Y634-L721 HydrophobicContact CD2-CD1 3.89Å; Y634-L721 HydrophobicContact CG-CD1 4.42Å; Y634-F752 AromaticContact CD1-CD2 3.73Å; Y634-F752 HydrophobicContact CD1-CD2 3.73Å; Y634-F752 AromaticContact CD1-CE2 3.41Å; Y634-F752 HydrophobicContact CD1-CE2 3.41Å; Y634-F752 VanDerWaalsContact CD1-CE2 3.41Å; Y634-F752 HydrophobicContact CD1-CZ 4.19Å; Y634-F752 AromaticContact CD2-CE2 3.8Å; Y634-F752 HydrophobicContact CD2-CE2 3.8Å; Y634-F752 HydrophobicContact CD2-CZ 4.45Å; Y634-F752 AromaticContact CE1-CD2 3.78Å; Y634-F752 HydrophobicContact CE1-CD2 3.78Å; Y634-F752 AromaticContact CE1-CE2 3.76Å; Y634-F752 HydrophobicContact CE1-CE2 3.76Å; Y634-F752 HydrophobicContact CE2-CE2 4.14Å; Y634-F752 HydrophobicContact CG-CD2 4.23Å; Y634-F752 AromaticContact CG-CE2 3.43Å; Y634-F752 HydrophobicContact CG-CE2 3.43Å; Y634-F752 VanDerWaalsContact CG-CE2 3.43Å; Y634-F752 AromaticContact CG-CZ 3.94Å; Y634-F752 HydrophobicContact CG-CZ 3.94Å; Y634-T754 HydrophobicContact CD2-CG2 4.44Å; Y634-T754 HydrophobicContact CE2-CG2 3.84Å; Y634-T754 VanDerWaalsContact OH-CA 3.27Å; Y634-T754 WeakPolarHBondContact OH-CA 3.25Å; Y634-I755 PolarHBondContact OH-N 2.98Å
635	R	92.6	Very high	79	Confident	90 Å²	90	60.6 Å²	60.6	34%	0.34	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	124.2	174.3	-177.7	178.9	-172.8	-176	2.2	110.2	I627 I629 W715 I716 V717	I627-R635 HydrophobicContact CB-CB 4.23Å; I627-R635 PolarHBondContact N-O 2.94Å; I627-R635 PolarHBondContact O-N 3.29Å; I629-R635 HydrophobicContact CD1-CB 3.65Å; I629-R635 HydrophobicContact CG1-CB 4.02Å; R635-W715 HydrophobicContact CG-CB 4.42Å; R635-W715 HydrophobicContact CG-CE3 4.39Å; R635-I716 CarbonylContact C-O 3.57Å; R635-I716 VanDerWaalsContact CA-O 3.29Å; R635-I716 WeakPolarHBondContact CA-O 3.47Å; R635-V717 HydrophobicContact CB-CG2 4.21Å; R635-V717 HydrophobicContact CG-CG2 4.32Å
636	I	92.5	Very high	76.6	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	127	170.3	-45	-61.7	0	0	0	107.4	V624 Q625 V626 W638 W715 I716 L718 V729 V731 F752	V624-I636 HydrophobicContact CG1-CG2 4.02Å; Q625-I636 WeakPolarHBondContact O-CA 3.26Å; V626-I636 HydrophobicContact CB-CD1 4.26Å; V626-I636 HydrophobicContact CG1-CD1 4Å; V626-I636 HydrophobicContact CG2-CD1 3.8Å; I636-W638 HydrophobicContact CB-CZ3 4.35Å; I636-W638 HydrophobicContact CG2-CE3 4.22Å; I636-W638 HydrophobicContact CG2-CZ3 4.14Å; I636-W638 WeakPolarHBondContact O-CZ3 3.37Å; I636-W715 CarbonylContact O-C 3.57Å; I636-W715 WeakPolarHBondContact O-CA 3.32Å; I636-W715 WeakPolarHBondContact O-CB 3.36Å; I636-I716 HydrophobicContact CB-CG2 3.82Å; I636-I716 HydrophobicContact CG1-CG2 4.2Å; I636-I716 PolarHBondContact N-O 3.44Å; I636-I716 PolarHBondContact O-N 3.36Å; I636-L718 HydrophobicContact CD1-CD1 4.18Å; I636-L718 HydrophobicContact CG1-CD1 3.85Å; I636-L718 HydrophobicContact CG1-CG 4.01Å; I636-V729 HydrophobicContact CD1-CG2 4.09Å; I636-V729 HydrophobicContact CG1-CG1 4.23Å; I636-V729 HydrophobicContact CG1-CG2 4.43Å; I636-V729 HydrophobicContact CG2-CG1 4.19Å; I636-V731 HydrophobicContact CG2-CG2 4.27Å; I636-F752 HydrophobicContact CD1-CE1 3.99Å
637	S	92.1	Very high	74	Confident	24 Å²	24	64.9 Å²	64.9	17%	0.168	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	146.6	179.5	58.8	0	0	0	0	111.7	V624 Q625 T714	V624-S637 CarbonylContact C-O 3.57Å; V624-S637 WeakPolarHBondContact CA-O 3.5Å; Q625-S637 PolarHBondContact N-O 3.29Å; Q625-S637 PolarHBondContact O-N 2.92Å; S637-T714 WeakPolarHBondContact CA-O 3.17Å
638	W	90.8	Very high	71.5	Confident	7 Å²	7	65.6 Å²	65.6	3%	0.027	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	169.4	177.6	55.6	93.8	0	0	0	111.7	P621 V624 I636 Y672 V674 I709 T714 I716 V731	P621-W638 HydrophobicContact CB-CB 4.19Å; P621-W638 HydrophobicContact CB-CG 4.28Å; V624-W638 HydrophobicContact CG2-CB 4.02Å; I636-W638 HydrophobicContact CB-CZ3 4.35Å; I636-W638 HydrophobicContact CG2-CE3 4.22Å; I636-W638 HydrophobicContact CG2-CZ3 4.14Å; I636-W638 WeakPolarHBondContact O-CZ3 3.37Å; W638-Y672 AromaticContact CD1-CD1 3.95Å; W638-Y672 AromaticContact CD1-CE1 3.7Å; W638-Y672 AromaticContact CE2-CG 3.94Å; W638-Y672 HydrophobicContact CZ2-CD2 4.28Å; W638-Y672 AromaticContact CZ2-CG 3.99Å; W638-Y672 HydrophobicContact CZ2-CG 3.99Å; W638-Y672 AromaticContact NE1-CD1 3.24Å; W638-Y672 AromaticContact NE1-CD2 3.69Å; W638-Y672 AromaticContact NE1-CE1 3.31Å; W638-Y672 VanDerWaalsContact NE1-CE1 3.31Å; W638-Y672 AromaticContact NE1-CE2 3.76Å; W638-Y672 AromaticContact NE1-CG 3.43Å; W638-Y672 AromaticContact NE1-CZ 3.58Å; W638-V674 HydrophobicContact CH2-CG2 3.6Å; W638-V674 HydrophobicContact CZ2-CG2 4.23Å; W638-V674 HydrophobicContact CZ3-CG2 4.01Å; W638-I709 HydrophobicContact CH2-CD1 3.41Å; W638-I709 VanDerWaalsContact CH2-CD1 3.41Å; W638-I709 HydrophobicContact CZ2-CD1 3.81Å; W638-T714 PolarHBondContact N-O 3.45Å; W638-T714 VanDerWaalsContact O-CB 3.23Å; W638-T714 WeakPolarHBondContact O-CB 3.28Å; W638-T714 PolarHBondContact O-OG1 3.13Å; W638-I716 HydrophobicContact CH2-CB 4.38Å; W638-I716 HydrophobicContact CH2-CG2 4.04Å; W638-I716 HydrophobicContact CZ3-CG2 3.92Å; W638-V731 HydrophobicContact CD2-CG1 3.72Å; W638-V731 HydrophobicContact CE3-CG1 3.92Å; W638-V731 HydrophobicContact CE3-CG2 4.06Å; W638-V731 HydrophobicContact CG-CG1 4.1Å; W638-V731 HydrophobicContact CZ2-CG1 4.39Å; W638-V731 HydrophobicContact CZ3-CG1 4.35Å; W638-V731 HydrophobicContact CZ3-CG2 4.3Å
639	I	84.8	Confident	69.1	Low	81 Å²	81	65.3 Å²	65.3	42%	0.415	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	133.1	174	-58.7	-177.7	0	0	0	109.2	T622 K623	T622-I639 PolarHBondContact N-O 3.16Å; T622-I639 VanDerWaalsContact N-O 3.16Å; T622-I639 WeakPolarHBondContact O-CB 3.44Å; T622-I639 PolarHBondContact O-N 3.08Å; K623-I639 HydrophobicContact CB-CD1 4.09Å; K623-I639 HydrophobicContact CB-CG1 4.31Å; K623-I639 HydrophobicContact CD-CD1 3.7Å; K623-I639 HydrophobicContact CG-CD1 4.13Å
640	K	76.9	Confident	66.7	Low	82 Å²	82	70.2 Å²	70.2	36%	0.357	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-55.6	135.3	178	177.4	168.4	-175.5	-178.8	0	110.9	M642 Y672	K640-M642 PolarHBondContact O-N 3.25Å; K640-Y672 WeakPolarHBondContact CA-OH 3.43Å; K640-Y672 VanDerWaalsContact CB-OH 3.32Å; K640-Y672 WeakPolarHBondContact CB-OH 3.44Å; K640-Y672 VanDerWaalsContact CG-OH 3.26Å; K640-Y672 WeakPolarHBondContact CG-OH 3.26Å
641	P	68.4	Low	64.7	Low	4 Å²	4	73.9 Å²	73.9	3%	0.026	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-64.2	134.4	174	-9.2	20.4	0	0	0	110.6	S619 T643 P733 F735	S619-P641 VanDerWaalsContact O-CB 3.3Å; S619-P641 WeakPolarHBondContact O-CB 3.28Å; S619-P641 WeakPolarHBondContact O-CG 3.48Å; S619-P641 WeakPolarHBondContact OG-CB 3.39Å; P641-T643 PolarHBondContact O-N 3.25Å; P641-P733 HydrophobicContact CG-CB 4.4Å; P641-P733 HydrophobicContact CG-CG 3.87Å; P641-F735 HydrophobicContact CG-CZ 4.42Å
642	M	55.9	Low	63.1	Low	126 Å²	126	76 Å²	76	62%	0.621	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-63.7	124.1	169.5	-84	-178.3	158.2	0	0	109	S619 K640	S619-M642 PolarHBondContact OG-O 2.76Å; K640-M642 PolarHBondContact O-N 3.25Å
643	T	53.8	Low	60.9	Low	39 Å²	39	82.2 Å²	82.2	24%	0.239	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-78	149.2	175.6	58.8	0	0	0	0	110.4	P641 M645 D646 F735	P641-T643 PolarHBondContact O-N 3.25Å; T643-M645 PolarHBondContact O-N 2.88Å; T643-M645 VanDerWaalsContact O-N 3.11Å; T643-D646 PolarHBondContact N-OD2 2.05Å; T643-D646 PolarHBondContact O-N 3.34Å; T643-D646 PolarHBondContact OG1-OD2 3.05Å; T643-F735 HydrophobicContact CG2-CE1 3.96Å
644	T	44	Very low	58.6	Low	107 Å²	107	90 Å²	90	66%	0.656	45%	0.45	S	S	*	.	H	α-helix	trans	-56.7	-23.2	174.4	26.1	0	0	0	0	113	K647	T644-K647 PolarHBondContact O-N 3.34Å
645	M	39.5	Very low	56.1	Low	143 Å²	143	98.1 Å²	98.1	70%	0.704	49%	0.488	S	S	*	.	H	α-helix	trans	-69.3	-36	172.8	-85.4	-81.6	162.6	0	0	113.2	T643 K647 V648 T649	T643-M645 PolarHBondContact O-N 2.88Å; T643-M645 VanDerWaalsContact O-N 3.11Å; M645-K647 PolarHBondContact O-N 3.13Å; M645-V648 PolarHBondContact O-N 3.37Å; M645-T649 PolarHBondContact O-N 3.16Å; M645-T649 PolarHBondContact O-OG1 3.3Å
646	D	41.6	Very low	53.1	Low	80 Å²	80	99.1 Å²	99.1	43%	0.428	51%	0.508	S	S	.	.	H	α-helix	trans	-69.9	-20.2	176.1	-61.8	-49.2	0	0	0	112.8	T643	T643-D646 PolarHBondContact N-OD2 2.05Å; T643-D646 PolarHBondContact O-N 3.34Å; T643-D646 PolarHBondContact OG1-OD2 3.05Å
647	K	36.7	Very low	50.3	Low	161 Å²	161	104 Å²	104	70%	0.7	54%	0.543	S	S	*	.	H	α-helix	trans	-76.9	-29.3	175	-105.3	-178.6	176.5	-176.2	0	112.5	T644 M645	T644-K647 PolarHBondContact O-N 3.34Å; M645-K647 PolarHBondContact O-N 3.13Å
648	V	37.8	Very low	47.4	Very low	90 Å²	90	111.2 Å²	111.2	55%	0.545	58%	0.578	S	S	.	*	H	α-helix	trans	-85	-34.9	-177.8	179.6	0	0	0	0	111.4	M645 R650 D651 V652	M645-V648 PolarHBondContact O-N 3.37Å; V648-R650 VanDerWaalsContact C-N 3.29Å; V648-R650 PolarHBondContact O-N 2.92Å; V648-D651 PolarHBondContact O-N 2.86Å; V648-V652 HydrophobicContact CG1-CG2 4.42Å; V648-V652 WeakPolarHBondContact O-CG2 3.32Å
649	T	38.2	Very low	44.5	Very low	86 Å²	86	115.3 Å²	115.3	53%	0.528	61%	0.608	S	S	.	*	H	α-helix	trans	-69	-20.7	179.4	23.1	0	0	0	0	114.3	M645	M645-T649 PolarHBondContact O-N 3.16Å; M645-T649 PolarHBondContact O-OG1 3.3Å
650	R	36	Very low	41.9	Very low	189 Å²	189	117.3 Å²	117.3	71%	0.713	63%	0.63	S	S	*	*	H	α-helix	trans	-80.6	-16.7	175	-73.4	-173.2	-172	168.3	3.1	114.8	V648	V648-R650 VanDerWaalsContact C-N 3.29Å; V648-R650 PolarHBondContact O-N 2.92Å
651	D	38.4	Very low	39.8	Very low	143 Å²	143	118.6 Å²	118.6	77%	0.765	65%	0.649	S	S	*	*	H	α-helix	trans	-96.5	-11.2	177	-94	-32.3	0	0	0	113.3	V648	V648-D651 PolarHBondContact O-N 2.86Å
652	V	39.6	Very low	38.1	Very low	95 Å²	95	124 Å²	124	58%	0.576	68%	0.681	S	S	*	*	H	α-helix	trans	-97.7	-10.2	-176.7	-179.6	0	0	0	0	113.2	V648 K654 H655	V648-V652 HydrophobicContact CG1-CG2 4.42Å; V648-V652 WeakPolarHBondContact O-CG2 3.32Å; V652-K654 PolarHBondContact O-N 2.67Å; V652-H655 PolarHBondContact O-N 3.47Å
