A0A077ZDY5_TRITR Loading...

Peptidase A17 and DUF1759 and DUF1758 domain cont aining protein

AlphaFold DB , UniProt , Accession A0A077ZDY5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,299 aa.

						>A0A077ZDY5_TRITR|A0A077ZDY5
MERDIRALRVEARQYIEKSKEQTLSAKEVYNGGACAPALPKWDLPKFKGDVLLFTVFWDQFEAGVHSRSDLRTCLEGIAFDAIAGYSETAANYAAAVATLKSRFGRPNLIAEKHILELMQTEKCNRPTARELRQVHDTVARNVRALVALNKDPLNETLGRGAISSAQAETSSIVRKLWESKVLPEDQEELTLDAFVEFLQSQVEIEEAAVASEKEGCKNKRRTEPSELEQRRRKDWFSSAAALQATVHKRNMCSFCSGEHENATCQRFKNVGVKGRWKMVRENRACFLCLGSGHQMNECSKKVEGVQYHPMLVKKRRREKGQASEYRKVQVDLVGMPTKGRVLLQTARAVMRTMTGDRTVVISQRSFITEELANRMRLNGPLEYVEISTLGGQSKFCKRTRRVQFAFSALDSGEQRAAKQWRTANPLLQRRWKHLHGLKLADQFPRECSKIDVLIGLDYYYDFVSQEVRHGHAGEPVALRTLFGWIVCGTMGEGNKDPNEILRKLWDLEALGIRDAEEARRRQSTEAIRHYIESITFEGERYVVRLPWKTDAHHARLHIATYKRAAEEVLSNMFVDDFLSSCADSGEAEQLVDQLRKLMQLGGFNLTKWKCNSSSVAEAIGVTDVTVNNDRIVSKVLGVPWNLGQDALSFITPHGVISKSRETKRELLSAVAKIFDPMGFLAPFTIRAKIILQSLWQSGTGWDESIPDVLNAKWSRWKQDLHMLPQLLVQRTLIPVDINAVRSIELHAFADASEKAYGAVVYMKVVIVSANNFVDMVIAKSHLAPLKKITLPRRELIAALVAARLVCYVKREIEMTVDRVACWSDSKVALSWIRSPSKSWKPFVQKRVQEIQALVDSANWYHCAGKDNPADLLSRGTTIENLKSNSYWWHGPAWLKMPEGSWPKDDKMSELTDVHAQTVKQEGRKKIVGLLAEQSSDVQYALVLRYSSFERLLRITAWLFRFVKNCRLPKEMRNYGLISVEELLQAERQVQKEYFEDEINCIVKHKALRSSSKLLMFDPYLDEDGLLRVGGRLESASIQEAAKRQILLPHNHVVVDLLVRRCHERQLHADVQHTLAILRQRVWILRARSCVERNIRNCVVCKAQRTVPVEQKMSSLPVERVKVAFALENTGLDFAGPIYVRRRRTCEKAYICLFTCMTTRAIHLELVTDMTAARFVLALRRFFARRGRPAIIQSDNFKTFKSASRELQQLFSEDNSERFDEPPRTLEIYNRESTLDRWILGTVGEISERPTTKDSWRASLDEEETRTVLCNVDAMVSARLLTFVGDDPKDLAISRHLIF
					

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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	42	Very low	61.7	Low	178 Å²	178	134.3 Å²	134.3	88%	0.877	63%	0.627	S	S	*	*				0	-65.4	0	-147.6	179.7	-66.2	0	0	112.8	R3 D4 I5	M1-R3 VanDerWaalsContact C-N 3.31Å; M1-R3 PolarHBondContact O-N 2.96Å; M1-D4 WeakPolarHBondContact CA-OD2 3.06Å; M1-D4 PolarHBondContact N-OD2 2.96Å; M1-D4 WeakPolarHBondContact O-CB 3.5Å; M1-D4 PolarHBondContact O-N 3.43Å; M1-I5 WeakPolarHBondContact O-CG1 3.42Å; M1-I5 PolarHBondContact O-N 2.96Å
2	E	49	Very low	62	Low	158 Å²	158	127.3 Å²	127.3	74%	0.738	61%	0.609	S	S	*	*	H	α-helix	trans	-64.5	-35.7	179	-140	-177	-176.6	0	0	113	D4 I5 R6	E2-D4 VanDerWaalsContact C-N 3.34Å; E2-I5 PolarHBondContact O-N 2.72Å; E2-R6 PolarHBondContact O-N 3.27Å
3	R	55.3	Low	62.2	Low	224 Å²	224	131.4 Å²	131.4	85%	0.845	62%	0.615	S	S	*	*	H	α-helix	trans	-60.2	-40.6	169.4	-120.4	-179.8	-177	170.2	1	112.3	M1 R6 A7	M1-R3 VanDerWaalsContact C-N 3.31Å; M1-R3 PolarHBondContact O-N 2.96Å; R3-R6 PolarHBondContact O-N 3.19Å; R3-A7 WeakPolarHBondContact O-CB 3.02Å; R3-A7 PolarHBondContact O-N 3.48Å
4	D	62.7	Low	62.5	Low	99 Å²	99	130.4 Å²	130.4	53%	0.529	61%	0.611	S	S	.	*	H	α-helix	trans	-73.5	-36.1	-179.6	-48.3	-50.8	0	0	0	111.5	M1 E2 A7 L8	M1-D4 WeakPolarHBondContact CA-OD2 3.06Å; M1-D4 PolarHBondContact N-OD2 2.96Å; M1-D4 WeakPolarHBondContact O-CB 3.5Å; M1-D4 PolarHBondContact O-N 3.43Å; E2-D4 VanDerWaalsContact C-N 3.34Å; D4-A7 PolarHBondContact O-N 3.29Å; D4-L8 WeakPolarHBondContact O-CB 3.38Å; D4-L8 PolarHBondContact O-N 3.27Å
5	I	58.6	Low	62.2	Low	83 Å²	83	134.4 Å²	134.4	43%	0.426	62%	0.62	S	S	.	*	H	α-helix	trans	-66.9	-39.7	173.5	-66.7	169.2	0	0	0	110.6	M1 E2 R9	M1-I5 WeakPolarHBondContact O-CG1 3.42Å; M1-I5 PolarHBondContact O-N 2.96Å; E2-I5 PolarHBondContact O-N 2.72Å; I5-R9 WeakPolarHBondContact O-CB 3.35Å; I5-R9 WeakPolarHBondContact O-CG 3.24Å; I5-R9 PolarHBondContact O-N 2.83Å
6	R	63.4	Low	62.2	Low	186 Å²	186	131.9 Å²	131.9	70%	0.702	61%	0.611	S	S	*	*	H	α-helix	trans	-65.1	-43.2	172.1	-86.3	-175	177.5	176.3	1.6	111.6	E2 R3 R9 V10	E2-R6 PolarHBondContact O-N 3.27Å; R3-R6 PolarHBondContact O-N 3.19Å; R6-R9 PolarHBondContact O-N 3.18Å; R6-V10 WeakPolarHBondContact O-CG2 3.48Å; R6-V10 PolarHBondContact O-N 2.93Å
7	A	71.2	Confident	62.2	Low	57 Å²	57	131 Å²	131	47%	0.471	61%	0.607	S	S	.	*	H	α-helix	trans	-59.1	-48.9	175.6	0	0	0	0	0	111.1	R3 D4 R9 V10 E11	R3-A7 WeakPolarHBondContact O-CB 3.02Å; R3-A7 PolarHBondContact O-N 3.48Å; D4-A7 PolarHBondContact O-N 3.29Å; A7-R9 VanDerWaalsContact C-N 3.34Å; A7-R9 PolarHBondContact O-N 2.84Å; A7-V10 PolarHBondContact O-N 3.5Å; A7-V10 VanDerWaalsContact O-N 3.16Å; A7-E11 WeakPolarHBondContact O-CB 3.11Å; A7-E11 PolarHBondContact O-N 3.08Å
8	L	65.8	Low	61.4	Low	107 Å²	107	131.9 Å²	131.9	56%	0.56	61%	0.609	S	S	*	*	H	α-helix	trans	-61.6	-37.1	176	-85	159.7	0	0	0	113.2	D4 A12	D4-L8 WeakPolarHBondContact O-CB 3.38Å; D4-L8 PolarHBondContact O-N 3.27Å; L8-A12 WeakPolarHBondContact O-CB 3.39Å; L8-A12 PolarHBondContact O-N 3.13Å
9	R	64.3	Low	60.6	Low	178 Å²	178	127.9 Å²	127.9	67%	0.672	60%	0.598	S	S	*	*	H	α-helix	trans	-68.5	-37.3	175	-81.4	-177.9	175.7	177	0.8	112.3	I5 R6 A7 R13	I5-R9 WeakPolarHBondContact O-CB 3.35Å; I5-R9 WeakPolarHBondContact O-CG 3.24Å; I5-R9 PolarHBondContact O-N 2.83Å; R6-R9 PolarHBondContact O-N 3.18Å; A7-R9 VanDerWaalsContact C-N 3.34Å; A7-R9 PolarHBondContact O-N 2.84Å; R9-R13 WeakPolarHBondContact O-CB 3.37Å; R9-R13 WeakPolarHBondContact O-CG 3.3Å; R9-R13 PolarHBondContact O-N 2.95Å
10	V	75.6	Confident	59.7	Low	81 Å²	81	128 Å²	128	49%	0.491	60%	0.596	S	S	.	*	H	α-helix	trans	-69.3	-43.3	174.9	173.1	0	0	0	0	110.2	R6 A7 A12 R13 Q14	R6-V10 WeakPolarHBondContact O-CG2 3.48Å; R6-V10 PolarHBondContact O-N 2.93Å; A7-V10 PolarHBondContact O-N 3.5Å; A7-V10 VanDerWaalsContact O-N 3.16Å; V10-A12 PolarHBondContact O-N 3.3Å; V10-R13 PolarHBondContact O-N 3.17Å; V10-Q14 HydrophobicContact CG1-CG 4.47Å; V10-Q14 WeakPolarHBondContact O-CB 2.91Å; V10-Q14 WeakPolarHBondContact O-CG 3.29Å; V10-Q14 PolarHBondContact O-N 2.95Å
11	E	71	Confident	58.9	Low	126 Å²	126	128.7 Å²	128.7	59%	0.589	60%	0.599	S	S	*	*	H	α-helix	trans	-61.8	-44	176.1	-131.8	179.3	-174.6	0	0	111.4	A7 Q14 Y15	A7-E11 WeakPolarHBondContact O-CB 3.11Å; A7-E11 PolarHBondContact O-N 3.08Å; E11-Q14 PolarHBondContact O-N 2.99Å; E11-Y15 WeakPolarHBondContact O-CB 3.2Å; E11-Y15 PolarHBondContact O-N 3.07Å
12	A	65	Low	58.8	Low	50 Å²	50	127 Å²	127	41%	0.413	59%	0.59	S	S	.	*	H	α-helix	trans	-64.1	-40.4	175.6	0	0	0	0	0	112.1	L8 V10 Y15 I16	L8-A12 WeakPolarHBondContact O-CB 3.39Å; L8-A12 PolarHBondContact O-N 3.13Å; V10-A12 PolarHBondContact O-N 3.3Å; A12-Y15 PolarHBondContact O-N 2.76Å; A12-I16 WeakPolarHBondContact O-CD1 3.34Å; A12-I16 VanDerWaalsContact O-CG1 3.23Å; A12-I16 WeakPolarHBondContact O-CG1 3.14Å; A12-I16 PolarHBondContact O-N 3.21Å
13	R	64.4	Low	58.2	Low	181 Å²	181	124.1 Å²	124.1	68%	0.683	58%	0.582	S	S	*	*	H	α-helix	trans	-64.3	-46	174	-82.3	-176	-177.4	-179.3	-0.2	111.6	R9 V10 Y15 I16 E17	R9-R13 WeakPolarHBondContact O-CB 3.37Å; R9-R13 WeakPolarHBondContact O-CG 3.3Å; R9-R13 PolarHBondContact O-N 2.95Å; V10-R13 PolarHBondContact O-N 3.17Å; R13-Y15 VanDerWaalsContact C-N 3.26Å; R13-Y15 PolarHBondContact O-N 3.23Å; R13-I16 PolarHBondContact O-N 3.47Å; R13-I16 VanDerWaalsContact O-N 3.12Å; R13-E17 PolarHBondContact O-N 3.39Å
14	Q	66.2	Low	57.2	Low	118 Å²	118	120 Å²	120	55%	0.551	58%	0.576	S	S	*	*	H	α-helix	trans	-60.7	-35.9	176.2	-75.5	-179.4	-8.3	0	0	112.2	V10 E11 K18	V10-Q14 HydrophobicContact CG1-CG 4.47Å; V10-Q14 WeakPolarHBondContact O-CB 2.91Å; V10-Q14 WeakPolarHBondContact O-CG 3.29Å; V10-Q14 PolarHBondContact O-N 2.95Å; E11-Q14 PolarHBondContact O-N 2.99Å; Q14-K18 WeakPolarHBondContact O-CB 3.48Å; Q14-K18 PolarHBondContact O-N 3.16Å
15	Y	59.2	Low	55.9	Low	190 Å²	190	120.5 Å²	120.5	75%	0.745	59%	0.588	S	S	*	*	H	α-helix	trans	-67.9	-39.5	175.5	-145.4	-85.2	0	0	0	111.9	E11 A12 R13 S19	E11-Y15 WeakPolarHBondContact O-CB 3.2Å; E11-Y15 PolarHBondContact O-N 3.07Å; A12-Y15 PolarHBondContact O-N 2.76Å; R13-Y15 VanDerWaalsContact C-N 3.26Å; R13-Y15 PolarHBondContact O-N 3.23Å; Y15-S19 WeakPolarHBondContact O-CB 3.2Å; Y15-S19 PolarHBondContact O-N 3.18Å
16	I	61	Low	54.4	Low	95 Å²	95	120.1 Å²	120.1	49%	0.487	60%	0.597	S	S	.	*	H	α-helix	trans	-69	-42.6	176.6	-67.3	164.4	0	0	0	110.7	A12 R13 S19 K20	A12-I16 WeakPolarHBondContact O-CD1 3.34Å; A12-I16 VanDerWaalsContact O-CG1 3.23Å; A12-I16 WeakPolarHBondContact O-CG1 3.14Å; A12-I16 PolarHBondContact O-N 3.21Å; R13-I16 PolarHBondContact O-N 3.47Å; R13-I16 VanDerWaalsContact O-N 3.12Å; I16-S19 PolarHBondContact O-N 2.95Å; I16-S19 PolarHBondContact O-OG 3.3Å; I16-K20 PolarHBondContact O-N 3.34Å
17	E	62.8	Low	52.7	Low	116 Å²	116	119.6 Å²	119.6	54%	0.542	60%	0.6	S	S	.	*	H	α-helix	trans	-62	-48.2	175.5	-125	101	-135.2	0	0	110.6	R13 S19 K20 E21	R13-E17 PolarHBondContact O-N 3.39Å; E17-S19 VanDerWaalsContact C-N 3.3Å; E17-S19 PolarHBondContact O-N 2.71Å; E17-K20 WeakPolarHBondContact O-CB 3.49Å; E17-K20 PolarHBondContact O-N 3.49Å; E17-E21 PolarHBondContact O-N 3Å
18	K	48.1	Very low	50.4	Low	147 Å²	147	125.4 Å²	125.4	64%	0.639	62%	0.617	S	S	*	*	H	α-helix	trans	-60	-37.5	175.2	-90.4	-176.5	172.2	177	0	112.7	Q14 K20 Q22	Q14-K18 WeakPolarHBondContact O-CB 3.48Å; Q14-K18 PolarHBondContact O-N 3.16Å; K18-K20 VanDerWaalsContact C-N 3.3Å; K18-K20 PolarHBondContact O-N 3.29Å; K18-Q22 WeakPolarHBondContact O-CG 3.34Å; K18-Q22 PolarHBondContact O-N 3.28Å; K18-Q22 VanDerWaalsContact O-N 3.1Å
19	S	46.6	Very low	48.6	Very low	57 Å²	57	126.3 Å²	126.3	40%	0.399	63%	0.627	S	S	.	*	H	α-helix	trans	-68	-31.6	176.3	79.2	0	0	0	0	112.6	Y15 I16 E17 T23	Y15-S19 WeakPolarHBondContact O-CB 3.2Å; Y15-S19 PolarHBondContact O-N 3.18Å; I16-S19 PolarHBondContact O-N 2.95Å; I16-S19 PolarHBondContact O-OG 3.3Å; E17-S19 VanDerWaalsContact C-N 3.3Å; E17-S19 PolarHBondContact O-N 2.71Å; S19-T23 PolarHBondContact O-N 3.15Å; S19-T23 VanDerWaalsContact O-N 3.14Å; S19-T23 PolarHBondContact O-OG1 3.11Å
20	K	41.9	Very low	46.8	Very low	128 Å²	128	128.9 Å²	128.9	56%	0.557	64%	0.639	S	S	*	*	H	α-helix	trans	-74	-38.6	178.1	-80.7	-177.8	176.4	-178.7	0	112	I16 E17 K18 T23 L24	I16-K20 PolarHBondContact O-N 3.34Å; E17-K20 WeakPolarHBondContact O-CB 3.49Å; E17-K20 PolarHBondContact O-N 3.49Å; K18-K20 VanDerWaalsContact C-N 3.3Å; K18-K20 PolarHBondContact O-N 3.29Å; K20-T23 WeakPolarHBondContact CA-OG1 3.5Å; K20-T23 PolarHBondContact O-N 3.23Å; K20-T23 PolarHBondContact O-OG1 2.84Å; K20-L24 PolarHBondContact O-N 3.46Å
21	E	43.6	Very low	44.6	Very low	143 Å²	143	133.4 Å²	133.4	67%	0.668	66%	0.66	S	S	*	*	H	α-helix	trans	-68.5	-37.6	174.9	-72.8	-178.3	167.2	0	0	111.6	E17 T23 L24	E17-E21 PolarHBondContact O-N 3Å; E21-T23 VanDerWaalsContact C-N 3.31Å; E21-T23 PolarHBondContact O-N 3.01Å; E21-L24 PolarHBondContact O-N 2.98Å
22	Q	39.8	Very low	42.5	Very low	144 Å²	144	130.6 Å²	130.6	67%	0.673	66%	0.664	S	S	*	*	H	α-helix	trans	-71	-22	175.3	-73.6	-176.8	-12	0	0	113.9	K18	K18-Q22 WeakPolarHBondContact O-CG 3.34Å; K18-Q22 PolarHBondContact O-N 3.28Å; K18-Q22 VanDerWaalsContact O-N 3.1Å
23	T	35.7	Very low	40.9	Very low	96 Å²	96	132.1 Å²	132.1	59%	0.589	69%	0.685	S	S	*	*	H	α-helix	trans	-82	-15.1	174.8	17.4	0	0	0	0	113.7	S19 K20 E21	S19-T23 PolarHBondContact O-N 3.15Å; S19-T23 VanDerWaalsContact O-N 3.14Å; S19-T23 PolarHBondContact O-OG1 3.11Å; K20-T23 WeakPolarHBondContact CA-OG1 3.5Å; K20-T23 PolarHBondContact O-N 3.23Å; K20-T23 PolarHBondContact O-OG1 2.84Å; E21-T23 VanDerWaalsContact C-N 3.31Å; E21-T23 PolarHBondContact O-N 3.01Å
24	L	34.5	Very low	39.3	Very low	137 Å²	137	127.9 Å²	127.9	72%	0.717	69%	0.689	S	S	*	*	H	α-helix	trans	-85.7	-21.3	178	-80.3	160.8	0	0	0	113.5	K20 E21	K20-L24 PolarHBondContact O-N 3.46Å; E21-L24 PolarHBondContact O-N 2.98Å
25	S	34.3	Very low	37.8	Very low	110 Å²	110	128.6 Å²	128.6	77%	0.769	71%	0.706	S	S	*	*	S	Bend	trans	-100.1	5.4	-180	90.4	0	0	0	0	115.5
26	A	28	Very low	36.6	Very low	76 Å²	76	123.4 Å²	123.4	63%	0.628	70%	0.702	S	S	*	*			trans	-118.1	22.9	-179.1	0	0	0	0	0	113.3	E28	A26-E28 PolarHBondContact O-N 2.89Å; A26-E28 VanDerWaalsContact O-N 3.14Å
27	K	27	Very low	35.6	Very low	174 Å²	174	124 Å²	124	76%	0.757	71%	0.712	S	S	*	*			trans	-83.4	62.8	167.7	-80.3	-172.2	176.9	178.4	0	110.5
28	E	24.5	Very low	34.5	Very low	179 Å²	179	123.1 Å²	123.1	84%	0.836	73%	0.725	S	S	*	*	S	Bend	trans	-162.5	121.8	155.7	-110.2	161.3	-150.6	0	0	108.8	A26	A26-E28 PolarHBondContact O-N 2.89Å; A26-E28 VanDerWaalsContact O-N 3.14Å
29	V	27.9	Very low	34	Very low	126 Å²	126	123.4 Å²	123.4	76%	0.764	73%	0.732	S	S	*	*			trans	71.5	91.9	170.1	-163.5	0	0	0	0	116.2
30	Y	25.1	Very low	33.9	Very low	233 Å²	233	126.3 Å²	126.3	91%	0.914	75%	0.75	S	S	*	*			trans	-158.8	88.5	132.2	-105.7	-74.8	0	0	0	109.8
31	N	30	Very low	34.4	Very low	176 Å²	176	129.2 Å²	129.2	94%	0.941	76%	0.763	S	S	*	*			trans	-80.2	104.2	159.2	-88.6	-30.8	0	0	0	107.5
32	G	27.7	Very low	35	Very low	66 Å²	66	130.7 Å²	130.7	68%	0.68	76%	0.762	S	S	*	*			trans	-165	102.8	178.2	0	0	0	0	0	111	A34	G32-A34 PolarHBondContact O-N 3.25Å
33	G	30.2	Very low	36.4	Very low	83 Å²	83	130.2 Å²	130.2	86%	0.856	76%	0.764	S	S	*	*			trans	-64.9	120.1	-175.3	0	0	0	0	0	113.2
34	A	31.7	Very low	38.1	Very low	91 Å²	91	128.5 Å²	128.5	75%	0.752	75%	0.751	S	S	*	*			trans	-128.2	136.1	150	0	0	0	0	0	107.2	G32 A36	G32-A34 PolarHBondContact O-N 3.25Å; A34-A36 PolarHBondContact O-N 2.99Å
35	C	33.7	Very low	40.1	Very low	134 Å²	134	122.6 Å²	122.6	91%	0.905	72%	0.721	S	S	*	*			trans	-46	87.1	-176.4	-162.1	0	0	0	0	112.5
36	A	34.8	Very low	42.6	Very low	81 Å²	81	122.9 Å²	122.9	67%	0.669	71%	0.708	S	S	*	*			trans	-67.6	120.7	166.7	0	0	0	0	0	106.1	A34 A38	A34-A36 PolarHBondContact O-N 2.99Å; A36-A38 PolarHBondContact O-N 3.46Å
37	P	39.2	Very low	45.5	Very low	106 Å²	106	119.5 Å²	119.5	69%	0.688	68%	0.68	S	S	*	*			trans	-53.9	124.9	177.4	23	-30.9	0	0	0	106.7	L39	P37-L39 VanDerWaalsContact C-N 3.33Å; P37-L39 PolarHBondContact O-N 3.11Å
38	A	39.6	Very low	48.5	Very low	99 Å²	99	117.8 Å²	117.8	82%	0.818	67%	0.672	S	S	*	*			trans	-51.1	103.4	178.6	0	0	0	0	0	107.5	A36	A36-A38 PolarHBondContact O-N 3.46Å
39	L	37.5	Very low	51.4	Low	153 Å²	153	109.6 Å²	109.6	80%	0.801	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-58	131.6	176.2	-75.4	168.5	0	0	0	105.5	P37 K41	P37-L39 VanDerWaalsContact C-N 3.33Å; P37-L39 PolarHBondContact O-N 3.11Å; L39-K41 PolarHBondContact O-N 3.07Å; L39-K41 VanDerWaalsContact O-N 3.14Å
40	P	45.3	Very low	54.3	Low	117 Å²	117	107.4 Å²	107.4	76%	0.76	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-47	127.8	178.1	-25	31.5	0	0	0	108.8	W42	P40-W42 PolarHBondContact O-N 3.45Å
41	K	51.5	Low	57.2	Low	190 Å²	190	97.1 Å²	97.1	83%	0.826	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-54.4	121.2	172.3	-78.1	-174.4	176.9	-176.4	0	106.9	L39 D43	L39-K41 PolarHBondContact O-N 3.07Å; L39-K41 VanDerWaalsContact O-N 3.14Å; K41-D43 PolarHBondContact O-N 2.96Å
42	W	57.9	Low	59.8	Low	174 Å²	174	90.6 Å²	90.6	66%	0.659	55%	0.546	S	S	*	.			trans	-78.1	94.9	178	-174.5	29.3	0	0	0	108.1	P40 L44	P40-W42 PolarHBondContact O-N 3.45Å; W42-L44 PolarHBondContact O-N 2.66Å
43	D	68.3	Low	62.6	Low	133 Å²	133	92.1 Å²	92.1	71%	0.711	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-70.9	125.1	175	-67.8	-37	0	0	0	108.8	K41	K41-D43 PolarHBondContact O-N 2.96Å
44	L	70.7	Confident	65.4	Low	60 Å²	60	88.6 Å²	88.6	31%	0.314	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-59.9	135.2	177.8	-68.4	168.9	0	0	0	109.5	W42 K46 V65	W42-L44 PolarHBondContact O-N 2.66Å; L44-K46 PolarHBondContact O-N 2.76Å; L44-V65 HydrophobicContact CD2-CB 4.38Å; L44-V65 HydrophobicContact CD2-CG1 4.1Å; L44-V65 HydrophobicContact CD2-CG2 3.35Å
45	P	76.8	Confident	67.9	Low	14 Å²	14	87 Å²	87	9%	0.091	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-64	135.4	-178.8	28.7	-35.5	0	0	0	110	F57 Q60 F61 C74	P45-F57 HydrophobicContact CB-CD2 4.03Å; P45-F57 HydrophobicContact CB-CE2 4.38Å; P45-F57 HydrophobicContact CG-CD2 4.34Å; P45-F57 HydrophobicContact CG-CE2 4.34Å; P45-Q60 HydrophobicContact CB-CB 4.19Å; P45-Q60 HydrophobicContact CG-CB 4.02Å; P45-F61 HydrophobicContact CG-CB 4.5Å; P45-C74 WeakPolarHBondContact O-CB 2.97Å; P45-C74 PolarHBondContact O-SG 3.39Å; P45-C74 VanDerWaalsContact O-SG 3.4Å
46	K	86.4	Confident	70.3	Confident	116 Å²	116	84.5 Å²	84.5	50%	0.504	46%	0.46	S	S	.	.			trans	-107.3	131.1	-179.8	-67.7	-67.5	-167.6	152.7	0	110.6	L44 T73 C74 E76	L44-K46 PolarHBondContact O-N 2.76Å; K46-T73 VanDerWaalsContact CE-O 3.3Å; K46-T73 WeakPolarHBondContact CE-O 3.2Å; K46-T73 PolarHBondContact NZ-O 2.86Å; K46-C74 CarbonylContact C-O 3.58Å; K46-C74 WeakPolarHBondContact CA-O 2.88Å; K46-E76 WeakPolarHBondContact CD-OE1 3.47Å; K46-E76 IonicContact NZ-OE1 3.24Å; K46-E76 PolarHBondContact NZ-OE1 3.32Å
47	F	90.5	Very high	72.9	Confident	5 Å²	5	81 Å²	81	2%	0.022	43%	0.43	C	S	.	.	B	Isolated β-bridge	trans	-123	124.3	-179.3	-177.5	-111.7	0	0	0	112.6	G49 D50 F54 F57 C74 L75 E76 A79 F104	F47-G49 VanDerWaalsContact CE1-CA 3.46Å; F47-G49 VanDerWaalsContact CZ-CA 3.42Å; F47-D50 WeakPolarHBondContact CE2-O 3.29Å; F47-F54 HydrophobicContact CD1-CD2 4.43Å; F47-F54 AromaticContact CE1-CD2 3.73Å; F47-F54 HydrophobicContact CE1-CD2 3.73Å; F47-F54 HydrophobicContact CE1-CE2 4.38Å; F47-F54 HydrophobicContact CE2-CB 4Å; F47-F54 HydrophobicContact CE2-CD2 4.17Å; F47-F54 HydrophobicContact CZ-CB 3.92Å; F47-F54 AromaticContact CZ-CD2 3.59Å; F47-F54 HydrophobicContact CZ-CD2 3.59Å; F47-F54 HydrophobicContact CZ-CG 4.25Å; F47-F57 HydrophobicContact CB-CB 4.29Å; F47-F57 HydrophobicContact CB-CD1 3.65Å; F47-F57 HydrophobicContact CB-CD2 3.5Å; F47-F57 VanDerWaalsContact CB-CD2 3.5Å; F47-F57 HydrophobicContact CB-CE1 3.74Å; F47-F57 HydrophobicContact CB-CE2 3.59Å; F47-F57 HydrophobicContact CB-CG 3.51Å; F47-F57 HydrophobicContact CB-CZ 3.71Å; F47-F57 HydrophobicContact CD1-CD1 4.09Å; F47-F57 HydrophobicContact CD1-CE1 4.15Å; F47-F57 HydrophobicContact CD2-CB 3.86Å; F47-F57 AromaticContact CD2-CD1 3.95Å; F47-F57 HydrophobicContact CD2-CD1 3.95Å; F47-F57 AromaticContact CD2-CG 3.88Å; F47-F57 HydrophobicContact CD2-CG 3.88Å; F47-F57 HydrophobicContact CG-CB 4.3Å; F47-F57 AromaticContact CG-CD1 3.63Å; F47-F57 HydrophobicContact CG-CD1 3.63Å; F47-F57 HydrophobicContact CG-CD2 4.3Å; F47-F57 AromaticContact CG-CE1 3.98Å; F47-F57 HydrophobicContact CG-CE1 3.98Å; F47-F57 AromaticContact CG-CG 3.8Å; F47-F57 HydrophobicContact CG-CG 3.8Å; F47-F57 HydrophobicContact CG-CZ 4.44Å; F47-C74 PolarHBondContact N-O 3.36Å; F47-L75 HydrophobicContact CB-CD2 4.09Å; F47-L75 HydrophobicContact CD1-CD2 4.01Å; F47-E76 PolarHBondContact O-N 2.94Å; F47-A79 HydrophobicContact CD1-CB 3.51Å; F47-A79 HydrophobicContact CE1-CB 3.75Å; F47-F104 HydrophobicContact CE1-CB 4.1Å; F47-F104 HydrophobicContact CE1-CD1 4.27Å; F47-F104 AromaticContact CE1-CD2 3.96Å; F47-F104 HydrophobicContact CE1-CD2 3.96Å; F47-F104 HydrophobicContact CE1-CE2 4.48Å; F47-F104 AromaticContact CE1-CG 3.85Å; F47-F104 HydrophobicContact CE1-CG 3.85Å; F47-F104 HydrophobicContact CZ-CB 4.04Å; F47-F104 HydrophobicContact CZ-CD1 4.3Å; F47-F104 HydrophobicContact CZ-CG 4.09Å
48	K	89.1	Confident	75.2	Confident	138 Å²	138	76.7 Å²	76.7	60%	0.6	40%	0.4	S	S	*	.			trans	-99.6	-4.9	-176.2	-71.6	-178.5	178	-175.8	0	114.9	E76 I78	K48-E76 CarbonylContact C-O 3.58Å; K48-E76 VanDerWaalsContact CA-O 3.32Å; K48-E76 WeakPolarHBondContact CA-O 3.34Å; K48-E76 WeakPolarHBondContact CE-OE2 3.39Å; K48-E76 HydrophobicContact CG-CB 3.84Å; K48-E76 IonicContact NZ-OE2 2.72Å; K48-I78 VanDerWaalsContact O-CG1 3.24Å; K48-I78 WeakPolarHBondContact O-CG1 3.42Å
49	G	86.5	Confident	77.3	Confident	7 Å²	7	76.5 Å²	76.5	7%	0.072	39%	0.385	C	S	.	.	S	Bend	trans	102.9	10.6	-177.3	0	0	0	0	0	116	F47 V51 F104	F47-G49 VanDerWaalsContact CE1-CA 3.46Å; F47-G49 VanDerWaalsContact CZ-CA 3.42Å; G49-V51 PolarHBondContact O-N 3.11Å; G49-F104 WeakPolarHBondContact O-CD1 3.37Å