653	D	39.2	Very low	36.8	Very low	151 Å²	151	125.6 Å²	125.6	81%	0.807	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	13.5	175.6	-79.5	-24.1	0	0	0	114.6
654	K	40.7	Very low	35.6	Very low	184 Å²	184	133.4 Å²	133.4	80%	0.8	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	-2.8	177.6	-101	-179.3	178.8	176.4	0	116.1	V652	V652-K654 PolarHBondContact O-N 2.67Å
655	H	38.2	Very low	35	Very low	178 Å²	178	136 Å²	136	82%	0.824	73%	0.732	S	S	*	*			trans	-135.1	101.3	173.4	-76.5	-68.8	0	0	0	111.1	V652	V652-H655 PolarHBondContact O-N 3.47Å
656	S	31	Very low	34.7	Very low	111 Å²	111	137.7 Å²	137.7	78%	0.776	74%	0.743	S	S	*	*			trans	-71.3	160.8	172.2	58.6	0	0	0	0	111.9
657	S	31.8	Very low	34.7	Very low	104 Å²	104	136 Å²	136	73%	0.727	75%	0.745	S	S	*	*			trans	83.6	89.7	170.9	75.5	0	0	0	0	116.1
658	L	31.8	Very low	35.6	Very low	174 Å²	174	133.6 Å²	133.6	91%	0.911	74%	0.74	S	S	*	*			trans	169.9	144.4	136.9	-87.6	144.4	0	0	0	109.2
659	S	31.2	Very low	36.7	Very low	93 Å²	93	131.2 Å²	131.2	65%	0.65	73%	0.727	S	S	*	*			trans	86.1	72.8	173.5	84.4	0	0	0	0	118.6	S661	S659-S661 PolarHBondContact O-N 3.18Å
660	S	30	Very low	38.3	Very low	124 Å²	124	127.4 Å²	127.4	87%	0.867	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	76.9	145.1	53.2	0	0	0	0	110.2
661	S	31.6	Very low	40.4	Very low	109 Å²	109	121.6 Å²	121.6	76%	0.762	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-162.9	2	167.3	-21.6	0	0	0	0	117.3	S659	S659-S661 PolarHBondContact O-N 3.18Å
662	V	32.6	Very low	42.5	Very low	116 Å²	116	114.8 Å²	114.8	70%	0.703	65%	0.647	S	S	*	*			trans	-124.2	62.5	-170.6	-166.2	0	0	0	0	111.3
663	N	28.9	Very low	44.5	Very low	160 Å²	160	112.9 Å²	112.9	86%	0.856	63%	0.63	S	S	*	*			trans	-126.2	85.8	171.4	-85	-24.7	0	0	0	108.7
664	K	28.6	Very low	46.6	Very low	203 Å²	203	105.7 Å²	105.7	88%	0.883	59%	0.591	S	S	*	*			trans	159.7	70.4	156.4	-93.3	172.6	177.4	-178.8	0	112.3
665	I	30.9	Very low	48.8	Very low	163 Å²	163	98.6 Å²	98.6	84%	0.836	56%	0.561	S	S	*	*			trans	-143.9	77	156.5	-49.9	178.7	0	0	0	108.8
666	N	33.2	Very low	51.3	Low	177 Å²	177	91.6 Å²	91.6	95%	0.947	53%	0.528	S	S	*	.			trans	-87.7	110.4	168.9	-92.9	-6.6	0	0	0	108.3
667	G	41.7	Very low	53.9	Low	46 Å²	46	86.3 Å²	86.3	47%	0.474	49%	0.491	S	S	.	.			trans	-158.8	13.8	-175.4	0	0	0	0	0	118.5
668	N	55.5	Low	56.6	Low	109 Å²	109	81.8 Å²	81.8	58%	0.583	46%	0.459	S	S	*	.			trans	-101.3	118.3	174	-71.6	-11.2	0	0	0	109.5
669	S	61.5	Low	59.2	Low	40 Å²	40	75.5 Å²	75.5	28%	0.28	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	128.1	177.3	73.7	0	0	0	0	111.9	I736	S669-I736 PolarHBondContact N-O 3.49Å; S669-I736 VanDerWaalsContact N-O 3.14Å; S669-I736 PolarHBondContact O-N 3.27Å
670	T	71	Confident	61.4	Low	6 Å²	6	73.8 Å²	73.8	4%	0.037	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	122.2	173.5	-53.5	0	0	0	0	108.3	Q711 L734 F735	T670-Q711 WeakPolarHBondContact O-CA 3.29Å; T670-Q711 WeakPolarHBondContact O-CB 3.43Å; T670-Q711 PolarHBondContact O-N 3Å; T670-L734 CarbonylContact C-O 3.51Å; T670-L734 WeakPolarHBondContact CA-O 3.49Å; T670-F735 HydrophobicContact CG2-CD1 4.21Å; T670-F735 HydrophobicContact CG2-CD2 4.31Å; T670-F735 HydrophobicContact CG2-CE1 3.88Å; T670-F735 HydrophobicContact CG2-CE2 3.99Å; T670-F735 HydrophobicContact CG2-CG 4.44Å; T670-F735 HydrophobicContact CG2-CZ 3.8Å; T670-F735 WeakPolarHBondContact OG1-CD1 3.18Å; T670-F735 WeakPolarHBondContact OG1-CE1 3.28Å
671	K	80.5	Confident	63.4	Low	68 Å²	68	72.7 Å²	72.7	30%	0.296	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	168.1	169.2	-62.6	-173.4	177.4	-170.2	0	109.9	V708 I709 D710 P733 L734 I736	K671-V708 HydrophobicContact CB-CG1 4.02Å; K671-V708 HydrophobicContact CD-CG1 4.07Å; K671-I709 CarbonylContact C-O 3.57Å; K671-I709 VanDerWaalsContact CA-O 3.31Å; K671-I709 WeakPolarHBondContact CA-O 3.31Å; K671-I709 WeakPolarHBondContact CB-O 3.4Å; K671-D710 WeakPolarHBondContact CE-OD1 3.2Å; K671-D710 IonicContact NZ-OD1 2.83Å; K671-P733 WeakPolarHBondContact O-CA 3.37Å; K671-L734 HydrophobicContact CB-CB 4.24Å; K671-L734 PolarHBondContact N-O 2.66Å; K671-L734 PolarHBondContact O-N 3.01Å; K671-I736 HydrophobicContact CD-CD1 4.09Å; K671-I736 HydrophobicContact CG-CD1 4.48Å
672	Y	82.6	Confident	65.4	Low	0 Å²	0	68.6 Å²	68.6	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	125	173.9	-60.2	-87.8	0	0	0	110.2	W638 K640 V708 I709 P733	W638-Y672 AromaticContact CD1-CD1 3.95Å; W638-Y672 AromaticContact CD1-CE1 3.7Å; W638-Y672 AromaticContact CE2-CG 3.94Å; W638-Y672 HydrophobicContact CZ2-CD2 4.28Å; W638-Y672 AromaticContact CZ2-CG 3.99Å; W638-Y672 HydrophobicContact CZ2-CG 3.99Å; W638-Y672 AromaticContact NE1-CD1 3.24Å; W638-Y672 AromaticContact NE1-CD2 3.69Å; W638-Y672 AromaticContact NE1-CE1 3.31Å; W638-Y672 VanDerWaalsContact NE1-CE1 3.31Å; W638-Y672 AromaticContact NE1-CE2 3.76Å; W638-Y672 AromaticContact NE1-CG 3.43Å; W638-Y672 AromaticContact NE1-CZ 3.58Å; K640-Y672 WeakPolarHBondContact CA-OH 3.43Å; K640-Y672 VanDerWaalsContact CB-OH 3.32Å; K640-Y672 WeakPolarHBondContact CB-OH 3.44Å; K640-Y672 VanDerWaalsContact CG-OH 3.26Å; K640-Y672 WeakPolarHBondContact CG-OH 3.26Å; Y672-V708 CarbonylContact O-C 3.56Å; Y672-V708 VanDerWaalsContact O-CA 3.31Å; Y672-V708 WeakPolarHBondContact O-CA 3.4Å; Y672-I709 PolarHBondContact N-O 3.29Å; Y672-I709 PolarHBondContact O-N 2.84Å; Y672-P733 HydrophobicContact CD1-CB 4.24Å; Y672-P733 HydrophobicContact CD1-CG 4.02Å; Y672-P733 HydrophobicContact CE1-CB 4.2Å; Y672-P733 HydrophobicContact CE1-CG 3.92Å
673	R	81.3	Confident	67.4	Low	55 Å²	55	63.3 Å²	63.3	21%	0.208	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	121.3	166.3	-175.8	-174.3	-67.7	148.8	-0.7	108.2	M675 I706 Q732 L734 E744	R673-M675 HydrophobicContact CG-CG 3.98Å; R673-M675 HydrophobicContact CG-SD 4.45Å; R673-I706 HydrophobicContact CG-CG2 3.91Å; R673-Q732 HydrophobicContact CB-CB 4.39Å; R673-Q732 PolarHBondContact N-O 3.39Å; R673-Q732 VanDerWaalsContact NH1-OE1 3.13Å; R673-Q732 PolarHBondContact O-N 2.97Å; R673-L734 HydrophobicContact CB-CD1 4.04Å; R673-L734 HydrophobicContact CB-CD2 4.42Å; R673-L734 HydrophobicContact CB-CG 4.22Å; R673-E744 IonicContact CZ-OE1 3.83Å; R673-E744 IonicContact CZ-OE2 3.02Å; R673-E744 VanDerWaalsContact NH1-CD 3.3Å; R673-E744 IonicContact NH1-OE1 3.93Å; R673-E744 PolarHBondContact NH1-OE1 2.85Å; R673-E744 VanDerWaalsContact NH1-OE1 3.14Å; R673-E744 IonicContact NH1-OE2 3.66Å; R673-E744 PolarHBondContact NH1-OE2 3.49Å; R673-E744 IonicContact NH2-OE1 3.96Å; R673-E744 PolarHBondContact NH2-OE1 2.59Å; R673-E744 IonicContact NH2-OE2 3.33Å
674	V	85.3	Confident	69.8	Low	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	124.6	171.5	-173	0	0	0	0	108.2	W638 W676 I706 K707 I709 I716 V729 H730 V731	W638-V674 HydrophobicContact CH2-CG2 3.6Å; W638-V674 HydrophobicContact CZ2-CG2 4.23Å; W638-V674 HydrophobicContact CZ3-CG2 4.01Å; V674-W676 HydrophobicContact CG1-CE3 4.14Å; V674-W676 HydrophobicContact CG1-CZ3 4.49Å; V674-I706 WeakPolarHBondContact O-CA 3.28Å; V674-K707 PolarHBondContact N-O 2.86Å; V674-K707 PolarHBondContact O-N 3.09Å; V674-I709 HydrophobicContact CB-CD1 4.46Å; V674-I709 HydrophobicContact CG2-CD1 3.55Å; V674-I716 HydrophobicContact CB-CD1 4.46Å; V674-I716 HydrophobicContact CG1-CG2 4.12Å; V674-I716 HydrophobicContact CG2-CG2 4.28Å; V674-V729 HydrophobicContact CG1-CG1 3.66Å; V674-H730 CarbonylContact C-O 3.55Å; V674-H730 VanDerWaalsContact CA-O 3.3Å; V674-H730 WeakPolarHBondContact CA-O 3.27Å; V674-V731 HydrophobicContact CG1-CG2 4.33Å; V674-V731 HydrophobicContact CG2-CG1 4.33Å; V674-V731 HydrophobicContact CG2-CG2 4.36Å
675	M	85.5	Confident	72.2	Confident	35 Å²	35	47.4 Å²	47.4	17%	0.172	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	138.8	177.5	-48.1	-176.9	-62	0	0	108.6	R673 I704 D705 I706 V729 H730	R673-M675 HydrophobicContact CG-CG 3.98Å; R673-M675 HydrophobicContact CG-SD 4.45Å; M675-I704 HydrophobicContact CB-CD1 4.17Å; M675-I704 HydrophobicContact CB-CG1 4.43Å; M675-I704 HydrophobicContact SD-CD1 4.42Å; M675-D705 CarbonylContact C-O 3.53Å; M675-D705 VanDerWaalsContact CA-O 3.31Å; M675-D705 WeakPolarHBondContact CA-O 3.49Å; M675-I706 HydrophobicContact CB-CG1 4.25Å; M675-I706 HydrophobicContact CG-CB 4.44Å; M675-I706 HydrophobicContact CG-CD1 4.37Å; M675-I706 HydrophobicContact CG-CG1 3.93Å; M675-I706 HydrophobicContact CG-CG2 4.05Å; M675-I706 HydrophobicContact SD-CD1 4.21Å; M675-I706 HydrophobicContact SD-CG1 4.4Å; M675-V729 CarbonylContact O-C 3.45Å; M675-V729 WeakPolarHBondContact O-CA 3.39Å; M675-H730 HydrophobicContact CB-CB 4.42Å; M675-H730 HydrophobicContact CE-CB 3.84Å; M675-H730 PolarHBondContact N-O 3.37Å; M675-H730 PolarHBondContact O-N 3.09Å
676	W	91	Very high	74.3	Confident	30 Å²	30	43.1 Å²	43.1	11%	0.114	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	145.8	175.2	64.9	92.2	0	0	0	111.2	V674 D705 K707 I716 L718 I728 V729	V674-W676 HydrophobicContact CG1-CE3 4.14Å; V674-W676 HydrophobicContact CG1-CZ3 4.49Å; W676-D705 HydrophobicContact CD2-CB 3.95Å; W676-D705 HydrophobicContact CG-CB 4.46Å; W676-D705 HydrophobicContact CH2-CB 4.03Å; W676-D705 HydrophobicContact CZ2-CB 3.38Å; W676-D705 PolarHBondContact N-O 3.26Å; W676-D705 PolarHBondContact NE1-OD2 3.47Å; W676-D705 PolarHBondContact O-N 3.47Å; W676-K707 HydrophobicContact CH2-CB 3.95Å; W676-K707 HydrophobicContact CZ3-CB 3.84Å; W676-I716 HydrophobicContact CH2-CD1 4.22Å; W676-I716 HydrophobicContact CZ3-CD1 3.91Å; W676-L718 HydrophobicContact CB-CD1 4.15Å; W676-L718 HydrophobicContact CD2-CD1 4.14Å; W676-L718 HydrophobicContact CD2-CD2 3.56Å; W676-L718 HydrophobicContact CD2-CG 4.46Å; W676-L718 HydrophobicContact CE3-CD2 3.61Å; W676-L718 HydrophobicContact CG-CD1 3.88Å; W676-L718 HydrophobicContact CG-CD2 4.2Å; W676-L718 HydrophobicContact CH2-CD2 3.98Å; W676-L718 HydrophobicContact CZ2-CD2 3.92Å; W676-L718 HydrophobicContact CZ3-CD2 3.83Å; W676-I728 WeakPolarHBondContact CA-O 3.47Å; W676-I728 WeakPolarHBondContact CB-O 2.86Å; W676-V729 HydrophobicContact CB-CB 4.46Å; W676-V729 HydrophobicContact CB-CG1 4.47Å; W676-V729 HydrophobicContact CB-CG2 3.93Å
677	A	85.8	Confident	76.5	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	161.5	170.7	0	0	0	0	0	109.9	M699 I704 I728	A677-M699 HydrophobicContact CB-CG 3.18Å; A677-M699 HydrophobicContact CB-SD 3.69Å; A677-I704 HydrophobicContact CB-CB 4.12Å; A677-I704 HydrophobicContact CB-CG1 4.35Å; A677-I728 PolarHBondContact N-O 2.8Å; A677-I728 VanDerWaalsContact N-O 3.15Å; A677-I728 PolarHBondContact O-N 3.34Å
678	P	88.6	Confident	78.4	Confident	10 Å²	10	39 Å²	39	7%	0.065	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	154.4	168.1	28.4	-34.8	0	0	0	111.1	D700 Q703 T725 L726 Y727	P678-D700 WeakPolarHBondContact O-CB 3.24Å; P678-D700 PolarHBondContact O-N 3.28Å; P678-Q703 HydrophobicContact CG-CB 3.76Å; P678-Q703 HydrophobicContact CG-CG 4.33Å; P678-T725 HydrophobicContact CB-CG2 3.65Å; P678-L726 CarbonylContact C-O 3.49Å; P678-L726 WeakPolarHBondContact CA-O 3.34Å; P678-Y727 HydrophobicContact CB-CE1 4.48Å
679	R	86.4	Confident	79.4	Confident	42 Å²	42	34.8 Å²	34.8	16%	0.158	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-58.5	140.4	169.3	-171.3	-168.9	56.7	-158.4	16.3	110	E682 V684 Y689 P697 I698 L726 I728	R679-E682 PolarHBondContact NH2-O 2.92Å; R679-V684 PolarHBondContact NH1-O 2.02Å; R679-V684 VanDerWaalsContact NH1-O 3.08Å; R679-V684 PolarHBondContact NH2-O 3.28Å; R679-Y689 WeakPolarHBondContact CD-OH 3.22Å; R679-Y689 PolarHBondContact NE-OH 3.05Å; R679-Y689 VanDerWaalsContact NH1-CE2 3.3Å; R679-Y689 PolarHBondContact NH1-OH 2.99Å; R679-P697 HydrophobicContact CG-CB 4.01Å; R679-I698 CarbonylContact C-O 3.56Å; R679-I698 WeakPolarHBondContact CA-O 3.46Å; R679-L726 HydrophobicContact CB-CB 4.32Å; R679-L726 HydrophobicContact CB-CD2 3.97Å; R679-L726 HydrophobicContact CB-CG 4.41Å; R679-L726 HydrophobicContact CG-CD2 4.21Å; R679-L726 PolarHBondContact N-O 3.43Å; R679-I728 HydrophobicContact CB-CD1 4.29Å; R679-I728 HydrophobicContact CG-CD1 4.47Å
680	I	77.8	Confident	79.9	Confident	57 Å²	57	35.2 Å²	35.2	29%	0.292	17%	0.173	S	C	.	.	P	Polyproline II helix	trans	-55.9	141.2	166	-163.2	171	0	0	0	109.6	E682 I698 D700	I680-E682 HydrophobicContact CG2-CG 3.98Å; I680-E682 VanDerWaalsContact CG2-OE1 3.26Å; I680-E682 WeakPolarHBondContact CG2-OE1 3.37Å; I680-E682 PolarHBondContact O-N 3.14Å; I680-I698 HydrophobicContact CG2-CB 3.74Å; I680-I698 HydrophobicContact CG2-CG2 4.06Å; I680-I698 PolarHBondContact N-O 3.26Å; I680-D700 HydrophobicContact CB-CB 4.41Å
681	H	70.6	Confident	79.7	Confident	101 Å²	101	37.7 Å²	37.7	47%	0.468	19%	0.186	S	C	.	.			trans	-66.9	102.7	-174.1	-174.3	78	0	0	0	111	E284	E284-H681 IonicContact OE1-CE1 3.8Å; E284-H681 IonicContact OE1-NE2 3.78Å; E284-H681 IonicContact OE2-NE2 3.89Å
682	E	73.8	Confident	78.8	Confident	22 Å²	22	39.9 Å²	39.9	10%	0.103	20%	0.198	C	C	.	.			trans	-127.2	132.7	176.3	-73.7	169.2	-178.6	0	0	107.9	L270 R679 I680 V684	L270-E682 HydrophobicContact CD1-CB 3.86Å; L270-E682 HydrophobicContact CD1-CG 4.03Å; R679-E682 PolarHBondContact NH2-O 2.92Å; I680-E682 HydrophobicContact CG2-CG 3.98Å; I680-E682 VanDerWaalsContact CG2-OE1 3.26Å; I680-E682 WeakPolarHBondContact CG2-OE1 3.37Å; I680-E682 PolarHBondContact O-N 3.14Å; E682-V684 HydrophobicContact CB-CG2 4.44Å; E682-V684 PolarHBondContact O-N 3.35Å
683	P	74.2	Confident	77.8	Confident	5 Å²	5	41.3 Å²	41.3	3%	0.032	21%	0.205	C	C	.	.			trans	-77.9	45.7	176.9	33	-39	0	0	0	111.7	I251 L270 L280 E281 F283	I251-P683 HydrophobicContact CD1-CG 3.44Å; I251-P683 VanDerWaalsContact CD1-CG 3.44Å; L270-P683 HydrophobicContact CD1-CG 4.12Å; L270-P683 HydrophobicContact CD2-CG 4.36Å; L280-P683 CarbonylContact C-O 3.55Å; L280-P683 WeakPolarHBondContact CA-O 3.24Å; L280-P683 WeakPolarHBondContact CB-O 3.35Å; L280-P683 WeakPolarHBondContact CD2-O 3.03Å; E281-P683 PolarHBondContact N-O 3.3Å; E281-P683 VanDerWaalsContact N-O 3.08Å; E281-P683 CarbonylContact O-C 3.47Å; E281-P683 WeakPolarHBondContact O-CA 3.27Å; E281-P683 WeakPolarHBondContact O-CB 3.18Å; F283-P683 HydrophobicContact CE1-CB 4.21Å
684	V	79.5	Confident	76.7	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-109	130.7	178.5	-179.7	0	0	0	0	109.5	L270 L280 R679 E682 M688 Y689	L270-V684 HydrophobicContact CD1-CG2 3.59Å; L270-V684 HydrophobicContact CD2-CG2 3.99Å; L270-V684 HydrophobicContact CG-CG2 3.56Å; L280-V684 HydrophobicContact CD2-CG2 4.09Å; R679-V684 PolarHBondContact NH1-O 2.02Å; R679-V684 VanDerWaalsContact NH1-O 3.08Å; R679-V684 PolarHBondContact NH2-O 3.28Å; E682-V684 HydrophobicContact CB-CG2 4.44Å; E682-V684 PolarHBondContact O-N 3.35Å; V684-M688 HydrophobicContact CG1-CB 3.83Å; V684-M688 HydrophobicContact CG1-CG 4.36Å; V684-Y689 HydrophobicContact CG1-CE1 4.39Å
685	D	78.9	Confident	76	Confident	30 Å²	30	40.5 Å²	40.5	16%	0.16	21%	0.209	C	C	.	.			trans	-62.3	137.5	176.7	-173.8	-73.5	0	0	0	111.4	N279 E281 S687 M688	N279-D685 HydrophobicContact CB-CB 3.66Å; N279-D685 WeakPolarHBondContact O-CB 3.15Å; N279-D685 PolarHBondContact O-N 3.46Å; E281-D685 HydrophobicContact CG-CB 4.42Å; D685-S687 PolarHBondContact O-N 2.9Å; D685-S687 VanDerWaalsContact O-N 3.16Å; D685-S687 VanDerWaalsContact OD1-CB 3.22Å; D685-S687 WeakPolarHBondContact OD1-CB 2.99Å; D685-S687 PolarHBondContact OD1-N 2.83Å; D685-S687 PolarHBondContact OD1-OG 3.3Å; D685-M688 HydrophobicContact CB-CG 4.45Å; D685-M688 WeakPolarHBondContact O-CB 3.18Å; D685-M688 PolarHBondContact O-N 3Å; D685-M688 VanDerWaalsContact O-N 3.08Å
686	E	76.5	Confident	75.4	Confident	73 Å²	73	41.6 Å²	41.6	34%	0.341	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-55.1	-33.2	-178.4	-173.3	178.8	172.4	0	0	113.4	M688 Y689 L726 T753	E686-M688 PolarHBondContact O-N 3.49Å; E686-M688 VanDerWaalsContact O-N 3.13Å; E686-Y689 VanDerWaalsContact O-CD2 3.31Å; E686-Y689 WeakPolarHBondContact O-CD2 3.36Å; E686-Y689 PolarHBondContact O-N 3.49Å; E686-L726 HydrophobicContact CG-CD1 3.99Å; E686-T753 PolarHBondContact OE2-OG1 3.03Å
687	S	79.3	Confident	75	Confident	88 Å²	88	40.7 Å²	40.7	62%	0.615	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-67.5	-11.8	-179.3	66.7	0	0	0	0	114.5	D685	D685-S687 PolarHBondContact O-N 2.9Å; D685-S687 VanDerWaalsContact O-N 3.16Å; D685-S687 VanDerWaalsContact OD1-CB 3.22Å; D685-S687 WeakPolarHBondContact OD1-CB 2.99Å; D685-S687 PolarHBondContact OD1-N 2.83Å; D685-S687 PolarHBondContact OD1-OG 3.3Å
688	M	80.1	Confident	74.6	Confident	48 Å²	48	45.2 Å²	45.2	24%	0.236	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-84.8	-15.7	179.6	-70	-76	149.9	0	0	113.4	N279 V684 D685 E686	N279-M688 HydrophobicContact CB-CE 3.81Å; N279-M688 HydrophobicContact CB-CG 4.28Å; N279-M688 VanDerWaalsContact CG-CE 3.44Å; N279-M688 WeakPolarHBondContact ND2-CE 3.28Å; V684-M688 HydrophobicContact CG1-CB 3.83Å; V684-M688 HydrophobicContact CG1-CG 4.36Å; D685-M688 HydrophobicContact CB-CG 4.45Å; D685-M688 WeakPolarHBondContact O-CB 3.18Å; D685-M688 PolarHBondContact O-N 3Å; D685-M688 VanDerWaalsContact O-N 3.08Å; E686-M688 PolarHBondContact O-N 3.49Å; E686-M688 VanDerWaalsContact O-N 3.13Å
689	Y	77.8	Confident	74.1	Confident	21 Å²	21	45.5 Å²	45.5	8%	0.082	24%	0.242	C	C	.	.			trans	-76.1	132.8	179.6	-60	-63.8	0	0	0	111.4	R679 V684 E686 F695 P697 L726	R679-Y689 WeakPolarHBondContact CD-OH 3.22Å; R679-Y689 PolarHBondContact NE-OH 3.05Å; R679-Y689 VanDerWaalsContact NH1-CE2 3.3Å; R679-Y689 PolarHBondContact NH1-OH 2.99Å; V684-Y689 HydrophobicContact CG1-CE1 4.39Å; E686-Y689 VanDerWaalsContact O-CD2 3.31Å; E686-Y689 WeakPolarHBondContact O-CD2 3.36Å; E686-Y689 PolarHBondContact O-N 3.49Å; Y689-F695 CarbonylContact C-O 3.56Å; Y689-F695 VanDerWaalsContact CA-O 3.28Å; Y689-F695 WeakPolarHBondContact CA-O 3.38Å; Y689-F695 WeakPolarHBondContact CB-O 3.49Å; Y689-P697 HydrophobicContact CD1-CB 3.95Å; Y689-P697 HydrophobicContact CD1-CG 4.41Å; Y689-P697 HydrophobicContact CD2-CB 4.23Å; Y689-P697 HydrophobicContact CD2-CG 4.47Å; Y689-P697 HydrophobicContact CE1-CB 3.8Å; Y689-P697 HydrophobicContact CE2-CB 4.13Å; Y689-P697 HydrophobicContact CG-CB 4.18Å; Y689-P697 HydrophobicContact CG-CG 4.31Å; Y689-L726 HydrophobicContact CE2-CD2 4.09Å
690	N	70.4	Confident	73.8	Confident	49 Å²	49	44 Å²	44	26%	0.262	24%	0.237	S	C	.	.	B	Isolated β-bridge	trans	-145.3	104.4	176.5	-172	-16	0	0	0	110.6	E692 I693 G694 F695	N690-E692 VanDerWaalsContact C-N 3.25Å; N690-E692 PolarHBondContact O-N 3.31Å; N690-E692 WeakPolarHBondContact OD1-CB 3.33Å; N690-E692 WeakPolarHBondContact OD1-CG 3.46Å; N690-E692 PolarHBondContact OD1-N 2.94Å; N690-I693 VanDerWaalsContact ND2-CD1 3.34Å; N690-I693 WeakPolarHBondContact ND2-CD1 2.84Å; N690-I693 PolarHBondContact O-N 3.44Å; N690-G694 PolarHBondContact O-N 3.35Å; N690-F695 PolarHBondContact N-O 3.16Å; N690-F695 WeakPolarHBondContact O-CA 2.83Å; N690-F695 PolarHBondContact O-N 3.5Å
691	D	67.5	Low	73.6	Confident	58 Å²	58	47.3 Å²	47.3	31%	0.31	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-61.3	-30.8	177.7	-72.5	-16.2	0	0	0	112.8	I693 G694 S696 Y751	D691-I693 PolarHBondContact O-N 2.86Å; D691-I693 VanDerWaalsContact O-N 3.16Å; D691-G694 PolarHBondContact O-N 2.78Å; D691-G694 VanDerWaalsContact O-N 3.13Å; D691-S696 WeakPolarHBondContact OD1-CB 3.34Å; D691-S696 PolarHBondContact OD1-OG 2.85Å; D691-Y751 WeakPolarHBondContact OD2-CE1 3.28Å
692	E	62.3	Low	73.7	Confident	113 Å²	113	51.7 Å²	51.7	53%	0.528	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-62	-26.9	-178.4	-58.3	171.3	179	0	0	112	N690	N690-E692 VanDerWaalsContact C-N 3.25Å; N690-E692 PolarHBondContact O-N 3.31Å; N690-E692 WeakPolarHBondContact OD1-CB 3.33Å; N690-E692 WeakPolarHBondContact OD1-CG 3.46Å; N690-E692 PolarHBondContact OD1-N 2.94Å