50	D	88.2	Confident	79.3	Confident	79 Å²	79	74.2 Å²	74.2	42%	0.422	37%	0.37	S	S	.	.			trans	-73.6	111.9	170.7	-174.4	-5.1	0	0	0	110.2	F47 L52 L53 F54	F47-D50 WeakPolarHBondContact CE2-O 3.29Å; D50-L52 PolarHBondContact O-N 3.49Å; D50-L52 PolarHBondContact OD1-N 2.86Å; D50-L52 VanDerWaalsContact OD1-N 3.11Å; D50-L53 HydrophobicContact CB-CB 4.34Å; D50-L53 HydrophobicContact CB-CD1 4.14Å; D50-L53 HydrophobicContact CB-CG 4.25Å; D50-L53 PolarHBondContact O-N 2.85Å; D50-F54 PolarHBondContact O-N 3.22Å
51	V	86.4	Confident	81.1	Confident	18 Å²	18	68.6 Å²	68.6	11%	0.109	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-56.4	-35	-176.6	177	0	0	0	0	112.1	G49 L53 F54 F104 L109 I110	G49-V51 PolarHBondContact O-N 3.11Å; V51-L53 PolarHBondContact O-N 3.49Å; V51-F54 WeakPolarHBondContact O-CB 3.5Å; V51-F54 PolarHBondContact O-N 2.93Å; V51-F104 HydrophobicContact CG2-CD1 4.31Å; V51-L109 HydrophobicContact CG1-CD2 4.12Å; V51-L109 HydrophobicContact CG1-CG 4.08Å; V51-L109 HydrophobicContact CG2-CD2 3.94Å; V51-I110 HydrophobicContact CG1-CB 4.12Å; V51-I110 HydrophobicContact CG1-CG1 3.39Å
52	L	83.6	Confident	82.7	Confident	39 Å²	39	64.2 Å²	64.2	20%	0.204	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-68.5	-23.6	179.7	-66.3	177.5	0	0	0	113.2	D50 K113 E117	D50-L52 PolarHBondContact O-N 3.49Å; D50-L52 PolarHBondContact OD1-N 2.86Å; D50-L52 VanDerWaalsContact OD1-N 3.11Å; L52-K113 HydrophobicContact CD2-CB 3.51Å; L52-K113 HydrophobicContact CG-CB 3.99Å; L52-E117 WeakPolarHBondContact CD1-OE2 3.23Å
53	L	86.5	Confident	83.5	Confident	97 Å²	97	60.2 Å²	60.2	51%	0.508	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-96.9	-5	179.4	-61.7	179.3	0	0	0	112.6	D50 V51 T55 V56 F57	D50-L53 HydrophobicContact CB-CB 4.34Å; D50-L53 HydrophobicContact CB-CD1 4.14Å; D50-L53 HydrophobicContact CB-CG 4.25Å; D50-L53 PolarHBondContact O-N 2.85Å; V51-L53 PolarHBondContact O-N 3.49Å; L53-T55 PolarHBondContact O-N 2.87Å; L53-V56 PolarHBondContact O-N 2.92Å; L53-F57 WeakPolarHBondContact O-CB 3.39Å; L53-F57 PolarHBondContact O-N 3.08Å
54	F	88.6	Confident	83.7	Confident	10 Å²	10	54.3 Å²	54.3	4%	0.044	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-44.1	-174.5	-177.6	-95	0	0	0	112.2	F47 D50 V51 F57 W58 K101 F104	F47-F54 HydrophobicContact CD1-CD2 4.43Å; F47-F54 AromaticContact CE1-CD2 3.73Å; F47-F54 HydrophobicContact CE1-CD2 3.73Å; F47-F54 HydrophobicContact CE1-CE2 4.38Å; F47-F54 HydrophobicContact CE2-CB 4Å; F47-F54 HydrophobicContact CE2-CD2 4.17Å; F47-F54 HydrophobicContact CZ-CB 3.92Å; F47-F54 AromaticContact CZ-CD2 3.59Å; F47-F54 HydrophobicContact CZ-CD2 3.59Å; F47-F54 HydrophobicContact CZ-CG 4.25Å; D50-F54 PolarHBondContact O-N 3.22Å; V51-F54 WeakPolarHBondContact O-CB 3.5Å; V51-F54 PolarHBondContact O-N 2.93Å; F54-F57 HydrophobicContact CD2-CD1 4.38Å; F54-F57 HydrophobicContact CE2-CD1 4.49Å; F54-F57 PolarHBondContact O-N 3.42Å; F54-W58 HydrophobicContact CD1-CB 4.4Å; F54-W58 HydrophobicContact CE1-CB 4.07Å; F54-W58 HydrophobicContact CE1-CD2 4.48Å; F54-W58 HydrophobicContact CE1-CE3 4.49Å; F54-W58 HydrophobicContact CE1-CG 4.26Å; F54-W58 HydrophobicContact CE2-CE3 4.23Å; F54-W58 HydrophobicContact CZ-CB 4.34Å; F54-W58 HydrophobicContact CZ-CD2 4.16Å; F54-W58 AromaticContact CZ-CE3 3.75Å; F54-W58 HydrophobicContact CZ-CE3 3.75Å; F54-W58 HydrophobicContact CZ-CG 4.37Å; F54-W58 VanDerWaalsContact O-CB 3.22Å; F54-W58 WeakPolarHBondContact O-CB 3.08Å; F54-W58 PolarHBondContact O-N 3.31Å; F54-K101 HydrophobicContact CZ-CG 4.2Å; F54-F104 HydrophobicContact CB-CB 4.38Å; F54-F104 HydrophobicContact CD2-CB 3.5Å; F54-F104 VanDerWaalsContact CD2-CB 3.5Å; F54-F104 HydrophobicContact CE2-CB 3.93Å; F54-F104 HydrophobicContact CG-CB 3.98Å
55	T	84.2	Confident	83.6	Confident	57 Å²	57	51.4 Å²	51.4	35%	0.35	28%	0.276	S	S	.	.	H	α-helix	trans	-61.4	-48.7	-179.3	-42.2	0	0	0	0	111.2	L53 F57 W58 D59	L53-T55 PolarHBondContact O-N 2.87Å; T55-F57 VanDerWaalsContact C-N 3.35Å; T55-F57 PolarHBondContact O-N 3.14Å; T55-W58 PolarHBondContact O-N 3.33Å; T55-D59 WeakPolarHBondContact O-CB 3.39Å; T55-D59 PolarHBondContact O-N 2.93Å
56	V	84	Confident	83.4	Confident	81 Å²	81	53.8 Å²	53.8	49%	0.491	29%	0.286	S	S	.	.	H	α-helix	trans	-62.2	-43.4	178.4	178.9	0	0	0	0	111.3	L53 Q60	L53-V56 PolarHBondContact O-N 2.92Å; V56-Q60 WeakPolarHBondContact O-CG 3.47Å; V56-Q60 PolarHBondContact O-N 2.77Å
57	F	89.6	Confident	82.4	Confident	9 Å²	9	53.3 Å²	53.3	4%	0.039	30%	0.297	C	S	.	.	H	α-helix	trans	-60.3	-49	174.5	161.7	-107.9	0	0	0	111.3	P45 F47 L53 F54 T55 Q60 F61 C74 L75	P45-F57 HydrophobicContact CB-CD2 4.03Å; P45-F57 HydrophobicContact CB-CE2 4.38Å; P45-F57 HydrophobicContact CG-CD2 4.34Å; P45-F57 HydrophobicContact CG-CE2 4.34Å; F47-F57 HydrophobicContact CB-CB 4.29Å; F47-F57 HydrophobicContact CB-CD1 3.65Å; F47-F57 HydrophobicContact CB-CD2 3.5Å; F47-F57 VanDerWaalsContact CB-CD2 3.5Å; F47-F57 HydrophobicContact CB-CE1 3.74Å; F47-F57 HydrophobicContact CB-CE2 3.59Å; F47-F57 HydrophobicContact CB-CG 3.51Å; F47-F57 HydrophobicContact CB-CZ 3.71Å; F47-F57 HydrophobicContact CD1-CD1 4.09Å; F47-F57 HydrophobicContact CD1-CE1 4.15Å; F47-F57 HydrophobicContact CD2-CB 3.86Å; F47-F57 AromaticContact CD2-CD1 3.95Å; F47-F57 HydrophobicContact CD2-CD1 3.95Å; F47-F57 AromaticContact CD2-CG 3.88Å; F47-F57 HydrophobicContact CD2-CG 3.88Å; F47-F57 HydrophobicContact CG-CB 4.3Å; F47-F57 AromaticContact CG-CD1 3.63Å; F47-F57 HydrophobicContact CG-CD1 3.63Å; F47-F57 HydrophobicContact CG-CD2 4.3Å; F47-F57 AromaticContact CG-CE1 3.98Å; F47-F57 HydrophobicContact CG-CE1 3.98Å; F47-F57 AromaticContact CG-CG 3.8Å; F47-F57 HydrophobicContact CG-CG 3.8Å; F47-F57 HydrophobicContact CG-CZ 4.44Å; L53-F57 WeakPolarHBondContact O-CB 3.39Å; L53-F57 PolarHBondContact O-N 3.08Å; F54-F57 HydrophobicContact CD2-CD1 4.38Å; F54-F57 HydrophobicContact CE2-CD1 4.49Å; F54-F57 PolarHBondContact O-N 3.42Å; T55-F57 VanDerWaalsContact C-N 3.35Å; T55-F57 PolarHBondContact O-N 3.14Å; F57-Q60 PolarHBondContact O-N 3.16Å; F57-F61 HydrophobicContact CE2-CB 4.13Å; F57-F61 HydrophobicContact CE2-CD2 4.34Å; F57-F61 HydrophobicContact CE2-CG 4.48Å; F57-F61 HydrophobicContact CZ-CB 4.13Å; F57-F61 HydrophobicContact CZ-CD2 4.12Å; F57-F61 HydrophobicContact CZ-CG 4.14Å; F57-F61 WeakPolarHBondContact O-CB 3.12Å; F57-F61 PolarHBondContact O-N 3.16Å; F57-C74 HydrophobicContact CE2-CB 4.01Å; F57-C74 HydrophobicContact CZ-CB 4.16Å; F57-L75 HydrophobicContact CE1-CD2 4.15Å; F57-L75 HydrophobicContact CZ-CD2 3.88Å
58	W	87.9	Confident	81.3	Confident	14 Å²	14	60.2 Å²	60.2	5%	0.053	32%	0.323	C	S	.	.	H	α-helix	trans	-65.4	-41.6	-175	-170.2	-91.4	0	0	0	111	F54 T55 Q60 F61 E62 V97 K101	F54-W58 HydrophobicContact CD1-CB 4.4Å; F54-W58 HydrophobicContact CE1-CB 4.07Å; F54-W58 HydrophobicContact CE1-CD2 4.48Å; F54-W58 HydrophobicContact CE1-CE3 4.49Å; F54-W58 HydrophobicContact CE1-CG 4.26Å; F54-W58 HydrophobicContact CE2-CE3 4.23Å; F54-W58 HydrophobicContact CZ-CB 4.34Å; F54-W58 HydrophobicContact CZ-CD2 4.16Å; F54-W58 AromaticContact CZ-CE3 3.75Å; F54-W58 HydrophobicContact CZ-CE3 3.75Å; F54-W58 HydrophobicContact CZ-CG 4.37Å; F54-W58 VanDerWaalsContact O-CB 3.22Å; F54-W58 WeakPolarHBondContact O-CB 3.08Å; F54-W58 PolarHBondContact O-N 3.31Å; T55-W58 PolarHBondContact O-N 3.33Å; W58-Q60 PolarHBondContact O-N 3.23Å; W58-F61 HydrophobicContact CE3-CD1 4.28Å; W58-F61 HydrophobicContact CH2-CD1 4.05Å; W58-F61 HydrophobicContact CH2-CE1 4.06Å; W58-F61 HydrophobicContact CZ2-CD1 4.48Å; W58-F61 AromaticContact CZ3-CD1 3.96Å; W58-F61 HydrophobicContact CZ3-CD1 3.96Å; W58-F61 HydrophobicContact CZ3-CE1 4.18Å; W58-F61 CarbonylContact O-C 3.55Å; W58-F61 PolarHBondContact O-N 3.12Å; W58-E62 PolarHBondContact NE1-OE2 3.11Å; W58-E62 WeakPolarHBondContact O-CB 3.35Å; W58-E62 PolarHBondContact O-N 3.14Å; W58-V97 HydrophobicContact CH2-CB 4.36Å; W58-V97 HydrophobicContact CH2-CG1 3.48Å; W58-V97 VanDerWaalsContact CH2-CG1 3.48Å; W58-V97 HydrophobicContact CH2-CG2 4.12Å; W58-V97 HydrophobicContact CZ2-CG1 4.05Å; W58-V97 HydrophobicContact CZ3-CG1 4.38Å; W58-K101 HydrophobicContact CZ2-CD 4.43Å
59	D	83.2	Confident	80.1	Confident	95 Å²	95	57.1 Å²	57.1	51%	0.508	32%	0.319	S	S	.	.	H	α-helix	trans	-61.9	-42.9	176.5	-66.7	-18.1	0	0	0	111.6	T55 A63	T55-D59 WeakPolarHBondContact O-CB 3.39Å; T55-D59 PolarHBondContact O-N 2.93Å; D59-A63 VanDerWaalsContact O-CB 3.24Å; D59-A63 WeakPolarHBondContact O-CB 3.4Å; D59-A63 PolarHBondContact O-N 2.72Å
60	Q	80.5	Confident	79.4	Confident	105 Å²	105	59.6 Å²	59.6	49%	0.491	33%	0.33	S	S	.	.	H	α-helix	trans	-68.5	-40.4	176	-70.4	179.1	8.4	0	0	112.2	P45 V56 F57 W58 G64	P45-Q60 HydrophobicContact CB-CB 4.19Å; P45-Q60 HydrophobicContact CG-CB 4.02Å; V56-Q60 WeakPolarHBondContact O-CG 3.47Å; V56-Q60 PolarHBondContact O-N 2.77Å; F57-Q60 PolarHBondContact O-N 3.16Å; W58-Q60 PolarHBondContact O-N 3.23Å; Q60-G64 PolarHBondContact O-N 2.74Å
61	F	83.8	Confident	79	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-65.5	-42.6	176.9	179.9	-96.7	0	0	0	110.9	P45 F57 W58 G64 V65 H66 L71 C74 Y93	P45-F61 HydrophobicContact CG-CB 4.5Å; F57-F61 HydrophobicContact CE2-CB 4.13Å; F57-F61 HydrophobicContact CE2-CD2 4.34Å; F57-F61 HydrophobicContact CE2-CG 4.48Å; F57-F61 HydrophobicContact CZ-CB 4.13Å; F57-F61 HydrophobicContact CZ-CD2 4.12Å; F57-F61 HydrophobicContact CZ-CG 4.14Å; F57-F61 WeakPolarHBondContact O-CB 3.12Å; F57-F61 PolarHBondContact O-N 3.16Å; W58-F61 HydrophobicContact CE3-CD1 4.28Å; W58-F61 HydrophobicContact CH2-CD1 4.05Å; W58-F61 HydrophobicContact CH2-CE1 4.06Å; W58-F61 HydrophobicContact CZ2-CD1 4.48Å; W58-F61 AromaticContact CZ3-CD1 3.96Å; W58-F61 HydrophobicContact CZ3-CD1 3.96Å; W58-F61 HydrophobicContact CZ3-CE1 4.18Å; W58-F61 CarbonylContact O-C 3.55Å; W58-F61 PolarHBondContact O-N 3.12Å; F61-G64 PolarHBondContact O-N 3.45Å; F61-V65 HydrophobicContact CD2-CB 3.66Å; F61-V65 HydrophobicContact CD2-CG1 3.99Å; F61-V65 HydrophobicContact CD2-CG2 4.23Å; F61-V65 HydrophobicContact CE2-CB 3.68Å; F61-V65 HydrophobicContact CE2-CG1 3.56Å; F61-V65 HydrophobicContact CG-CB 4.37Å; F61-V65 HydrophobicContact CZ-CB 4.41Å; F61-V65 HydrophobicContact CZ-CG1 4.33Å; F61-V65 CarbonylContact O-C 3.58Å; F61-V65 WeakPolarHBondContact O-CA 3.31Å; F61-V65 PolarHBondContact O-N 3.1Å; F61-H66 HydrophobicContact CD1-CB 4.17Å; F61-H66 HydrophobicContact CE1-CB 3.96Å; F61-H66 AromaticContact CE1-ND1 3.87Å; F61-H66 PolarHBondContact O-N 2.94Å; F61-L71 HydrophobicContact CE1-CD1 3.86Å; F61-L71 HydrophobicContact CE2-CB 4.41Å; F61-L71 HydrophobicContact CE2-CD1 3.87Å; F61-L71 HydrophobicContact CZ-CB 3.88Å; F61-L71 HydrophobicContact CZ-CD1 3.45Å; F61-L71 VanDerWaalsContact CZ-CD1 3.45Å; F61-L71 HydrophobicContact CZ-CG 4.29Å; F61-C74 HydrophobicContact CD2-CB 4.05Å; F61-C74 HydrophobicContact CE2-CB 4.1Å; F61-Y93 WeakPolarHBondContact CZ-OH 3.48Å
62	E	83.4	Confident	78.6	Confident	97 Å²	97	58.2 Å²	58.2	45%	0.453	32%	0.317	S	S	.	.	H	α-helix	trans	-68.4	-44.2	179.1	-173.4	159.4	-161.1	0	0	112.2	W58 G64	W58-E62 PolarHBondContact NE1-OE2 3.11Å; W58-E62 WeakPolarHBondContact O-CB 3.35Å; W58-E62 PolarHBondContact O-N 3.14Å; E62-G64 PolarHBondContact O-N 2.78Å
63	A	76.4	Confident	78.5	Confident	91 Å²	91	59.9 Å²	59.9	75%	0.752	33%	0.33	S	S	*	.	H	α-helix	trans	-63.5	-24.9	177.5	0	0	0	0	0	113.5	D59	D59-A63 VanDerWaalsContact O-CB 3.24Å; D59-A63 WeakPolarHBondContact O-CB 3.4Å; D59-A63 PolarHBondContact O-N 2.72Å
64	G	70.5	Confident	78.5	Confident	8 Å²	8	55.3 Å²	55.3	8%	0.082	31%	0.305	C	S	.	.	H	α-helix	trans	-131.1	-28.3	-166.5	0	0	0	0	0	119.4	Q60 F61 E62	Q60-G64 PolarHBondContact O-N 2.74Å; F61-G64 PolarHBondContact O-N 3.45Å; E62-G64 PolarHBondContact O-N 2.78Å
65	V	69.2	Low	78.4	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.3	-26.8	-166.4	-166.9	0	0	0	0	111.8	L44 F61 S67 R68 S69 D70	L44-V65 HydrophobicContact CD2-CB 4.38Å; L44-V65 HydrophobicContact CD2-CG1 4.1Å; L44-V65 HydrophobicContact CD2-CG2 3.35Å; F61-V65 HydrophobicContact CD2-CB 3.66Å; F61-V65 HydrophobicContact CD2-CG1 3.99Å; F61-V65 HydrophobicContact CD2-CG2 4.23Å; F61-V65 HydrophobicContact CE2-CB 3.68Å; F61-V65 HydrophobicContact CE2-CG1 3.56Å; F61-V65 HydrophobicContact CG-CB 4.37Å; F61-V65 HydrophobicContact CZ-CB 4.41Å; F61-V65 HydrophobicContact CZ-CG1 4.33Å; F61-V65 CarbonylContact O-C 3.58Å; F61-V65 WeakPolarHBondContact O-CA 3.31Å; F61-V65 PolarHBondContact O-N 3.1Å; V65-S67 PolarHBondContact O-N 3.2Å; V65-R68 WeakPolarHBondContact O-CA 3.43Å; V65-R68 WeakPolarHBondContact O-CB 3.47Å; V65-R68 PolarHBondContact O-N 3.28Å; V65-S69 PolarHBondContact O-N 2.96Å; V65-D70 HydrophobicContact CG1-CB 3.92Å
66	H	73.5	Confident	78.6	Confident	63 Å²	63	55.5 Å²	55.5	29%	0.292	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-59.5	-33	-179.3	-170	46.8	0	0	0	112	F61 R68 S69 Y93	F61-H66 HydrophobicContact CD1-CB 4.17Å; F61-H66 HydrophobicContact CE1-CB 3.96Å; F61-H66 AromaticContact CE1-ND1 3.87Å; F61-H66 PolarHBondContact O-N 2.94Å; H66-R68 PolarHBondContact O-N 2.74Å; H66-S69 PolarHBondContact O-N 2.97Å; H66-Y93 AromaticContact CE1-CE1 3.69Å; H66-Y93 AromaticContact ND1-CE1 3.72Å; H66-Y93 AromaticContact ND1-CZ 3.7Å; H66-Y93 PolarHBondContact ND1-OH 3.31Å
67	S	65.6	Low	78.9	Confident	107 Å²	107	53.8 Å²	53.8	75%	0.748	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-66.9	-19.5	172.2	58.2	0	0	0	0	114.3	V65	V65-S67 PolarHBondContact O-N 3.2Å
68	R	66.5	Low	78.8	Confident	150 Å²	150	57.6 Å²	57.6	57%	0.566	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-99.7	-5	-179.7	-65.8	176.7	54.7	156.2	3.4	114	V65 H66 D70	V65-R68 WeakPolarHBondContact O-CA 3.43Å; V65-R68 WeakPolarHBondContact O-CB 3.47Å; V65-R68 PolarHBondContact O-N 3.28Å; H66-R68 PolarHBondContact O-N 2.74Å; R68-D70 IonicContact CZ-OD2 2.97Å; R68-D70 IonicContact NE-OD2 3.55Å; R68-D70 PolarHBondContact NE-OD2 3.35Å; R68-D70 VanDerWaalsContact NE-OD2 3.12Å; R68-D70 IonicContact NH2-OD2 3.13Å; R68-D70 PolarHBondContact NH2-OD2 3.4Å; R68-D70 PolarHBondContact O-N 3.24Å; R68-D70 VanDerWaalsContact O-N 3.09Å
69	S	64.2	Low	78.9	Confident	73 Å²	73	56.9 Å²	56.9	51%	0.51	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	15.9	-176.8	55.8	0	0	0	0	116.5	V65 H66 L71 Y93	V65-S69 PolarHBondContact O-N 2.96Å; H66-S69 PolarHBondContact O-N 2.97Å; S69-L71 VanDerWaalsContact C-N 3.29Å; S69-L71 PolarHBondContact O-N 2.94Å; S69-Y93 VanDerWaalsContact CA-CE2 3.44Å; S69-Y93 WeakPolarHBondContact O-CD2 3.44Å; S69-Y93 VanDerWaalsContact O-CE2 3.22Å; S69-Y93 WeakPolarHBondContact O-CE2 3.37Å
70	D	72	Confident	79.2	Confident	58 Å²	58	55.9 Å²	55.9	31%	0.31	31%	0.31	S	S	.	.			trans	-85.1	52.4	-176.3	-66.1	-33.3	0	0	0	112.7	V65 R68 T73	V65-D70 HydrophobicContact CG1-CB 3.92Å; R68-D70 IonicContact CZ-OD2 2.97Å; R68-D70 IonicContact NE-OD2 3.55Å; R68-D70 PolarHBondContact NE-OD2 3.35Å; R68-D70 VanDerWaalsContact NE-OD2 3.12Å; R68-D70 IonicContact NH2-OD2 3.13Å; R68-D70 PolarHBondContact NH2-OD2 3.4Å; R68-D70 PolarHBondContact O-N 3.24Å; R68-D70 VanDerWaalsContact O-N 3.09Å; D70-T73 PolarHBondContact O-OG1 3.33Å; D70-T73 VanDerWaalsContact O-OG1 3.14Å
71	L	79	Confident	79.5	Confident	5 Å²	5	55.6 Å²	55.6	3%	0.026	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-42	-171.8	176.8	64.5	0	0	0	114	F61 S69 T73 C74 L75 I83 Y93 A96 V97 L100	F61-L71 HydrophobicContact CE1-CD1 3.86Å; F61-L71 HydrophobicContact CE2-CB 4.41Å; F61-L71 HydrophobicContact CE2-CD1 3.87Å; F61-L71 HydrophobicContact CZ-CB 3.88Å; F61-L71 HydrophobicContact CZ-CD1 3.45Å; F61-L71 VanDerWaalsContact CZ-CD1 3.45Å; F61-L71 HydrophobicContact CZ-CG 4.29Å; S69-L71 VanDerWaalsContact C-N 3.29Å; S69-L71 PolarHBondContact O-N 2.94Å; L71-T73 VanDerWaalsContact C-N 3.34Å; L71-T73 PolarHBondContact O-N 3.17Å; L71-C74 WeakPolarHBondContact O-CB 3.16Å; L71-C74 PolarHBondContact O-N 3.42Å; L71-C74 VanDerWaalsContact O-N 3.16Å; L71-L75 HydrophobicContact CD1-CD1 4.04Å; L71-L75 HydrophobicContact CD1-CG 4.38Å; L71-L75 HydrophobicContact CG-CD1 3.89Å; L71-L75 WeakPolarHBondContact O-CG 3.27Å; L71-I83 HydrophobicContact CD2-CD1 4.23Å; L71-I83 HydrophobicContact CG-CD1 4.36Å; L71-Y93 HydrophobicContact CB-CD2 4.23Å; L71-Y93 HydrophobicContact CB-CE2 3.54Å; L71-Y93 HydrophobicContact CD2-CE2 4.39Å; L71-A96 HydrophobicContact CD2-CB 3.99Å; L71-V97 HydrophobicContact CD2-CG2 3.8Å; L71-L100 HydrophobicContact CD1-CD1 3.67Å; L71-L100 HydrophobicContact CD2-CD1 3.48Å; L71-L100 VanDerWaalsContact CD2-CD1 3.48Å; L71-L100 HydrophobicContact CG-CD1 3.88Å
72	R	78.7	Confident	79.6	Confident	63 Å²	63	56.4 Å²	56.4	24%	0.238	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-64.7	-35.1	-173.2	-94.5	177.1	170.3	-137.7	-4.3	113.5	C74 L75 F80 I83 A84 Y86 E88	R72-C74 PolarHBondContact O-N 3Å; R72-L75 PolarHBondContact O-N 3.48Å; R72-F80 HydrophobicContact CG-CE2 4.28Å; R72-I83 HydrophobicContact CG-CD1 3.74Å; R72-A84 PolarHBondContact NH2-O 2.9Å; R72-Y86 PolarHBondContact NH2-O 3.23Å; R72-E88 VanDerWaalsContact CD-CG 3.46Å; R72-E88 WeakPolarHBondContact CD-OE1 3.38Å; R72-E88 IonicContact NE-OE1 3.19Å; R72-E88 IonicContact NH1-OE1 2.69Å
73	T	81.7	Confident	79.8	Confident	75 Å²	75	51.9 Å²	51.9	46%	0.46	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-69	-19.4	179.6	59.4	0	0	0	0	112.3	K46 D70 L71	K46-T73 VanDerWaalsContact CE-O 3.3Å; K46-T73 WeakPolarHBondContact CE-O 3.2Å; K46-T73 PolarHBondContact NZ-O 2.86Å; D70-T73 PolarHBondContact O-OG1 3.33Å; D70-T73 VanDerWaalsContact O-OG1 3.14Å; L71-T73 VanDerWaalsContact C-N 3.34Å; L71-T73 PolarHBondContact O-N 3.17Å
74	C	85.3	Confident	80.1	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-87.9	-4.3	176.9	-74.1	0	0	0	0	114.3	P45 K46 F47 F57 F61 L71 R72	P45-C74 WeakPolarHBondContact O-CB 2.97Å; P45-C74 PolarHBondContact O-SG 3.39Å; P45-C74 VanDerWaalsContact O-SG 3.4Å; K46-C74 CarbonylContact C-O 3.58Å; K46-C74 WeakPolarHBondContact CA-O 2.88Å; F47-C74 PolarHBondContact N-O 3.36Å; F57-C74 HydrophobicContact CE2-CB 4.01Å; F57-C74 HydrophobicContact CZ-CB 4.16Å; F61-C74 HydrophobicContact CD2-CB 4.05Å; F61-C74 HydrophobicContact CE2-CB 4.1Å; L71-C74 WeakPolarHBondContact O-CB 3.16Å; L71-C74 PolarHBondContact O-N 3.42Å; L71-C74 VanDerWaalsContact O-N 3.16Å; R72-C74 PolarHBondContact O-N 3Å
75	L	87.4	Confident	80.7	Confident	7 Å²	7	53.3 Å²	53.3	4%	0.037	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-115.5	143.9	-172.8	-57.8	171	0	0	0	112.2	F47 F57 L71 R72 A79 F80 I83 L100	F47-L75 HydrophobicContact CB-CD2 4.09Å; F47-L75 HydrophobicContact CD1-CD2 4.01Å; F57-L75 HydrophobicContact CE1-CD2 4.15Å; F57-L75 HydrophobicContact CZ-CD2 3.88Å; L71-L75 HydrophobicContact CD1-CD1 4.04Å; L71-L75 HydrophobicContact CD1-CG 4.38Å; L71-L75 HydrophobicContact CG-CD1 3.89Å; L71-L75 WeakPolarHBondContact O-CG 3.27Å; R72-L75 PolarHBondContact O-N 3.48Å; L75-A79 HydrophobicContact CD2-CB 4.17Å; L75-F80 HydrophobicContact CB-CB 4.16Å; L75-I83 HydrophobicContact CD1-CD1 3.36Å; L75-I83 HydrophobicContact CD1-CG1 3.89Å; L75-L100 HydrophobicContact CD1-CD1 3.51Å; L75-L100 HydrophobicContact CD1-CD2 4.07Å; L75-L100 HydrophobicContact CD1-CG 4.37Å; L75-L100 HydrophobicContact CD2-CD1 4.2Å; L75-L100 HydrophobicContact CD2-CD2 4.07Å; L75-L100 HydrophobicContact CG-CD1 4.48Å
76	E	88	Confident	81.3	Confident	65 Å²	65	57 Å²	57	30%	0.304	33%	0.331	S	S	.	.			trans	-140.6	159.6	177.8	-71.8	177.8	-169.2	0	0	110.3	K46 F47 K48 A79	K46-E76 WeakPolarHBondContact CD-OE1 3.47Å; K46-E76 IonicContact NZ-OE1 3.24Å; K46-E76 PolarHBondContact NZ-OE1 3.32Å; F47-E76 PolarHBondContact O-N 2.94Å; K48-E76 CarbonylContact C-O 3.58Å; K48-E76 VanDerWaalsContact CA-O 3.32Å; K48-E76 WeakPolarHBondContact CA-O 3.34Å; K48-E76 WeakPolarHBondContact CE-OE2 3.39Å; K48-E76 HydrophobicContact CG-CB 3.84Å; K48-E76 IonicContact NZ-OE2 2.72Å; E76-A79 PolarHBondContact O-N 2.89Å