693	I	60.7	Low	73.8	Confident	30 Å²	30	52.9 Å²	52.9	15%	0.154	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-113.3	8.5	-175.1	-38	175.3	0	0	0	110.9	L59 H274 N690 D691 F695	L59-I693 HydrophobicContact CD2-CG2 4.35Å; H274-I693 WeakPolarHBondContact CE1-CD1 3.46Å; H274-I693 WeakPolarHBondContact ND1-CG2 3.47Å; N690-I693 VanDerWaalsContact ND2-CD1 3.34Å; N690-I693 WeakPolarHBondContact ND2-CD1 2.84Å; N690-I693 PolarHBondContact O-N 3.44Å; D691-I693 PolarHBondContact O-N 2.86Å; D691-I693 VanDerWaalsContact O-N 3.16Å; I693-F695 HydrophobicContact CB-CD2 4.28Å; I693-F695 HydrophobicContact CB-CE2 4.05Å; I693-F695 HydrophobicContact CB-CZ 4.35Å; I693-F695 HydrophobicContact CG2-CE2 3.85Å; I693-F695 HydrophobicContact CG2-CZ 3.81Å; I693-F695 VanDerWaalsContact O-CE1 3.3Å; I693-F695 WeakPolarHBondContact O-CE1 3.34Å
694	G	58.7	Low	74	Confident	21 Å²	21	55.1 Å²	55.1	22%	0.216	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	76	27	177.3	0	0	0	0	0	114.2	N690 D691	N690-G694 PolarHBondContact O-N 3.35Å; D691-G694 PolarHBondContact O-N 2.78Å; D691-G694 VanDerWaalsContact O-N 3.13Å
695	F	69.8	Low	74	Confident	18 Å²	18	59.4 Å²	59.4	8%	0.079	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-108.4	67	177.7	-52.8	-26	0	0	0	110.5	M272 T273 H274 Y689 N690 I693	M272-F695 WeakPolarHBondContact O-CD1 3.45Å; M272-F695 WeakPolarHBondContact O-CE1 3.33Å; M272-F695 WeakPolarHBondContact O-CG 3.37Å; M272-F695 WeakPolarHBondContact O-CZ 3.38Å; T273-F695 WeakPolarHBondContact OG1-CE2 3.49Å; H274-F695 AromaticContact CE1-CE2 3.99Å; H274-F695 AromaticContact ND1-CE2 3.34Å; H274-F695 VanDerWaalsContact ND1-CE2 3.34Å; H274-F695 WeakPolarHBondContact ND1-CE2 3.37Å; H274-F695 AromaticContact ND1-CZ 3.64Å; Y689-F695 CarbonylContact C-O 3.56Å; Y689-F695 VanDerWaalsContact CA-O 3.28Å; Y689-F695 WeakPolarHBondContact CA-O 3.38Å; Y689-F695 WeakPolarHBondContact CB-O 3.49Å; N690-F695 PolarHBondContact N-O 3.16Å; N690-F695 WeakPolarHBondContact O-CA 2.83Å; N690-F695 PolarHBondContact O-N 3.5Å; I693-F695 HydrophobicContact CB-CD2 4.28Å; I693-F695 HydrophobicContact CB-CE2 4.05Å; I693-F695 HydrophobicContact CB-CZ 4.35Å; I693-F695 HydrophobicContact CG2-CE2 3.85Å; I693-F695 HydrophobicContact CG2-CZ 3.81Å; I693-F695 VanDerWaalsContact O-CE1 3.3Å; I693-F695 WeakPolarHBondContact O-CE1 3.34Å
696	S	74.7	Confident	74	Confident	58 Å²	58	62.7 Å²	62.7	41%	0.406	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-91.9	145.7	179.3	-50.5	0	0	0	0	111.3	D691	D691-S696 WeakPolarHBondContact OD1-CB 3.34Å; D691-S696 PolarHBondContact OD1-OG 2.85Å
697	P	80.8	Confident	74.1	Confident	11 Å²	11	64.2 Å²	64.2	7%	0.071	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-65.2	147	172.8	30.3	-36.4	0	0	0	110.9	R679 Y689 L726 I728 Y751	R679-P697 HydrophobicContact CG-CB 4.01Å; Y689-P697 HydrophobicContact CD1-CB 3.95Å; Y689-P697 HydrophobicContact CD1-CG 4.41Å; Y689-P697 HydrophobicContact CD2-CB 4.23Å; Y689-P697 HydrophobicContact CD2-CG 4.47Å; Y689-P697 HydrophobicContact CE1-CB 3.8Å; Y689-P697 HydrophobicContact CE2-CB 4.13Å; Y689-P697 HydrophobicContact CG-CB 4.18Å; Y689-P697 HydrophobicContact CG-CG 4.31Å; P697-L726 HydrophobicContact CB-CD2 4.24Å; P697-I728 HydrophobicContact CB-CD1 3.92Å; P697-I728 HydrophobicContact CB-CG1 4.29Å; P697-I728 HydrophobicContact CG-CD1 4.03Å; P697-I728 HydrophobicContact CG-CG1 3.93Å; P697-I728 WeakPolarHBondContact O-CD1 3.27Å; P697-Y751 HydrophobicContact CG-CD1 3.79Å; P697-Y751 HydrophobicContact CG-CD2 4.42Å; P697-Y751 HydrophobicContact CG-CE1 4.26Å; P697-Y751 HydrophobicContact CG-CG 3.88Å
698	I	78	Confident	74	Confident	95 Å²	95	63.6 Å²	63.6	49%	0.487	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-94.4	131.5	-177.7	-58	173.9	0	0	0	110.3	R679 I680 I728	R679-I698 CarbonylContact C-O 3.56Å; R679-I698 WeakPolarHBondContact CA-O 3.46Å; I680-I698 HydrophobicContact CG2-CB 3.74Å; I680-I698 HydrophobicContact CG2-CG2 4.06Å; I680-I698 PolarHBondContact N-O 3.26Å; I698-I728 WeakPolarHBondContact O-CD1 3.35Å
699	M	78.3	Confident	73.9	Confident	15 Å²	15	61.5 Å²	61.5	7%	0.074	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-74.3	131.2	176.9	-171.6	178.3	-72.6	0	0	111.5	A677 L701 I704 I728 H730	A677-M699 HydrophobicContact CB-CG 3.18Å; A677-M699 HydrophobicContact CB-SD 3.69Å; M699-L701 PolarHBondContact O-N 3.32Å; M699-I704 HydrophobicContact SD-CD1 3.65Å; M699-I704 HydrophobicContact SD-CG1 3.88Å; M699-I728 HydrophobicContact CB-CD1 4.04Å; M699-I728 HydrophobicContact CE-CB 3.75Å; M699-I728 HydrophobicContact CE-CG2 3.67Å; M699-I728 WeakPolarHBondContact CE-O 3.22Å; M699-H730 WeakPolarHBondContact CE-CD2 3.07Å
700	D	80.5	Confident	73.6	Confident	12 Å²	12	65.3 Å²	65.3	6%	0.064	33%	0.333	C	S	.	.			trans	-74.6	93.4	171.2	-172.2	4.3	0	0	0	109.7	P678 I680 R702 Q703	P678-D700 WeakPolarHBondContact O-CB 3.24Å; P678-D700 PolarHBondContact O-N 3.28Å; I680-D700 HydrophobicContact CB-CB 4.41Å; D700-R702 PolarHBondContact O-N 3.48Å; D700-R702 WeakPolarHBondContact OD1-CB 3.3Å; D700-R702 IonicContact OD1-CZ 3.82Å; D700-R702 PolarHBondContact OD1-N 3.49Å; D700-R702 IonicContact OD1-NE 3.65Å; D700-R702 PolarHBondContact OD1-NE 2.72Å; D700-R702 VanDerWaalsContact OD1-NE 3.14Å; D700-R702 IonicContact OD1-NH2 2.81Å; D700-R702 IonicContact OD2-NH2 3.83Å; D700-Q703 PolarHBondContact O-N 3.04Å; D700-Q703 PolarHBondContact OD2-NE2 3.29Å
701	L	73.8	Confident	73.4	Confident	125 Å²	125	66 Å²	66	65%	0.654	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-58	-15.8	-179.1	-60.1	-179.9	0	0	0	113.5	M699 Q703 I704	M699-L701 PolarHBondContact O-N 3.32Å; L701-Q703 VanDerWaalsContact C-N 3.27Å; L701-Q703 PolarHBondContact O-N 2.93Å; L701-I704 HydrophobicContact CD2-CD1 4.01Å; L701-I704 WeakPolarHBondContact O-CG2 3.34Å
702	R	72.3	Confident	73.5	Confident	194 Å²	194	70.7 Å²	70.7	73%	0.732	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-76.7	-14.2	175.1	-60.9	177.5	-68.7	175.7	1.1	113.4	D700	D700-R702 PolarHBondContact O-N 3.48Å; D700-R702 WeakPolarHBondContact OD1-CB 3.3Å; D700-R702 IonicContact OD1-CZ 3.82Å; D700-R702 PolarHBondContact OD1-N 3.49Å; D700-R702 IonicContact OD1-NE 3.65Å; D700-R702 PolarHBondContact OD1-NE 2.72Å; D700-R702 VanDerWaalsContact OD1-NE 3.14Å; D700-R702 IonicContact OD1-NH2 2.81Å; D700-R702 IonicContact OD2-NH2 3.83Å
703	Q	75.9	Confident	74.2	Confident	46 Å²	46	68.8 Å²	68.8	22%	0.215	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-122.4	21.1	-179.2	-64.3	-176.7	76.9	0	0	111.5	P678 D700 L701 H784	P678-Q703 HydrophobicContact CG-CB 3.76Å; P678-Q703 HydrophobicContact CG-CG 4.33Å; D700-Q703 PolarHBondContact O-N 3.04Å; D700-Q703 PolarHBondContact OD2-NE2 3.29Å; L701-Q703 VanDerWaalsContact C-N 3.27Å; L701-Q703 PolarHBondContact O-N 2.93Å; Q703-H784 VanDerWaalsContact CD-CE1 3.42Å; Q703-H784 WeakPolarHBondContact CG-CE1 3.28Å; Q703-H784 PolarHBondContact NE2-NE2 3.41Å
704	I	78.5	Confident	75.4	Confident	52 Å²	52	69.5 Å²	69.5	27%	0.267	36%	0.356	S	S	.	.			trans	-75.8	132.7	-177.2	-164.7	170.2	0	0	0	111.3	M675 A677 M699 L701 I706	M675-I704 HydrophobicContact CB-CD1 4.17Å; M675-I704 HydrophobicContact CB-CG1 4.43Å; M675-I704 HydrophobicContact SD-CD1 4.42Å; A677-I704 HydrophobicContact CB-CB 4.12Å; A677-I704 HydrophobicContact CB-CG1 4.35Å; M699-I704 HydrophobicContact SD-CD1 3.65Å; M699-I704 HydrophobicContact SD-CG1 3.88Å; L701-I704 HydrophobicContact CD2-CD1 4.01Å; L701-I704 WeakPolarHBondContact O-CG2 3.34Å; I704-I706 HydrophobicContact CD1-CD1 4.49Å; I704-I706 HydrophobicContact CD1-CG1 4.43Å; I704-I706 HydrophobicContact CG1-CG1 4.22Å
705	D	80.1	Confident	76.9	Confident	91 Å²	91	73.2 Å²	73.2	49%	0.487	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	147.3	166.5	-72.8	-45	0	0	0	109.4	M675 W676	M675-D705 CarbonylContact C-O 3.53Å; M675-D705 VanDerWaalsContact CA-O 3.31Å; M675-D705 WeakPolarHBondContact CA-O 3.49Å; W676-D705 HydrophobicContact CD2-CB 3.95Å; W676-D705 HydrophobicContact CG-CB 4.46Å; W676-D705 HydrophobicContact CH2-CB 4.03Å; W676-D705 HydrophobicContact CZ2-CB 3.38Å; W676-D705 PolarHBondContact N-O 3.26Å; W676-D705 PolarHBondContact NE1-OD2 3.47Å; W676-D705 PolarHBondContact O-N 3.47Å
706	I	78.4	Confident	77.8	Confident	98 Å²	98	72.5 Å²	72.5	50%	0.503	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	134.9	-176.5	-54.3	177.7	0	0	0	109.6	R673 V674 M675 I704	R673-I706 HydrophobicContact CG-CG2 3.91Å; V674-I706 WeakPolarHBondContact O-CA 3.28Å; M675-I706 HydrophobicContact CB-CG1 4.25Å; M675-I706 HydrophobicContact CG-CB 4.44Å; M675-I706 HydrophobicContact CG-CD1 4.37Å; M675-I706 HydrophobicContact CG-CG1 3.93Å; M675-I706 HydrophobicContact CG-CG2 4.05Å; M675-I706 HydrophobicContact SD-CD1 4.21Å; M675-I706 HydrophobicContact SD-CG1 4.4Å; I704-I706 HydrophobicContact CD1-CD1 4.49Å; I704-I706 HydrophobicContact CD1-CG1 4.43Å; I704-I706 HydrophobicContact CG1-CG1 4.22Å
707	K	77.6	Confident	78.6	Confident	106 Å²	106	71.7 Å²	71.7	46%	0.461	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	134.5	171.8	-171	165.4	178.3	-179.9	0	111.2	V674 W676 I709 I716	V674-K707 PolarHBondContact N-O 2.86Å; V674-K707 PolarHBondContact O-N 3.09Å; W676-K707 HydrophobicContact CH2-CB 3.95Å; W676-K707 HydrophobicContact CZ3-CB 3.84Å; K707-I709 HydrophobicContact CG-CG1 4.44Å; K707-I716 HydrophobicContact CB-CD1 3.93Å; K707-I716 HydrophobicContact CD-CD1 3.63Å; K707-I716 HydrophobicContact CD-CG1 4.39Å; K707-I716 HydrophobicContact CG-CD1 4.17Å
708	V	77.6	Confident	79.1	Confident	74 Å²	74	71.3 Å²	71.3	45%	0.448	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	132.5	171.5	-176.8	0	0	0	0	108.9	K671 Y672 L734	K671-V708 HydrophobicContact CB-CG1 4.02Å; K671-V708 HydrophobicContact CD-CG1 4.07Å; Y672-V708 CarbonylContact O-C 3.56Å; Y672-V708 VanDerWaalsContact O-CA 3.31Å; Y672-V708 WeakPolarHBondContact O-CA 3.4Å; V708-L734 HydrophobicContact CG1-CD1 4.25Å