77	G	90.4	Very high	81.4	Confident	45 Å²	45	57.3 Å²	57.3	46%	0.464	34%	0.34	S	S	.	.	H	α-helix	trans	55.3	-138.9	176.5	0	0	0	0	0	113.6	A79 F80 D81	G77-A79 PolarHBondContact O-N 3.35Å; G77-F80 WeakPolarHBondContact O-CB 3.44Å; G77-F80 PolarHBondContact O-N 3.42Å; G77-D81 PolarHBondContact O-N 2.97Å
78	I	87.7	Confident	81.7	Confident	88 Å²	88	59.4 Å²	59.4	45%	0.451	34%	0.338	S	S	.	.	H	α-helix	trans	-61.3	-21.2	-174.6	61	170.2	0	0	0	113.8	K48 A82 F104	K48-I78 VanDerWaalsContact O-CG1 3.24Å; K48-I78 WeakPolarHBondContact O-CG1 3.42Å; I78-A82 WeakPolarHBondContact O-CB 3.48Å; I78-A82 PolarHBondContact O-N 2.91Å; I78-F104 HydrophobicContact CD1-CE1 4.04Å; I78-F104 HydrophobicContact CG1-CE1 4.27Å; I78-F104 HydrophobicContact CG1-CZ 4.32Å
79	A	89.7	Confident	82.1	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-76.5	-36.5	174.9	0	0	0	0	0	112.2	F47 L75 E76 G77 L100 F104	F47-A79 HydrophobicContact CD1-CB 3.51Å; F47-A79 HydrophobicContact CE1-CB 3.75Å; L75-A79 HydrophobicContact CD2-CB 4.17Å; E76-A79 PolarHBondContact O-N 2.89Å; G77-A79 PolarHBondContact O-N 3.35Å; A79-L100 HydrophobicContact CB-CD2 4.29Å; A79-F104 HydrophobicContact CB-CE2 3.97Å; A79-F104 HydrophobicContact CB-CZ 4.1Å
80	F	89	Confident	82.2	Confident	73 Å²	73	56.4 Å²	56.4	32%	0.32	34%	0.343	S	S	.	.	H	α-helix	trans	-67.4	-46.8	171	179.4	-93.1	0	0	0	110.5	R72 L75 G77 A82 I83 A84	R72-F80 HydrophobicContact CG-CE2 4.28Å; L75-F80 HydrophobicContact CB-CB 4.16Å; G77-F80 WeakPolarHBondContact O-CB 3.44Å; G77-F80 PolarHBondContact O-N 3.42Å; F80-A82 PolarHBondContact O-N 2.85Å; F80-I83 CarbonylContact O-C 3.51Å; F80-I83 WeakPolarHBondContact O-CG1 3.15Å; F80-I83 PolarHBondContact O-N 2.82Å; F80-A84 HydrophobicContact CE1-CB 4.36Å; F80-A84 PolarHBondContact O-N 3.03Å
81	D	87.3	Confident	82.3	Confident	100 Å²	100	57.7 Å²	57.7	54%	0.535	36%	0.362	S	S	.	.	H	α-helix	trans	-58.4	-33.3	179.5	-60.5	-25.1	0	0	0	112.2	G77 I83 A84	G77-D81 PolarHBondContact O-N 2.97Å; D81-I83 PolarHBondContact O-N 3.06Å; D81-A84 PolarHBondContact O-N 3.45Å
82	A	85.6	Confident	82.5	Confident	16 Å²	16	59.8 Å²	59.8	13%	0.132	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-26.4	177.5	0	0	0	0	0	114	I78 F80 T99 R103 F104	I78-A82 WeakPolarHBondContact O-CB 3.48Å; I78-A82 PolarHBondContact O-N 2.91Å; F80-A82 PolarHBondContact O-N 2.85Å; A82-T99 WeakPolarHBondContact O-CG2 3.48Å; A82-R103 VanDerWaalsContact CB-NH1 3.3Å; A82-F104 HydrophobicContact CB-CE2 3.99Å; A82-F104 HydrophobicContact CB-CZ 4.4Å
83	I	87.2	Confident	82.7	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.015	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	3.6	-179.4	67.3	155.4	0	0	0	113.2	L71 R72 L75 F80 D81 G85 Y86 A96 T99 L100	L71-I83 HydrophobicContact CD2-CD1 4.23Å; L71-I83 HydrophobicContact CG-CD1 4.36Å; R72-I83 HydrophobicContact CG-CD1 3.74Å; L75-I83 HydrophobicContact CD1-CD1 3.36Å; L75-I83 HydrophobicContact CD1-CG1 3.89Å; F80-I83 CarbonylContact O-C 3.51Å; F80-I83 WeakPolarHBondContact O-CG1 3.15Å; F80-I83 PolarHBondContact O-N 2.82Å; D81-I83 PolarHBondContact O-N 3.06Å; I83-G85 PolarHBondContact O-N 2.96Å; I83-G85 VanDerWaalsContact O-N 3.08Å; I83-Y86 HydrophobicContact CB-CD2 3.98Å; I83-Y86 HydrophobicContact CG2-CD2 4.36Å; I83-Y86 PolarHBondContact O-N 3.44Å; I83-A96 HydrophobicContact CB-CB 4.22Å; I83-A96 HydrophobicContact CD1-CB 4.38Å; I83-A96 HydrophobicContact CG2-CB 4.07Å; I83-T99 HydrophobicContact CG2-CG2 4.43Å; I83-L100 HydrophobicContact CG2-CD1 4.01Å; I83-L100 HydrophobicContact CG2-CD2 4.35Å; I83-L100 HydrophobicContact CG2-CG 3.75Å
84	A	84	Confident	82.7	Confident	46 Å²	46	58.3 Å²	58.3	38%	0.38	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-28.2	-175.3	0	0	0	0	0	112.8	R72 F80 D81 Y86	R72-A84 PolarHBondContact NH2-O 2.9Å; F80-A84 HydrophobicContact CE1-CB 4.36Å; F80-A84 PolarHBondContact O-N 3.03Å; D81-A84 PolarHBondContact O-N 3.45Å; A84-Y86 VanDerWaalsContact C-N 3.33Å; A84-Y86 PolarHBondContact O-N 3.01Å
85	G	82.8	Confident	82.7	Confident	83 Å²	83	60 Å²	60	86%	0.856	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-12.8	176	0	0	0	0	0	115.9	I83	I83-G85 PolarHBondContact O-N 2.96Å; I83-G85 VanDerWaalsContact O-N 3.08Å
86	Y	82.7	Confident	82.6	Confident	76 Å²	76	60 Å²	60	30%	0.298	39%	0.389	S	S	.	.	S	Bend	trans	-90.3	126.7	175.7	-63.9	-69.7	0	0	0	110.6	R72 I83 A84 N92 A95 A96 T99	R72-Y86 PolarHBondContact NH2-O 3.23Å; I83-Y86 HydrophobicContact CB-CD2 3.98Å; I83-Y86 HydrophobicContact CG2-CD2 4.36Å; I83-Y86 PolarHBondContact O-N 3.44Å; A84-Y86 VanDerWaalsContact C-N 3.33Å; A84-Y86 PolarHBondContact O-N 3.01Å; Y86-N92 HydrophobicContact CD1-CB 4.41Å; Y86-A95 HydrophobicContact CD1-CB 4.13Å; Y86-A95 HydrophobicContact CE1-CB 3.6Å; Y86-A96 HydrophobicContact CD2-CB 3.95Å; Y86-A96 HydrophobicContact CG-CB 4.26Å; Y86-T99 HydrophobicContact CE2-CG2 4.28Å; Y86-T99 WeakPolarHBondContact CE2-OG1 3.42Å; Y86-T99 PolarHBondContact OH-OG1 3.47Å
87	S	75.6	Confident	82.6	Confident	71 Å²	71	57.6 Å²	57.6	50%	0.497	38%	0.378	S	S	.	.			trans	-73.2	149.9	171.8	59.4	0	0	0	0	111.8	T89 N92	S87-T89 PolarHBondContact O-N 3.29Å; S87-N92 PolarHBondContact N-ND2 3.15Å; S87-N92 WeakPolarHBondContact O-CB 3.15Å; S87-N92 PolarHBondContact O-ND2 3.16Å; S87-N92 VanDerWaalsContact O-ND2 3.15Å; S87-N92 PolarHBondContact OG-ND2 3.44Å
88	E	71.4	Confident	82.4	Confident	151 Å²	151	58.1 Å²	58.1	71%	0.706	38%	0.378	S	S	*	.	S	Bend	trans	-68.5	70.6	-179.6	-76.7	177.9	-168.1	0	0	112.5	R72	R72-E88 VanDerWaalsContact CD-CG 3.46Å; R72-E88 WeakPolarHBondContact CD-OE1 3.38Å; R72-E88 IonicContact NE-OE1 3.19Å; R72-E88 IonicContact NH1-OE1 2.69Å
89	T	73.5	Confident	82.5	Confident	67 Å²	67	55.7 Å²	55.7	41%	0.411	37%	0.367	S	S	.	.			trans	-124.8	149.5	174.2	64.7	0	0	0	0	110	S87 A91 N92 Y93	S87-T89 PolarHBondContact O-N 3.29Å; T89-A91 PolarHBondContact O-N 3.39Å; T89-N92 PolarHBondContact O-N 3.29Å; T89-N92 VanDerWaalsContact O-N 3.07Å; T89-N92 PolarHBondContact OG1-N 3.05Å; T89-N92 PolarHBondContact OG1-ND2 3.45Å; T89-Y93 PolarHBondContact O-N 3.09Å; T89-Y93 VanDerWaalsContact O-N 3.15Å
90	A	68.2	Low	82.5	Confident	93 Å²	93	55.7 Å²	55.7	77%	0.769	37%	0.367	S	S	*	.	H	α-helix	trans	-57.2	-32.9	177.6	0	0	0	0	0	112.4	Y93	A90-Y93 WeakPolarHBondContact O-CB 3.25Å; A90-Y93 PolarHBondContact O-N 2.95Å
91	A	74.1	Confident	82.4	Confident	84 Å²	84	56.3 Å²	56.3	69%	0.694	37%	0.37	S	S	*	.	H	α-helix	trans	-65.2	-39.3	176.7	0	0	0	0	0	112.7	T89	T89-A91 PolarHBondContact O-N 3.39Å
92	N	81.9	Confident	82.4	Confident	49 Å²	49	54.6 Å²	54.6	26%	0.262	37%	0.366	S	S	.	.	H	α-helix	trans	-81.7	-17.8	-179.2	-70.5	-19.5	0	0	0	113.5	Y86 S87 T89 A94 A95 A96	Y86-N92 HydrophobicContact CD1-CB 4.41Å; S87-N92 PolarHBondContact N-ND2 3.15Å; S87-N92 WeakPolarHBondContact O-CB 3.15Å; S87-N92 PolarHBondContact O-ND2 3.16Å; S87-N92 VanDerWaalsContact O-ND2 3.15Å; S87-N92 PolarHBondContact OG-ND2 3.44Å; T89-N92 PolarHBondContact O-N 3.29Å; T89-N92 VanDerWaalsContact O-N 3.07Å; T89-N92 PolarHBondContact OG1-N 3.05Å; T89-N92 PolarHBondContact OG1-ND2 3.45Å; N92-A94 VanDerWaalsContact C-N 3.3Å; N92-A94 PolarHBondContact O-N 3.34Å; N92-A95 WeakPolarHBondContact O-CB 3.35Å; N92-A95 PolarHBondContact O-N 3.01Å; N92-A96 PolarHBondContact O-N 3.23Å
93	Y	83	Confident	82.5	Confident	40 Å²	40	59.4 Å²	59.4	16%	0.157	38%	0.381	C	S	.	.	H	α-helix	trans	-55.1	-45.8	-178.2	-177.4	-96.7	0	0	0	112.1	F61 H66 S69 L71 T89 A90 A95 A96 V97	F61-Y93 WeakPolarHBondContact CZ-OH 3.48Å; H66-Y93 AromaticContact CE1-CE1 3.69Å; H66-Y93 AromaticContact ND1-CE1 3.72Å; H66-Y93 AromaticContact ND1-CZ 3.7Å; H66-Y93 PolarHBondContact ND1-OH 3.31Å; S69-Y93 VanDerWaalsContact CA-CE2 3.44Å; S69-Y93 WeakPolarHBondContact O-CD2 3.44Å; S69-Y93 VanDerWaalsContact O-CE2 3.22Å; S69-Y93 WeakPolarHBondContact O-CE2 3.37Å; L71-Y93 HydrophobicContact CB-CD2 4.23Å; L71-Y93 HydrophobicContact CB-CE2 3.54Å; L71-Y93 HydrophobicContact CD2-CE2 4.39Å; T89-Y93 PolarHBondContact O-N 3.09Å; T89-Y93 VanDerWaalsContact O-N 3.15Å; A90-Y93 WeakPolarHBondContact O-CB 3.25Å; A90-Y93 PolarHBondContact O-N 2.95Å; Y93-A95 VanDerWaalsContact C-N 3.32Å; Y93-A95 PolarHBondContact O-N 3.42Å; Y93-A96 PolarHBondContact O-N 3.08Å; Y93-V97 HydrophobicContact CD1-CG2 4.04Å; Y93-V97 HydrophobicContact CE1-CG2 3.61Å; Y93-V97 HydrophobicContact CE2-CG2 4.29Å; Y93-V97 WeakPolarHBondContact O-CB 3.5Å; Y93-V97 WeakPolarHBondContact O-CG2 3.46Å; Y93-V97 PolarHBondContact O-N 3.35Å
94	A	81.3	Confident	82.7	Confident	68 Å²	68	59.6 Å²	59.6	56%	0.562	38%	0.381	S	S	*	.	H	α-helix	trans	-60.4	-41	177.6	0	0	0	0	0	112	N92 A98	N92-A94 VanDerWaalsContact C-N 3.3Å; N92-A94 PolarHBondContact O-N 3.34Å; A94-A98 VanDerWaalsContact O-CB 3.28Å; A94-A98 WeakPolarHBondContact O-CB 3.45Å; A94-A98 PolarHBondContact O-N 3.43Å
95	A	85	Confident	82.8	Confident	36 Å²	36	58.4 Å²	58.4	30%	0.298	37%	0.374	S	S	.	.	H	α-helix	trans	-68.8	-39.2	177.3	0	0	0	0	0	112.4	Y86 N92 Y93 A98 T99	Y86-A95 HydrophobicContact CD1-CB 4.13Å; Y86-A95 HydrophobicContact CE1-CB 3.6Å; N92-A95 WeakPolarHBondContact O-CB 3.35Å; N92-A95 PolarHBondContact O-N 3.01Å; Y93-A95 VanDerWaalsContact C-N 3.32Å; Y93-A95 PolarHBondContact O-N 3.42Å; A95-A98 PolarHBondContact O-N 2.91Å; A95-T99 WeakPolarHBondContact O-CB 3.27Å; A95-T99 PolarHBondContact O-N 3.19Å; A95-T99 PolarHBondContact O-OG1 3.07Å
96	A	87.3	Confident	82.8	Confident	6 Å²	6	60.9 Å²	60.9	5%	0.05	36%	0.358	C	S	.	.	H	α-helix	trans	-65.2	-44.5	175.7	0	0	0	0	0	111.8	L71 I83 Y86 N92 Y93 T99 L100	L71-A96 HydrophobicContact CD2-CB 3.99Å; I83-A96 HydrophobicContact CB-CB 4.22Å; I83-A96 HydrophobicContact CD1-CB 4.38Å; I83-A96 HydrophobicContact CG2-CB 4.07Å; Y86-A96 HydrophobicContact CD2-CB 3.95Å; Y86-A96 HydrophobicContact CG-CB 4.26Å; N92-A96 PolarHBondContact O-N 3.23Å; Y93-A96 PolarHBondContact O-N 3.08Å; A96-T99 PolarHBondContact O-N 3.32Å; A96-L100 PolarHBondContact O-N 3.18Å
97	V	86.8	Confident	82.6	Confident	14 Å²	14	60.7 Å²	60.7	9%	0.085	37%	0.365	C	S	.	.	H	α-helix	trans	-60.9	-46.4	173.5	167.3	0	0	0	0	111	W58 L71 Y93 T99 L100 K101	W58-V97 HydrophobicContact CH2-CB 4.36Å; W58-V97 HydrophobicContact CH2-CG1 3.48Å; W58-V97 VanDerWaalsContact CH2-CG1 3.48Å; W58-V97 HydrophobicContact CH2-CG2 4.12Å; W58-V97 HydrophobicContact CZ2-CG1 4.05Å; W58-V97 HydrophobicContact CZ3-CG1 4.38Å; L71-V97 HydrophobicContact CD2-CG2 3.8Å; Y93-V97 HydrophobicContact CD1-CG2 4.04Å; Y93-V97 HydrophobicContact CE1-CG2 3.61Å; Y93-V97 HydrophobicContact CE2-CG2 4.29Å; Y93-V97 WeakPolarHBondContact O-CB 3.5Å; Y93-V97 WeakPolarHBondContact O-CG2 3.46Å; Y93-V97 PolarHBondContact O-N 3.35Å; V97-T99 VanDerWaalsContact C-N 3.27Å; V97-T99 PolarHBondContact O-N 3.2Å; V97-L100 PolarHBondContact O-N 3.29Å; V97-K101 HydrophobicContact CG1-CD 4.31Å; V97-K101 HydrophobicContact CG1-CG 4.5Å; V97-K101 PolarHBondContact O-N 3.04Å
98	A	86.3	Confident	82.7	Confident	57 Å²	57	62.3 Å²	62.3	47%	0.471	37%	0.368	S	S	.	.	H	α-helix	trans	-59.9	-39.5	177	0	0	0	0	0	111.7	A94 A95 S102	A94-A98 VanDerWaalsContact O-CB 3.28Å; A94-A98 WeakPolarHBondContact O-CB 3.45Å; A94-A98 PolarHBondContact O-N 3.43Å; A95-A98 PolarHBondContact O-N 2.91Å; A98-S102 WeakPolarHBondContact O-CB 3.38Å; A98-S102 PolarHBondContact O-N 3.42Å
99	T	89.1	Confident	83.2	Confident	36 Å²	36	57.6 Å²	57.6	22%	0.221	35%	0.348	C	S	.	.	H	α-helix	trans	-66.1	-42	177.1	-59.7	0	0	0	0	112.2	A82 I83 Y86 A95 A96 V97 S102 R103	A82-T99 WeakPolarHBondContact O-CG2 3.48Å; I83-T99 HydrophobicContact CG2-CG2 4.43Å; Y86-T99 HydrophobicContact CE2-CG2 4.28Å; Y86-T99 WeakPolarHBondContact CE2-OG1 3.42Å; Y86-T99 PolarHBondContact OH-OG1 3.47Å; A95-T99 WeakPolarHBondContact O-CB 3.27Å; A95-T99 PolarHBondContact O-N 3.19Å; A95-T99 PolarHBondContact O-OG1 3.07Å; A96-T99 PolarHBondContact O-N 3.32Å; V97-T99 VanDerWaalsContact C-N 3.27Å; V97-T99 PolarHBondContact O-N 3.2Å; T99-S102 PolarHBondContact O-N 2.79Å; T99-R103 VanDerWaalsContact O-CB 3.26Å; T99-R103 WeakPolarHBondContact O-CB 3.21Å; T99-R103 PolarHBondContact O-N 3.12Å
100	L	90	Very high	83.6	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-65.6	-48.2	175.8	-78.3	160.3	0	0	0	112.5	L71 L75 A79 I83 A96 V97 S102 R103 F104	L71-L100 HydrophobicContact CD1-CD1 3.67Å; L71-L100 HydrophobicContact CD2-CD1 3.48Å; L71-L100 VanDerWaalsContact CD2-CD1 3.48Å; L71-L100 HydrophobicContact CG-CD1 3.88Å; L75-L100 HydrophobicContact CD1-CD1 3.51Å; L75-L100 HydrophobicContact CD1-CD2 4.07Å; L75-L100 HydrophobicContact CD1-CG 4.37Å; L75-L100 HydrophobicContact CD2-CD1 4.2Å; L75-L100 HydrophobicContact CD2-CD2 4.07Å; L75-L100 HydrophobicContact CG-CD1 4.48Å; A79-L100 HydrophobicContact CB-CD2 4.29Å; I83-L100 HydrophobicContact CG2-CD1 4.01Å; I83-L100 HydrophobicContact CG2-CD2 4.35Å; I83-L100 HydrophobicContact CG2-CG 3.75Å; A96-L100 PolarHBondContact O-N 3.18Å; V97-L100 PolarHBondContact O-N 3.29Å; L100-S102 VanDerWaalsContact C-N 3.3Å; L100-S102 PolarHBondContact O-N 2.88Å; L100-R103 PolarHBondContact O-N 3.36Å; L100-F104 HydrophobicContact CD2-CD2 3.85Å; L100-F104 HydrophobicContact CD2-CE2 3.87Å; L100-F104 PolarHBondContact O-N 3.5Å
101	K	88.3	Confident	84.1	Confident	86 Å²	86	50.5 Å²	50.5	37%	0.374	30%	0.295	S	S	.	.	H	α-helix	trans	-60.3	-42.8	175.6	-74	-170.9	176.6	-173.3	0	110.8	F54 W58 V97 R103 G105	F54-K101 HydrophobicContact CZ-CG 4.2Å; W58-K101 HydrophobicContact CZ2-CD 4.43Å; V97-K101 HydrophobicContact CG1-CD 4.31Å; V97-K101 HydrophobicContact CG1-CG 4.5Å; V97-K101 PolarHBondContact O-N 3.04Å; K101-R103 PolarHBondContact O-N 3.15Å; K101-G105 CarbonylContact O-C 3.56Å; K101-G105 VanDerWaalsContact O-C 3.29Å; K101-G105 WeakPolarHBondContact O-CA 3.45Å; K101-G105 PolarHBondContact O-N 3.35Å
102	S	86.4	Confident	84.2	Confident	64 Å²	64	51.9 Å²	51.9	45%	0.448	29%	0.287	S	S	.	.	H	α-helix	trans	-65.1	-36	176.3	-179.9	0	0	0	0	112.3	A98 T99 L100 R106	A98-S102 WeakPolarHBondContact O-CB 3.38Å; A98-S102 PolarHBondContact O-N 3.42Å; T99-S102 PolarHBondContact O-N 2.79Å; L100-S102 VanDerWaalsContact C-N 3.3Å; L100-S102 PolarHBondContact O-N 2.88Å; S102-R106 WeakPolarHBondContact O-CD 3.38Å; S102-R106 WeakPolarHBondContact O-CG 3.5Å; S102-R106 PolarHBondContact O-NE 2.84Å; S102-R106 PolarHBondContact O-NH2 3.36Å
103	R	87.5	Confident	84.2	Confident	118 Å²	118	54.2 Å²	54.2	45%	0.445	30%	0.295	S	S	.	.	H	α-helix	trans	-85.5	-40.6	-176.1	-170.7	170.2	179.3	168.3	-3	113.6	A82 T99 L100 K101	A82-R103 VanDerWaalsContact CB-NH1 3.3Å; T99-R103 VanDerWaalsContact O-CB 3.26Å; T99-R103 WeakPolarHBondContact O-CB 3.21Å; T99-R103 PolarHBondContact O-N 3.12Å; L100-R103 PolarHBondContact O-N 3.36Å; K101-R103 PolarHBondContact O-N 3.15Å
104	F	92.3	Very high	84.2	Confident	6 Å²	6	53 Å²	53	3%	0.026	29%	0.291	C	S	.	.	H	α-helix	trans	-117	-28.7	-171.2	-55.3	-75.4	0	0	0	113.3	F47 G49 V51 F54 I78 A79 A82 L100 R106	F47-F104 HydrophobicContact CE1-CB 4.1Å; F47-F104 HydrophobicContact CE1-CD1 4.27Å; F47-F104 AromaticContact CE1-CD2 3.96Å; F47-F104 HydrophobicContact CE1-CD2 3.96Å; F47-F104 HydrophobicContact CE1-CE2 4.48Å; F47-F104 AromaticContact CE1-CG 3.85Å; F47-F104 HydrophobicContact CE1-CG 3.85Å; F47-F104 HydrophobicContact CZ-CB 4.04Å; F47-F104 HydrophobicContact CZ-CD1 4.3Å; F47-F104 HydrophobicContact CZ-CG 4.09Å; G49-F104 WeakPolarHBondContact O-CD1 3.37Å; V51-F104 HydrophobicContact CG2-CD1 4.31Å; F54-F104 HydrophobicContact CB-CB 4.38Å; F54-F104 HydrophobicContact CD2-CB 3.5Å; F54-F104 VanDerWaalsContact CD2-CB 3.5Å; F54-F104 HydrophobicContact CE2-CB 3.93Å; F54-F104 HydrophobicContact CG-CB 3.98Å; I78-F104 HydrophobicContact CD1-CE1 4.04Å; I78-F104 HydrophobicContact CG1-CE1 4.27Å; I78-F104 HydrophobicContact CG1-CZ 4.32Å; A79-F104 HydrophobicContact CB-CE2 3.97Å; A79-F104 HydrophobicContact CB-CZ 4.1Å; A82-F104 HydrophobicContact CB-CE2 3.99Å; A82-F104 HydrophobicContact CB-CZ 4.4Å; L100-F104 HydrophobicContact CD2-CD2 3.85Å; L100-F104 HydrophobicContact CD2-CE2 3.87Å; L100-F104 PolarHBondContact O-N 3.5Å; F104-R106 VanDerWaalsContact C-N 3.3Å; F104-R106 PolarHBondContact O-N 2.87Å
105	G	86.2	Confident	83.9	Confident	22 Å²	22	52.3 Å²	52.3	23%	0.227	28%	0.277	C	S	.	.			trans	-87.9	28.5	-177.2	0	0	0	0	0	115.5	K101 P107	K101-G105 CarbonylContact O-C 3.56Å; K101-G105 VanDerWaalsContact O-C 3.29Å; K101-G105 WeakPolarHBondContact O-CA 3.45Å; K101-G105 PolarHBondContact O-N 3.35Å; G105-P107 VanDerWaalsContact O-CD 3.3Å; G105-P107 WeakPolarHBondContact O-CD 3.25Å
106	R	83	Confident	83.4	Confident	135 Å²	135	53.5 Å²	53.5	51%	0.509	28%	0.278	S	S	.	.			trans	-82.2	112.8	179	-66.7	-176.2	-176.9	164.5	12.4	109.9	S102 F104 N108 L109 I110	S102-R106 WeakPolarHBondContact O-CD 3.38Å; S102-R106 WeakPolarHBondContact O-CG 3.5Å; S102-R106 PolarHBondContact O-NE 2.84Å; S102-R106 PolarHBondContact O-NH2 3.36Å; F104-R106 VanDerWaalsContact C-N 3.3Å; F104-R106 PolarHBondContact O-N 2.87Å; R106-N108 VanDerWaalsContact C-N 3.25Å; R106-N108 PolarHBondContact O-N 2.96Å; R106-N108 VanDerWaalsContact O-N 3.15Å; R106-L109 HydrophobicContact CB-CB 3.84Å; R106-L109 PolarHBondContact O-N 3.43Å; R106-I110 WeakPolarHBondContact O-CG1 3.48Å; R106-I110 PolarHBondContact O-N 3.22Å
107	P	77.6	Confident	83.1	Confident	71 Å²	71	56.1 Å²	56.1	46%	0.461	29%	0.29	S	S	.	.	H	α-helix	trans	-55.2	-39.3	-175.9	-27.1	35.7	0	0	0	113.5	G105 I110 A111 L149	G105-P107 VanDerWaalsContact O-CD 3.3Å; G105-P107 WeakPolarHBondContact O-CD 3.25Å; P107-I110 PolarHBondContact O-N 3.01Å; P107-A111 WeakPolarHBondContact O-CB 3.22Å; P107-A111 PolarHBondContact O-N 2.95Å; P107-L149 HydrophobicContact CB-CD2 4.49Å
108	N	78.8	Confident	82.5	Confident	105 Å²	105	55.8 Å²	55.8	56%	0.561	29%	0.287	S	S	*	.	H	α-helix	trans	-67.7	-37.1	178.5	-66.2	-20.4	0	0	0	112.9	R106 A111 E112 K151	R106-N108 VanDerWaalsContact C-N 3.25Å; R106-N108 PolarHBondContact O-N 2.96Å; R106-N108 VanDerWaalsContact O-N 3.15Å; N108-A111 PolarHBondContact O-N 2.83Å; N108-E112 WeakPolarHBondContact O-CB 3.28Å; N108-E112 PolarHBondContact O-N 3.23Å; N108-K151 WeakPolarHBondContact OD1-CE 3.5Å; N108-K151 PolarHBondContact OD1-NZ 3.08Å
109	L	80.4	Confident	81.6	Confident	53 Å²	53	57.8 Å²	57.8	28%	0.277	29%	0.288	S	S	.	.	H	α-helix	trans	-70.8	-39.3	178	-175.6	68.5	0	0	0	111.1	V51 R106 E112 K113	V51-L109 HydrophobicContact CG1-CD2 4.12Å; V51-L109 HydrophobicContact CG1-CG 4.08Å; V51-L109 HydrophobicContact CG2-CD2 3.94Å; R106-L109 HydrophobicContact CB-CB 3.84Å; R106-L109 PolarHBondContact O-N 3.43Å; L109-E112 PolarHBondContact O-N 2.97Å; L109-K113 WeakPolarHBondContact O-CG 3.47Å; L109-K113 PolarHBondContact O-N 3.47Å
110	I	83.1	Confident	80.7	Confident	5 Å²	5	63 Å²	63	3%	0.026	31%	0.31	C	S	.	.	H	α-helix	trans	-63.8	-45.7	175.1	-57.8	164.3	0	0	0	109.5	V51 R106 P107 K113 H114 L149	V51-I110 HydrophobicContact CG1-CB 4.12Å; V51-I110 HydrophobicContact CG1-CG1 3.39Å; R106-I110 WeakPolarHBondContact O-CG1 3.48Å; R106-I110 PolarHBondContact O-N 3.22Å; P107-I110 PolarHBondContact O-N 3.01Å; I110-K113 PolarHBondContact O-N 2.88Å; I110-H114 PolarHBondContact O-CD2 3.41Å; I110-H114 VanDerWaalsContact O-CD2 3.3Å; I110-H114 PolarHBondContact O-N 3.35Å; I110-L149 HydrophobicContact CB-CD1 4.06Å; I110-L149 HydrophobicContact CG2-CD1 3.7Å