709	I	78.7	Confident	79.5	Confident	5 Å²	5	71.7 Å²	71.7	3%	0.026	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	136.3	-173.4	-56.9	167.3	0	0	0	108.6	W638 K671 Y672 V674 K707 Q713 I716	W638-I709 HydrophobicContact CH2-CD1 3.41Å; W638-I709 VanDerWaalsContact CH2-CD1 3.41Å; W638-I709 HydrophobicContact CZ2-CD1 3.81Å; K671-I709 CarbonylContact C-O 3.57Å; K671-I709 VanDerWaalsContact CA-O 3.31Å; K671-I709 WeakPolarHBondContact CA-O 3.31Å; K671-I709 WeakPolarHBondContact CB-O 3.4Å; Y672-I709 PolarHBondContact N-O 3.29Å; Y672-I709 PolarHBondContact O-N 2.84Å; V674-I709 HydrophobicContact CB-CD1 4.46Å; V674-I709 HydrophobicContact CG2-CD1 3.55Å; K707-I709 HydrophobicContact CG-CG1 4.44Å; I709-Q713 HydrophobicContact CG2-CB 3.49Å; I709-Q713 VanDerWaalsContact CG2-CB 3.49Å; I709-Q713 HydrophobicContact CG2-CG 3.59Å; I709-Q713 WeakPolarHBondContact CG2-O 3.12Å; I709-I716 HydrophobicContact CD1-CB 3.71Å; I709-I716 HydrophobicContact CD1-CD1 4.18Å; I709-I716 HydrophobicContact CD1-CG1 4.32Å; I709-I716 HydrophobicContact CD1-CG2 4.25Å
710	D	70.9	Confident	79.7	Confident	101 Å²	101	77.8 Å²	77.8	54%	0.54	38%	0.382	S	S	.	.			trans	-75.5	166.8	-178.9	-66.9	-49.3	0	0	0	113	K671 D712 Q713	K671-D710 WeakPolarHBondContact CE-OD1 3.2Å; K671-D710 IonicContact NZ-OD1 2.83Å; D710-D712 PolarHBondContact O-N 2.78Å; D710-Q713 PolarHBondContact O-N 2.85Å; D710-Q713 VanDerWaalsContact O-N 3.13Å
711	Q	66.5	Low	80.1	Confident	63 Å²	63	77.6 Å²	77.6	29%	0.294	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-28.6	-162.9	-177	170.9	-22.7	0	0	116.9	T670	T670-Q711 WeakPolarHBondContact O-CA 3.29Å; T670-Q711 WeakPolarHBondContact O-CB 3.43Å; T670-Q711 PolarHBondContact O-N 3Å
712	D	68.6	Low	80.7	Confident	156 Å²	156	75.8 Å²	75.8	83%	0.834	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-10.7	-172.4	-57.3	-31.3	0	0	0	112.9	D710	D710-D712 PolarHBondContact O-N 2.78Å
713	Q	78.3	Confident	81.3	Confident	73 Å²	73	68.7 Å²	68.7	34%	0.341	35%	0.347	S	S	.	.			trans	-107.1	106.9	-175.1	-180	175.7	-6.4	0	0	110.9	I709 D710 W715	I709-Q713 HydrophobicContact CG2-CB 3.49Å; I709-Q713 VanDerWaalsContact CG2-CB 3.49Å; I709-Q713 HydrophobicContact CG2-CG 3.59Å; I709-Q713 WeakPolarHBondContact CG2-O 3.12Å; D710-Q713 PolarHBondContact O-N 2.85Å; D710-Q713 VanDerWaalsContact O-N 3.13Å; Q713-W715 WeakPolarHBondContact CG-O 2.99Å; Q713-W715 PolarHBondContact NE2-O 3.33Å
714	T	86.2	Confident	81.5	Confident	46 Å²	46	70.4 Å²	70.4	28%	0.282	36%	0.357	S	S	.	.			trans	-99.5	26.8	178.2	67.2	0	0	0	0	113.3	S637 W638	S637-T714 WeakPolarHBondContact CA-O 3.17Å; W638-T714 PolarHBondContact N-O 3.45Å; W638-T714 VanDerWaalsContact O-CB 3.23Å; W638-T714 WeakPolarHBondContact O-CB 3.28Å; W638-T714 PolarHBondContact O-OG1 3.13Å
715	W	89.8	Confident	81.8	Confident	99 Å²	99	69.4 Å²	69.4	38%	0.375	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	155.3	178.4	62.8	-88.6	0	0	0	112	R635 I636 Q713 V717	R635-W715 HydrophobicContact CG-CB 4.42Å; R635-W715 HydrophobicContact CG-CE3 4.39Å; I636-W715 CarbonylContact O-C 3.57Å; I636-W715 WeakPolarHBondContact O-CA 3.32Å; I636-W715 WeakPolarHBondContact O-CB 3.36Å; Q713-W715 WeakPolarHBondContact CG-O 2.99Å; Q713-W715 PolarHBondContact NE2-O 3.33Å; W715-V717 HydrophobicContact CE3-CG2 4.1Å; W715-V717 HydrophobicContact CZ3-CG2 3.78Å
716	I	89.2	Confident	82.2	Confident	3 Å²	3	65.9 Å²	65.9	2%	0.015	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	148.1	174.5	-177.1	178.2	0	0	0	109.2	R635 I636 W638 V674 W676 K707 I709 L718	R635-I716 CarbonylContact C-O 3.57Å; R635-I716 VanDerWaalsContact CA-O 3.29Å; R635-I716 WeakPolarHBondContact CA-O 3.47Å; I636-I716 HydrophobicContact CB-CG2 3.82Å; I636-I716 HydrophobicContact CG1-CG2 4.2Å; I636-I716 PolarHBondContact N-O 3.44Å; I636-I716 PolarHBondContact O-N 3.36Å; W638-I716 HydrophobicContact CH2-CB 4.38Å; W638-I716 HydrophobicContact CH2-CG2 4.04Å; W638-I716 HydrophobicContact CZ3-CG2 3.92Å; V674-I716 HydrophobicContact CB-CD1 4.46Å; V674-I716 HydrophobicContact CG1-CG2 4.12Å; V674-I716 HydrophobicContact CG2-CG2 4.28Å; W676-I716 HydrophobicContact CH2-CD1 4.22Å; W676-I716 HydrophobicContact CZ3-CD1 3.91Å; K707-I716 HydrophobicContact CB-CD1 3.93Å; K707-I716 HydrophobicContact CD-CD1 3.63Å; K707-I716 HydrophobicContact CD-CG1 4.39Å; K707-I716 HydrophobicContact CG-CD1 4.17Å; I709-I716 HydrophobicContact CD1-CB 3.71Å; I709-I716 HydrophobicContact CD1-CD1 4.18Å; I709-I716 HydrophobicContact CD1-CG1 4.32Å; I709-I716 HydrophobicContact CD1-CG2 4.25Å; I716-L718 HydrophobicContact CD1-CD2 3.87Å; I716-L718 HydrophobicContact CG1-CD2 4.17Å; I716-L718 HydrophobicContact CG2-CD2 4.3Å
717	V	90.4	Very high	82.9	Confident	41 Å²	41	61.9 Å²	61.9	25%	0.248	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	124.8	167.5	-178.7	0	0	0	0	108.5	I629 N633 Y634 R635 W715 N719	I629-V717 HydrophobicContact CD1-CB 4.33Å; I629-V717 HydrophobicContact CD1-CG1 3.69Å; I629-V717 HydrophobicContact CD1-CG2 3.63Å; N633-V717 HydrophobicContact CB-CG1 4.37Å; Y634-V717 WeakPolarHBondContact O-CA 3.35Å; R635-V717 HydrophobicContact CB-CG2 4.21Å; R635-V717 HydrophobicContact CG-CG2 4.32Å; W715-V717 HydrophobicContact CE3-CG2 4.1Å; W715-V717 HydrophobicContact CZ3-CG2 3.78Å; V717-N719 WeakPolarHBondContact CG1-OD1 3.3Å
718	L	90.7	Very high	83.5	Confident	3 Å²	3	57 Å²	57	2%	0.016	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	114.4	170.7	-51.9	-174.3	0	0	0	107.2	N633 Y634 I636 W676 I716 L721 V729	N633-L718 WeakPolarHBondContact CA-O 3.28Å; Y634-L718 PolarHBondContact N-O 3.46Å; Y634-L718 PolarHBondContact O-N 3.35Å; I636-L718 HydrophobicContact CD1-CD1 4.18Å; I636-L718 HydrophobicContact CG1-CD1 3.85Å; I636-L718 HydrophobicContact CG1-CG 4.01Å; W676-L718 HydrophobicContact CB-CD1 4.15Å; W676-L718 HydrophobicContact CD2-CD1 4.14Å; W676-L718 HydrophobicContact CD2-CD2 3.56Å; W676-L718 HydrophobicContact CD2-CG 4.46Å; W676-L718 HydrophobicContact CE3-CD2 3.61Å; W676-L718 HydrophobicContact CG-CD1 3.88Å; W676-L718 HydrophobicContact CG-CD2 4.2Å; W676-L718 HydrophobicContact CH2-CD2 3.98Å; W676-L718 HydrophobicContact CZ2-CD2 3.92Å; W676-L718 HydrophobicContact CZ3-CD2 3.83Å; I716-L718 HydrophobicContact CD1-CD2 3.87Å; I716-L718 HydrophobicContact CG1-CD2 4.17Å; I716-L718 HydrophobicContact CG2-CD2 4.3Å; L718-L721 HydrophobicContact CB-CD1 4.04Å; L718-L721 HydrophobicContact CB-CD2 4.1Å; L718-L721 HydrophobicContact CB-CG 4.2Å; L718-L721 HydrophobicContact CD1-CD1 4.4Å; L718-V729 HydrophobicContact CD1-CG2 3.98Å
719	N	87.4	Confident	84.1	Confident	103 Å²	103	53.5 Å²	53.5	55%	0.551	27%	0.271	S	S	*	.			trans	-99.3	146.5	-173.6	-64.9	-40.5	0	0	0	111.3	N633 V717 L721	N633-N719 WeakPolarHBondContact OD1-CA 3.39Å; V717-N719 WeakPolarHBondContact CG1-OD1 3.3Å; N719-L721 VanDerWaalsContact C-N 3.32Å; N719-L721 PolarHBondContact O-N 2.82Å
720	Q	83.3	Confident	84.5	Confident	143 Å²	143	55.1 Å²	55.1	67%	0.668	28%	0.279	S	S	*	.	S	Bend	trans	56.4	42.3	169.1	-57.9	-67.6	-26	0	0	113.5	L632 N633	L632-Q720 PolarHBondContact O-N 3.38Å; N633-Q720 PolarHBondContact OD1-N 3.08Å
721	L	87.8	Confident	85.4	Confident	8 Å²	8	50.3 Å²	50.3	4%	0.042	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-64.9	154.4	174.8	-63.3	-175.7	0	0	0	111	L632 Y634 L718 N719 Y727 F752 T754	L632-L721 WeakPolarHBondContact CB-O 3.11Å; L632-L721 WeakPolarHBondContact CD1-O 3.08Å; L632-L721 WeakPolarHBondContact CD2-O 3.42Å; L632-L721 PolarHBondContact O-N 2.92Å; Y634-L721 HydrophobicContact CD2-CD1 3.89Å; Y634-L721 HydrophobicContact CG-CD1 4.42Å; L718-L721 HydrophobicContact CB-CD1 4.04Å; L718-L721 HydrophobicContact CB-CD2 4.1Å; L718-L721 HydrophobicContact CB-CG 4.2Å; L718-L721 HydrophobicContact CD1-CD1 4.4Å; N719-L721 VanDerWaalsContact C-N 3.32Å; N719-L721 PolarHBondContact O-N 2.82Å; L721-Y727 HydrophobicContact CB-CD2 4.42Å; L721-Y727 HydrophobicContact CB-CE2 3.79Å; L721-Y727 HydrophobicContact CD1-CD2 4.22Å; L721-Y727 HydrophobicContact CD1-CE2 4.36Å; L721-Y727 HydrophobicContact CD1-CG 4.37Å; L721-Y727 HydrophobicContact CD2-CD1 4.32Å; L721-Y727 HydrophobicContact CD2-CE1 3.85Å; L721-Y727 HydrophobicContact CD2-CE2 4.33Å; L721-Y727 HydrophobicContact CG-CE2 4.39Å; L721-F752 HydrophobicContact CD1-CE2 3.89Å; L721-F752 HydrophobicContact CD1-CZ 3.61Å; L721-T754 HydrophobicContact CB-CG2 3.82Å; L721-T754 HydrophobicContact CD1-CG2 4.11Å
722	K	85.7	Confident	86.2	Confident	86 Å²	86	48.3 Å²	48.3	37%	0.374	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-64.7	135.8	177.4	-68	177.1	-179.5	179.5	0	109.7	T725 Y727 T754	K722-T725 HydrophobicContact CB-CG2 4.44Å; K722-T725 WeakPolarHBondContact CB-OG1 3.42Å; K722-T725 WeakPolarHBondContact O-CB 3.46Å; K722-T725 PolarHBondContact O-OG1 3.07Å; K722-Y727 HydrophobicContact CB-CE2 4.37Å; K722-Y727 PolarHBondContact N-OH 2.86Å; K722-T754 WeakPolarHBondContact O-CB 3.38Å; K722-T754 WeakPolarHBondContact O-CG2 3.48Å; K722-T754 PolarHBondContact O-OG1 3.33Å
723	P	85.7	Confident	86.9	Confident	45 Å²	45	40.9 Å²	40.9	29%	0.292	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	155.3	176.9	27.4	-34.4	0	0	0	111.5	L632 T725 T754 I755	L632-P723 HydrophobicContact CD2-CB 3.99Å; P723-T725 PolarHBondContact O-N 3.48Å; P723-T725 VanDerWaalsContact O-N 3.09Å; P723-T725 PolarHBondContact O-OG1 3.23Å; P723-T754 VanDerWaalsContact C-OG1 3.27Å; P723-I755 WeakPolarHBondContact CA-O 3.27Å; P723-I755 WeakPolarHBondContact CB-O 3.48Å
724	N	80.1	Confident	86.7	Confident	82 Å²	82	37.7 Å²	37.7	44%	0.439	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.3	39.6	178.3	-162	57.5	0	0	0	115.1	T754 I755 C756	N724-T754 WeakPolarHBondContact CA-O 3.33Å; N724-T754 PolarHBondContact N-O 2.87Å; N724-T754 PolarHBondContact N-OG1 3.1Å; N724-I755 PolarHBondContact N-O 3.18Å; N724-I755 VanDerWaalsContact N-O 3.12Å; N724-C756 VanDerWaalsContact CG-SG 3.56Å; N724-C756 PolarHBondContact OD1-SG 2.78Å
725	T	84.9	Confident	85.9	Confident	32 Å²	32	37.2 Å²	37.2	20%	0.196	18%	0.183	C	C	.	.			trans	-121.5	131.7	-176.4	-59.1	0	0	0	0	109.4	P678 K722 P723 Y727 T754	P678-T725 HydrophobicContact CB-CG2 3.65Å; K722-T725 HydrophobicContact CB-CG2 4.44Å; K722-T725 WeakPolarHBondContact CB-OG1 3.42Å; K722-T725 WeakPolarHBondContact O-CB 3.46Å; K722-T725 PolarHBondContact O-OG1 3.07Å; P723-T725 PolarHBondContact O-N 3.48Å; P723-T725 VanDerWaalsContact O-N 3.09Å; P723-T725 PolarHBondContact O-OG1 3.23Å; T725-Y727 HydrophobicContact CG2-CD2 3.97Å; T725-Y727 HydrophobicContact CG2-CE2 3.62Å; T725-Y727 WeakPolarHBondContact O-CD2 3.23Å; T725-Y727 PolarHBondContact O-N 3.36Å; T725-T754 PolarHBondContact N-OG1 3.38Å; T725-T754 PolarHBondContact O-N 3.18Å; T725-T754 VanDerWaalsContact O-N 3.08Å; T725-T754 PolarHBondContact O-OG1 3.45Å