111	A	77.2	Confident	79.8	Confident	6 Å²	6	63.3 Å²	63.3	5%	0.05	31%	0.312	C	S	.	.	H	α-helix	trans	-60.4	-46.1	175.9	0	0	0	0	0	112.1	P107 N108 K113 H114 I115 L146 L149 K151	P107-A111 WeakPolarHBondContact O-CB 3.22Å; P107-A111 PolarHBondContact O-N 2.95Å; N108-A111 PolarHBondContact O-N 2.83Å; A111-K113 VanDerWaalsContact C-N 3.3Å; A111-K113 PolarHBondContact O-N 3.44Å; A111-H114 PolarHBondContact O-N 3.35Å; A111-I115 VanDerWaalsContact O-CG1 3.3Å; A111-I115 WeakPolarHBondContact O-CG1 3.4Å; A111-I115 PolarHBondContact O-N 3.06Å; A111-L146 HydrophobicContact CB-CD2 3.8Å; A111-L149 HydrophobicContact CB-CD1 4.29Å; A111-K151 HydrophobicContact CB-CB 4.13Å; A111-K151 HydrophobicContact CB-CG 3.97Å
112	E	77	Confident	78.8	Confident	112 Å²	112	67.3 Å²	67.3	52%	0.523	33%	0.332	S	S	.	.	H	α-helix	trans	-58.7	-41	176.7	-172.9	-176.3	174.4	0	0	111.9	N108 L109 I115 L116	N108-E112 WeakPolarHBondContact O-CB 3.28Å; N108-E112 PolarHBondContact O-N 3.23Å; L109-E112 PolarHBondContact O-N 2.97Å; E112-I115 PolarHBondContact O-N 3.38Å; E112-L116 HydrophobicContact CG-CD1 4.38Å; E112-L116 WeakPolarHBondContact O-CB 3.34Å; E112-L116 WeakPolarHBondContact O-CG 3.39Å; E112-L116 PolarHBondContact O-N 3.22Å
113	K	81.1	Confident	77.7	Confident	99 Å²	99	70.4 Å²	70.4	43%	0.43	34%	0.337	S	S	.	.	H	α-helix	trans	-65.5	-41	176.1	-76.8	-70.4	-173.7	-178.6	0	112.8	L52 L109 I110 A111 I115 L116 E117	L52-K113 HydrophobicContact CD2-CB 3.51Å; L52-K113 HydrophobicContact CG-CB 3.99Å; L109-K113 WeakPolarHBondContact O-CG 3.47Å; L109-K113 PolarHBondContact O-N 3.47Å; I110-K113 PolarHBondContact O-N 2.88Å; A111-K113 VanDerWaalsContact C-N 3.3Å; A111-K113 PolarHBondContact O-N 3.44Å; K113-I115 VanDerWaalsContact C-N 3.34Å; K113-L116 PolarHBondContact O-N 3.21Å; K113-E117 PolarHBondContact O-N 2.82Å
114	H	83.4	Confident	76.6	Confident	15 Å²	15	65.1 Å²	65.1	7%	0.069	32%	0.318	C	S	.	.	H	α-helix	trans	-64.2	-38.7	173.6	-79.3	-61.5	0	0	0	112.2	I110 A111 E117 L118 N142 A145 L146	I110-H114 PolarHBondContact O-CD2 3.41Å; I110-H114 VanDerWaalsContact O-CD2 3.3Å; I110-H114 PolarHBondContact O-N 3.35Å; A111-H114 PolarHBondContact O-N 3.35Å; H114-E117 PolarHBondContact O-N 3.03Å; H114-L118 WeakPolarHBondContact O-CG 3.47Å; H114-L118 PolarHBondContact O-N 2.81Å; H114-N142 HydrophobicContact CB-CB 4.43Å; H114-N142 PolarHBondContact ND1-OD1 2.94Å; H114-A145 WeakPolarHBondContact CE1-CB 3.27Å; H114-A145 VanDerWaalsContact NE2-CB 3.26Å; H114-A145 WeakPolarHBondContact NE2-CB 3.37Å; H114-L146 HydrophobicContact CB-CD1 4.36Å; H114-L146 HydrophobicContact CB-CD2 3.97Å; H114-L146 HydrophobicContact CB-CG 3.93Å
115	I	75.5	Confident	75.3	Confident	52 Å²	52	71.2 Å²	71.2	27%	0.267	35%	0.351	S	S	.	.	H	α-helix	trans	-63.5	-45.6	174.5	-67.9	164.1	0	0	0	110.3	A111 E112 K113 E117 L118 M119 L146 L158	A111-I115 VanDerWaalsContact O-CG1 3.3Å; A111-I115 WeakPolarHBondContact O-CG1 3.4Å; A111-I115 PolarHBondContact O-N 3.06Å; E112-I115 PolarHBondContact O-N 3.38Å; K113-I115 VanDerWaalsContact C-N 3.34Å; I115-E117 VanDerWaalsContact C-N 3.33Å; I115-E117 PolarHBondContact O-N 2.96Å; I115-L118 WeakPolarHBondContact O-CB 3.5Å; I115-L118 PolarHBondContact O-N 2.84Å; I115-M119 HydrophobicContact CG2-CG 4.5Å; I115-M119 HydrophobicContact CG2-SD 4.1Å; I115-M119 VanDerWaalsContact O-CG 3.31Å; I115-M119 WeakPolarHBondContact O-CG 3.29Å; I115-M119 PolarHBondContact O-N 3.41Å; I115-L146 HydrophobicContact CD1-CD2 4.5Å; I115-L146 HydrophobicContact CG1-CD1 4.09Å; I115-L146 HydrophobicContact CG1-CD2 4.14Å; I115-L158 HydrophobicContact CD1-CD2 4.09Å
116	L	75.2	Confident	74.1	Confident	61 Å²	61	78.6 Å²	78.6	32%	0.319	37%	0.372	S	S	.	.	H	α-helix	trans	-61.5	-40	176.5	-75.7	169.9	0	0	0	112.2	E112 K113 M119 Q120	E112-L116 HydrophobicContact CG-CD1 4.38Å; E112-L116 WeakPolarHBondContact O-CB 3.34Å; E112-L116 WeakPolarHBondContact O-CG 3.39Å; E112-L116 PolarHBondContact O-N 3.22Å; K113-L116 PolarHBondContact O-N 3.21Å; L116-M119 PolarHBondContact O-N 2.87Å; L116-Q120 WeakPolarHBondContact O-CB 3.22Å; L116-Q120 VanDerWaalsContact O-CG 3.3Å; L116-Q120 WeakPolarHBondContact O-CG 3.44Å; L116-Q120 PolarHBondContact O-N 2.97Å
117	E	79.2	Confident	73.5	Confident	62 Å²	62	74.1 Å²	74.1	29%	0.29	36%	0.361	S	S	.	.	H	α-helix	trans	-68	-36.2	177	-163.4	178.8	165.1	0	0	111.9	L52 K113 H114 I115 M119 Q120 T121 R141 N142	L52-E117 WeakPolarHBondContact CD1-OE2 3.23Å; K113-E117 PolarHBondContact O-N 2.82Å; H114-E117 PolarHBondContact O-N 3.03Å; I115-E117 VanDerWaalsContact C-N 3.33Å; I115-E117 PolarHBondContact O-N 2.96Å; E117-M119 VanDerWaalsContact C-N 3.34Å; E117-Q120 CarbonylContact O-C 3.57Å; E117-Q120 PolarHBondContact O-N 2.92Å; E117-T121 PolarHBondContact O-N 3.02Å; E117-T121 PolarHBondContact O-OG1 2.87Å; E117-R141 IonicContact OE1-NH1 2.76Å; E117-R141 PolarHBondContact OE1-NH1 2.86Å; E117-N142 PolarHBondContact OE2-OD1 3.38Å
118	L	75	Confident	73.4	Confident	6 Å²	6	73.6 Å²	73.6	3%	0.031	36%	0.356	C	S	.	.	H	α-helix	trans	-62.2	-40.6	169.9	-78.4	167.3	0	0	0	112	H114 I115 Q120 T121 V139 N142 V143 L146	H114-L118 WeakPolarHBondContact O-CG 3.47Å; H114-L118 PolarHBondContact O-N 2.81Å; I115-L118 WeakPolarHBondContact O-CB 3.5Å; I115-L118 PolarHBondContact O-N 2.84Å; L118-Q120 VanDerWaalsContact C-N 3.34Å; L118-T121 PolarHBondContact O-OG1 3.2Å; L118-V139 HydrophobicContact CD2-CB 4.28Å; L118-V139 HydrophobicContact CD2-CG1 4.05Å; L118-V139 HydrophobicContact CD2-CG2 4.35Å; L118-N142 HydrophobicContact CD1-CB 3.84Å; L118-N142 HydrophobicContact CD2-CB 3.74Å; L118-N142 HydrophobicContact CG-CB 3.5Å; L118-N142 VanDerWaalsContact CG-CB 3.5Å; L118-V143 HydrophobicContact CD2-CG2 4.43Å; L118-L146 HydrophobicContact CD1-CD1 3.74Å
119	M	67.2	Low	73.3	Confident	99 Å²	99	69.3 Å²	69.3	49%	0.488	34%	0.335	S	S	.	.	H	α-helix	trans	-73.1	-25.8	178.2	-68.1	179.9	75.5	0	0	113.3	I115 L116 E117	I115-M119 HydrophobicContact CG2-CG 4.5Å; I115-M119 HydrophobicContact CG2-SD 4.1Å; I115-M119 VanDerWaalsContact O-CG 3.31Å; I115-M119 WeakPolarHBondContact O-CG 3.29Å; I115-M119 PolarHBondContact O-N 3.41Å; L116-M119 PolarHBondContact O-N 2.87Å; E117-M119 VanDerWaalsContact C-N 3.34Å
120	Q	71	Confident	73.3	Confident	146 Å²	146	75.8 Å²	75.8	68%	0.682	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	17.4	-177	-63.7	179	14.5	0	0	113.2	L116 E117 L118 E122	L116-Q120 WeakPolarHBondContact O-CB 3.22Å; L116-Q120 VanDerWaalsContact O-CG 3.3Å; L116-Q120 WeakPolarHBondContact O-CG 3.44Å; L116-Q120 PolarHBondContact O-N 2.97Å; E117-Q120 CarbonylContact O-C 3.57Å; E117-Q120 PolarHBondContact O-N 2.92Å; L118-Q120 VanDerWaalsContact C-N 3.34Å; Q120-E122 PolarHBondContact O-N 3.26Å
121	T	70.4	Confident	73.1	Confident	6 Å²	6	78.5 Å²	78.5	4%	0.037	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-57.2	131.5	178.3	-61.6	0	0	0	0	109.9	E117 L118 V135 T138 E169	E117-T121 PolarHBondContact O-N 3.02Å; E117-T121 PolarHBondContact O-OG1 2.87Å; L118-T121 PolarHBondContact O-OG1 3.2Å; T121-V135 HydrophobicContact CG2-CG1 4.25Å; T121-T138 HydrophobicContact CG2-CG2 4.16Å; T121-E169 WeakPolarHBondContact O-CB 3.41Å; T121-E169 VanDerWaalsContact O-CD 3.27Å; T121-E169 WeakPolarHBondContact O-CG 3.21Å
122	E	67.4	Low	73.4	Confident	170 Å²	170	78.6 Å²	78.6	79%	0.794	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-62.6	136.7	-173	-68.1	-173.9	156.8	0	0	113.4	Q120 C124	Q120-E122 PolarHBondContact O-N 3.26Å; E122-C124 PolarHBondContact O-N 3.39Å
123	K	63.4	Low	73.8	Confident	129 Å²	129	76 Å²	76	56%	0.561	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-55.3	118.7	177	-71.4	-170.2	176.6	171.4	0	113.2	N125 E169	K123-N125 PolarHBondContact O-N 3.02Å; K123-E169 WeakPolarHBondContact CA-O 3.43Å; K123-E169 WeakPolarHBondContact CE-OE1 3.33Å; K123-E169 VanDerWaalsContact CE-OE2 3.31Å; K123-E169 WeakPolarHBondContact CE-OE2 3.4Å; K123-E169 WeakPolarHBondContact CG-OE2 3.44Å; K123-E169 PolarHBondContact N-OE2 2.69Å; K123-E169 IonicContact NZ-OE1 3.67Å
124	C	64.9	Low	74	Confident	8 Å²	8	76 Å²	76	5%	0.054	36%	0.355	C	S	.	.			trans	-74.8	95.9	165.6	177.1	0	0	0	0	109.7	E122 R126 V135 E169 S171	E122-C124 PolarHBondContact O-N 3.39Å; C124-R126 PolarHBondContact SG-O 3.08Å; C124-V135 HydrophobicContact CB-CG2 3.97Å; C124-E169 PolarHBondContact N-O 2.85Å; C124-S171 WeakPolarHBondContact O-CA 3.49Å; C124-S171 WeakPolarHBondContact O-CB 3.28Å; C124-S171 PolarHBondContact O-N 3.24Å
125	N	63.7	Low	73.9	Confident	134 Å²	134	75.9 Å²	75.9	72%	0.717	36%	0.355	S	S	*	.	S	Bend	trans	-77.2	-26	178.9	-70.8	-47.6	0	0	0	112.3	K123	K123-N125 PolarHBondContact O-N 3.02Å
126	R	62.5	Low	74.5	Confident	177 Å²	177	73.9 Å²	73.9	67%	0.668	35%	0.345	S	S	*	.	S	Bend	trans	-134.3	124.1	179.1	-63.5	-176.8	179.3	-179.6	0.7	110	C124 T128 E131	C124-R126 PolarHBondContact SG-O 3.08Å; R126-T128 HydrophobicContact CB-CG2 4.2Å; R126-T128 PolarHBondContact O-N 2.91Å; R126-E131 PolarHBondContact N-OE2 3.36Å; R126-E131 WeakPolarHBondContact O-CB 3.21Å
127	P	69.9	Low	75	Confident	41 Å²	41	74.2 Å²	74.2	27%	0.266	35%	0.347	S	S	.	.			trans	-75.5	59.1	-179.1	33.6	-36.7	0	0	0	111.4	L132 I173 V174	P127-L132 HydrophobicContact CB-CD1 4.16Å; P127-L132 HydrophobicContact CB-CG 4.42Å; P127-I173 HydrophobicContact CG-CD1 4.08Å; P127-V174 HydrophobicContact CB-CG2 4.36Å
128	T	75.3	Confident	75.2	Confident	60 Å²	60	72.5 Å²	72.5	37%	0.368	34%	0.341	S	S	.	.			trans	-82.8	149	170.8	66.1	0	0	0	0	108.8	R126 R130 E131 L132	R126-T128 HydrophobicContact CB-CG2 4.2Å; R126-T128 PolarHBondContact O-N 2.91Å; T128-R130 PolarHBondContact O-N 2.92Å; T128-E131 PolarHBondContact O-N 3.26Å; T128-E131 PolarHBondContact OG1-N 2.99Å; T128-L132 WeakPolarHBondContact O-CB 3.24Å; T128-L132 PolarHBondContact O-N 3.24Å
129	A	77.6	Confident	75.5	Confident	15 Å²	15	72.2 Å²	72.2	12%	0.124	34%	0.339	C	S	.	.	H	α-helix	trans	-46.9	-40.9	178.5	0	0	0	0	0	113	R133 E206 E207	A129-R133 VanDerWaalsContact O-CB 3.3Å; A129-R133 WeakPolarHBondContact O-CB 2.88Å; A129-R133 PolarHBondContact O-N 3.01Å; A129-E206 HydrophobicContact CB-CB 4.2Å; A129-E206 HydrophobicContact CB-CG 3.97Å; A129-E207 HydrophobicContact CB-CG 3.79Å
130	R	79.5	Confident	76.4	Confident	189 Å²	189	67.6 Å²	67.6	71%	0.713	32%	0.317	S	S	*	.	H	α-helix	trans	-67.7	-48.5	179.2	-175.2	-178.5	176.7	-180	0.9	113.3	T128 R133 Q134	T128-R130 PolarHBondContact O-N 2.92Å; R130-R133 PolarHBondContact O-N 3.38Å; R130-Q134 WeakPolarHBondContact O-CG 3.37Å; R130-Q134 PolarHBondContact O-N 3.08Å; R130-Q134 VanDerWaalsContact O-N 3.07Å
131	E	79.3	Confident	76.9	Confident	62 Å²	62	65.9 Å²	65.9	29%	0.29	30%	0.304	S	S	.	.	H	α-helix	trans	-66.5	-41	179.9	-73.7	-179.2	-151.3	0	0	110.5	R126 T128 Q134 V135	R126-E131 PolarHBondContact N-OE2 3.36Å; R126-E131 WeakPolarHBondContact O-CB 3.21Å; T128-E131 PolarHBondContact O-N 3.26Å; T128-E131 PolarHBondContact OG1-N 2.99Å; E131-Q134 PolarHBondContact O-N 3.08Å; E131-V135 PolarHBondContact O-N 3.33Å; E131-V135 VanDerWaalsContact O-N 3.14Å
132	L	82.2	Confident	77.6	Confident	7 Å²	7	65.6 Å²	65.6	4%	0.037	30%	0.302	C	S	.	.	H	α-helix	trans	-60.9	-45.1	174.8	-81.8	175.3	0	0	0	112.2	P127 T128 Q134 V135 H136 V174 V203 E206	P127-L132 HydrophobicContact CB-CD1 4.16Å; P127-L132 HydrophobicContact CB-CG 4.42Å; T128-L132 WeakPolarHBondContact O-CB 3.24Å; T128-L132 PolarHBondContact O-N 3.24Å; L132-Q134 VanDerWaalsContact C-N 3.33Å; L132-Q134 PolarHBondContact O-N 2.95Å; L132-V135 PolarHBondContact O-N 3.29Å; L132-H136 WeakPolarHBondContact O-CB 3.29Å; L132-H136 PolarHBondContact O-N 3Å; L132-V174 HydrophobicContact CD2-CG2 3.7Å; L132-V203 HydrophobicContact CB-CG2 3.76Å; L132-E206 HydrophobicContact CD1-CB 4.43Å
133	R	87.2	Confident	78.2	Confident	59 Å²	59	57.7 Å²	57.7	22%	0.223	27%	0.266	C	S	.	.	H	α-helix	trans	-60.6	-42.7	176.5	-169.8	112.8	-72.1	167.7	-2.1	111.3	A129 R130 V135 H136 D137 V203 E207	A129-R133 VanDerWaalsContact O-CB 3.3Å; A129-R133 WeakPolarHBondContact O-CB 2.88Å; A129-R133 PolarHBondContact O-N 3.01Å; R130-R133 PolarHBondContact O-N 3.38Å; R133-V135 PolarHBondContact O-N 3.11Å; R133-H136 PolarHBondContact O-N 3.31Å; R133-D137 WeakPolarHBondContact CG-OD2 3.32Å; R133-D137 WeakPolarHBondContact O-CB 3.1Å; R133-D137 PolarHBondContact O-N 3.38Å; R133-V203 HydrophobicContact CB-CG1 3.93Å; R133-V203 VanDerWaalsContact NH2-CG1 3.28Å; R133-E207 IonicContact CZ-OE1 3.8Å; R133-E207 IonicContact CZ-OE2 2.87Å; R133-E207 IonicContact NE-OE1 3.03Å; R133-E207 IonicContact NH1-OE1 3.86Å; R133-E207 PolarHBondContact NH1-OE1 3.44Å; R133-E207 IonicContact NH1-OE2 3.99Å; R133-E207 PolarHBondContact NH1-OE2 3Å
134	Q	83.4	Confident	79.1	Confident	99 Å²	99	59.2 Å²	59.2	46%	0.463	27%	0.268	S	S	.	.	H	α-helix	trans	-60.4	-42.3	178	-76.1	176.5	-35.3	0	0	112.7	R130 E131 L132 T138	R130-Q134 WeakPolarHBondContact O-CG 3.37Å; R130-Q134 PolarHBondContact O-N 3.08Å; R130-Q134 VanDerWaalsContact O-N 3.07Å; E131-Q134 PolarHBondContact O-N 3.08Å; L132-Q134 VanDerWaalsContact C-N 3.33Å; L132-Q134 PolarHBondContact O-N 2.95Å; Q134-T138 VanDerWaalsContact O-CB 3.31Å; Q134-T138 WeakPolarHBondContact O-CB 3.38Å; Q134-T138 PolarHBondContact O-N 3.27Å; Q134-T138 VanDerWaalsContact O-N 3.12Å; Q134-T138 PolarHBondContact O-OG1 3.23Å
135	V	81.8	Confident	79.8	Confident	11 Å²	11	60 Å²	60	7%	0.067	28%	0.275	C	S	.	.	H	α-helix	trans	-66.6	-49.6	175.6	175.8	0	0	0	0	110.7	T121 C124 E131 L132 R133 D137 T138 V139 T170 L199	T121-V135 HydrophobicContact CG2-CG1 4.25Å; C124-V135 HydrophobicContact CB-CG2 3.97Å; E131-V135 PolarHBondContact O-N 3.33Å; E131-V135 VanDerWaalsContact O-N 3.14Å; L132-V135 PolarHBondContact O-N 3.29Å; R133-V135 PolarHBondContact O-N 3.11Å; V135-D137 PolarHBondContact O-N 3.08Å; V135-T138 PolarHBondContact O-N 3.32Å; V135-V139 HydrophobicContact CG1-CG2 4.33Å; V135-V139 WeakPolarHBondContact O-CG2 3.3Å; V135-V139 PolarHBondContact O-N 3.02Å; V135-T170 HydrophobicContact CG1-CG2 4.29Å; V135-L199 HydrophobicContact CG1-CD1 4.35Å
136	H	87.7	Confident	80.6	Confident	10 Å²	10	53.8 Å²	53.8	5%	0.046	24%	0.242	C	C	.	.	H	α-helix	trans	-52.9	-52.3	176.8	167.3	-91.7	0	0	0	111.7	L132 R133 T138 V139 A140 V196 L199 Q200 V203	L132-H136 WeakPolarHBondContact O-CB 3.29Å; L132-H136 PolarHBondContact O-N 3Å; R133-H136 PolarHBondContact O-N 3.31Å; H136-T138 PolarHBondContact O-N 3.23Å; H136-V139 PolarHBondContact O-N 3.47Å; H136-A140 VanDerWaalsContact O-CB 3.23Å; H136-A140 WeakPolarHBondContact O-CB 3.43Å; H136-A140 PolarHBondContact O-N 3.18Å; H136-V196 PolarHBondContact CD2-O 3.37Å; H136-L199 HydrophobicContact CB-CB 4.2Å; H136-Q200 PolarHBondContact CD2-N 2.84Å; H136-V203 HydrophobicContact CB-CG2 4.18Å
137	D	87	Confident	81.4	Confident	68 Å²	68	48.1 Å²	48.1	36%	0.364	23%	0.227	S	C	.	.	H	α-helix	trans	-66.3	-30.2	-176.3	-65.6	-9.8	0	0	0	111.6	R133 V135 R141	R133-D137 WeakPolarHBondContact CG-OD2 3.32Å; R133-D137 WeakPolarHBondContact O-CB 3.1Å; R133-D137 PolarHBondContact O-N 3.38Å; V135-D137 PolarHBondContact O-N 3.08Å; D137-R141 WeakPolarHBondContact O-CB 3.46Å; D137-R141 PolarHBondContact O-N 3.01Å; D137-R141 PolarHBondContact O-NH2 2.7Å
138	T	83.5	Confident	81.7	Confident	27 Å²	27	50.2 Å²	50.2	17%	0.166	25%	0.248	C	C	.	.	H	α-helix	trans	-72.8	-46.9	176.4	-59.4	0	0	0	0	111.7	T121 Q134 V135 H136 R141 N142	T121-T138 HydrophobicContact CG2-CG2 4.16Å; Q134-T138 VanDerWaalsContact O-CB 3.31Å; Q134-T138 WeakPolarHBondContact O-CB 3.38Å; Q134-T138 PolarHBondContact O-N 3.27Å; Q134-T138 VanDerWaalsContact O-N 3.12Å; Q134-T138 PolarHBondContact O-OG1 3.23Å; V135-T138 PolarHBondContact O-N 3.32Å; H136-T138 PolarHBondContact O-N 3.23Å; T138-R141 PolarHBondContact OG1-NH2 3.43Å; T138-N142 PolarHBondContact O-N 3.12Å; T138-N142 PolarHBondContact O-ND2 3.41Å; T138-N142 VanDerWaalsContact O-ND2 3.08Å
139	V	81	Confident	81.7	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.6	-53.1	174.7	178.2	0	0	0	0	109.9	L118 V135 H136 R141 N142 V143 A166 L192 V196	L118-V139 HydrophobicContact CD2-CB 4.28Å; L118-V139 HydrophobicContact CD2-CG1 4.05Å; L118-V139 HydrophobicContact CD2-CG2 4.35Å; V135-V139 HydrophobicContact CG1-CG2 4.33Å; V135-V139 WeakPolarHBondContact O-CG2 3.3Å; V135-V139 PolarHBondContact O-N 3.02Å; H136-V139 PolarHBondContact O-N 3.47Å; V139-R141 VanDerWaalsContact C-N 3.31Å; V139-R141 PolarHBondContact O-N 3.5Å; V139-N142 PolarHBondContact O-N 2.76Å; V139-V143 HydrophobicContact CG1-CG2 4.1Å; V139-V143 WeakPolarHBondContact O-CG2 3.3Å; V139-V143 PolarHBondContact O-N 3.1Å; V139-A166 HydrophobicContact CG2-CB 4.42Å; V139-L192 HydrophobicContact CG1-CD2 4.01Å; V139-V196 HydrophobicContact CG1-CG2 3.76Å
140	A	85.2	Confident	81.5	Confident	2 Å²	2	55.9 Å²	55.9	2%	0.017	27%	0.273	C	S	.	.	H	α-helix	trans	-61.2	-36.2	-177.1	0	0	0	0	0	113.1	H136 R144 V196	H136-A140 VanDerWaalsContact O-CB 3.23Å; H136-A140 WeakPolarHBondContact O-CB 3.43Å; H136-A140 PolarHBondContact O-N 3.18Å; A140-R144 WeakPolarHBondContact O-CB 3.07Å; A140-R144 VanDerWaalsContact O-CG 3.28Å; A140-R144 WeakPolarHBondContact O-CG 3.16Å; A140-R144 PolarHBondContact O-N 3.39Å; A140-V196 HydrophobicContact CB-CG1 3.83Å
141	R	83.2	Confident	81	Confident	109 Å²	109	51.6 Å²	51.6	41%	0.411	26%	0.26	S	S	.	.	H	α-helix	trans	-63.2	-49.8	175.6	-176	-165.5	-37.5	110.2	11.6	111.7	E117 D137 T138 V139 A145	E117-R141 IonicContact OE1-NH1 2.76Å; E117-R141 PolarHBondContact OE1-NH1 2.86Å; D137-R141 WeakPolarHBondContact O-CB 3.46Å; D137-R141 PolarHBondContact O-N 3.01Å; D137-R141 PolarHBondContact O-NH2 2.7Å; T138-R141 PolarHBondContact OG1-NH2 3.43Å; V139-R141 VanDerWaalsContact C-N 3.31Å; V139-R141 PolarHBondContact O-N 3.5Å; R141-A145 WeakPolarHBondContact O-CB 3.41Å; R141-A145 PolarHBondContact O-N 2.99Å
142	N	83.6	Confident	80.2	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.3	-37.1	-177.4	-71.8	-39.7	0	0	0	111.9	H114 E117 L118 T138 V139 A145 L146	H114-N142 HydrophobicContact CB-CB 4.43Å; H114-N142 PolarHBondContact ND1-OD1 2.94Å; E117-N142 PolarHBondContact OE2-OD1 3.38Å; L118-N142 HydrophobicContact CD1-CB 3.84Å; L118-N142 HydrophobicContact CD2-CB 3.74Å; L118-N142 HydrophobicContact CG-CB 3.5Å; L118-N142 VanDerWaalsContact CG-CB 3.5Å; T138-N142 PolarHBondContact O-N 3.12Å; T138-N142 PolarHBondContact O-ND2 3.41Å; T138-N142 VanDerWaalsContact O-ND2 3.08Å; V139-N142 PolarHBondContact O-N 2.76Å; N142-A145 PolarHBondContact O-N 3.03Å; N142-L146 WeakPolarHBondContact O-CG 3.29Å; N142-L146 PolarHBondContact O-N 2.67Å
143	V	80.2	Confident	79	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.03	26%	0.26	C	S	.	.	H	α-helix	trans	-64.4	-50.5	176.3	175.6	0	0	0	0	110.9	L118 V139 A145 L146 V147 L192	L118-V143 HydrophobicContact CD2-CG2 4.43Å; V139-V143 HydrophobicContact CG1-CG2 4.1Å; V139-V143 WeakPolarHBondContact O-CG2 3.3Å; V139-V143 PolarHBondContact O-N 3.1Å; V143-A145 PolarHBondContact O-N 3.15Å; V143-L146 PolarHBondContact O-N 3.29Å; V143-L146 VanDerWaalsContact O-N 3.14Å; V143-V147 HydrophobicContact CG1-CG2 4.48Å; V143-V147 WeakPolarHBondContact O-CG2 3.49Å; V143-V147 PolarHBondContact O-N 2.84Å; V143-L192 HydrophobicContact CB-CD2 4.31Å; V143-L192 HydrophobicContact CG1-CD2 4.26Å; V143-L192 HydrophobicContact CG2-CD2 3.13Å; V143-L192 HydrophobicContact CG2-CG 4.43Å
144	R	82	Confident	77.3	Confident	161 Å²	161	51.7 Å²	51.7	61%	0.608	27%	0.267	S	S	*	.	H	α-helix	trans	-58.4	-38.1	176.2	-73.9	-175.6	-125.5	127.4	-3.9	112.3	A140 A148	A140-R144 WeakPolarHBondContact O-CB 3.07Å; A140-R144 VanDerWaalsContact O-CG 3.28Å; A140-R144 WeakPolarHBondContact O-CG 3.16Å; A140-R144 PolarHBondContact O-N 3.39Å; R144-A148 VanDerWaalsContact O-CB 3.31Å; R144-A148 WeakPolarHBondContact O-CB 3.24Å; R144-A148 PolarHBondContact O-N 3.37Å