726	L	88.9	Confident	84.8	Confident	16 Å²	16	34.5 Å²	34.5	8%	0.084	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	114.2	172	-176.8	76	0	0	0	108.9	P678 R679 E686 Y689 P697 Y751 T753	P678-L726 CarbonylContact C-O 3.49Å; P678-L726 WeakPolarHBondContact CA-O 3.34Å; R679-L726 HydrophobicContact CB-CB 4.32Å; R679-L726 HydrophobicContact CB-CD2 3.97Å; R679-L726 HydrophobicContact CB-CG 4.41Å; R679-L726 HydrophobicContact CG-CD2 4.21Å; R679-L726 PolarHBondContact N-O 3.43Å; E686-L726 HydrophobicContact CG-CD1 3.99Å; Y689-L726 HydrophobicContact CE2-CD2 4.09Å; P697-L726 HydrophobicContact CB-CD2 4.24Å; L726-Y751 HydrophobicContact CD1-CD2 4.47Å; L726-T753 VanDerWaalsContact CD1-OG1 3.3Å; L726-T753 WeakPolarHBondContact CD1-OG1 3.41Å
727	Y	91.7	Very high	83.3	Confident	15 Å²	15	35.6 Å²	35.6	6%	0.059	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	144.5	175.7	-83.1	-91.1	0	0	0	110.9	P678 L721 K722 T725 Y751 F752 T754	P678-Y727 HydrophobicContact CB-CE1 4.48Å; L721-Y727 HydrophobicContact CB-CD2 4.42Å; L721-Y727 HydrophobicContact CB-CE2 3.79Å; L721-Y727 HydrophobicContact CD1-CD2 4.22Å; L721-Y727 HydrophobicContact CD1-CE2 4.36Å; L721-Y727 HydrophobicContact CD1-CG 4.37Å; L721-Y727 HydrophobicContact CD2-CD1 4.32Å; L721-Y727 HydrophobicContact CD2-CE1 3.85Å; L721-Y727 HydrophobicContact CD2-CE2 4.33Å; L721-Y727 HydrophobicContact CG-CE2 4.39Å; K722-Y727 HydrophobicContact CB-CE2 4.37Å; K722-Y727 PolarHBondContact N-OH 2.86Å; T725-Y727 HydrophobicContact CG2-CD2 3.97Å; T725-Y727 HydrophobicContact CG2-CE2 3.62Å; T725-Y727 WeakPolarHBondContact O-CD2 3.23Å; T725-Y727 PolarHBondContact O-N 3.36Å; Y727-Y751 CarbonylContact O-C 3.57Å; Y727-Y751 WeakPolarHBondContact O-CA 3.31Å; Y727-Y751 WeakPolarHBondContact O-CB 3.31Å; Y727-F752 PolarHBondContact N-O 2.95Å; Y727-F752 PolarHBondContact O-N 2.53Å; Y727-T754 HydrophobicContact CD2-CG2 3.73Å; Y727-T754 HydrophobicContact CE2-CG2 3.9Å
728	I	90.7	Very high	81.5	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.015	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	137.2	171.6	-57.4	154.5	0	0	0	106.9	W676 A677 R679 P697 I698 M699	W676-I728 WeakPolarHBondContact CA-O 3.47Å; W676-I728 WeakPolarHBondContact CB-O 2.86Å; A677-I728 PolarHBondContact N-O 2.8Å; A677-I728 VanDerWaalsContact N-O 3.15Å; A677-I728 PolarHBondContact O-N 3.34Å; R679-I728 HydrophobicContact CB-CD1 4.29Å; R679-I728 HydrophobicContact CG-CD1 4.47Å; P697-I728 HydrophobicContact CB-CD1 3.92Å; P697-I728 HydrophobicContact CB-CG1 4.29Å; P697-I728 HydrophobicContact CG-CD1 4.03Å; P697-I728 HydrophobicContact CG-CG1 3.93Å; P697-I728 WeakPolarHBondContact O-CD1 3.27Å; I698-I728 WeakPolarHBondContact O-CD1 3.35Å; M699-I728 HydrophobicContact CB-CD1 4.04Å; M699-I728 HydrophobicContact CE-CB 3.75Å; M699-I728 HydrophobicContact CE-CG2 3.67Å; M699-I728 WeakPolarHBondContact CE-O 3.22Å
729	V	91.7	Very high	79.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	125.2	178.9	-174.1	0	0	0	0	109.3	I636 V674 M675 W676 L718 V731 S749 V750 F752	I636-V729 HydrophobicContact CD1-CG2 4.09Å; I636-V729 HydrophobicContact CG1-CG1 4.23Å; I636-V729 HydrophobicContact CG1-CG2 4.43Å; I636-V729 HydrophobicContact CG2-CG1 4.19Å; V674-V729 HydrophobicContact CG1-CG1 3.66Å; M675-V729 CarbonylContact O-C 3.45Å; M675-V729 WeakPolarHBondContact O-CA 3.39Å; W676-V729 HydrophobicContact CB-CB 4.46Å; W676-V729 HydrophobicContact CB-CG1 4.47Å; W676-V729 HydrophobicContact CB-CG2 3.93Å; L718-V729 HydrophobicContact CD1-CG2 3.98Å; V729-V731 HydrophobicContact CG1-CG2 4.37Å; V729-S749 CarbonylContact O-C 3.5Å; V729-S749 VanDerWaalsContact O-CA 3.27Å; V729-S749 WeakPolarHBondContact O-CA 3.44Å; V729-V750 HydrophobicContact CB-CG1 3.93Å; V729-V750 PolarHBondContact N-O 2.89Å; V729-V750 PolarHBondContact O-N 3.23Å; V729-F752 HydrophobicContact CG2-CD1 4.49Å; V729-F752 HydrophobicContact CG2-CE1 3.75Å
730	H	87	Confident	77.9	Confident	40 Å²	40	42.6 Å²	42.6	19%	0.185	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	129.3	172.6	-66	-51.7	0	0	0	110.2	V674 M675 M699 P747 V748 S749	V674-H730 CarbonylContact C-O 3.55Å; V674-H730 VanDerWaalsContact CA-O 3.3Å; V674-H730 WeakPolarHBondContact CA-O 3.27Å; M675-H730 HydrophobicContact CB-CB 4.42Å; M675-H730 HydrophobicContact CE-CB 3.84Å; M675-H730 PolarHBondContact N-O 3.37Å; M675-H730 PolarHBondContact O-N 3.09Å; M699-H730 WeakPolarHBondContact CE-CD2 3.07Å; H730-P747 HydrophobicContact CB-CB 4.12Å; H730-V748 CarbonylContact C-O 3.52Å; H730-V748 WeakPolarHBondContact CA-O 3.47Å; H730-S749 PolarHBondContact CE1-OG 2.95Å; H730-S749 PolarHBondContact ND1-OG 3.11Å
731	V	88.6	Confident	76.3	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	121.6	175.3	-174.5	0	0	0	0	109.3	P621 V624 I636 W638 V674 V729 P747 V748	P621-V731 HydrophobicContact CG-CB 4.21Å; P621-V731 HydrophobicContact CG-CG1 3.92Å; V624-V731 HydrophobicContact CG1-CG2 3.96Å; V624-V731 HydrophobicContact CG2-CB 4.4Å; V624-V731 HydrophobicContact CG2-CG2 4.44Å; I636-V731 HydrophobicContact CG2-CG2 4.27Å; W638-V731 HydrophobicContact CD2-CG1 3.72Å; W638-V731 HydrophobicContact CE3-CG1 3.92Å; W638-V731 HydrophobicContact CE3-CG2 4.06Å; W638-V731 HydrophobicContact CG-CG1 4.1Å; W638-V731 HydrophobicContact CZ2-CG1 4.39Å; W638-V731 HydrophobicContact CZ3-CG1 4.35Å; W638-V731 HydrophobicContact CZ3-CG2 4.3Å; V674-V731 HydrophobicContact CG1-CG2 4.33Å; V674-V731 HydrophobicContact CG2-CG1 4.33Å; V674-V731 HydrophobicContact CG2-CG2 4.36Å; V729-V731 HydrophobicContact CG1-CG2 4.37Å; V731-P747 WeakPolarHBondContact O-CA 3.47Å; V731-V748 PolarHBondContact N-O 3.2Å; V731-V748 PolarHBondContact O-N 2.83Å
732	Q	83.5	Confident	75	Confident	21 Å²	21	43.5 Å²	43.5	10%	0.098	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	111.2	-173.7	-163.5	-171.3	18.3	0	0	111.2	R673 E744 S745 P747	R673-Q732 HydrophobicContact CB-CB 4.39Å; R673-Q732 PolarHBondContact N-O 3.39Å; R673-Q732 VanDerWaalsContact NH1-OE1 3.13Å; R673-Q732 PolarHBondContact O-N 2.97Å; Q732-E744 PolarHBondContact NE2-OE2 3.45Å; Q732-S745 WeakPolarHBondContact CG-O 3.48Å; Q732-S745 PolarHBondContact NE2-O 3.35Å; Q732-P747 HydrophobicContact CB-CB 4.2Å; Q732-P747 HydrophobicContact CG-CB 4.36Å
733	P	82.6	Confident	74	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	133.4	168.5	-25.4	27.5	0	0	0	112.8	P621 P641 K671 Y672 F735 S745	P621-P733 HydrophobicContact CB-CG 4.15Å; P621-P733 HydrophobicContact CG-CG 4.02Å; P641-P733 HydrophobicContact CG-CB 4.4Å; P641-P733 HydrophobicContact CG-CG 3.87Å; K671-P733 WeakPolarHBondContact O-CA 3.37Å; Y672-P733 HydrophobicContact CD1-CB 4.24Å; Y672-P733 HydrophobicContact CD1-CG 4.02Å; Y672-P733 HydrophobicContact CE1-CB 4.2Å; Y672-P733 HydrophobicContact CE1-CG 3.92Å; P733-F735 HydrophobicContact CB-CD2 4.16Å; P733-F735 HydrophobicContact CB-CE2 3.46Å; P733-F735 VanDerWaalsContact CB-CE2 3.46Å; P733-F735 HydrophobicContact CB-CZ 4.32Å; P733-S745 WeakPolarHBondContact CB-OG 3.25Å; P733-S745 WeakPolarHBondContact CD-OG 3.2Å; P733-S745 WeakPolarHBondContact CG-OG 3.17Å; P733-S745 PolarHBondContact O-N 3.43Å; P733-S745 VanDerWaalsContact O-N 3.15Å; P733-S745 PolarHBondContact O-OG 2.96Å
734	L	74.5	Confident	73.2	Confident	6 Å²	6	43.5 Å²	43.5	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	120.8	173.7	-54.8	178.3	0	0	0	108.4	T670 K671 R673 V708 R743 E744	T670-L734 CarbonylContact C-O 3.51Å; T670-L734 WeakPolarHBondContact CA-O 3.49Å; K671-L734 HydrophobicContact CB-CB 4.24Å; K671-L734 PolarHBondContact N-O 2.66Å; K671-L734 PolarHBondContact O-N 3.01Å; R673-L734 HydrophobicContact CB-CD1 4.04Å; R673-L734 HydrophobicContact CB-CD2 4.42Å; R673-L734 HydrophobicContact CB-CG 4.22Å; V708-L734 HydrophobicContact CG1-CD1 4.25Å; L734-R743 CarbonylContact C-O 3.49Å; L734-R743 WeakPolarHBondContact CA-O 3.34Å; L734-E744 HydrophobicContact CD2-CB 4.1Å; L734-E744 HydrophobicContact CD2-CG 3.63Å
735	F	70.3	Confident	72.9	Confident	36 Å²	36	39.8 Å²	39.8	16%	0.158	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	119.8	-179.6	-71.6	-102.7	0	0	0	109	P618 P641 T643 T670 P733 Q742 R743	P618-F735 HydrophobicContact CB-CD1 4.27Å; P618-F735 HydrophobicContact CB-CD2 3.11Å; P618-F735 HydrophobicContact CB-CE1 4.19Å; P618-F735 HydrophobicContact CB-CE2 3.01Å; P618-F735 HydrophobicContact CB-CG 3.76Å; P618-F735 HydrophobicContact CB-CZ 3.58Å; P618-F735 HydrophobicContact CG-CB 4.29Å; P618-F735 HydrophobicContact CG-CD2 3.15Å; P618-F735 HydrophobicContact CG-CE2 3.57Å; P618-F735 HydrophobicContact CG-CG 3.86Å; P641-F735 HydrophobicContact CG-CZ 4.42Å; T643-F735 HydrophobicContact CG2-CE1 3.96Å; T670-F735 HydrophobicContact CG2-CD1 4.21Å; T670-F735 HydrophobicContact CG2-CD2 4.31Å; T670-F735 HydrophobicContact CG2-CE1 3.88Å; T670-F735 HydrophobicContact CG2-CE2 3.99Å; T670-F735 HydrophobicContact CG2-CG 4.44Å; T670-F735 HydrophobicContact CG2-CZ 3.8Å; T670-F735 WeakPolarHBondContact OG1-CD1 3.18Å; T670-F735 WeakPolarHBondContact OG1-CE1 3.28Å; P733-F735 HydrophobicContact CB-CD2 4.16Å; P733-F735 HydrophobicContact CB-CE2 3.46Å; P733-F735 VanDerWaalsContact CB-CE2 3.46Å; P733-F735 HydrophobicContact CB-CZ 4.32Å; F735-Q742 CarbonylContact O-C 3.6Å; F735-Q742 WeakPolarHBondContact O-CA 3.28Å; F735-R743 HydrophobicContact CB-CB 4.44Å; F735-R743 PolarHBondContact N-O 3.44Å; F735-R743 PolarHBondContact O-N 3.49Å
736	I	66.9	Low	72.1	Confident	42 Å²	42	41.3 Å²	41.3	22%	0.215	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	108.7	175.1	-54.5	169.3	0	0	0	106.2	S669 K671 M741	S669-I736 PolarHBondContact N-O 3.49Å; S669-I736 VanDerWaalsContact N-O 3.14Å; S669-I736 PolarHBondContact O-N 3.27Å; K671-I736 HydrophobicContact CD-CD1 4.09Å; K671-I736 HydrophobicContact CG-CD1 4.48Å; I736-M741 WeakPolarHBondContact CA-O 3.31Å
737	S	57.5	Low	71.7	Confident	26 Å²	26	42.7 Å²	42.7	18%	0.182	22%	0.218	C	C	.	.			trans	-74.8	163.5	173.4	45.3	0	0	0	0	111.2	N739 G740 M741	S737-N739 WeakPolarHBondContact CB-OD1 2.98Å; S737-N739 PolarHBondContact O-N 3.17Å; S737-N739 PolarHBondContact OG-OD1 3.07Å; S737-G740 PolarHBondContact O-N 3.06Å; S737-M741 PolarHBondContact N-O 3.12Å; S737-M741 WeakPolarHBondContact OG-CB 3.2Å; S737-M741 PolarHBondContact OG-O 3.36Å
738	Y	52.2	Low	71.4	Confident	170 Å²	170	44 Å²	44	67%	0.667	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-24.1	179.7	68.3	-89	0	0	0	115.3
739	N	49.2	Very low	71.2	Confident	68 Å²	68	46.1 Å²	46.1	36%	0.364	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	9.2	178.2	62.4	-2.3	0	0	0	113.8	S737 M741	S737-N739 WeakPolarHBondContact CB-OD1 2.98Å; S737-N739 PolarHBondContact O-N 3.17Å; S737-N739 PolarHBondContact OG-OD1 3.07Å; N739-M741 VanDerWaalsContact C-N 3.26Å; N739-M741 PolarHBondContact O-N 3.46Å; N739-M741 WeakPolarHBondContact OD1-CB 3.18Å; N739-M741 WeakPolarHBondContact OD1-CG 3.15Å; N739-M741 PolarHBondContact OD1-N 3.29Å
740	G	53.8	Low	71	Confident	56 Å²	56	47.5 Å²	47.5	58%	0.577	25%	0.251	S	S	*	.	S	Bend	trans	78.9	1.1	-179.1	0	0	0	0	0	114.8	S737 Q742	S737-G740 PolarHBondContact O-N 3.06Å; G740-Q742 PolarHBondContact O-N 3.18Å
741	M	48	Very low	71.2	Confident	69 Å²	69	48.4 Å²	48.4	34%	0.34	25%	0.253	S	S	.	.			trans	-69	120.2	174.6	-68.7	-104.6	-52.7	0	0	110.4	L612 I736 S737 N739	L612-M741 HydrophobicContact CD1-CE 3.59Å; L612-M741 HydrophobicContact CD1-CG 3.94Å; L612-M741 HydrophobicContact CD1-SD 3.31Å; L612-M741 WeakPolarHBondContact CD1-SD 3.4Å; L612-M741 HydrophobicContact CD2-CE 3.22Å; L612-M741 HydrophobicContact CD2-CG 4.07Å; L612-M741 HydrophobicContact CD2-SD 3.97Å; L612-M741 HydrophobicContact CG-CE 3.99Å; L612-M741 HydrophobicContact CG-SD 4.23Å; I736-M741 WeakPolarHBondContact CA-O 3.31Å; S737-M741 PolarHBondContact N-O 3.12Å; S737-M741 WeakPolarHBondContact OG-CB 3.2Å; S737-M741 PolarHBondContact OG-O 3.36Å; N739-M741 VanDerWaalsContact C-N 3.26Å; N739-M741 PolarHBondContact O-N 3.46Å; N739-M741 WeakPolarHBondContact OD1-CB 3.18Å; N739-M741 WeakPolarHBondContact OD1-CG 3.15Å; N739-M741 PolarHBondContact OD1-N 3.29Å
742	Q	61.6	Low	71.3	Confident	100 Å²	100	49.2 Å²	49.2	47%	0.467	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	128.2	171	-175.2	174.2	-39.1	0	0	109.5	F735 G740 E744	F735-Q742 CarbonylContact O-C 3.6Å; F735-Q742 WeakPolarHBondContact O-CA 3.28Å; G740-Q742 PolarHBondContact O-N 3.18Å; Q742-E744 PolarHBondContact NE2-OE1 3.33Å
743	R	63.7	Low	71.5	Confident	57 Å²	57	50.7 Å²	50.7	22%	0.215	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	137.6	173.8	-68	-173.5	176.8	152.6	-2.1	110	L612 P613 L615 P618 L734 F735	L612-R743 VanDerWaalsContact CD2-NH2 3.3Å; P613-R743 PolarHBondContact O-NH2 3.06Å; L615-R743 VanDerWaalsContact O-CZ 3.28Å; L615-R743 PolarHBondContact O-NH1 2.8Å; P618-R743 HydrophobicContact CG-CB 4.36Å; L734-R743 CarbonylContact C-O 3.49Å; L734-R743 WeakPolarHBondContact CA-O 3.34Å; F735-R743 HydrophobicContact CB-CB 4.44Å; F735-R743 PolarHBondContact N-O 3.44Å; F735-R743 PolarHBondContact O-N 3.49Å
744	E	69.7	Low	71.8	Confident	75 Å²	75	50.9 Å²	50.9	35%	0.35	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	147.2	-178.6	-42.2	-163.4	156.9	0	0	109.6	R673 Q732 L734 Q742	R673-E744 IonicContact CZ-OE1 3.83Å; R673-E744 IonicContact CZ-OE2 3.02Å; R673-E744 VanDerWaalsContact NH1-CD 3.3Å; R673-E744 IonicContact NH1-OE1 3.93Å; R673-E744 PolarHBondContact NH1-OE1 2.85Å; R673-E744 VanDerWaalsContact NH1-OE1 3.14Å; R673-E744 IonicContact NH1-OE2 3.66Å; R673-E744 PolarHBondContact NH1-OE2 3.49Å; R673-E744 IonicContact NH2-OE1 3.96Å; R673-E744 PolarHBondContact NH2-OE1 2.59Å; R673-E744 IonicContact NH2-OE2 3.33Å; Q732-E744 PolarHBondContact NE2-OE2 3.45Å; L734-E744 HydrophobicContact CD2-CB 4.1Å; L734-E744 HydrophobicContact CD2-CG 3.63Å; Q742-E744 PolarHBondContact NE2-OE1 3.33Å
745	S	74.2	Confident	72.3	Confident	4 Å²	4	52.9 Å²	52.9	3%	0.028	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-96.9	171.1	171.2	55.3	0	0	0	0	110.3	P618 Q732 P733	P618-S745 WeakPolarHBondContact O-CB 3.22Å; Q732-S745 WeakPolarHBondContact CG-O 3.48Å; Q732-S745 PolarHBondContact NE2-O 3.35Å; P733-S745 WeakPolarHBondContact CB-OG 3.25Å; P733-S745 WeakPolarHBondContact CD-OG 3.2Å; P733-S745 WeakPolarHBondContact CG-OG 3.17Å; P733-S745 PolarHBondContact O-N 3.43Å; P733-S745 VanDerWaalsContact O-N 3.15Å; P733-S745 PolarHBondContact O-OG 2.96Å
746	D	68.4	Low	72.2	Confident	64 Å²	64	52.2 Å²	52.2	34%	0.342	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-61.8	136.9	168	-76.7	-5.9	0	0	0	110.5	R102	R102-D746 IonicContact CZ-OD2 3.34Å; R102-D746 IonicContact NH1-OD2 2.87Å; R102-D746 IonicContact NH2-OD2 3.33Å; R102-D746 PolarHBondContact NH2-OD2 3.2Å
747	P	80	Confident	71.7	Confident	45 Å²	45	54.9 Å²	54.9	29%	0.292	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-70	143.8	176.1	29.1	-33.7	0	0	0	110.9	H730 V731 Q732	H730-P747 HydrophobicContact CB-CB 4.12Å; V731-P747 WeakPolarHBondContact O-CA 3.47Å; Q732-P747 HydrophobicContact CB-CB 4.2Å; Q732-P747 HydrophobicContact CG-CB 4.36Å
748	V	85.1	Confident	71.3	Confident	43 Å²	43	61.1 Å²	61.1	26%	0.261	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	128.5	168.4	174.2	0	0	0	0	109.2	P620 P621 V624 H730 V731	P620-V748 HydrophobicContact CB-CG2 3.74Å; P621-V748 HydrophobicContact CG-CB 4.2Å; P621-V748 HydrophobicContact CG-CG2 4.13Å; V624-V748 HydrophobicContact CB-CG1 4.06Å; V624-V748 HydrophobicContact CG2-CB 3.94Å; V624-V748 HydrophobicContact CG2-CG1 3.49Å; V624-V748 VanDerWaalsContact CG2-CG1 3.49Å; H730-V748 CarbonylContact C-O 3.52Å; H730-V748 WeakPolarHBondContact CA-O 3.47Å; V731-V748 PolarHBondContact N-O 3.2Å; V731-V748 PolarHBondContact O-N 2.83Å
749	S	85.7	Confident	71	Confident	46 Å²	46	58.6 Å²	58.6	32%	0.322	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	145.4	-176.7	-49.1	0	0	0	0	111.4	V729 H730	V729-S749 CarbonylContact O-C 3.5Å; V729-S749 VanDerWaalsContact O-CA 3.27Å; V729-S749 WeakPolarHBondContact O-CA 3.44Å; H730-S749 PolarHBondContact CE1-OG 2.95Å; H730-S749 PolarHBondContact ND1-OG 3.11Å
750	V	89.5	Confident	70.5	Confident	29 Å²	29	58.8 Å²	58.8	18%	0.176	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	144.7	162.5	66.7	0	0	0	0	108.7	V624 V626 V729	V624-V750 HydrophobicContact CG1-CB 4.23Å; V624-V750 HydrophobicContact CG1-CG1 3.78Å; V626-V750 HydrophobicContact CG2-CB 4.36Å; V626-V750 HydrophobicContact CG2-CG1 3.72Å; V626-V750 HydrophobicContact CG2-CG2 3.65Å; V729-V750 HydrophobicContact CB-CG1 3.93Å; V729-V750 PolarHBondContact N-O 2.89Å; V729-V750 PolarHBondContact O-N 3.23Å
751	Y	89.9	Confident	69.7	Low	59 Å²	59	65.4 Å²	65.4	23%	0.231	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	147.7	177.1	48.7	-91.7	0	0	0	111.4	D691 P697 L726 Y727	D691-Y751 WeakPolarHBondContact OD2-CE1 3.28Å; P697-Y751 HydrophobicContact CG-CD1 3.79Å; P697-Y751 HydrophobicContact CG-CD2 4.42Å; P697-Y751 HydrophobicContact CG-CE1 4.26Å; P697-Y751 HydrophobicContact CG-CG 3.88Å; L726-Y751 HydrophobicContact CD1-CD2 4.47Å; Y727-Y751 CarbonylContact O-C 3.57Å; Y727-Y751 WeakPolarHBondContact O-CA 3.31Å; Y727-Y751 WeakPolarHBondContact O-CB 3.31Å
752	F	90.2	Very high	69.1	Low	18 Å²	18	66.3 Å²	66.3	8%	0.079	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	152	-178.3	66.8	-83	0	0	0	111.5	V626 Y634 I636 L721 Y727 V729 T754	V626-F752 HydrophobicContact CB-CD1 4.3Å; V626-F752 HydrophobicContact CB-CG 4.46Å; V626-F752 HydrophobicContact CG1-CB 4.23Å; V626-F752 HydrophobicContact CG1-CD1 3.72Å; V626-F752 HydrophobicContact CG1-CD2 4.02Å; V626-F752 HydrophobicContact CG1-CE1 3.99Å; V626-F752 HydrophobicContact CG1-CE2 4.29Å; V626-F752 HydrophobicContact CG1-CG 3.72Å; V626-F752 HydrophobicContact CG1-CZ 4.27Å; V626-F752 HydrophobicContact CG2-CB 4.4Å; V626-F752 HydrophobicContact CG2-CD1 3.67Å; V626-F752 HydrophobicContact CG2-CE1 4.24Å; V626-F752 HydrophobicContact CG2-CG 4.23Å; Y634-F752 AromaticContact CD1-CD2 3.73Å; Y634-F752 HydrophobicContact CD1-CD2 3.73Å; Y634-F752 AromaticContact CD1-CE2 3.41Å; Y634-F752 HydrophobicContact CD1-CE2 3.41Å; Y634-F752 VanDerWaalsContact CD1-CE2 3.41Å; Y634-F752 HydrophobicContact CD1-CZ 4.19Å; Y634-F752 AromaticContact CD2-CE2 3.8Å; Y634-F752 HydrophobicContact CD2-CE2 3.8Å; Y634-F752 HydrophobicContact CD2-CZ 4.45Å; Y634-F752 AromaticContact CE1-CD2 3.78Å; Y634-F752 HydrophobicContact CE1-CD2 3.78Å; Y634-F752 AromaticContact CE1-CE2 3.76Å; Y634-F752 HydrophobicContact CE1-CE2 3.76Å; Y634-F752 HydrophobicContact CE2-CE2 4.14Å; Y634-F752 HydrophobicContact CG-CD2 4.23Å; Y634-F752 AromaticContact CG-CE2 3.43Å; Y634-F752 HydrophobicContact CG-CE2 3.43Å; Y634-F752 VanDerWaalsContact CG-CE2 3.43Å; Y634-F752 AromaticContact CG-CZ 3.94Å; Y634-F752 HydrophobicContact CG-CZ 3.94Å; I636-F752 HydrophobicContact CD1-CE1 3.99Å; L721-F752 HydrophobicContact CD1-CE2 3.89Å; L721-F752 HydrophobicContact CD1-CZ 3.61Å; Y727-F752 PolarHBondContact N-O 2.95Å; Y727-F752 PolarHBondContact O-N 2.53Å; V729-F752 HydrophobicContact CG2-CD1 4.49Å; V729-F752 HydrophobicContact CG2-CE1 3.75Å; F752-T754 HydrophobicContact CE2-CG2 4.07Å
753	T	88.3	Confident	67.8	Low	52 Å²	52	66.6 Å²	66.6	32%	0.319	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	127.7	175.7	-64.4	0	0	0	0	110.9	E686 L726	E686-T753 PolarHBondContact OE2-OG1 3.03Å; L726-T753 VanDerWaalsContact CD1-OG1 3.3Å; L726-T753 WeakPolarHBondContact CD1-OG1 3.41Å