145	A	80.8	Confident	75.9	Confident	24 Å²	24	53.9 Å²	53.9	20%	0.198	28%	0.282	C	S	.	.	H	α-helix	trans	-68.1	-39.2	177.6	0	0	0	0	0	112.7	H114 R141 N142 V143 A148 L149	H114-A145 WeakPolarHBondContact CE1-CB 3.27Å; H114-A145 VanDerWaalsContact NE2-CB 3.26Å; H114-A145 WeakPolarHBondContact NE2-CB 3.37Å; R141-A145 WeakPolarHBondContact O-CB 3.41Å; R141-A145 PolarHBondContact O-N 2.99Å; N142-A145 PolarHBondContact O-N 3.03Å; V143-A145 PolarHBondContact O-N 3.15Å; A145-A148 PolarHBondContact O-N 3.26Å; A145-L149 VanDerWaalsContact O-CG 3.32Å; A145-L149 WeakPolarHBondContact O-CG 3.37Å; A145-L149 PolarHBondContact O-N 2.98Å; A145-L149 VanDerWaalsContact O-N 3.09Å
146	L	80.9	Confident	74.1	Confident	3 Å²	3	60.4 Å²	60.4	2%	0.016	31%	0.312	C	S	.	.	H	α-helix	trans	-66.5	-43.2	175.2	-74.2	169.5	0	0	0	112.4	A111 H114 I115 L118 N142 V143 A148 L149 N150 K151 P153	A111-L146 HydrophobicContact CB-CD2 3.8Å; H114-L146 HydrophobicContact CB-CD1 4.36Å; H114-L146 HydrophobicContact CB-CD2 3.97Å; H114-L146 HydrophobicContact CB-CG 3.93Å; I115-L146 HydrophobicContact CD1-CD2 4.5Å; I115-L146 HydrophobicContact CG1-CD1 4.09Å; I115-L146 HydrophobicContact CG1-CD2 4.14Å; L118-L146 HydrophobicContact CD1-CD1 3.74Å; N142-L146 WeakPolarHBondContact O-CG 3.29Å; N142-L146 PolarHBondContact O-N 2.67Å; V143-L146 PolarHBondContact O-N 3.29Å; V143-L146 VanDerWaalsContact O-N 3.14Å; L146-A148 VanDerWaalsContact C-N 3.33Å; L146-A148 PolarHBondContact O-N 3.21Å; L146-L149 PolarHBondContact O-N 2.91Å; L146-L149 VanDerWaalsContact O-N 3.15Å; L146-N150 PolarHBondContact O-N 3.37Å; L146-K151 HydrophobicContact CD2-CB 4.43Å; L146-K151 CarbonylContact O-C 3.57Å; L146-K151 PolarHBondContact O-N 3.09Å; L146-P153 HydrophobicContact CD1-CG 4.38Å
147	V	79.1	Confident	72.2	Confident	59 Å²	59	66.9 Å²	66.9	36%	0.358	35%	0.352	S	S	.	.	H	α-helix	trans	-59.5	-45.6	173.3	173.3	0	0	0	0	110.2	V143 L149 N150	V143-V147 HydrophobicContact CG1-CG2 4.48Å; V143-V147 WeakPolarHBondContact O-CG2 3.49Å; V143-V147 PolarHBondContact O-N 2.84Å; V147-L149 PolarHBondContact O-N 2.83Å; V147-N150 PolarHBondContact O-N 2.8Å
148	A	76.3	Confident	70.5	Confident	85 Å²	85	68 Å²	68	70%	0.702	36%	0.358	S	S	*	.	H	α-helix	trans	-63.4	-25.5	177.3	0	0	0	0	0	113.8	R144 A145 L146 N150	R144-A148 VanDerWaalsContact O-CB 3.31Å; R144-A148 WeakPolarHBondContact O-CB 3.24Å; R144-A148 PolarHBondContact O-N 3.37Å; A145-A148 PolarHBondContact O-N 3.26Å; L146-A148 VanDerWaalsContact C-N 3.33Å; L146-A148 PolarHBondContact O-N 3.21Å; A148-N150 VanDerWaalsContact C-N 3.27Å; A148-N150 PolarHBondContact O-N 2.73Å
149	L	75.4	Confident	69.1	Low	40 Å²	40	67.4 Å²	67.4	21%	0.209	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	5.7	174.8	-71.5	168.4	0	0	0	113.4	P107 I110 A111 A145 L146 V147 K151	P107-L149 HydrophobicContact CB-CD2 4.49Å; I110-L149 HydrophobicContact CB-CD1 4.06Å; I110-L149 HydrophobicContact CG2-CD1 3.7Å; A111-L149 HydrophobicContact CB-CD1 4.29Å; A145-L149 VanDerWaalsContact O-CG 3.32Å; A145-L149 WeakPolarHBondContact O-CG 3.37Å; A145-L149 PolarHBondContact O-N 2.98Å; A145-L149 VanDerWaalsContact O-N 3.09Å; L146-L149 PolarHBondContact O-N 2.91Å; L146-L149 VanDerWaalsContact O-N 3.15Å; V147-L149 PolarHBondContact O-N 2.83Å; L149-K151 HydrophobicContact CB-CB 4.4Å; L149-K151 HydrophobicContact CB-CG 4.33Å; L149-K151 PolarHBondContact O-N 3.45Å; L149-K151 VanDerWaalsContact O-N 3.11Å
150	N	72.4	Confident	67.8	Low	153 Å²	153	76.5 Å²	76.5	82%	0.818	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	26.2	-168.2	-79.2	-12.4	0	0	0	112.8	L146 V147 A148 D152	L146-N150 PolarHBondContact O-N 3.37Å; V147-N150 PolarHBondContact O-N 2.8Å; A148-N150 VanDerWaalsContact C-N 3.27Å; A148-N150 PolarHBondContact O-N 2.73Å; N150-D152 VanDerWaalsContact C-N 3.34Å
151	K	69.2	Low	66.5	Low	100 Å²	100	78.4 Å²	78.4	44%	0.435	41%	0.411	S	S	.	.			trans	-108.6	49	172.7	-66.1	-60.3	-172.7	178.7	0	108.6	N108 A111 L146 L149 P153	N108-K151 WeakPolarHBondContact OD1-CE 3.5Å; N108-K151 PolarHBondContact OD1-NZ 3.08Å; A111-K151 HydrophobicContact CB-CB 4.13Å; A111-K151 HydrophobicContact CB-CG 3.97Å; L146-K151 HydrophobicContact CD2-CB 4.43Å; L146-K151 CarbonylContact O-C 3.57Å; L146-K151 PolarHBondContact O-N 3.09Å; L149-K151 HydrophobicContact CB-CB 4.4Å; L149-K151 HydrophobicContact CB-CG 4.33Å; L149-K151 PolarHBondContact O-N 3.45Å; L149-K151 VanDerWaalsContact O-N 3.11Å; K151-P153 VanDerWaalsContact O-CD 3.24Å; K151-P153 WeakPolarHBondContact O-CD 3.4Å; K151-P153 VanDerWaalsContact O-N 3.13Å
152	D	61.6	Low	65.4	Low	45 Å²	45	74 Å²	74	24%	0.241	40%	0.398	C	S	.	.			trans	-60.7	114.7	-177.7	-168.6	-11.6	0	0	0	109.3	N150 L154 N155	N150-D152 VanDerWaalsContact C-N 3.34Å; D152-L154 PolarHBondContact O-N 3.22Å; D152-L154 WeakPolarHBondContact OD1-CB 3.28Å; D152-L154 VanDerWaalsContact OD1-CD1 3.3Å; D152-L154 WeakPolarHBondContact OD1-CD1 3.49Å; D152-L154 WeakPolarHBondContact OD1-CG 3.47Å; D152-L154 PolarHBondContact OD1-N 3.2Å; D152-L154 WeakPolarHBondContact OD2-CD1 3.37Å; D152-N155 PolarHBondContact O-N 3.42Å
153	P	57.6	Low	64.3	Low	15 Å²	15	74.4 Å²	74.4	10%	0.097	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-8.2	176.4	26.2	-33.2	0	0	0	112.7	L146 K151 G159	L146-P153 HydrophobicContact CD1-CG 4.38Å; K151-P153 VanDerWaalsContact O-CD 3.24Å; K151-P153 WeakPolarHBondContact O-CD 3.4Å; K151-P153 VanDerWaalsContact O-N 3.13Å; P153-G159 WeakPolarHBondContact O-CA 3.4Å; P153-G159 PolarHBondContact O-N 2.81Å
154	L	51.9	Low	63.6	Low	70 Å²	70	77.5 Å²	77.5	37%	0.366	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-24.8	176.6	-61.2	167.6	0	0	0	113.9	D152 T191	D152-L154 PolarHBondContact O-N 3.22Å; D152-L154 WeakPolarHBondContact OD1-CB 3.28Å; D152-L154 VanDerWaalsContact OD1-CD1 3.3Å; D152-L154 WeakPolarHBondContact OD1-CD1 3.49Å; D152-L154 WeakPolarHBondContact OD1-CG 3.47Å; D152-L154 PolarHBondContact OD1-N 3.2Å; D152-L154 WeakPolarHBondContact OD2-CD1 3.37Å; L154-T191 HydrophobicContact CD2-CG2 4.01Å
155	N	53.4	Low	62.7	Low	144 Å²	144	71.4 Å²	71.4	77%	0.77	40%	0.404	S	S	*	.	S	Bend	trans	-92.7	-13.7	-173.4	-86.2	-10.9	0	0	0	115.6	D152	D152-N155 PolarHBondContact O-N 3.42Å
156	E	44.4	Very low	61.8	Low	149 Å²	149	70.4 Å²	70.4	70%	0.696	40%	0.396	S	S	*	.	S	Bend	trans	-139.1	160.8	178.6	-73.5	-175.6	163.8	0	0	110.3	L158 G159	E156-L158 PolarHBondContact O-N 3.34Å; E156-G159 PolarHBondContact O-N 2.8Å
157	T	48.3	Very low	61	Low	146 Å²	146	72.1 Å²	72.1	90%	0.896	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.6	-2.2	-172.6	38.6	0	0	0	0	118.2
158	L	50.1	Low	60.3	Low	91 Å²	91	71.3 Å²	71.3	48%	0.476	40%	0.403	S	S	.	.	H	α-helix	trans	-66.8	-28.4	174.7	-91.5	127.3	0	0	0	114.5	I115 E156 R160 G161 A162	I115-L158 HydrophobicContact CD1-CD2 4.09Å; E156-L158 PolarHBondContact O-N 3.34Å; L158-R160 PolarHBondContact O-N 3.19Å; L158-G161 PolarHBondContact O-N 2.94Å; L158-A162 PolarHBondContact O-N 2.94Å
159	G	54.2	Low	59.7	Low	15 Å²	15	68.8 Å²	68.8	16%	0.155	38%	0.377	C	S	.	.	H	α-helix	trans	-56.3	-43.5	-174.9	0	0	0	0	0	114.9	P153 E156 G161 A162 I163	P153-G159 WeakPolarHBondContact O-CA 3.4Å; P153-G159 PolarHBondContact O-N 2.81Å; E156-G159 PolarHBondContact O-N 2.8Å; G159-G161 PolarHBondContact O-N 3.16Å; G159-A162 PolarHBondContact O-N 3.38Å; G159-I163 VanDerWaalsContact O-CG1 3.29Å; G159-I163 WeakPolarHBondContact O-CG1 3.27Å; G159-I163 PolarHBondContact O-N 3.14Å
160	R	53.6	Low	59.2	Low	190 Å²	190	67 Å²	67	72%	0.717	37%	0.368	S	S	*	.	H	α-helix	trans	-66	-40.9	-180	-79.8	-172.4	-174.7	-109.9	0.9	112.8	L158 I163 S164	L158-R160 PolarHBondContact O-N 3.19Å; R160-I163 PolarHBondContact O-N 2.86Å; R160-S164 PolarHBondContact O-N 2.7Å; R160-S164 PolarHBondContact O-OG 3.37Å
161	G	58.3	Low	58.9	Low	42 Å²	42	60.2 Å²	60.2	43%	0.433	33%	0.332	S	S	.	.	H	α-helix	trans	-66.4	-39.8	180	0	0	0	0	0	112.5	L158 G159 S165	L158-G161 PolarHBondContact O-N 2.94Å; G159-G161 PolarHBondContact O-N 3.16Å; G161-S165 WeakPolarHBondContact O-CB 3.39Å; G161-S165 PolarHBondContact O-N 3.27Å; G161-S165 PolarHBondContact O-OG 3.38Å
162	A	60.7	Low	58.8	Low	17 Å²	17	58.9 Å²	58.9	14%	0.14	34%	0.335	C	S	.	.	H	α-helix	trans	-67.2	-42.8	176.5	0	0	0	0	0	111.9	L158 G159 S165 A166 L192	L158-A162 PolarHBondContact O-N 2.94Å; G159-A162 PolarHBondContact O-N 3.38Å; A162-S165 PolarHBondContact O-N 3.08Å; A162-A166 WeakPolarHBondContact O-CB 3.45Å; A162-A166 PolarHBondContact O-N 3.4Å; A162-L192 HydrophobicContact CB-CD1 3.62Å
163	I	59.8	Low	59.1	Low	9 Å²	9	61.2 Å²	61.2	5%	0.046	35%	0.347	C	S	.	.	H	α-helix	trans	-61.8	-48.4	174.6	-67.3	166.6	0	0	0	110.6	G159 R160 S165 A166 Q167 L190 L192	G159-I163 VanDerWaalsContact O-CG1 3.29Å; G159-I163 WeakPolarHBondContact O-CG1 3.27Å; G159-I163 PolarHBondContact O-N 3.14Å; R160-I163 PolarHBondContact O-N 2.86Å; I163-S165 VanDerWaalsContact C-N 3.3Å; I163-S165 PolarHBondContact O-N 2.73Å; I163-A166 PolarHBondContact O-N 2.82Å; I163-Q167 HydrophobicContact CG2-CG 4.13Å; I163-Q167 VanDerWaalsContact CG2-NE2 3.34Å; I163-Q167 VanDerWaalsContact O-CB 3.3Å; I163-Q167 WeakPolarHBondContact O-CB 3.33Å; I163-Q167 WeakPolarHBondContact O-CG 3.18Å; I163-Q167 PolarHBondContact O-N 2.87Å; I163-L190 WeakPolarHBondContact CD1-O 3.5Å; I163-L192 HydrophobicContact CD1-CB 4.18Å; I163-L192 HydrophobicContact CD1-CG 4.47Å; I163-L192 HydrophobicContact CG1-CB 4Å; I163-L192 HydrophobicContact CG1-CD1 3.96Å; I163-L192 HydrophobicContact CG1-CG 3.74Å
164	S	64.8	Low	59.6	Low	70 Å²	70	60.6 Å²	60.6	49%	0.49	34%	0.343	S	S	.	.	H	α-helix	trans	-62.3	-36.6	178.4	-73.2	0	0	0	0	112.9	R160 A168	R160-S164 PolarHBondContact O-N 2.7Å; R160-S164 PolarHBondContact O-OG 3.37Å; S164-A168 WeakPolarHBondContact O-CB 3.44Å; S164-A168 PolarHBondContact O-N 2.92Å
165	S	63.1	Low	60.6	Low	32 Å²	32	61.8 Å²	61.8	22%	0.224	34%	0.343	C	S	.	.	H	α-helix	trans	-67.2	-48.9	175.2	-57.5	0	0	0	0	111.1	G161 A162 I163 Q167 A168 E169	G161-S165 WeakPolarHBondContact O-CB 3.39Å; G161-S165 PolarHBondContact O-N 3.27Å; G161-S165 PolarHBondContact O-OG 3.38Å; A162-S165 PolarHBondContact O-N 3.08Å; I163-S165 VanDerWaalsContact C-N 3.3Å; I163-S165 PolarHBondContact O-N 2.73Å; S165-Q167 VanDerWaalsContact C-N 3.32Å; S165-Q167 PolarHBondContact O-N 2.91Å; S165-A168 WeakPolarHBondContact O-CB 3.34Å; S165-A168 PolarHBondContact O-N 3.28Å; S165-A168 VanDerWaalsContact O-N 3.1Å; S165-E169 PolarHBondContact O-N 3.3Å
166	A	63.1	Low	61.2	Low	3 Å²	3	58.6 Å²	58.6	3%	0.025	32%	0.322	C	S	.	.	H	α-helix	trans	-62.2	-38.4	176.7	0	0	0	0	0	112.1	V139 A162 I163 A168 E169 T170 F195	V139-A166 HydrophobicContact CG2-CB 4.42Å; A162-A166 WeakPolarHBondContact O-CB 3.45Å; A162-A166 PolarHBondContact O-N 3.4Å; I163-A166 PolarHBondContact O-N 2.82Å; A166-A168 VanDerWaalsContact C-N 3.34Å; A166-A168 PolarHBondContact O-N 2.84Å; A166-E169 PolarHBondContact O-N 2.74Å; A166-T170 PolarHBondContact O-N 2.85Å; A166-F195 HydrophobicContact CB-CE1 3.8Å; A166-F195 HydrophobicContact CB-CZ 4.5Å
167	Q	63.5	Low	62.6	Low	40 Å²	40	55.2 Å²	55.2	19%	0.187	31%	0.308	C	S	.	.	H	α-helix	trans	-58.8	-44.2	172.6	-77.6	170.8	-6.2	0	0	111.5	I163 S165 E169 T170 R175 F195	I163-Q167 HydrophobicContact CG2-CG 4.13Å; I163-Q167 VanDerWaalsContact CG2-NE2 3.34Å; I163-Q167 VanDerWaalsContact O-CB 3.3Å; I163-Q167 WeakPolarHBondContact O-CB 3.33Å; I163-Q167 WeakPolarHBondContact O-CG 3.18Å; I163-Q167 PolarHBondContact O-N 2.87Å; S165-Q167 VanDerWaalsContact C-N 3.32Å; S165-Q167 PolarHBondContact O-N 2.91Å; Q167-E169 PolarHBondContact O-N 2.88Å; Q167-T170 PolarHBondContact O-N 2.76Å; Q167-T170 PolarHBondContact O-OG1 2.82Å; Q167-R175 WeakPolarHBondContact O-CD 3.08Å; Q167-R175 VanDerWaalsContact O-CG 3.3Å; Q167-R175 WeakPolarHBondContact O-CG 3.46Å; Q167-R175 PolarHBondContact O-NE 3.23Å; Q167-F195 HydrophobicContact CG-CE2 4.09Å; Q167-F195 HydrophobicContact CG-CZ 4.3Å
168	A	64.4	Low	63.9	Low	42 Å²	42	48.8 Å²	48.8	35%	0.347	27%	0.268	S	S	.	.	H	α-helix	trans	-60.1	-27.4	-179.4	0	0	0	0	0	113.1	S164 S165 A166 R175	S164-A168 WeakPolarHBondContact O-CB 3.44Å; S164-A168 PolarHBondContact O-N 2.92Å; S165-A168 WeakPolarHBondContact O-CB 3.34Å; S165-A168 PolarHBondContact O-N 3.28Å; S165-A168 VanDerWaalsContact O-N 3.1Å; A166-A168 VanDerWaalsContact C-N 3.34Å; A166-A168 PolarHBondContact O-N 2.84Å; A168-R175 PolarHBondContact O-NH2 3.47Å
169	E	64.6	Low	64.9	Low	31 Å²	31	50 Å²	50	15%	0.145	27%	0.271	C	S	.	.	H	α-helix	trans	-89.5	-21.4	-178.7	-59.3	-57.1	126.3	0	0	113.4	T121 K123 C124 S165 A166 Q167	T121-E169 WeakPolarHBondContact O-CB 3.41Å; T121-E169 VanDerWaalsContact O-CD 3.27Å; T121-E169 WeakPolarHBondContact O-CG 3.21Å; K123-E169 WeakPolarHBondContact CA-O 3.43Å; K123-E169 WeakPolarHBondContact CE-OE1 3.33Å; K123-E169 VanDerWaalsContact CE-OE2 3.31Å; K123-E169 WeakPolarHBondContact CE-OE2 3.4Å; K123-E169 WeakPolarHBondContact CG-OE2 3.44Å; K123-E169 PolarHBondContact N-OE2 2.69Å; K123-E169 IonicContact NZ-OE1 3.67Å; C124-E169 PolarHBondContact N-O 2.85Å; S165-E169 PolarHBondContact O-N 3.3Å; A166-E169 PolarHBondContact O-N 2.74Å; Q167-E169 PolarHBondContact O-N 2.88Å
170	T	64.2	Low	65.5	Low	3 Å²	3	53.1 Å²	53.1	2%	0.018	29%	0.29	C	S	.	.	S	Bend	trans	-72.2	154	172	64	0	0	0	0	112.4	V135 A166 Q167 V174 R175 F195 L199	V135-T170 HydrophobicContact CG1-CG2 4.29Å; A166-T170 PolarHBondContact O-N 2.85Å; Q167-T170 PolarHBondContact O-N 2.76Å; Q167-T170 PolarHBondContact O-OG1 2.82Å; T170-V174 HydrophobicContact CG2-CG1 4.21Å; T170-R175 VanDerWaalsContact O-CZ 3.22Å; T170-R175 PolarHBondContact O-NE 2.88Å; T170-R175 PolarHBondContact O-NH2 3.19Å; T170-R175 WeakPolarHBondContact OG1-CG 3.19Å; T170-F195 HydrophobicContact CG2-CZ 4Å; T170-L199 HydrophobicContact CG2-CD2 4.07Å
171	S	66.4	Low	66.1	Low	10 Å²	10	49.3 Å²	49.3	7%	0.07	28%	0.279	C	S	.	.			trans	-61.5	151.9	177	83.5	0	0	0	0	111.7	C124 I173 V174 R175	C124-S171 WeakPolarHBondContact O-CA 3.49Å; C124-S171 WeakPolarHBondContact O-CB 3.28Å; C124-S171 PolarHBondContact O-N 3.24Å; S171-I173 PolarHBondContact O-N 3.3Å; S171-V174 PolarHBondContact O-N 2.73Å; S171-V174 WeakPolarHBondContact OG-CG2 3.21Å; S171-R175 PolarHBondContact O-N 3.44Å; S171-R175 VanDerWaalsContact O-N 3.13Å
172	S	66.4	Low	66.5	Low	72 Å²	72	50 Å²	50	50%	0.503	27%	0.274	S	S	.	.	H	α-helix	trans	-56.1	-22.2	179.1	64.8	0	0	0	0	114.7	K176	S172-K176 VanDerWaalsContact O-CG 3.29Å; S172-K176 WeakPolarHBondContact O-CG 3.44Å; S172-K176 PolarHBondContact O-N 3.44Å
173	I	67.6	Low	66.3	Low	94 Å²	94	55.8 Å²	55.8	48%	0.482	30%	0.302	S	S	.	.	H	α-helix	trans	-73.6	-45.9	176.7	-68.5	163.9	0	0	0	110.3	P127 S171 K176 L177	P127-I173 HydrophobicContact CG-CD1 4.08Å; S171-I173 PolarHBondContact O-N 3.3Å; I173-K176 PolarHBondContact O-N 2.83Å; I173-L177 HydrophobicContact CG2-CD1 4.24Å; I173-L177 WeakPolarHBondContact O-CG 3.36Å; I173-L177 PolarHBondContact O-N 3.16Å; I173-L177 VanDerWaalsContact O-N 3.14Å
174	V	69.8	Low	65.7	Low	3 Å²	3	59.5 Å²	59.5	2%	0.018	33%	0.327	C	S	.	.	H	α-helix	trans	-66.4	-41.6	-179.1	178.1	0	0	0	0	110.2	P127 L132 T170 S171 K176 L177 W178 F198 L199	P127-V174 HydrophobicContact CB-CG2 4.36Å; L132-V174 HydrophobicContact CD2-CG2 3.7Å; T170-V174 HydrophobicContact CG2-CG1 4.21Å; S171-V174 PolarHBondContact O-N 2.73Å; S171-V174 WeakPolarHBondContact OG-CG2 3.21Å; V174-K176 VanDerWaalsContact C-N 3.33Å; V174-K176 PolarHBondContact O-N 3.18Å; V174-L177 PolarHBondContact O-N 3.16Å; V174-L177 VanDerWaalsContact O-N 3.15Å; V174-W178 PolarHBondContact O-N 3.45Å; V174-F198 HydrophobicContact CG1-CE1 3.64Å; V174-F198 HydrophobicContact CG1-CZ 4.04Å; V174-F198 WeakPolarHBondContact O-CZ 3.31Å; V174-L199 HydrophobicContact CG1-CD2 3.85Å
175	R	71.1	Confident	64.9	Low	95 Å²	95	65.2 Å²	65.2	36%	0.358	35%	0.346	S	S	.	.	H	α-helix	trans	-57.4	-42.9	174.1	-66.6	-177.4	-131.3	170.3	-5.1	113.1	Q167 A168 T170 S171 L177 W178 E179	Q167-R175 WeakPolarHBondContact O-CD 3.08Å; Q167-R175 VanDerWaalsContact O-CG 3.3Å; Q167-R175 WeakPolarHBondContact O-CG 3.46Å; Q167-R175 PolarHBondContact O-NE 3.23Å; A168-R175 PolarHBondContact O-NH2 3.47Å; T170-R175 VanDerWaalsContact O-CZ 3.22Å; T170-R175 PolarHBondContact O-NE 2.88Å; T170-R175 PolarHBondContact O-NH2 3.19Å; T170-R175 WeakPolarHBondContact OG1-CG 3.19Å; S171-R175 PolarHBondContact O-N 3.44Å; S171-R175 VanDerWaalsContact O-N 3.13Å; R175-L177 VanDerWaalsContact C-N 3.33Å; R175-L177 PolarHBondContact O-N 2.93Å; R175-W178 WeakPolarHBondContact O-CB 3.4Å; R175-W178 PolarHBondContact O-N 3.46Å; R175-E179 PolarHBondContact O-N 2.91Å
176	K	67.8	Low	64.1	Low	77 Å²	77	70.5 Å²	70.5	34%	0.335	37%	0.372	S	S	.	.	H	α-helix	trans	-65.5	-37.3	177.6	-73.7	173.8	-174.9	-176.3	0	112.5	S172 I173 V174 W178 S180	S172-K176 VanDerWaalsContact O-CG 3.29Å; S172-K176 WeakPolarHBondContact O-CG 3.44Å; S172-K176 PolarHBondContact O-N 3.44Å; I173-K176 PolarHBondContact O-N 2.83Å; V174-K176 VanDerWaalsContact C-N 3.33Å; V174-K176 PolarHBondContact O-N 3.18Å; K176-W178 VanDerWaalsContact C-N 3.33Å; K176-S180 WeakPolarHBondContact O-CB 3.44Å; K176-S180 PolarHBondContact O-N 3.15Å
177	L	72.7	Confident	63.2	Low	78 Å²	78	79.5 Å²	79.5	41%	0.408	41%	0.413	S	S	.	.	H	α-helix	trans	-68.4	-37.1	176.4	-69.2	170.9	0	0	0	111	I173 V174 R175 K181 F198 Q202	I173-L177 HydrophobicContact CG2-CD1 4.24Å; I173-L177 WeakPolarHBondContact O-CG 3.36Å; I173-L177 PolarHBondContact O-N 3.16Å; I173-L177 VanDerWaalsContact O-N 3.14Å; V174-L177 PolarHBondContact O-N 3.16Å; V174-L177 VanDerWaalsContact O-N 3.15Å; R175-L177 VanDerWaalsContact C-N 3.33Å; R175-L177 PolarHBondContact O-N 2.93Å; L177-K181 PolarHBondContact O-N 3.1Å; L177-K181 VanDerWaalsContact O-N 3.08Å; L177-F198 HydrophobicContact CB-CE2 3.93Å; L177-F198 HydrophobicContact CB-CZ 3.78Å; L177-Q202 VanDerWaalsContact CD1-OE1 3.25Å
178	W	75	Confident	62.5	Low	11 Å²	11	85.8 Å²	85.8	4%	0.042	44%	0.443	C	S	.	.	H	α-helix	trans	-63.3	-54.3	172.1	176.1	-107.4	0	0	0	111.7	V174 R175 K176 S180 K181 V182 L190 A194 F195 F198	V174-W178 PolarHBondContact O-N 3.45Å; R175-W178 WeakPolarHBondContact O-CB 3.4Å; R175-W178 PolarHBondContact O-N 3.46Å; K176-W178 VanDerWaalsContact C-N 3.33Å; W178-S180 PolarHBondContact O-N 2.85Å; W178-K181 WeakPolarHBondContact O-CA 3.4Å; W178-K181 WeakPolarHBondContact O-CB 3.43Å; W178-K181 PolarHBondContact O-N 3.33Å; W178-V182 HydrophobicContact CD2-CG2 4Å; W178-V182 HydrophobicContact CE3-CG2 4.46Å; W178-V182 HydrophobicContact CG-CG2 4.49Å; W178-V182 HydrophobicContact CH2-CG2 4.29Å; W178-V182 HydrophobicContact CZ2-CG2 3.77Å; W178-V182 WeakPolarHBondContact O-CG2 3.42Å; W178-V182 PolarHBondContact O-N 2.75Å; W178-L190 HydrophobicContact CZ2-CD2 3.78Å; W178-A194 HydrophobicContact CH2-CB 4.09Å; W178-A194 WeakPolarHBondContact CZ3-O 3.44Å; W178-F195 AromaticContact CD2-CD2 3.71Å; W178-F195 HydrophobicContact CD2-CD2 3.71Å; W178-F195 HydrophobicContact CD2-CE2 4.25Å; W178-F195 AromaticContact CE2-CD2 3.86Å; W178-F195 AromaticContact CE3-CD2 3.9Å; W178-F195 HydrophobicContact CE3-CD2 3.9Å; W178-F195 HydrophobicContact CG-CD2 4.17Å; W178-F195 HydrophobicContact CG-CE2 4.24Å; W178-F195 HydrophobicContact CH2-CB 3.92Å; W178-F195 HydrophobicContact CH2-CD2 4.29Å; W178-F195 HydrophobicContact CZ2-CB 4.17Å; W178-F195 HydrophobicContact CZ2-CD2 4.15Å; W178-F195 HydrophobicContact CZ3-CB 4.28Å; W178-F195 HydrophobicContact CZ3-CD2 4.18Å; W178-F198 HydrophobicContact CB-CD1 4.2Å; W178-F198 HydrophobicContact CB-CE1 3.69Å; W178-F198 HydrophobicContact CB-CE2 4.39Å; W178-F198 HydrophobicContact CB-CZ 3.81Å; W178-F198 HydrophobicContact CD2-CD1 4.29Å; W178-F198 HydrophobicContact CD2-CG 4.48Å; W178-F198 HydrophobicContact CE3-CB 3.58Å; W178-F198 AromaticContact CE3-CD1 3.58Å; W178-F198 HydrophobicContact CE3-CD1 3.58Å; W178-F198 AromaticContact CE3-CD2 3.95Å; W178-F198 HydrophobicContact CE3-CD2 3.95Å; W178-F198 HydrophobicContact CE3-CE1 4.25Å; W178-F198 AromaticContact CE3-CG 3.41Å; W178-F198 HydrophobicContact CE3-CG 3.41Å; W178-F198 VanDerWaalsContact CE3-CG 3.41Å; W178-F198 HydrophobicContact CG-CE1 4.5Å; W178-F198 HydrophobicContact CZ3-CB 3.52Å; W178-F198 HydrophobicContact CZ3-CD1 4.34Å; W178-F198 AromaticContact CZ3-CG 3.93Å; W178-F198 HydrophobicContact CZ3-CG 3.93Å; W178-F198 VanDerWaalsContact N-CZ 3.31Å
179	E	71.7	Confident	61.9	Low	116 Å²	116	91.9 Å²	91.9	54%	0.542	46%	0.464	S	S	.	.	H	α-helix	trans	-60.1	-36.4	178.8	-73.7	-169.2	-164.8	0	0	112.1	R175 K181 V182 L183	R175-E179 PolarHBondContact O-N 2.91Å; E179-K181 VanDerWaalsContact C-N 3.28Å; E179-K181 PolarHBondContact O-N 2.92Å; E179-V182 PolarHBondContact O-N 3.3Å; E179-L183 WeakPolarHBondContact O-CD1 3.43Å; E179-L183 VanDerWaalsContact O-CG 3.29Å; E179-L183 WeakPolarHBondContact O-CG 3.29Å; E179-L183 PolarHBondContact O-N 3.3Å
180	S	66.8	Low	61.6	Low	80 Å²	80	94 Å²	94	56%	0.559	48%	0.476	S	S	*	.	H	α-helix	trans	-65.6	-27.7	173.3	-173.5	0	0	0	0	113.8	K176 W178	K176-S180 WeakPolarHBondContact O-CB 3.44Å; K176-S180 PolarHBondContact O-N 3.15Å; W178-S180 PolarHBondContact O-N 2.85Å
181	K	67.3	Low	61.6	Low	111 Å²	111	96 Å²	96	48%	0.483	49%	0.488	S	S	.	.	H	α-helix	trans	-78.1	-32.2	175	-173	-177.3	176.2	-170.7	0	111.3	L177 W178 E179 P184 F198	L177-K181 PolarHBondContact O-N 3.1Å; L177-K181 VanDerWaalsContact O-N 3.08Å; W178-K181 WeakPolarHBondContact O-CA 3.4Å; W178-K181 WeakPolarHBondContact O-CB 3.43Å; W178-K181 PolarHBondContact O-N 3.33Å; E179-K181 VanDerWaalsContact C-N 3.28Å; E179-K181 PolarHBondContact O-N 2.92Å; K181-P184 WeakPolarHBondContact O-CD 3.45Å; K181-F198 HydrophobicContact CD-CD2 4.08Å
182	V	65.9	Low	61.5	Low	56 Å²	56	95.7 Å²	95.7	34%	0.339	49%	0.486	S	S	.	.	H	α-helix	trans	-82.3	-22.6	-178.5	172	0	0	0	0	113.2	W178 E179 L190	W178-V182 HydrophobicContact CD2-CG2 4Å; W178-V182 HydrophobicContact CE3-CG2 4.46Å; W178-V182 HydrophobicContact CG-CG2 4.49Å; W178-V182 HydrophobicContact CH2-CG2 4.29Å; W178-V182 HydrophobicContact CZ2-CG2 3.77Å; W178-V182 WeakPolarHBondContact O-CG2 3.42Å; W178-V182 PolarHBondContact O-N 2.75Å; E179-V182 PolarHBondContact O-N 3.3Å; V182-L190 HydrophobicContact CB-CD2 4.12Å; V182-L190 HydrophobicContact CG1-CD1 4.11Å; V182-L190 HydrophobicContact CG1-CD2 3.53Å; V182-L190 HydrophobicContact CG1-CG 4.28Å; V182-L190 HydrophobicContact CG2-CD2 3.41Å; V182-L190 VanDerWaalsContact CG2-CD2 3.41Å
183	L	56.1	Low	61.6	Low	138 Å²	138	95.7 Å²	95.7	72%	0.723	48%	0.48	S	S	*	.			trans	-61.8	-20.6	-178.2	-87.8	161.2	0	0	0	118	E179	E179-L183 WeakPolarHBondContact O-CD1 3.43Å; E179-L183 VanDerWaalsContact O-CG 3.29Å; E179-L183 WeakPolarHBondContact O-CG 3.29Å; E179-L183 PolarHBondContact O-N 3.3Å
184	P	47.9	Very low	61.8	Low	87 Å²	87	92.6 Å²	92.6	57%	0.565	47%	0.468	S	S	*	.	S	Bend	trans	-69.5	136	172.9	-14.6	30.1	0	0	0	111.6	K181 D186	K181-P184 WeakPolarHBondContact O-CD 3.45Å; P184-D186 PolarHBondContact O-N 3.23Å
185	E	48.6	Very low	62.2	Low	191 Å²	191	92.5 Å²	92.5	89%	0.893	47%	0.467	S	S	*	.	S	Bend	trans	-65.3	5.9	-164.4	-72.2	-179	150.7	0	0	118.1	Q187	E185-Q187 PolarHBondContact O-N 2.84Å
186	D	46.4	Very low	62.6	Low	142 Å²	142	88.8 Å²	88.8	76%	0.759	46%	0.456	S	S	*	.			trans	-83.7	104.7	172.3	-68.9	-39	0	0	0	108.5	P184 E188	P184-D186 PolarHBondContact O-N 3.23Å; D186-E188 PolarHBondContact O-N 3.34Å
187	Q	43.6	Very low	63.2	Low	192 Å²	192	91.1 Å²	91.1	90%	0.897	47%	0.468	S	S	*	.			trans	-66.6	45.7	175	-63.1	-165.3	-13.4	0	0	112.4	E185 E189	E185-Q187 PolarHBondContact O-N 2.84Å; Q187-E189 PolarHBondContact O-N 3.5Å
188	E	48.2	Very low	63.9	Low	173 Å²	173	87.6 Å²	87.6	81%	0.808	45%	0.449	S	S	*	.			trans	-59.4	121.8	162.4	-74.6	-170.4	163.8	0	0	107.2	D186 L190	D186-E188 PolarHBondContact O-N 3.34Å; E188-L190 PolarHBondContact O-N 3.45Å
189	E	52.5	Low	64.3	Low	170 Å²	170	87.1 Å²	87.1	79%	0.794	45%	0.447	S	S	*	.			trans	-46.2	126.8	-171.6	-68.2	178.4	146.7	0	0	110.7	Q187 T191	Q187-E189 PolarHBondContact O-N 3.5Å; E189-T191 HydrophobicContact CB-CG2 4.25Å; E189-T191 WeakPolarHBondContact O-CG2 3.4Å; E189-T191 PolarHBondContact O-N 3.21Å
190	L	58.1	Low	65	Low	75 Å²	75	85.3 Å²	85.3	39%	0.393	44%	0.439	S	S	.	.			trans	-66.1	80.1	177.9	-78	160.9	0	0	0	110	I163 W178 V182 E188	I163-L190 WeakPolarHBondContact CD1-O 3.5Å; W178-L190 HydrophobicContact CZ2-CD2 3.78Å; V182-L190 HydrophobicContact CB-CD2 4.12Å; V182-L190 HydrophobicContact CG1-CD1 4.11Å; V182-L190 HydrophobicContact CG1-CD2 3.53Å; V182-L190 HydrophobicContact CG1-CG 4.28Å; V182-L190 HydrophobicContact CG2-CD2 3.41Å; V182-L190 VanDerWaalsContact CG2-CD2 3.41Å; E188-L190 PolarHBondContact O-N 3.45Å
191	T	63.4	Low	65.8	Low	44 Å²	44	83.4 Å²	83.4	27%	0.27	43%	0.425	S	S	.	.			trans	-83.1	153.8	-178.1	61.1	0	0	0	0	111.2	L154 E189 D193 A194 F195	L154-T191 HydrophobicContact CD2-CG2 4.01Å; E189-T191 HydrophobicContact CB-CG2 4.25Å; E189-T191 WeakPolarHBondContact O-CG2 3.4Å; E189-T191 PolarHBondContact O-N 3.21Å; T191-D193 VanDerWaalsContact C-N 3.25Å; T191-D193 PolarHBondContact O-N 2.86Å; T191-A194 PolarHBondContact O-N 3.32Å; T191-A194 WeakPolarHBondContact OG1-CB 3.22Å; T191-A194 PolarHBondContact OG1-N 3.49Å; T191-F195 PolarHBondContact O-N 3.12Å
192	L	65.3	Low	66.6	Low	5 Å²	5	79.7 Å²	79.7	3%	0.026	41%	0.41	C	S	.	.	H	α-helix	trans	-71	-27.7	178.5	-151.4	153.7	0	0	0	110.6	V139 V143 A162 I163 F195 V196	V139-L192 HydrophobicContact CG1-CD2 4.01Å; V143-L192 HydrophobicContact CB-CD2 4.31Å; V143-L192 HydrophobicContact CG1-CD2 4.26Å; V143-L192 HydrophobicContact CG2-CD2 3.13Å; V143-L192 HydrophobicContact CG2-CG 4.43Å; A162-L192 HydrophobicContact CB-CD1 3.62Å; I163-L192 HydrophobicContact CD1-CB 4.18Å; I163-L192 HydrophobicContact CD1-CG 4.47Å; I163-L192 HydrophobicContact CG1-CB 4Å; I163-L192 HydrophobicContact CG1-CD1 3.96Å; I163-L192 HydrophobicContact CG1-CG 3.74Å; L192-F195 WeakPolarHBondContact O-CB 3.43Å; L192-F195 PolarHBondContact O-N 3.21Å; L192-V196 HydrophobicContact CD2-CG2 4.22Å; L192-V196 WeakPolarHBondContact O-CG2 3.27Å; L192-V196 PolarHBondContact O-N 3.08Å
193	D	66.9	Low	67.5	Low	72 Å²	72	77 Å²	77	39%	0.385	39%	0.393	S	S	.	.	H	α-helix	trans	-63.5	-44.9	170.2	-72.2	-35.7	0	0	0	112.4	T191 F195 V196 E197	T191-D193 VanDerWaalsContact C-N 3.25Å; T191-D193 PolarHBondContact O-N 2.86Å; D193-F195 PolarHBondContact O-N 3.24Å; D193-V196 PolarHBondContact O-N 3.43Å; D193-E197 WeakPolarHBondContact O-CG 3.28Å; D193-E197 PolarHBondContact O-N 3.47Å
194	A	73	Confident	68.8	Low	28 Å²	28	75 Å²	75	23%	0.231	38%	0.38	C	S	.	.	H	α-helix	trans	-58.9	-32.9	174.4	0	0	0	0	0	111.9	W178 T191 F198	W178-A194 HydrophobicContact CH2-CB 4.09Å; W178-A194 WeakPolarHBondContact CZ3-O 3.44Å; T191-A194 PolarHBondContact O-N 3.32Å; T191-A194 WeakPolarHBondContact OG1-CB 3.22Å; T191-A194 PolarHBondContact OG1-N 3.49Å; A194-F198 VanDerWaalsContact O-CB 3.26Å; A194-F198 WeakPolarHBondContact O-CB 3.48Å; A194-F198 PolarHBondContact O-N 3.06Å
195	F	77.7	Confident	70.3	Confident	1 Å²	1	75.5 Å²	75.5	0%	0.004	38%	0.377	C	S	.	.	H	α-helix	trans	-72.1	-40.3	174	-175.5	-109.8	0	0	0	112.8	A166 Q167 T170 W178 T191 L192 D193 F198 L199	A166-F195 HydrophobicContact CB-CE1 3.8Å; A166-F195 HydrophobicContact CB-CZ 4.5Å; Q167-F195 HydrophobicContact CG-CE2 4.09Å; Q167-F195 HydrophobicContact CG-CZ 4.3Å; T170-F195 HydrophobicContact CG2-CZ 4Å; W178-F195 AromaticContact CD2-CD2 3.71Å; W178-F195 HydrophobicContact CD2-CD2 3.71Å; W178-F195 HydrophobicContact CD2-CE2 4.25Å; W178-F195 AromaticContact CE2-CD2 3.86Å; W178-F195 AromaticContact CE3-CD2 3.9Å; W178-F195 HydrophobicContact CE3-CD2 3.9Å; W178-F195 HydrophobicContact CG-CD2 4.17Å; W178-F195 HydrophobicContact CG-CE2 4.24Å; W178-F195 HydrophobicContact CH2-CB 3.92Å; W178-F195 HydrophobicContact CH2-CD2 4.29Å; W178-F195 HydrophobicContact CZ2-CB 4.17Å; W178-F195 HydrophobicContact CZ2-CD2 4.15Å; W178-F195 HydrophobicContact CZ3-CB 4.28Å; W178-F195 HydrophobicContact CZ3-CD2 4.18Å; T191-F195 PolarHBondContact O-N 3.12Å; L192-F195 WeakPolarHBondContact O-CB 3.43Å; L192-F195 PolarHBondContact O-N 3.21Å; D193-F195 PolarHBondContact O-N 3.24Å; F195-F198 HydrophobicContact CD2-CD1 4.13Å; F195-F198 HydrophobicContact CE2-CD1 4.16Å; F195-F198 HydrophobicContact CE2-CE1 4.43Å; F195-F198 WeakPolarHBondContact O-CB 3.44Å; F195-F198 PolarHBondContact O-N 3.24Å; F195-L199 HydrophobicContact CD1-CD1 4.07Å; F195-L199 HydrophobicContact CD1-CG 4.5Å; F195-L199 HydrophobicContact CE1-CD1 3.54Å; F195-L199 HydrophobicContact CE1-CG 4.1Å; F195-L199 HydrophobicContact CE2-CG 4.48Å; F195-L199 HydrophobicContact CZ-CD1 3.94Å; F195-L199 HydrophobicContact CZ-CD2 4.33Å; F195-L199 HydrophobicContact CZ-CG 4.1Å; F195-L199 PolarHBondContact O-N 3.21Å
196	V	79.7	Confident	71.8	Confident	18 Å²	18	69.7 Å²	69.7	11%	0.109	35%	0.35	C	S	.	.	H	α-helix	trans	-63.3	-46.9	174.4	172.1	0	0	0	0	110.7	H136 V139 A140 L192 D193 F198 L199 Q200	H136-V196 PolarHBondContact CD2-O 3.37Å; V139-V196 HydrophobicContact CG1-CG2 3.76Å; A140-V196 HydrophobicContact CB-CG1 3.83Å; L192-V196 HydrophobicContact CD2-CG2 4.22Å; L192-V196 WeakPolarHBondContact O-CG2 3.27Å; L192-V196 PolarHBondContact O-N 3.08Å; D193-V196 PolarHBondContact O-N 3.43Å; V196-F198 VanDerWaalsContact C-N 3.3Å; V196-F198 PolarHBondContact O-N 3.37Å; V196-L199 PolarHBondContact O-N 3.26Å; V196-L199 VanDerWaalsContact O-N 3.16Å; V196-Q200 PolarHBondContact O-N 2.82Å
197	E	80.9	Confident	73.5	Confident	126 Å²	126	66.6 Å²	66.6	59%	0.589	33%	0.331	S	S	*	.	H	α-helix	trans	-60.5	-40.7	174.9	-72.8	-172.7	168.2	0	0	112	D193 Q200 S201	D193-E197 WeakPolarHBondContact O-CG 3.28Å; D193-E197 PolarHBondContact O-N 3.47Å; E197-Q200 PolarHBondContact O-N 3.09Å; E197-S201 PolarHBondContact O-N 3.33Å
198	F	86.4	Confident	75.1	Confident	4 Å²	4	60.4 Å²	60.4	2%	0.018	31%	0.313	C	S	.	.	H	α-helix	trans	-60	-49.9	173	163.2	-99.7	0	0	0	111.3	V174 L177 W178 K181 A194 F195 V196 Q200 S201 Q202	V174-F198 HydrophobicContact CG1-CE1 3.64Å; V174-F198 HydrophobicContact CG1-CZ 4.04Å; V174-F198 WeakPolarHBondContact O-CZ 3.31Å; L177-F198 HydrophobicContact CB-CE2 3.93Å; L177-F198 HydrophobicContact CB-CZ 3.78Å; W178-F198 HydrophobicContact CB-CD1 4.2Å; W178-F198 HydrophobicContact CB-CE1 3.69Å; W178-F198 HydrophobicContact CB-CE2 4.39Å; W178-F198 HydrophobicContact CB-CZ 3.81Å; W178-F198 HydrophobicContact CD2-CD1 4.29Å; W178-F198 HydrophobicContact CD2-CG 4.48Å; W178-F198 HydrophobicContact CE3-CB 3.58Å; W178-F198 AromaticContact CE3-CD1 3.58Å; W178-F198 HydrophobicContact CE3-CD1 3.58Å; W178-F198 AromaticContact CE3-CD2 3.95Å; W178-F198 HydrophobicContact CE3-CD2 3.95Å; W178-F198 HydrophobicContact CE3-CE1 4.25Å; W178-F198 AromaticContact CE3-CG 3.41Å; W178-F198 HydrophobicContact CE3-CG 3.41Å; W178-F198 VanDerWaalsContact CE3-CG 3.41Å; W178-F198 HydrophobicContact CG-CE1 4.5Å; W178-F198 HydrophobicContact CZ3-CB 3.52Å; W178-F198 HydrophobicContact CZ3-CD1 4.34Å; W178-F198 AromaticContact CZ3-CG 3.93Å; W178-F198 HydrophobicContact CZ3-CG 3.93Å; W178-F198 VanDerWaalsContact N-CZ 3.31Å; K181-F198 HydrophobicContact CD-CD2 4.08Å; A194-F198 VanDerWaalsContact O-CB 3.26Å; A194-F198 WeakPolarHBondContact O-CB 3.48Å; A194-F198 PolarHBondContact O-N 3.06Å; F195-F198 HydrophobicContact CD2-CD1 4.13Å; F195-F198 HydrophobicContact CE2-CD1 4.16Å; F195-F198 HydrophobicContact CE2-CE1 4.43Å; F195-F198 WeakPolarHBondContact O-CB 3.44Å; F195-F198 PolarHBondContact O-N 3.24Å; V196-F198 VanDerWaalsContact C-N 3.3Å; V196-F198 PolarHBondContact O-N 3.37Å; F198-Q200 VanDerWaalsContact C-N 3.28Å; F198-Q200 PolarHBondContact O-N 3.19Å; F198-S201 PolarHBondContact O-N 3.07Å; F198-S201 PolarHBondContact O-OG 2.96Å; F198-Q202 HydrophobicContact CD2-CG 4.23Å; F198-Q202 HydrophobicContact CE1-CG 4.04Å; F198-Q202 HydrophobicContact CE2-CG 3.7Å; F198-Q202 HydrophobicContact CZ-CG 3.59Å; F198-Q202 WeakPolarHBondContact O-CG 3.29Å; F198-Q202 PolarHBondContact O-N 3.45Å
199	L	83	Confident	76.2	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-59.5	-41	177.5	-77.3	178.6	0	0	0	111.6	V135 H136 T170 V174 F195 V196 S201 Q202 V203	V135-L199 HydrophobicContact CG1-CD1 4.35Å; H136-L199 HydrophobicContact CB-CB 4.2Å; T170-L199 HydrophobicContact CG2-CD2 4.07Å; V174-L199 HydrophobicContact CG1-CD2 3.85Å; F195-L199 HydrophobicContact CD1-CD1 4.07Å; F195-L199 HydrophobicContact CD1-CG 4.5Å; F195-L199 HydrophobicContact CE1-CD1 3.54Å; F195-L199 HydrophobicContact CE1-CG 4.1Å; F195-L199 HydrophobicContact CE2-CG 4.48Å; F195-L199 HydrophobicContact CZ-CD1 3.94Å; F195-L199 HydrophobicContact CZ-CD2 4.33Å; F195-L199 HydrophobicContact CZ-CG 4.1Å; F195-L199 PolarHBondContact O-N 3.21Å; V196-L199 PolarHBondContact O-N 3.26Å; V196-L199 VanDerWaalsContact O-N 3.16Å; L199-S201 PolarHBondContact O-N 3.26Å; L199-Q202 PolarHBondContact O-N 2.66Å; L199-V203 WeakPolarHBondContact O-CG2 3.43Å; L199-V203 PolarHBondContact O-N 3.47Å
200	Q	86.3	Confident	77	Confident	79 Å²	79	48.1 Å²	48.1	37%	0.369	27%	0.265	S	S	.	.	H	α-helix	trans	-57.9	-49.1	175.7	-173.4	172.9	-21.7	0	0	111.2	H136 V196 E197 F198 Q202 V203 E204	H136-Q200 PolarHBondContact CD2-N 2.84Å; V196-Q200 PolarHBondContact O-N 2.82Å; E197-Q200 PolarHBondContact O-N 3.09Å; F198-Q200 VanDerWaalsContact C-N 3.28Å; F198-Q200 PolarHBondContact O-N 3.19Å; Q200-Q202 VanDerWaalsContact C-N 3.28Å; Q200-Q202 PolarHBondContact O-N 3.5Å; Q200-V203 PolarHBondContact O-N 3.27Å; Q200-V203 VanDerWaalsContact O-N 3.11Å; Q200-E204 WeakPolarHBondContact CG-OE1 3.46Å; Q200-E204 PolarHBondContact NE2-OE1 3.48Å; Q200-E204 WeakPolarHBondContact O-CG 3.39Å; Q200-E204 PolarHBondContact O-N 3.33Å
201	S	83.9	Confident	77.1	Confident	40 Å²	40	47 Å²	47	28%	0.28	27%	0.267	S	S	.	.	H	α-helix	trans	-58.3	-40.5	177.5	76.1	0	0	0	0	112	E197 F198 L199 V203 E204 I205	E197-S201 PolarHBondContact O-N 3.33Å; F198-S201 PolarHBondContact O-N 3.07Å; F198-S201 PolarHBondContact O-OG 2.96Å; L199-S201 PolarHBondContact O-N 3.26Å; S201-V203 VanDerWaalsContact C-N 3.33Å; S201-V203 PolarHBondContact O-N 2.89Å; S201-E204 PolarHBondContact O-N 3.46Å; S201-I205 WeakPolarHBondContact O-CD1 3.4Å; S201-I205 WeakPolarHBondContact O-CG1 3.27Å; S201-I205 PolarHBondContact O-N 3.14Å
202	Q	85.1	Confident	76.6	Confident	32 Å²	32	48.6 Å²	48.6	15%	0.15	28%	0.279	C	S	.	.	H	α-helix	trans	-66.3	-37.1	178.3	-65.3	-46.7	-63.3	0	0	112	L177 F198 L199 Q200 E206	L177-Q202 VanDerWaalsContact CD1-OE1 3.25Å; F198-Q202 HydrophobicContact CD2-CG 4.23Å; F198-Q202 HydrophobicContact CE1-CG 4.04Å; F198-Q202 HydrophobicContact CE2-CG 3.7Å; F198-Q202 HydrophobicContact CZ-CG 3.59Å; F198-Q202 WeakPolarHBondContact O-CG 3.29Å; F198-Q202 PolarHBondContact O-N 3.45Å; L199-Q202 PolarHBondContact O-N 2.66Å; Q200-Q202 VanDerWaalsContact C-N 3.28Å; Q200-Q202 PolarHBondContact O-N 3.5Å; Q202-E206 PolarHBondContact O-N 3.46Å; Q202-E206 VanDerWaalsContact O-N 3.14Å
203	V	85.3	Confident	75.6	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-70.8	-41.8	177.9	-171.4	0	0	0	0	111.1	L132 R133 H136 L199 Q200 S201 I205 E206 E207	L132-V203 HydrophobicContact CB-CG2 3.76Å; R133-V203 HydrophobicContact CB-CG1 3.93Å; R133-V203 VanDerWaalsContact NH2-CG1 3.28Å; H136-V203 HydrophobicContact CB-CG2 4.18Å; L199-V203 WeakPolarHBondContact O-CG2 3.43Å; L199-V203 PolarHBondContact O-N 3.47Å; Q200-V203 PolarHBondContact O-N 3.27Å; Q200-V203 VanDerWaalsContact O-N 3.11Å; S201-V203 VanDerWaalsContact C-N 3.33Å; S201-V203 PolarHBondContact O-N 2.89Å; V203-I205 VanDerWaalsContact C-N 3.33Å; V203-I205 PolarHBondContact O-N 3.15Å; V203-E206 PolarHBondContact O-N 3.28Å; V203-E207 HydrophobicContact CG1-CG 4.16Å; V203-E207 WeakPolarHBondContact O-CB 3.44Å; V203-E207 WeakPolarHBondContact O-CG 3.39Å; V203-E207 PolarHBondContact O-N 2.88Å
204	E	83.5	Confident	74.4	Confident	96 Å²	96	59.1 Å²	59.1	45%	0.449	32%	0.324	S	S	.	.	H	α-helix	trans	-61.6	-41.2	177	-72.4	173.8	-171.5	0	0	111.7	Q200 S201 E206 E207 A208	Q200-E204 WeakPolarHBondContact CG-OE1 3.46Å; Q200-E204 PolarHBondContact NE2-OE1 3.48Å; Q200-E204 WeakPolarHBondContact O-CG 3.39Å; Q200-E204 PolarHBondContact O-N 3.33Å; S201-E204 PolarHBondContact O-N 3.46Å; E204-E206 VanDerWaalsContact C-N 3.34Å; E204-E206 PolarHBondContact O-N 3.46Å; E204-E207 PolarHBondContact O-N 3.5Å; E204-A208 VanDerWaalsContact O-CB 3.26Å; E204-A208 WeakPolarHBondContact O-CB 3.45Å; E204-A208 PolarHBondContact O-N 2.92Å
205	I	79.4	Confident	72.8	Confident	97 Å²	97	65.4 Å²	65.4	50%	0.497	35%	0.348	S	S	.	.	H	α-helix	trans	-58.5	-47	173.4	-70.2	163.5	0	0	0	110.6	S201 V203 A208 A209	S201-I205 WeakPolarHBondContact O-CD1 3.4Å; S201-I205 WeakPolarHBondContact O-CG1 3.27Å; S201-I205 PolarHBondContact O-N 3.14Å; V203-I205 VanDerWaalsContact C-N 3.33Å; V203-I205 PolarHBondContact O-N 3.15Å; I205-A208 PolarHBondContact O-N 2.78Å; I205-A209 WeakPolarHBondContact O-CB 3.26Å; I205-A209 PolarHBondContact O-N 2.9Å
206	E	78.8	Confident	70.8	Confident	69 Å²	69	67.5 Å²	67.5	32%	0.322	37%	0.37	S	S	.	.	H	α-helix	trans	-73.6	-35	-176.8	-163.6	62.1	-169.4	0	0	112.4	A129 L132 Q202 V203 E204 A209 V210	A129-E206 HydrophobicContact CB-CB 4.2Å; A129-E206 HydrophobicContact CB-CG 3.97Å; L132-E206 HydrophobicContact CD1-CB 4.43Å; Q202-E206 PolarHBondContact O-N 3.46Å; Q202-E206 VanDerWaalsContact O-N 3.14Å; V203-E206 PolarHBondContact O-N 3.28Å; E204-E206 VanDerWaalsContact C-N 3.34Å; E204-E206 PolarHBondContact O-N 3.46Å; E206-A209 PolarHBondContact O-N 3.45Å; E206-V210 VanDerWaalsContact O-CG2 3.29Å; E206-V210 WeakPolarHBondContact O-CG2 3.42Å; E206-V210 PolarHBondContact O-N 2.68Å
207	E	83.3	Confident	68.5	Low	78 Å²	78	71.1 Å²	71.1	36%	0.364	40%	0.396	S	S	.	.	H	α-helix	trans	-65.5	-41.1	172.3	-76.2	-179.3	165.7	0	0	111.8	A129 R133 V203 E204 V210 A211	A129-E207 HydrophobicContact CB-CG 3.79Å; R133-E207 IonicContact CZ-OE1 3.8Å; R133-E207 IonicContact CZ-OE2 2.87Å; R133-E207 IonicContact NE-OE1 3.03Å; R133-E207 IonicContact NH1-OE1 3.86Å; R133-E207 PolarHBondContact NH1-OE1 3.44Å; R133-E207 IonicContact NH1-OE2 3.99Å; R133-E207 PolarHBondContact NH1-OE2 3Å; V203-E207 HydrophobicContact CG1-CG 4.16Å; V203-E207 WeakPolarHBondContact O-CB 3.44Å; V203-E207 WeakPolarHBondContact O-CG 3.39Å; V203-E207 PolarHBondContact O-N 2.88Å; E204-E207 PolarHBondContact O-N 3.5Å; E207-V210 PolarHBondContact O-N 3.33Å; E207-A211 VanDerWaalsContact O-CB 3.29Å; E207-A211 WeakPolarHBondContact O-CB 3.47Å; E207-A211 PolarHBondContact O-N 2.99Å
208	A	75.6	Confident	66.1	Low	62 Å²	62	74.2 Å²	74.2	51%	0.512	41%	0.407	S	S	.	.	H	α-helix	trans	-63.5	-41.6	173.5	0	0	0	0	0	111.5	E204 I205 A211 S212	E204-A208 VanDerWaalsContact O-CB 3.26Å; E204-A208 WeakPolarHBondContact O-CB 3.45Å; E204-A208 PolarHBondContact O-N 2.92Å; I205-A208 PolarHBondContact O-N 2.78Å; A208-A211 PolarHBondContact O-N 3.41Å; A208-S212 WeakPolarHBondContact O-CB 3.4Å; A208-S212 PolarHBondContact O-N 3.22Å
209	A	71.8	Confident	63.2	Low	38 Å²	38	80.7 Å²	80.7	31%	0.314	44%	0.442	S	S	.	.	H	α-helix	trans	-60.2	-48.1	173.9	0	0	0	0	0	111.4	I205 E206 A211 S212 E213	I205-A209 WeakPolarHBondContact O-CB 3.26Å; I205-A209 PolarHBondContact O-N 2.9Å; E206-A209 PolarHBondContact O-N 3.45Å; A209-A211 PolarHBondContact O-N 3.41Å; A209-S212 PolarHBondContact O-N 2.94Å; A209-S212 PolarHBondContact O-OG 3.4Å; A209-E213 PolarHBondContact O-N 3.48Å