754	T	88.5	Confident	66.4	Low	3 Å²	3	74.6 Å²	74.6	2%	0.018	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-72.1	150.6	176.6	57.1	0	0	0	0	111.9	Y634 L721 K722 P723 N724 T725 Y727 F752	Y634-T754 HydrophobicContact CD2-CG2 4.44Å; Y634-T754 HydrophobicContact CE2-CG2 3.84Å; Y634-T754 VanDerWaalsContact OH-CA 3.27Å; Y634-T754 WeakPolarHBondContact OH-CA 3.25Å; L721-T754 HydrophobicContact CB-CG2 3.82Å; L721-T754 HydrophobicContact CD1-CG2 4.11Å; K722-T754 WeakPolarHBondContact O-CB 3.38Å; K722-T754 WeakPolarHBondContact O-CG2 3.48Å; K722-T754 PolarHBondContact O-OG1 3.33Å; P723-T754 VanDerWaalsContact C-OG1 3.27Å; N724-T754 WeakPolarHBondContact CA-O 3.33Å; N724-T754 PolarHBondContact N-O 2.87Å; N724-T754 PolarHBondContact N-OG1 3.1Å; T725-T754 PolarHBondContact N-OG1 3.38Å; T725-T754 PolarHBondContact O-N 3.18Å; T725-T754 VanDerWaalsContact O-N 3.08Å; T725-T754 PolarHBondContact O-OG1 3.45Å; Y727-T754 HydrophobicContact CD2-CG2 3.73Å; Y727-T754 HydrophobicContact CE2-CG2 3.9Å; F752-T754 HydrophobicContact CE2-CG2 4.07Å
755	I	85.4	Confident	64.6	Low	48 Å²	48	75.8 Å²	75.8	25%	0.246	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-64.5	160	179.6	60.4	169.6	0	0	0	114.2	S631 Y634 P723 N724 M760	S631-I755 VanDerWaalsContact O-CD1 3.23Å; S631-I755 WeakPolarHBondContact O-CD1 3.12Å; S631-I755 WeakPolarHBondContact O-CG1 3.14Å; Y634-I755 PolarHBondContact OH-N 2.98Å; P723-I755 WeakPolarHBondContact CA-O 3.27Å; P723-I755 WeakPolarHBondContact CB-O 3.48Å; N724-I755 PolarHBondContact N-O 3.18Å; N724-I755 VanDerWaalsContact N-O 3.12Å; I755-M760 HydrophobicContact CD1-CE 4.13Å
756	C	68.9	Low	62.3	Low	23 Å²	23	78.8 Å²	78.8	16%	0.155	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-88.2	137.3	175.7	-74.6	0	0	0	0	112.1	N724 K758 Q759	N724-C756 VanDerWaalsContact CG-SG 3.56Å; N724-C756 PolarHBondContact OD1-SG 2.78Å; C756-K758 PolarHBondContact O-N 3.11Å; C756-Q759 PolarHBondContact O-N 2.97Å
757	D	56	Low	60.3	Low	97 Å²	97	85 Å²	85	52%	0.519	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-52.5	-27.8	176.7	-89	-19.2	0	0	0	114.6	Q759 M760	D757-Q759 PolarHBondContact O-N 3.38Å; D757-M760 WeakPolarHBondContact O-CB 3.07Å; D757-M760 PolarHBondContact O-N 3.33Å
758	K	49.1	Very low	57.8	Low	157 Å²	157	93.5 Å²	93.5	68%	0.683	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-74.1	-22.5	-176.3	-73.7	-175.7	179.7	176.3	0	114.4	C756 M760	C756-K758 PolarHBondContact O-N 3.11Å; K758-M760 PolarHBondContact O-N 3.06Å
759	Q	45.8	Very low	55	Low	118 Å²	118	102.6 Å²	102.6	55%	0.551	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-70.9	-16.3	173.9	-76.5	-172.2	-8.8	0	0	112.5	C756 D757 K761 S762	C756-Q759 PolarHBondContact O-N 2.97Å; D757-Q759 PolarHBondContact O-N 3.38Å; Q759-K761 VanDerWaalsContact C-N 3.31Å; Q759-K761 PolarHBondContact O-N 3.13Å; Q759-S762 PolarHBondContact O-N 3.38Å; Q759-S762 PolarHBondContact O-OG 3.36Å
760	M	39.8	Very low	52.2	Low	72 Å²	72	105.6 Å²	105.6	36%	0.355	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-70.7	-23.1	-180	-62.8	-170.4	173.7	0	0	113.8	S631 I755 D757 K758	S631-M760 VanDerWaalsContact CA-CE 3.47Å; I755-M760 HydrophobicContact CD1-CE 4.13Å; D757-M760 WeakPolarHBondContact O-CB 3.07Å; D757-M760 PolarHBondContact O-N 3.33Å; K758-M760 PolarHBondContact O-N 3.06Å
761	K	36.4	Very low	49.2	Very low	195 Å²	195	115.2 Å²	115.2	85%	0.848	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-81.7	-16.5	-179.8	-73.6	-173.3	177.9	-178.8	0	114	Q759	Q759-K761 VanDerWaalsContact C-N 3.31Å; Q759-K761 PolarHBondContact O-N 3.13Å
762	S	36	Very low	46.2	Very low	88 Å²	88	120 Å²	120	62%	0.615	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	-12	-179	60.7	0	0	0	0	114.6	Q759	Q759-S762 PolarHBondContact O-N 3.38Å; Q759-S762 PolarHBondContact O-OG 3.36Å
763	S	32.7	Very low	43.2	Very low	105 Å²	105	129.2 Å²	129.2	73%	0.734	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-1.4	-175.5	-159.9	0	0	0	0	115.1
764	Y	35.4	Very low	40.3	Very low	225 Å²	225	131 Å²	131	88%	0.882	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	8	177.3	-99.1	-87.3	0	0	0	114.4
765	S	31.2	Very low	37.5	Very low	101 Å²	101	135.9 Å²	135.9	71%	0.706	69%	0.689	S	S	*	*	S	Bend	trans	-115	115	175.2	168.5	0	0	0	0	109.4
766	G	25.7	Very low	35	Very low	66 Å²	66	138.3 Å²	138.3	68%	0.68	71%	0.708	S	S	*	*			trans	-62.1	160.6	-172.8	0	0	0	0	0	116.1
767	K	26.5	Very low	33.2	Very low	195 Å²	195	139.7 Å²	139.7	85%	0.848	72%	0.717	S	S	*	*			trans	44.9	104.4	156.7	-65.2	179.2	178.7	175.4	0	116.5
768	Y	28.8	Very low	32	Very low	223 Å²	223	139.8 Å²	139.8	88%	0.875	72%	0.723	S	S	*	*				172.5	150.3	114.1	-110.8	-99.2	0	0	0	111.7
769	R	25.6	Very low	31.2	Very low	234 Å²	234	134.9 Å²	134.9	88%	0.883	71%	0.712	S	S	*	*			trans	-44.8	140.3	173.8	-71	168.8	165.6	174.8	-5	113.8
770	S	27.2	Very low	30.5	Very low	109 Å²	109	132.7 Å²	132.7	76%	0.762	71%	0.714	S	S	*	*				165.5	143.1	107.3	-173.6	0	0	0	0	110.8	N772	S770-N772 PolarHBondContact O-N 3.03Å
771	R	26.2	Very low	30	Very low	231 Å²	231	130.6 Å²	130.6	87%	0.872	71%	0.705	S	S	*	*			trans	-43.9	126	169.3	-63.9	168	179.7	168.1	-2	110.5
772	N	27.2	Very low	29.6	Very low	160 Å²	160	129.1 Å²	129.1	86%	0.856	70%	0.699	S	S	*	*			trans	-164.1	136.6	149	-90	-27.4	0	0	0	109.8	S770 A774	S770-N772 PolarHBondContact O-N 3.03Å; N772-A774 PolarHBondContact O-N 3.11Å
773	F	26.8	Very low	29.4	Very low	212 Å²	212	127.8 Å²	127.8	93%	0.93	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-50.9	123	179.4	-80.7	-103.6	0	0	0	111.4
774	A	26.8	Very low	29.1	Very low	89 Å²	89	127.8 Å²	127.8	74%	0.736	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-79.1	124.2	172.4	0	0	0	0	0	109.6	N772	N772-A774 PolarHBondContact O-N 3.11Å
775	S	29.2	Very low	28.8	Very low	105 Å²	105	120.8 Å²	120.8	73%	0.734	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-65.4	149.4	172.9	30.7	0	0	0	0	111.8
776	P	34.4	Very low	28.8	Very low	99 Å²	99	123.7 Å²	123.7	64%	0.643	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-69.1	136.8	177.2	4.6	8.5	0	0	0	109.9
777	C	30.8	Very low	29	Very low	52 Å²	52	130.3 Å²	130.3	35%	0.351	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-64.2	139.2	172.7	-76	0	0	0	0	110	A779	C777-A779 PolarHBondContact O-N 3.15Å
778	P	31	Very low	29.2	Very low	99 Å²	99	129.3 Å²	129.3	64%	0.643	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-63.9	131.9	174.2	26.2	-31.3	0	0	0	109.4	A780	P778-A780 PolarHBondContact O-N 2.91Å
779	A	32	Very low	29.2	Very low	55 Å²	55	125.2 Å²	125.2	46%	0.455	67%	0.665	S	S	.	*			trans	-52.3	111.6	178.9	0	0	0	0	0	110.5	C777 V781	C777-A779 PolarHBondContact O-N 3.15Å; A779-V781 PolarHBondContact O-N 3.36Å
780	A	31	Very low	29.4	Very low	71 Å²	71	120.8 Å²	120.8	59%	0.587	66%	0.657	S	S	*	*			trans	-81.8	112.6	168.8	0	0	0	0	0	107.9	P778 F782	P778-A780 PolarHBondContact O-N 2.91Å; A780-F782 HydrophobicContact CB-CD2 4.06Å; A780-F782 HydrophobicContact CB-CE2 4.15Å; A780-F782 PolarHBondContact O-N 2.7Å; A780-F782 VanDerWaalsContact O-N 3.1Å
781	V	28.7	Very low	29.5	Very low	29 Å²	29	125.1 Å²	125.1	18%	0.176	66%	0.663	C	S	.	*			trans	-57	107.9	170.2	178.6	0	0	0	0	108.5	P285 Q351 A779	P285-V781 HydrophobicContact CG-CG2 4.16Å; Q351-V781 PolarHBondContact NE2-O 2.93Å; Q351-V781 VanDerWaalsContact NE2-O 3.15Å; A779-V781 PolarHBondContact O-N 3.36Å
782	F	29.5	Very low	29.5	Very low	164 Å²	164	119 Å²	119	72%	0.719	66%	0.656	S	S	*	*			trans	-120.2	107.4	172.2	-95.3	-78.8	0	0	0	110.9	A780	A780-F782 HydrophobicContact CB-CD2 4.06Å; A780-F782 HydrophobicContact CB-CE2 4.15Å; A780-F782 PolarHBondContact O-N 2.7Å; A780-F782 VanDerWaalsContact O-N 3.1Å
783	T	30.1	Very low	29.7	Very low	60 Å²	60	119.1 Å²	119.1	37%	0.368	66%	0.655	S	S	.	*			trans	-78.6	146	171.2	43.1	0	0	0	0	112.2	V350 S352	V350-T783 PolarHBondContact O-OG1 2.75Å; S352-T783 WeakPolarHBondContact O-CG2 3.31Å
784	H	27.1	Very low	30.1	Very low	105 Å²	105	117.2 Å²	117.2	49%	0.486	65%	0.654	S	S	.	*			trans	-38.2	141.5	174.7	-93	-99	0	0	0	116.6	Q703	Q703-H784 VanDerWaalsContact CD-CE1 3.42Å; Q703-H784 WeakPolarHBondContact CG-CE1 3.28Å; Q703-H784 PolarHBondContact NE2-NE2 3.41Å
785	A	30.2	Very low	30.3	Very low	78 Å²	78	116 Å²	116	65%	0.645	65%	0.649	S	S	*	*			trans	-143.1	130.4	151.3	0	0	0	0	0	110.3
786	Q	29.5	Very low	30.6	Very low	162 Å²	162	118.3 Å²	118.3	76%	0.757	65%	0.652	S	S	*	*			trans	-76.5	157.3	-176.2	-62.8	167.1	-51.8	0	0	113.5
787	F	31.4	Very low	30.5	Very low	204 Å²	204	123.1 Å²	123.1	90%	0.895	66%	0.659	S	S	*	*			trans	-134	111.5	150.3	-87.6	-86.6	0	0	0	105.9
788	F	28.9	Very low	30.6	Very low	174 Å²	174	129.8 Å²	129.8	76%	0.763	68%	0.682	S	S	*	*				43	121.6	76.3	-84	-71.8	0	0	0	110.8
789	I	30	Very low	30.7	Very low	138 Å²	138	136.7 Å²	136.7	71%	0.708	71%	0.712	S	S	*	*			cis	-165.1	146.6	42.8	-60.6	-177.1	0	0	0	105.4
790	I	28.4	Very low	30.6	Very low	140 Å²	140	140.8 Å²	140.8	72%	0.718	73%	0.725	S	S	*	*				180	115.6	97.3	-73.7	154.4	0	0	0	107.8
791	F	30.1	Very low	30.6	Very low	201 Å²	201	144.4 Å²	144.4	88%	0.882	73%	0.732	S	S	*	*				-171.3	78.8	129.4	-104.2	-72.7	0	0	0	108
792	S	26.8	Very low	30.7	Very low	103 Å²	103	150.8 Å²	150.8	72%	0.72	76%	0.763	S	S	*	*			trans	-86.8	123.6	148.3	-56	0	0	0	0	106
793	L	32.1	Very low	30.8	Very low	161 Å²	161	150.1 Å²	150.1	84%	0.843	77%	0.766	S	S	*	*			trans	171.4	132.9	141.8	-91.3	158.5	0	0	0	109.9
794	L	33.7	Very low	30.8	Very low	173 Å²	173	155.7 Å²	155.7	91%	0.906	79%	0.791	S	S	*	*			trans	79.1	98.5	172.5	-59.9	150.3	0	0	0	114.4
795	G	31.8	Very low	31	Very low	62 Å²	62	159.1 Å²	159.1	64%	0.639	81%	0.811	S	S	*	*			cis	101.7	100.6	29.1	0	0	0	0	0	109.8
796	I	35	Very low	31.1	Very low	154 Å²	154	164.9 Å²	164.9	79%	0.79	82%	0.823	S	S	*	*			trans	54	107.1	136.4	-53	165.3	0	0	0	115.5
797	Y	32.8	Very low	31.2	Very low	201 Å²	201	165.1 Å²	165.1	79%	0.788	83%	0.828	S	S	*	*				-176.6	132.9	117.4	-107.5	-78.6	0	0	0	111.8
798	F	33.1	Very low	31.2	Very low	192 Å²	192	161.8 Å²	161.8	84%	0.842	82%	0.823	S	S	*	*			trans	86	79.7	169.2	-64.5	-76.5	0	0	0	119.9
799	L	32	Very low	31.4	Very low	243 Å²	243	160.7 Å²	160.7	100%	1.272	83%	0.828	S	S	*	*				-154.6	0	90.6	-118.2	159.6	0	0	0	110.5

Retrieved 799 of 799 residues in 154.8 ms (Link to these results)

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