210	V	70.2	Confident	60.5	Low	46 Å²	46	89 Å²	89	28%	0.279	48%	0.478	S	S	.	.	H	α-helix	trans	-65.4	-37.5	177.4	172.6	0	0	0	0	112.3	E206 E207 S212 E213 K214	E206-V210 VanDerWaalsContact O-CG2 3.29Å; E206-V210 WeakPolarHBondContact O-CG2 3.42Å; E206-V210 PolarHBondContact O-N 2.68Å; E207-V210 PolarHBondContact O-N 3.33Å; V210-S212 VanDerWaalsContact C-N 3.33Å; V210-E213 PolarHBondContact O-N 3.31Å; V210-K214 HydrophobicContact CG1-CD 4.46Å; V210-K214 PolarHBondContact O-N 3.35Å
211	A	59.2	Low	57.6	Low	52 Å²	52	96.2 Å²	96.2	43%	0.43	50%	0.502	S	S	.	.	H	α-helix	trans	-61.5	-43.7	175.1	0	0	0	0	0	110.8	E207 A208 A209 E213 K214 E215	E207-A211 VanDerWaalsContact O-CB 3.29Å; E207-A211 WeakPolarHBondContact O-CB 3.47Å; E207-A211 PolarHBondContact O-N 2.99Å; A208-A211 PolarHBondContact O-N 3.41Å; A209-A211 PolarHBondContact O-N 3.41Å; A211-E213 VanDerWaalsContact C-N 3.31Å; A211-E213 PolarHBondContact O-N 2.89Å; A211-K214 PolarHBondContact O-N 3.19Å; A211-E215 PolarHBondContact O-N 3.42Å
212	S	52.3	Low	54.9	Low	77 Å²	77	105.5 Å²	105.5	54%	0.538	53%	0.531	S	S	.	.	H	α-helix	trans	-63	-35.5	175.6	79.7	0	0	0	0	112.6	A208 A209 V210 G216	A208-S212 WeakPolarHBondContact O-CB 3.4Å; A208-S212 PolarHBondContact O-N 3.22Å; A209-S212 PolarHBondContact O-N 2.94Å; A209-S212 PolarHBondContact O-OG 3.4Å; V210-S212 VanDerWaalsContact C-N 3.33Å; S212-G216 PolarHBondContact O-N 3.01Å; S212-G216 VanDerWaalsContact O-N 3.15Å
213	E	45.7	Very low	52.1	Low	147 Å²	147	110.4 Å²	110.4	69%	0.687	56%	0.563	S	S	*	*	H	α-helix	trans	-69	-37.8	173.9	-71.3	-169.5	162.3	0	0	112.8	A209 V210 A211	A209-E213 PolarHBondContact O-N 3.48Å; V210-E213 PolarHBondContact O-N 3.31Å; A211-E213 VanDerWaalsContact C-N 3.31Å; A211-E213 PolarHBondContact O-N 2.89Å
214	K	41.2	Very low	49.4	Very low	152 Å²	152	114.9 Å²	114.9	66%	0.661	58%	0.584	S	S	*	*	H	α-helix	trans	-73.9	-37.1	179.2	-80.2	-177.7	179.7	172.4	0	113	V210 A211 G216 C217	V210-K214 HydrophobicContact CG1-CD 4.46Å; V210-K214 PolarHBondContact O-N 3.35Å; A211-K214 PolarHBondContact O-N 3.19Å; K214-G216 VanDerWaalsContact C-N 3.32Å; K214-C217 PolarHBondContact O-N 3.21Å
215	E	40.5	Very low	46.8	Very low	159 Å²	159	114.6 Å²	114.6	74%	0.743	59%	0.59	S	S	*	*	H	α-helix	trans	-68.5	-34.2	173.1	-72.5	-165.2	154.6	0	0	111.9	A211 C217 K218	A211-E215 PolarHBondContact O-N 3.42Å; E215-C217 PolarHBondContact O-N 2.87Å; E215-K218 PolarHBondContact O-N 3.26Å
216	G	35.8	Very low	44.5	Very low	45 Å²	45	113.9 Å²	113.9	46%	0.464	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.2	-15.6	172.1	0	0	0	0	0	114.8	S212 K214	S212-G216 PolarHBondContact O-N 3.01Å; S212-G216 VanDerWaalsContact O-N 3.15Å; K214-G216 VanDerWaalsContact C-N 3.32Å
217	C	29.6	Very low	42.5	Very low	95 Å²	95	118.6 Å²	118.6	64%	0.642	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	-4.1	-177.1	-143.7	0	0	0	0	115.4	K214 E215	K214-C217 PolarHBondContact O-N 3.21Å; E215-C217 PolarHBondContact O-N 2.87Å
218	K	30.5	Very low	40.2	Very low	190 Å²	190	121.4 Å²	121.4	83%	0.826	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-11	175	-78.7	-172.6	177	-179.6	0	115.7	E215	E215-K218 PolarHBondContact O-N 3.26Å
219	N	26.9	Very low	38.3	Very low	140 Å²	140	124.7 Å²	124.7	75%	0.749	64%	0.637	S	S	*	*			trans	-124.3	65.4	174.8	-83.7	-20.7	0	0	0	112.6	R221	N219-R221 VanDerWaalsContact C-N 3.34Å
220	K	25.9	Very low	36.6	Very low	175 Å²	175	128 Å²	128	76%	0.761	65%	0.647	S	S	*	*			trans	-96.8	54.8	160.2	-77.2	-176.8	-179.7	170.7	0	110.9	R222	K220-R222 PolarHBondContact O-N 2.91Å
221	R	24.9	Very low	35	Very low	230 Å²	230	136.4 Å²	136.4	87%	0.868	67%	0.673	S	S	*	*			trans	-81.5	98.9	156.5	-75.3	-174	178.6	-175.6	0.6	106.9	N219 T223	N219-R221 VanDerWaalsContact C-N 3.34Å; R221-T223 PolarHBondContact O-N 3.27Å
222	R	27	Very low	33.8	Very low	236 Å²	236	144.4 Å²	144.4	89%	0.891	69%	0.692	S	S	*	*			trans	-64.3	101.6	170.6	-83.9	179.2	166.6	179	-4.6	108.2	K220 E224	K220-R222 PolarHBondContact O-N 2.91Å; R222-E224 PolarHBondContact O-N 2.92Å
223	T	27.3	Very low	32.9	Very low	135 Å²	135	150.3 Å²	150.3	83%	0.828	70%	0.703	S	S	*	*			trans	-70.2	111.4	159.8	13.3	0	0	0	0	107.8	R221	R221-T223 PolarHBondContact O-N 3.27Å
224	E	27.9	Very low	32.3	Very low	94 Å²	94	151.6 Å²	151.6	44%	0.439	71%	0.706	S	S	.	*	P	Polyproline II helix	trans	-66.6	127.5	169.6	-73.4	172.4	168	0	0	109	R222 R327	R222-E224 PolarHBondContact O-N 2.92Å; E224-R327 VanDerWaalsContact OE1-CG 3.26Å; E224-R327 WeakPolarHBondContact OE1-CG 2.92Å; E224-R327 VanDerWaalsContact OE2-CG 3.28Å; E224-R327 WeakPolarHBondContact OE2-CG 3.44Å; E224-R327 IonicContact OE2-CZ 3.29Å; E224-R327 IonicContact OE2-NE 3.94Å; E224-R327 PolarHBondContact OE2-NE 3.34Å; E224-R327 IonicContact OE2-NH2 3.87Å; E224-R327 PolarHBondContact OE2-NH2 3.24Å
225	P	30.1	Very low	31.9	Very low	90 Å²	90	151.4 Å²	151.4	58%	0.584	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-69.9	142.7	174.8	-9.6	25.1	0	0	0	110.3
226	S	30	Very low	31.1	Very low	81 Å²	81	154.6 Å²	154.6	57%	0.566	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-66	150.5	-174.9	75.6	0	0	0	0	112.8	L228 E229	S226-L228 PolarHBondContact O-N 2.84Å; S226-E229 PolarHBondContact O-N 3.04Å; S226-E229 VanDerWaalsContact O-N 3.11Å
227	E	36.1	Very low	30.7	Very low	169 Å²	169	161.7 Å²	161.7	79%	0.79	74%	0.736	S	S	*	*	H	α-helix	trans	-52.9	-18.6	-174.5	-84.2	179.5	133.9	0	0	115.3
228	L	34.9	Very low	30.6	Very low	137 Å²	137	160.5 Å²	160.5	72%	0.717	73%	0.729	S	S	*	*	H	α-helix	trans	-74.5	-29.2	-179.9	-133.1	89.4	0	0	0	113	S226	S226-L228 PolarHBondContact O-N 2.84Å
229	E	36.7	Very low	30.5	Very low	130 Å²	130	155 Å²	155	61%	0.607	72%	0.715	S	S	*	*	H	α-helix	trans	-80.8	-21.5	-179.8	-81	179.2	138.2	0	0	113.2	S226	S226-E229 PolarHBondContact O-N 3.04Å; S226-E229 VanDerWaalsContact O-N 3.11Å
230	Q	36	Very low	30.9	Very low	109 Å²	109	152.9 Å²	152.9	51%	0.509	72%	0.716	S	S	.	*	H	α-helix	trans	-72.9	-28.1	176.5	-78.2	-173	-9.6	0	0	112.9
231	R	37.6	Very low	31.2	Very low	222 Å²	222	149.3 Å²	149.3	84%	0.838	72%	0.719	S	S	*	*	H	α-helix	trans	-73.3	-30.9	177.4	-77.8	-173.3	177.3	-173.4	0.2	113.3	R233	R231-R233 PolarHBondContact O-N 3.41Å
232	R	33.1	Very low	31.5	Very low	220 Å²	220	142.1 Å²	142.1	83%	0.83	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-11	-177.9	-72.5	-168.7	-177.6	-166.7	1.6	115.3
233	R	33.3	Very low	31.7	Very low	201 Å²	201	138.1 Å²	138.1	76%	0.758	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	1.8	-179.6	-84	-169.6	-178.5	171.8	6.5	115.6	R231	R231-R233 PolarHBondContact O-N 3.41Å
234	K	33.5	Very low	31.8	Very low	173 Å²	173	141 Å²	141	75%	0.752	71%	0.708	S	S	*	*	S	Bend	trans	-85.9	-12.8	178.9	-99	-176.1	176.9	178.7	0	115.5
235	D	31.4	Very low	31.8	Very low	149 Å²	149	140.2 Å²	140.2	80%	0.797	72%	0.719	S	S	*	*	S	Bend	trans	-111.9	68.5	179.3	-63.6	-29	0	0	0	111.2
236	W	24.2	Very low	31.8	Very low	225 Å²	225	141.8 Å²	141.8	85%	0.852	73%	0.726	S	S	*	*			trans	-155.9	83.7	164	-159.5	-70.8	0	0	0	111.1
237	F	27.9	Very low	31.9	Very low	194 Å²	194	143.5 Å²	143.5	85%	0.851	73%	0.733	S	S	*	*			trans	-116.3	124	163.6	-82	-78.5	0	0	0	110.2
238	S	26.9	Very low	31.6	Very low	70 Å²	70	143.4 Å²	143.4	49%	0.49	73%	0.732	S	S	.	*			trans	-94.1	136	-171.7	-177.6	0	0	0	0	111.9
239	S	28.3	Very low	31.6	Very low	76 Å²	76	145 Å²	145	53%	0.531	73%	0.733	S	S	.	*			trans	72.3	99	149.5	58.5	0	0	0	0	120.7	A241	S239-A241 PolarHBondContact O-N 3.37Å
240	A	35.4	Very low	32.2	Very low	94 Å²	94	149.9 Å²	149.9	78%	0.777	75%	0.746	S	S	*	*	S	Bend		71.8	-16.1	114.8	0	0	0	0	0	122.2
241	A	32	Very low	33	Very low	100 Å²	100	151 Å²	151	83%	0.826	76%	0.756	S	S	*	*	S	Bend	trans	-94.6	-6.3	171.1	0	0	0	0	0	114	S239	S239-A241 PolarHBondContact O-N 3.37Å
242	A	31.7	Very low	34.3	Very low	79 Å²	79	143.8 Å²	143.8	65%	0.653	73%	0.733	S	S	*	*	S	Bend	trans	-100.3	-3.7	179.3	0	0	0	0	0	114	Q244 A245	A242-Q244 PolarHBondContact O-N 3.05Å; A242-A245 PolarHBondContact O-N 2.85Å
243	L	30.6	Very low	36.6	Very low	153 Å²	153	133.4 Å²	133.4	80%	0.801	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-11.7	-179	-136.6	127	0	0	0	112.9
244	Q	30.9	Very low	38.8	Very low	194 Å²	194	125.4 Å²	125.4	91%	0.907	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	7.7	172.5	-76.8	-172	-23.9	0	0	114.5	A242	A242-Q244 PolarHBondContact O-N 3.05Å
245	A	27.1	Very low	41.4	Very low	79 Å²	79	117.4 Å²	117.4	65%	0.653	63%	0.634	S	S	*	*	S	Bend	trans	-111.1	70.6	163.1	0	0	0	0	0	108.3	A242 V247	A242-A245 PolarHBondContact O-N 2.85Å; A245-V247 PolarHBondContact O-N 3.39Å; A245-V247 VanDerWaalsContact O-N 3.1Å
246	T	29.1	Very low	44	Very low	122 Å²	122	112.3 Å²	112.3	75%	0.748	61%	0.61	S	S	*	*			trans	-41.7	113.6	173.8	34.9	0	0	0	0	111.6
247	V	33.5	Very low	46.7	Very low	117 Å²	117	105.5 Å²	105.5	71%	0.709	60%	0.596	S	S	*	*	S	Bend	trans	31.2	98	138.5	-170.9	0	0	0	0	114.7	A245	A245-V247 PolarHBondContact O-N 3.39Å; A245-V247 VanDerWaalsContact O-N 3.1Å
248	H	29.5	Very low	49.2	Very low	167 Å²	167	97.2 Å²	97.2	77%	0.773	57%	0.565	S	S	*	*			trans	174.5	1.8	138.1	-89.5	-50.9	0	0	0	115.4
249	K	35.7	Very low	51.8	Low	170 Å²	170	102.2 Å²	102.2	74%	0.739	58%	0.581	S	S	*	*			trans	-98.7	3.6	-171.6	-80.3	-174.4	179	177.6	0	118.6	N251 M252	K249-N251 PolarHBondContact O-N 3.11Å; K249-N251 VanDerWaalsContact O-N 3.15Å; K249-M252 HydrophobicContact CG-SD 3.76Å; K249-M252 PolarHBondContact O-N 3Å
250	R	47.6	Very low	54.4	Low	233 Å²	233	101.8 Å²	101.8	88%	0.879	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-16.6	-174	-97.7	-177.2	177.5	166.1	-0	115.2
251	N	54	Low	56.5	Low	134 Å²	134	104 Å²	104	72%	0.717	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122	14.2	177.9	-74	-10.4	0	0	0	114.7	K249	K249-N251 PolarHBondContact O-N 3.11Å; K249-N251 VanDerWaalsContact O-N 3.15Å
252	M	64.2	Low	59	Low	69 Å²	69	100.1 Å²	100.1	34%	0.34	53%	0.53	S	S	.	.	S	Bend	trans	-89.1	132.8	178.3	-63.2	-178.9	79.1	0	0	111.3	K249 S254 S257 G258	K249-M252 HydrophobicContact CG-SD 3.76Å; K249-M252 PolarHBondContact O-N 3Å; M252-S254 PolarHBondContact O-N 3.04Å; M252-S257 WeakPolarHBondContact CE-O 3.48Å; M252-G258 CarbonylContact C-O 3.37Å; M252-G258 WeakPolarHBondContact CA-O 3.39Å
253	C	81.4	Confident	61.3	Low	3 Å²	3	97.7 Å²	97.7	2%	0.02	51%	0.51	C	S	.	.			trans	-60.3	123.5	174.7	177.9	0	0	0	0	110.6	F255 C256 S257 G258 H260 N262 C265	C253-F255 PolarHBondContact O-N 3.34Å; C253-F255 VanDerWaalsContact O-N 3.1Å; C253-F255 PolarHBondContact SG-N 2.64Å; C253-C256 PolarHBondContact O-N 2.94Å; C253-S257 WeakPolarHBondContact O-CA 3.47Å; C253-S257 PolarHBondContact O-N 2.85Å; C253-G258 VanDerWaalsContact CB-O 3.32Å; C253-G258 WeakPolarHBondContact CB-O 3.26Å; C253-G258 PolarHBondContact N-O 3.34Å; C253-H260 WeakPolarHBondContact CB-O 3.36Å; C253-N262 WeakPolarHBondContact CA-OD1 3.41Å; C253-N262 PolarHBondContact SG-OD1 3.48Å; C253-C265 WeakPolarHBondContact SG-CB 3.27Å
254	S	80.6	Confident	63.9	Low	32 Å²	32	93.6 Å²	93.6	22%	0.224	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-14.9	177.6	60.2	0	0	0	0	114.4	M252 N262 N283	M252-S254 PolarHBondContact O-N 3.04Å; S254-N262 PolarHBondContact N-OD1 2.98Å; S254-N262 PolarHBondContact OG-ND2 3.41Å; S254-N262 PolarHBondContact OG-OD1 2.94Å; S254-N283 PolarHBondContact O-OD1 2.76Å
255	F	87.9	Confident	66.6	Low	5 Å²	5	84.3 Å²	84.3	2%	0.022	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-30.3	-176.2	-57	-47.8	0	0	0	113.9	C253 N262 C265 R267 F268 M279 V280 N283 A285	C253-F255 PolarHBondContact O-N 3.34Å; C253-F255 VanDerWaalsContact O-N 3.1Å; C253-F255 PolarHBondContact SG-N 2.64Å; F255-N262 HydrophobicContact CD2-CB 4.05Å; F255-N262 HydrophobicContact CE2-CB 3.56Å; F255-N262 HydrophobicContact CZ-CB 4.31Å; F255-C265 HydrophobicContact CD2-CB 4.21Å; F255-R267 WeakPolarHBondContact O-CD 3.4Å; F255-R267 PolarHBondContact O-NH1 2.89Å; F255-F268 HydrophobicContact CB-CB 4.29Å; F255-F268 HydrophobicContact CD1-CD2 4.13Å; F255-F268 HydrophobicContact CD2-CB 3.64Å; F255-F268 HydrophobicContact CD2-CD1 4.4Å; F255-F268 AromaticContact CD2-CD2 3.76Å; F255-F268 HydrophobicContact CD2-CD2 3.76Å; F255-F268 AromaticContact CD2-CG 3.68Å; F255-F268 HydrophobicContact CD2-CG 3.68Å; F255-F268 HydrophobicContact CE1-CD2 4.1Å; F255-F268 HydrophobicContact CE1-CE2 4.17Å; F255-F268 HydrophobicContact CE2-CB 4.19Å; F255-F268 HydrophobicContact CE2-CD1 4.1Å; F255-F268 AromaticContact CE2-CD2 3.69Å; F255-F268 HydrophobicContact CE2-CD2 3.69Å; F255-F268 HydrophobicContact CE2-CE1 4.41Å; F255-F268 HydrophobicContact CE2-CE2 4.02Å; F255-F268 AromaticContact CE2-CG 3.72Å; F255-F268 HydrophobicContact CE2-CG 3.72Å; F255-F268 HydrophobicContact CE2-CZ 4.36Å; F255-F268 HydrophobicContact CG-CB 4.1Å; F255-F268 AromaticContact CG-CD2 3.98Å; F255-F268 HydrophobicContact CG-CD2 3.98Å; F255-F268 HydrophobicContact CG-CG 4.26Å; F255-F268 AromaticContact CZ-CD2 3.88Å; F255-F268 HydrophobicContact CZ-CD2 3.88Å; F255-F268 AromaticContact CZ-CE2 3.85Å; F255-F268 HydrophobicContact CZ-CE2 3.85Å; F255-F268 HydrophobicContact CZ-CG 4.38Å; F255-F268 HydrophobicContact CZ-CZ 4.31Å; F255-M279 HydrophobicContact CB-CE 3.63Å; F255-M279 HydrophobicContact CD1-CB 4.13Å; F255-M279 HydrophobicContact CD1-CE 4.1Å; F255-M279 HydrophobicContact CE1-CB 4.29Å; F255-M279 HydrophobicContact CG-CE 4.17Å; F255-V280 HydrophobicContact CE1-CG2 4.23Å; F255-V280 HydrophobicContact CZ-CG2 3.99Å; F255-N283 HydrophobicContact CE1-CB 4.38Å; F255-A285 HydrophobicContact CE1-CB 4.42Å; F255-A285 HydrophobicContact CZ-CB 4.26Å
256	C	85.3	Confident	69.4	Low	43 Å²	43	86.1 Å²	86.1	29%	0.291	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.7	2.9	-177.6	76.3	0	0	0	0	114.3	C253 G258 H260 R267	C253-C256 PolarHBondContact O-N 2.94Å; C256-G258 PolarHBondContact O-N 3.45Å; C256-G258 PolarHBondContact SG-N 3.42Å; C256-H260 PolarHBondContact SG-CE1 3.2Å; C256-H260 PolarHBondContact SG-NE2 2.97Å; C256-H260 VanDerWaalsContact SG-NE2 3.39Å; C256-R267 HydrophobicContact CB-CB 3.86Å; C256-R267 HydrophobicContact CB-CG 4.47Å
257	S	81.3	Confident	72.2	Confident	81 Å²	81	87.8 Å²	87.8	57%	0.566	44%	0.436	S	S	*	.			trans	58.4	28.4	-176.2	-52.6	0	0	0	0	114.1	M252 C253	M252-S257 WeakPolarHBondContact CE-O 3.48Å; C253-S257 WeakPolarHBondContact O-CA 3.47Å; C253-S257 PolarHBondContact O-N 2.85Å
258	G	80.4	Confident	75	Confident	20 Å²	20	82.2 Å²	82.2	21%	0.206	40%	0.402	C	S	.	.			trans	-98	159.4	174.5	0	0	0	0	0	112.5	M252 C253 C256 H260	M252-G258 CarbonylContact C-O 3.37Å; M252-G258 WeakPolarHBondContact CA-O 3.39Å; C253-G258 VanDerWaalsContact CB-O 3.32Å; C253-G258 WeakPolarHBondContact CB-O 3.26Å; C253-G258 PolarHBondContact N-O 3.34Å; C256-G258 PolarHBondContact O-N 3.45Å; C256-G258 PolarHBondContact SG-N 3.42Å; G258-H260 VanDerWaalsContact C-N 3.29Å; G258-H260 PolarHBondContact O-N 2.93Å
259	E	80.9	Confident	77.7	Confident	176 Å²	176	77.4 Å²	77.4	82%	0.822	38%	0.379	S	S	*	.	S	Bend	trans	-79	69	-178	-62.8	-172.3	160.8	0	0	112.9
260	H	82.5	Confident	80.1	Confident	66 Å²	66	75.6 Å²	75.6	31%	0.306	38%	0.377	S	S	.	.	S	Bend	trans	-155.3	163.3	176.1	53.4	-94.7	0	0	0	111.3	C253 C256 G258 C265	C253-H260 WeakPolarHBondContact CB-O 3.36Å; C256-H260 PolarHBondContact SG-CE1 3.2Å; C256-H260 PolarHBondContact SG-NE2 2.97Å; C256-H260 VanDerWaalsContact SG-NE2 3.39Å; G258-H260 VanDerWaalsContact C-N 3.29Å; G258-H260 PolarHBondContact O-N 2.93Å; H260-C265 VanDerWaalsContact CD2-CA 3.41Å; H260-C265 WeakPolarHBondContact CD2-CA 3.36Å; H260-C265 WeakPolarHBondContact NE2-CA 3.42Å; H260-C265 VanDerWaalsContact NE2-CB 3.34Å; H260-C265 WeakPolarHBondContact NE2-CB 3.36Å; H260-C265 PolarHBondContact NE2-SG 2.93Å
261	E	79.7	Confident	81.9	Confident	142 Å²	142	66.9 Å²	66.9	66%	0.664	35%	0.35	S	S	*	.			trans	-63.3	144.9	175.7	-65	-171.9	167.6	0	0	112.5	A263 T264 C265	E261-A263 PolarHBondContact O-N 3.01Å; E261-T264 PolarHBondContact N-OG1 2.94Å; E261-T264 PolarHBondContact O-N 2.87Å; E261-T264 PolarHBondContact O-OG1 3.33Å; E261-C265 PolarHBondContact O-N 2.9Å
262	N	84.3	Confident	83.5	Confident	17 Å²	17	63 Å²	63	9%	0.091	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-34	175	-78	-11.9	0	0	0	113.7	C253 S254 F255 T264 L290	C253-N262 WeakPolarHBondContact CA-OD1 3.41Å; C253-N262 PolarHBondContact SG-OD1 3.48Å; S254-N262 PolarHBondContact N-OD1 2.98Å; S254-N262 PolarHBondContact OG-ND2 3.41Å; S254-N262 PolarHBondContact OG-OD1 2.94Å; F255-N262 HydrophobicContact CD2-CB 4.05Å; F255-N262 HydrophobicContact CE2-CB 3.56Å; F255-N262 HydrophobicContact CZ-CB 4.31Å; N262-T264 VanDerWaalsContact C-N 3.34Å; N262-L290 HydrophobicContact CB-CB 4.13Å; N262-L290 WeakPolarHBondContact CB-O 3.41Å; N262-L290 PolarHBondContact ND2-O 2.97Å
263	A	81.2	Confident	84.5	Confident	29 Å²	29	62 Å²	62	24%	0.24	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-22.1	178	0	0	0	0	0	114	E261 K269 L290	E261-A263 PolarHBondContact O-N 3.01Å; A263-K269 WeakPolarHBondContact O-CE 3.24Å; A263-L290 HydrophobicContact CB-CD1 4.47Å
264	T	84.4	Confident	84.6	Confident	66 Å²	66	71.1 Å²	71.1	41%	0.405	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-11.3	179.5	55.8	0	0	0	0	113.3	E261 N262 Q266 K269	E261-T264 PolarHBondContact N-OG1 2.94Å; E261-T264 PolarHBondContact O-N 2.87Å; E261-T264 PolarHBondContact O-OG1 3.33Å; N262-T264 VanDerWaalsContact C-N 3.34Å; T264-Q266 PolarHBondContact O-N 2.89Å; T264-K269 WeakPolarHBondContact O-CE 3.44Å; T264-K269 PolarHBondContact O-NZ 3.25Å
265	C	87.3	Confident	85	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	38%	0.378	C	S	.	.			trans	-54.1	121	-178.6	-176.1	0	0	0	0	115	C253 F255 H260 E261 F268 K269	C253-C265 WeakPolarHBondContact SG-CB 3.27Å; F255-C265 HydrophobicContact CD2-CB 4.21Å; H260-C265 VanDerWaalsContact CD2-CA 3.41Å; H260-C265 WeakPolarHBondContact CD2-CA 3.36Å; H260-C265 WeakPolarHBondContact NE2-CA 3.42Å; H260-C265 VanDerWaalsContact NE2-CB 3.34Å; H260-C265 WeakPolarHBondContact NE2-CB 3.36Å; H260-C265 PolarHBondContact NE2-SG 2.93Å; E261-C265 PolarHBondContact O-N 2.9Å; C265-F268 HydrophobicContact CB-CB 3.94Å; C265-F268 PolarHBondContact O-N 2.85Å; C265-K269 WeakPolarHBondContact O-CG 3.43Å; C265-K269 PolarHBondContact O-N 3.36Å
266	Q	86	Confident	85.2	Confident	117 Å²	117	72.6 Å²	72.6	55%	0.547	39%	0.385	S	S	.	.	H	α-helix	trans	-68.8	-39.2	178.8	-84.8	-66.5	25	0	0	113	T264 F268 K269 N270	T264-Q266 PolarHBondContact O-N 2.89Å; Q266-F268 PolarHBondContact O-N 3.29Å; Q266-K269 PolarHBondContact O-N 3.31Å; Q266-K269 VanDerWaalsContact O-N 3.13Å; Q266-N270 WeakPolarHBondContact O-CB 3.14Å; Q266-N270 VanDerWaalsContact O-CG 3.23Å; Q266-N270 PolarHBondContact O-N 2.93Å
267	R	89	Confident	85.5	Confident	157 Å²	157	73 Å²	73	59%	0.592	38%	0.381	S	S	*	.	H	α-helix	trans	-56.4	-43.2	175.6	-168.3	-179.4	-176.8	-169.6	11.2	111.1	F255 C256 N270 V271	F255-R267 WeakPolarHBondContact O-CD 3.4Å; F255-R267 PolarHBondContact O-NH1 2.89Å; C256-R267 HydrophobicContact CB-CB 3.86Å; C256-R267 HydrophobicContact CB-CG 4.47Å; R267-N270 PolarHBondContact O-N 3.08Å; R267-V271 WeakPolarHBondContact O-CG2 3.48Å
268	F	91.1	Very high	85.8	Confident	0 Å²	0	75.4 Å²	75.4	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-68.2	-39.9	177.2	-174.1	-108.2	0	0	0	112.9	F255 C265 Q266 N270 R276 M279 V280 L290 M311 L312	F255-F268 HydrophobicContact CB-CB 4.29Å; F255-F268 HydrophobicContact CD1-CD2 4.13Å; F255-F268 HydrophobicContact CD2-CB 3.64Å; F255-F268 HydrophobicContact CD2-CD1 4.4Å; F255-F268 AromaticContact CD2-CD2 3.76Å; F255-F268 HydrophobicContact CD2-CD2 3.76Å; F255-F268 AromaticContact CD2-CG 3.68Å; F255-F268 HydrophobicContact CD2-CG 3.68Å; F255-F268 HydrophobicContact CE1-CD2 4.1Å; F255-F268 HydrophobicContact CE1-CE2 4.17Å; F255-F268 HydrophobicContact CE2-CB 4.19Å; F255-F268 HydrophobicContact CE2-CD1 4.1Å; F255-F268 AromaticContact CE2-CD2 3.69Å; F255-F268 HydrophobicContact CE2-CD2 3.69Å; F255-F268 HydrophobicContact CE2-CE1 4.41Å; F255-F268 HydrophobicContact CE2-CE2 4.02Å; F255-F268 AromaticContact CE2-CG 3.72Å; F255-F268 HydrophobicContact CE2-CG 3.72Å; F255-F268 HydrophobicContact CE2-CZ 4.36Å; F255-F268 HydrophobicContact CG-CB 4.1Å; F255-F268 AromaticContact CG-CD2 3.98Å; F255-F268 HydrophobicContact CG-CD2 3.98Å; F255-F268 HydrophobicContact CG-CG 4.26Å; F255-F268 AromaticContact CZ-CD2 3.88Å; F255-F268 HydrophobicContact CZ-CD2 3.88Å; F255-F268 AromaticContact CZ-CE2 3.85Å; F255-F268 HydrophobicContact CZ-CE2 3.85Å; F255-F268 HydrophobicContact CZ-CG 4.38Å; F255-F268 HydrophobicContact CZ-CZ 4.31Å; C265-F268 HydrophobicContact CB-CB 3.94Å; C265-F268 PolarHBondContact O-N 2.85Å; Q266-F268 PolarHBondContact O-N 3.29Å; F268-N270 VanDerWaalsContact C-N 3.34Å; F268-N270 PolarHBondContact O-N 3.11Å; F268-R276 HydrophobicContact CD2-CB 4.35Å; F268-R276 HydrophobicContact CD2-CG 4.09Å; F268-R276 HydrophobicContact CE1-CB 4.45Å; F268-R276 HydrophobicContact CE1-CG 4.23Å; F268-R276 HydrophobicContact CE2-CB 3.56Å; F268-R276 HydrophobicContact CE2-CG 3.75Å; F268-R276 HydrophobicContact CG-CG 4.47Å; F268-R276 HydrophobicContact CZ-CB 3.63Å; F268-R276 HydrophobicContact CZ-CG 3.84Å; F268-R276 WeakPolarHBondContact O-CG 3.33Å; F268-R276 PolarHBondContact O-NE 2.92Å; F268-M279 HydrophobicContact CD2-CB 4.26Å; F268-M279 HydrophobicContact CD2-SD 4.01Å; F268-M279 HydrophobicContact CE2-CB 4.27Å; F268-V280 HydrophobicContact CE2-CG2 3.69Å; F268-V280 HydrophobicContact CZ-CG2 3.73Å; F268-L290 HydrophobicContact CD1-CD1 4.36Å; F268-L290 HydrophobicContact CE1-CD1 3.63Å; F268-L290 HydrophobicContact CE1-CD2 4.4Å; F268-L290 HydrophobicContact CZ-CD1 4.19Å; F268-L290 HydrophobicContact CZ-CD2 4.12Å; F268-M311 HydrophobicContact CD1-SD 4.4Å; F268-M311 HydrophobicContact CE1-CB 4.17Å; F268-M311 HydrophobicContact CE1-SD 4.37Å; F268-L312 HydrophobicContact CZ-CD2 4.12Å
269	K	86.1	Confident	86.2	Confident	66 Å²	66	75.7 Å²	75.7	29%	0.287	38%	0.377	S	S	.	.	H	α-helix	trans	-66.2	-33.6	176.3	-73.2	169.2	-178	164.1	0	112.6	A263 T264 C265 Q266 V271 R276 M311	A263-K269 WeakPolarHBondContact O-CE 3.24Å; T264-K269 WeakPolarHBondContact O-CE 3.44Å; T264-K269 PolarHBondContact O-NZ 3.25Å; C265-K269 WeakPolarHBondContact O-CG 3.43Å; C265-K269 PolarHBondContact O-N 3.36Å; Q266-K269 PolarHBondContact O-N 3.31Å; Q266-K269 VanDerWaalsContact O-N 3.13Å; K269-V271 VanDerWaalsContact C-N 3.32Å; K269-V271 PolarHBondContact O-N 3.32Å; K269-R276 PolarHBondContact O-NH2 2.85Å; K269-M311 HydrophobicContact CD-CE 4.4Å; K269-M311 HydrophobicContact CG-CE 4Å; K269-M311 HydrophobicContact CG-SD 4.18Å
270	N	87	Confident	86.7	Confident	131 Å²	131	67.3 Å²	67.3	70%	0.701	34%	0.338	S	S	*	.	H	α-helix	trans	-78.4	-13.8	-176.4	-69	-8.9	0	0	0	113.8	Q266 R267 F268	Q266-N270 WeakPolarHBondContact O-CB 3.14Å; Q266-N270 VanDerWaalsContact O-CG 3.23Å; Q266-N270 PolarHBondContact O-N 2.93Å; R267-N270 PolarHBondContact O-N 3.08Å; F268-N270 VanDerWaalsContact C-N 3.34Å; F268-N270 PolarHBondContact O-N 3.11Å
271	V	86.4	Confident	86.8	Confident	51 Å²	51	72 Å²	72	31%	0.309	35%	0.353	S	S	.	.	S	Bend	trans	-86	142.7	173.1	-142.9	0	0	0	0	111	R267 K269 R276 M279	R267-V271 WeakPolarHBondContact O-CG2 3.48Å; K269-V271 VanDerWaalsContact C-N 3.32Å; K269-V271 PolarHBondContact O-N 3.32Å; V271-R276 HydrophobicContact CB-CG 4.46Å; V271-R276 PolarHBondContact O-NE 3.18Å; V271-R276 PolarHBondContact O-NH2 2.97Å; V271-M279 HydrophobicContact CG2-SD 3.72Å
272	G	86.4	Confident	87	Confident	51 Å²	51	71 Å²	71	53%	0.526	35%	0.349	S	S	.	.			trans	-61	163.8	172	0	0	0	0	0	112.9	K274 G275 R276	G272-K274 VanDerWaalsContact C-N 3.3Å; G272-K274 PolarHBondContact O-N 2.92Å; G272-G275 WeakPolarHBondContact O-CA 3.31Å; G272-G275 PolarHBondContact O-N 3.25Å; G272-R276 PolarHBondContact O-N 3.33Å
273	V	85	Confident	86.9	Confident	49 Å²	49	73.2 Å²	73.2	30%	0.297	36%	0.36	S	S	.	.	H	α-helix	trans	-53.9	-41.6	-173.8	177.9	0	0	0	0	113	G275 R276 W277 L312	V273-G275 PolarHBondContact O-N 2.94Å; V273-R276 PolarHBondContact O-N 3.43Å; V273-W277 PolarHBondContact O-N 2.92Å; V273-W277 VanDerWaalsContact O-N 3.07Å; V273-L312 VanDerWaalsContact CG1-O 3.31Å; V273-L312 WeakPolarHBondContact CG1-O 3.42Å
274	K	84.2	Confident	86.8	Confident	195 Å²	195	82.2 Å²	82.2	85%	0.848	39%	0.388	S	S	*	.	H	α-helix	trans	-59.7	-43.7	174.6	-88.2	-172	175.1	-177.7	0	112.1	G272 W277 K278	G272-K274 VanDerWaalsContact C-N 3.3Å; G272-K274 PolarHBondContact O-N 2.92Å; K274-W277 PolarHBondContact O-N 3.46Å; K274-K278 PolarHBondContact O-N 2.84Å
275	G	88.2	Confident	86.8	Confident	22 Å²	22	79.2 Å²	79.2	23%	0.227	37%	0.37	C	S	.	.	H	α-helix	trans	-66.8	-37.9	177.2	0	0	0	0	0	112.8	G272 V273 W277 K278 M279	G272-G275 WeakPolarHBondContact O-CA 3.31Å; G272-G275 PolarHBondContact O-N 3.25Å; V273-G275 PolarHBondContact O-N 2.94Å; G275-W277 PolarHBondContact O-N 2.9Å; G275-K278 WeakPolarHBondContact O-CB 3.16Å; G275-K278 PolarHBondContact O-N 3.35Å; G275-M279 WeakPolarHBondContact O-CG 3.44Å; G275-M279 PolarHBondContact O-N 3.38Å
276	R	92.1	Very high	86.7	Confident	45 Å²	45	79.3 Å²	79.3	17%	0.17	37%	0.371	C	S	.	.	H	α-helix	trans	-61.9	-42.2	174	-68.4	-175.7	-166.1	155.3	5.3	112.6	F268 K269 V271 G272 V273 K278 M279 V280 M311 L312	F268-R276 HydrophobicContact CD2-CB 4.35Å; F268-R276 HydrophobicContact CD2-CG 4.09Å; F268-R276 HydrophobicContact CE1-CB 4.45Å; F268-R276 HydrophobicContact CE1-CG 4.23Å; F268-R276 HydrophobicContact CE2-CB 3.56Å; F268-R276 HydrophobicContact CE2-CG 3.75Å; F268-R276 HydrophobicContact CG-CG 4.47Å; F268-R276 HydrophobicContact CZ-CB 3.63Å; F268-R276 HydrophobicContact CZ-CG 3.84Å; F268-R276 WeakPolarHBondContact O-CG 3.33Å; F268-R276 PolarHBondContact O-NE 2.92Å; K269-R276 PolarHBondContact O-NH2 2.85Å; V271-R276 HydrophobicContact CB-CG 4.46Å; V271-R276 PolarHBondContact O-NE 3.18Å; V271-R276 PolarHBondContact O-NH2 2.97Å; G272-R276 PolarHBondContact O-N 3.33Å; V273-R276 PolarHBondContact O-N 3.43Å; R276-K278 VanDerWaalsContact C-N 3.3Å; R276-K278 PolarHBondContact O-N 3.25Å; R276-M279 PolarHBondContact O-N 3.02Å; R276-V280 WeakPolarHBondContact O-CG2 3.48Å; R276-V280 PolarHBondContact O-N 2.89Å; R276-M311 WeakPolarHBondContact CD-O 3.43Å; R276-M311 PolarHBondContact NH1-O 2.99Å; R276-L312 HydrophobicContact CB-CD2 3.88Å
277	W	91.8	Very high	86.9	Confident	51 Å²	51	77 Å²	77	19%	0.193	36%	0.359	C	S	.	.	H	α-helix	trans	-59.9	-40.8	173.8	-88.8	103.8	0	0	0	112.3	V273 K274 G275 R281 F287 Y308 L312	V273-W277 PolarHBondContact O-N 2.92Å; V273-W277 VanDerWaalsContact O-N 3.07Å; K274-W277 PolarHBondContact O-N 3.46Å; G275-W277 PolarHBondContact O-N 2.9Å; W277-R281 WeakPolarHBondContact O-CG 3.45Å; W277-R281 PolarHBondContact O-N 2.94Å; W277-F287 HydrophobicContact CZ3-CD1 4.25Å; W277-F287 HydrophobicContact CZ3-CD2 4.19Å; W277-F287 HydrophobicContact CZ3-CE1 4.39Å; W277-F287 HydrophobicContact CZ3-CE2 4.35Å; W277-F287 HydrophobicContact CZ3-CG 4.14Å; W277-F287 HydrophobicContact CZ3-CZ 4.44Å; W277-Y308 AromaticContact CH2-CD1 3.54Å; W277-Y308 HydrophobicContact CH2-CD1 3.54Å; W277-Y308 AromaticContact CH2-CE1 3.73Å; W277-Y308 HydrophobicContact CH2-CE1 3.73Å; W277-Y308 HydrophobicContact CH2-CG 4.03Å; W277-Y308 HydrophobicContact CZ2-CD1 4.03Å; W277-Y308 HydrophobicContact CZ2-CD2 4.39Å; W277-Y308 HydrophobicContact CZ2-CE1 4.38Å; W277-Y308 HydrophobicContact CZ2-CG 4.02Å; W277-L312 HydrophobicContact CD2-CD2 4.24Å; W277-L312 HydrophobicContact CG-CD2 4.21Å; W277-L312 HydrophobicContact CH2-CD1 4.37Å; W277-L312 HydrophobicContact CZ2-CB 4Å; W277-L312 HydrophobicContact CZ2-CD1 4.34Å; W277-L312 HydrophobicContact CZ3-CD1 4.5Å; W277-L312 PolarHBondContact NE1-O 2.97Å
278	K	87.7	Confident	86.8	Confident	132 Å²	132	70.2 Å²	70.2	57%	0.574	34%	0.335	S	S	*	.	H	α-helix	trans	-60.9	-50.6	174.8	-172.4	175.2	175	178.1	0	111	K274 G275 R276 V280 R281 E282	K274-K278 PolarHBondContact O-N 2.84Å; G275-K278 WeakPolarHBondContact O-CB 3.16Å; G275-K278 PolarHBondContact O-N 3.35Å; R276-K278 VanDerWaalsContact C-N 3.3Å; R276-K278 PolarHBondContact O-N 3.25Å; K278-V280 PolarHBondContact O-N 3.49Å; K278-R281 PolarHBondContact O-N 3.18Å; K278-E282 WeakPolarHBondContact CE-OE1 3.33Å; K278-E282 HydrophobicContact CG-CG 4.44Å; K278-E282 WeakPolarHBondContact CG-OE1 3.35Å; K278-E282 IonicContact NZ-OE1 3.42Å; K278-E282 WeakPolarHBondContact O-CG 3.46Å; K278-E282 PolarHBondContact O-N 2.77Å
279	M	90	Very high	86.5	Confident	26 Å²	26	71.4 Å²	71.4	13%	0.128	34%	0.342	C	S	.	.	H	α-helix	trans	-60.5	-40.3	179.1	-67.9	-173.6	83.7	0	0	113.5	F255 F268 V271 G275 R276 N283	F255-M279 HydrophobicContact CB-CE 3.63Å; F255-M279 HydrophobicContact CD1-CB 4.13Å; F255-M279 HydrophobicContact CD1-CE 4.1Å; F255-M279 HydrophobicContact CE1-CB 4.29Å; F255-M279 HydrophobicContact CG-CE 4.17Å; F268-M279 HydrophobicContact CD2-CB 4.26Å; F268-M279 HydrophobicContact CD2-SD 4.01Å; F268-M279 HydrophobicContact CE2-CB 4.27Å; V271-M279 HydrophobicContact CG2-SD 3.72Å; G275-M279 WeakPolarHBondContact O-CG 3.44Å; G275-M279 PolarHBondContact O-N 3.38Å; R276-M279 PolarHBondContact O-N 3.02Å; M279-N283 WeakPolarHBondContact O-CB 3.37Å; M279-N283 PolarHBondContact O-N 2.94Å; M279-N283 PolarHBondContact O-ND2 2.84Å
280	V	90.5	Very high	86.6	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-67.4	-38.1	179.7	171.6	0	0	0	0	111.5	F255 F268 R276 K278 R284 A285 F287 L290 L312	F255-V280 HydrophobicContact CE1-CG2 4.23Å; F255-V280 HydrophobicContact CZ-CG2 3.99Å; F268-V280 HydrophobicContact CE2-CG2 3.69Å; F268-V280 HydrophobicContact CZ-CG2 3.73Å; R276-V280 WeakPolarHBondContact O-CG2 3.48Å; R276-V280 PolarHBondContact O-N 2.89Å; K278-V280 PolarHBondContact O-N 3.49Å; V280-R284 PolarHBondContact O-N 3.16Å; V280-R284 VanDerWaalsContact O-N 3.16Å; V280-A285 HydrophobicContact CG1-CB 4.04Å; V280-A285 WeakPolarHBondContact CG1-O 3.25Å; V280-A285 PolarHBondContact O-N 2.94Å; V280-F287 HydrophobicContact CG1-CD1 3.43Å; V280-F287 VanDerWaalsContact CG1-CD1 3.43Å; V280-F287 HydrophobicContact CG1-CE1 3.73Å; V280-L290 HydrophobicContact CG2-CD2 3.69Å; V280-L312 HydrophobicContact CG1-CD1 4.43Å; V280-L312 HydrophobicContact CG2-CD1 4.34Å; V280-L312 HydrophobicContact CG2-CD2 4Å
281	R	84.5	Confident	86.2	Confident	165 Å²	165	63.1 Å²	63.1	62%	0.623	31%	0.306	S	S	*	.	H	α-helix	trans	-69.6	-46.6	176.7	-71.7	177.4	-176.6	175.9	0.7	111.9	W277 K278 N283 R284 F287	W277-R281 WeakPolarHBondContact O-CG 3.45Å; W277-R281 PolarHBondContact O-N 2.94Å; K278-R281 PolarHBondContact O-N 3.18Å; R281-N283 VanDerWaalsContact C-N 3.32Å; R281-N283 PolarHBondContact O-N 2.81Å; R281-R284 PolarHBondContact O-N 2.83Å; R281-F287 HydrophobicContact CG-CE1 4.3Å; R281-F287 HydrophobicContact CG-CZ 4.34Å
282	E	83.1	Confident	85.7	Confident	121 Å²	121	64.6 Å²	64.6	57%	0.565	32%	0.319	S	S	*	.	H	α-helix	trans	-61.9	-40.1	179.8	-74	171.6	170.1	0	0	111.9	K278 R284	K278-E282 WeakPolarHBondContact CE-OE1 3.33Å; K278-E282 HydrophobicContact CG-CG 4.44Å; K278-E282 WeakPolarHBondContact CG-OE1 3.35Å; K278-E282 IonicContact NZ-OE1 3.42Å; K278-E282 WeakPolarHBondContact O-CG 3.46Å; K278-E282 PolarHBondContact O-N 2.77Å; E282-R284 VanDerWaalsContact C-N 3.33Å; E282-R284 PolarHBondContact O-N 3.41Å
283	N	82.2	Confident	85.1	Confident	63 Å²	63	66.1 Å²	66.1	34%	0.337	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	7.2	179.5	-65.3	-70.5	0	0	0	113.9	S254 F255 M279 R281 A285	S254-N283 PolarHBondContact O-OD1 2.76Å; F255-N283 HydrophobicContact CE1-CB 4.38Å; M279-N283 WeakPolarHBondContact O-CB 3.37Å; M279-N283 PolarHBondContact O-N 2.94Å; M279-N283 PolarHBondContact O-ND2 2.84Å; R281-N283 VanDerWaalsContact C-N 3.32Å; R281-N283 PolarHBondContact O-N 2.81Å; N283-A285 PolarHBondContact O-N 3.14Å; N283-A285 VanDerWaalsContact O-N 3.12Å
284	R	80.6	Confident	84.9	Confident	219 Å²	219	66.2 Å²	66.2	83%	0.826	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	39.6	-178.1	-57.9	-177.9	-179.2	-175.6	-0.2	113.3	V280 R281 E282	V280-R284 PolarHBondContact O-N 3.16Å; V280-R284 VanDerWaalsContact O-N 3.16Å; R281-R284 PolarHBondContact O-N 2.83Å; E282-R284 VanDerWaalsContact C-N 3.33Å; E282-R284 PolarHBondContact O-N 3.41Å
285	A	84.4	Confident	84.4	Confident	3 Å²	3	63.3 Å²	63.3	3%	0.025	32%	0.322	C	S	.	.			trans	-82	143.1	178.5	0	0	0	0	0	110.7	F255 V280 N283 F287	F255-A285 HydrophobicContact CE1-CB 4.42Å; F255-A285 HydrophobicContact CZ-CB 4.26Å; V280-A285 HydrophobicContact CG1-CB 4.04Å; V280-A285 WeakPolarHBondContact CG1-O 3.25Å; V280-A285 PolarHBondContact O-N 2.94Å; N283-A285 PolarHBondContact O-N 3.14Å; N283-A285 VanDerWaalsContact O-N 3.12Å; A285-F287 WeakPolarHBondContact O-CD1 3.39Å; A285-F287 PolarHBondContact O-N 3.17Å
286	C	85.3	Confident	83.7	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.014	32%	0.322	C	S	.	.			trans	-59.8	127.7	178.4	172.3	0	0	0	0	111.1	L288 L290 G291 H294 C299	C286-L288 PolarHBondContact O-N 3.42Å; C286-L288 PolarHBondContact SG-N 2.89Å; C286-L290 WeakPolarHBondContact O-CA 3.43Å; C286-L290 PolarHBondContact O-N 2.81Å; C286-G291 WeakPolarHBondContact CB-O 3.41Å; C286-G291 PolarHBondContact N-O 3.46Å; C286-H294 WeakPolarHBondContact CB-NE2 3.47Å; C286-H294 PolarHBondContact SG-NE2 2.88Å; C286-H294 VanDerWaalsContact SG-NE2 3.41Å; C286-C299 VanDerWaalsContact SG-SG 3.69Å
287	F	89.6	Confident	82.8	Confident	68 Å²	68	67.2 Å²	67.2	30%	0.298	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-14	-176.8	-57.6	-19.3	0	0	0	113.8	W277 V280 R281 A285 M296 Y308 H309	W277-F287 HydrophobicContact CZ3-CD1 4.25Å; W277-F287 HydrophobicContact CZ3-CD2 4.19Å; W277-F287 HydrophobicContact CZ3-CE1 4.39Å; W277-F287 HydrophobicContact CZ3-CE2 4.35Å; W277-F287 HydrophobicContact CZ3-CG 4.14Å; W277-F287 HydrophobicContact CZ3-CZ 4.44Å; V280-F287 HydrophobicContact CG1-CD1 3.43Å; V280-F287 VanDerWaalsContact CG1-CD1 3.43Å; V280-F287 HydrophobicContact CG1-CE1 3.73Å; R281-F287 HydrophobicContact CG-CE1 4.3Å; R281-F287 HydrophobicContact CG-CZ 4.34Å; A285-F287 WeakPolarHBondContact O-CD1 3.39Å; A285-F287 PolarHBondContact O-N 3.17Å; F287-M296 HydrophobicContact CB-CB 4.44Å; F287-M296 HydrophobicContact CB-SD 4.26Å; F287-Y308 HydrophobicContact CB-CD1 4.23Å; F287-H309 WeakPolarHBondContact O-CB 3.42Å; F287-H309 PolarHBondContact O-N 3.17Å
288	L	86.1	Confident	81.8	Confident	15 Å²	15	71.1 Å²	71.1	8%	0.079	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-36.6	-175.6	-161.6	129.6	0	0	0	113.4	C286 M296 K301 V306 H309	C286-L288 PolarHBondContact O-N 3.42Å; C286-L288 PolarHBondContact SG-N 2.89Å; L288-M296 HydrophobicContact CB-CG 4.07Å; L288-M296 HydrophobicContact CD1-CE 4.45Å; L288-M296 HydrophobicContact CD1-CG 4.2Å; L288-K301 VanDerWaalsContact CD2-C 3.47Å; L288-K301 HydrophobicContact CD2-CB 4.02Å; L288-K301 WeakPolarHBondContact CD2-O 3.33Å; L288-V306 WeakPolarHBondContact CD1-O 3.4Å; L288-H309 WeakPolarHBondContact O-CB 3.44Å; L288-H309 PolarHBondContact O-CD2 3.4Å; L288-H309 VanDerWaalsContact O-CD2 3.25Å
289	C	85.7	Confident	81.3	Confident	24 Å²	24	65.2 Å²	65.2	16%	0.162	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118	-5.3	-179.3	76.7	0	0	0	0	114.9	G291 H294 K301	C289-G291 PolarHBondContact O-N 3.09Å; C289-G291 VanDerWaalsContact O-N 3.15Å; C289-G291 PolarHBondContact SG-N 3.29Å; C289-H294 PolarHBondContact SG-CE1 2.85Å; C289-H294 PolarHBondContact SG-NE2 3.23Å; C289-K301 HydrophobicContact CB-CD 3.9Å
290	L	88	Confident	80.6	Confident	1 Å²	1	69.7 Å²	69.7	1%	0.005	37%	0.369	C	S	.	.			trans	61	7	-172.9	-53.2	176.6	0	0	0	115.4	N262 A263 F268 V280 C286 H309 L312	N262-L290 HydrophobicContact CB-CB 4.13Å; N262-L290 WeakPolarHBondContact CB-O 3.41Å; N262-L290 PolarHBondContact ND2-O 2.97Å; A263-L290 HydrophobicContact CB-CD1 4.47Å; F268-L290 HydrophobicContact CD1-CD1 4.36Å; F268-L290 HydrophobicContact CE1-CD1 3.63Å; F268-L290 HydrophobicContact CE1-CD2 4.4Å; F268-L290 HydrophobicContact CZ-CD1 4.19Å; F268-L290 HydrophobicContact CZ-CD2 4.12Å; V280-L290 HydrophobicContact CG2-CD2 3.69Å; C286-L290 WeakPolarHBondContact O-CA 3.43Å; C286-L290 PolarHBondContact O-N 2.81Å; L290-H309 VanDerWaalsContact CD1-CE1 3.45Å; L290-H309 WeakPolarHBondContact CD1-CE1 3.49Å; L290-H309 WeakPolarHBondContact CD1-ND1 3.4Å; L290-H309 HydrophobicContact CD2-CB 4.14Å; L290-H309 HydrophobicContact CG-CB 4.1Å; L290-L312 HydrophobicContact CD2-CD1 4.12Å; L290-L312 HydrophobicContact CD2-CG 4.4Å
291	G	78.6	Confident	79.8	Confident	22 Å²	22	76.5 Å²	76.5	23%	0.227	40%	0.399	C	S	.	.			trans	-77.4	149.9	175.5	0	0	0	0	0	112.6	C286 C289	C286-G291 WeakPolarHBondContact CB-O 3.41Å; C286-G291 PolarHBondContact N-O 3.46Å; C289-G291 PolarHBondContact O-N 3.09Å; C289-G291 VanDerWaalsContact O-N 3.15Å; C289-G291 PolarHBondContact SG-N 3.29Å
292	S	76.1	Confident	78.9	Confident	82 Å²	82	74.5 Å²	74.5	57%	0.573	39%	0.394	S	S	*	.	S	Bend	trans	-83.8	158.1	173.7	44.3	0	0	0	0	111.7
293	G	74	Confident	78.3	Confident	84 Å²	84	72.6 Å²	72.6	87%	0.866	39%	0.391	S	S	*	.	S	Bend	trans	91.6	3.4	171.3	0	0	0	0	0	116.9
294	H	80	Confident	77.1	Confident	50 Å²	50	79 Å²	79	23%	0.231	42%	0.419	C	S	.	.	S	Bend	trans	-153.2	158.3	172.3	65.1	-76.3	0	0	0	110.9	C286 C289 E298 C299	C286-H294 WeakPolarHBondContact CB-NE2 3.47Å; C286-H294 PolarHBondContact SG-NE2 2.88Å; C286-H294 VanDerWaalsContact SG-NE2 3.41Å; C289-H294 PolarHBondContact SG-CE1 2.85Å; C289-H294 PolarHBondContact SG-NE2 3.23Å; H294-E298 HydrophobicContact CB-CB 4.37Å; H294-C299 PolarHBondContact NE2-SG 2.78Å
295	Q	75	Confident	76.1	Confident	135 Å²	135	72.5 Å²	72.5	63%	0.631	42%	0.42	S	S	*	.			trans	-95.8	166.3	173.4	-68.3	-167.3	12.5	0	0	112	N297 E298 C299	Q295-N297 WeakPolarHBondContact CB-OD1 3.34Å; Q295-N297 PolarHBondContact O-N 2.94Å; Q295-E298 PolarHBondContact N-OE2 3.18Å; Q295-E298 CarbonylContact O-C 3.58Å; Q295-E298 PolarHBondContact O-N 3.25Å; Q295-C299 PolarHBondContact O-N 2.93Å; Q295-C299 VanDerWaalsContact O-N 3.13Å
296	M	73.3	Confident	74.9	Confident	47 Å²	47	75.9 Å²	75.9	23%	0.232	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-58.9	-33.3	-175.2	168.7	-179.6	153.5	0	0	113.8	F287 L288 E298 C299 Q307 Y308	F287-M296 HydrophobicContact CB-CB 4.44Å; F287-M296 HydrophobicContact CB-SD 4.26Å; L288-M296 HydrophobicContact CB-CG 4.07Å; L288-M296 HydrophobicContact CD1-CE 4.45Å; L288-M296 HydrophobicContact CD1-CG 4.2Å; M296-E298 VanDerWaalsContact C-N 3.28Å; M296-E298 PolarHBondContact O-N 3.31Å; M296-C299 WeakPolarHBondContact O-CB 3.35Å; M296-C299 PolarHBondContact O-N 2.75Å; M296-Q307 WeakPolarHBondContact CE-O 3.33Å; M296-Y308 HydrophobicContact SD-CD1 4.46Å
297	N	71.9	Confident	74.1	Confident	101 Å²	101	82 Å²	82	54%	0.54	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-64.7	-29	174.2	48.7	-17	0	0	0	113.1	Q295	Q295-N297 WeakPolarHBondContact CB-OD1 3.34Å; Q295-N297 PolarHBondContact O-N 2.94Å
298	E	70.4	Confident	73.8	Confident	134 Å²	134	83.2 Å²	83.2	63%	0.626	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-99.1	1	178.9	-59.3	173.9	155.3	0	0	112.6	H294 Q295 M296 S300	H294-E298 HydrophobicContact CB-CB 4.37Å; Q295-E298 PolarHBondContact N-OE2 3.18Å; Q295-E298 CarbonylContact O-C 3.58Å; Q295-E298 PolarHBondContact O-N 3.25Å; M296-E298 VanDerWaalsContact C-N 3.28Å; M296-E298 PolarHBondContact O-N 3.31Å; E298-S300 PolarHBondContact O-N 2.91Å
299	C	77.5	Confident	73.7	Confident	7 Å²	7	84 Å²	84	5%	0.047	48%	0.475	C	S	.	.			trans	-72.1	118.1	-174.1	-168.1	0	0	0	0	111.1	C286 H294 Q295 M296 K301 K302	C286-C299 VanDerWaalsContact SG-SG 3.69Å; H294-C299 PolarHBondContact NE2-SG 2.78Å; Q295-C299 PolarHBondContact O-N 2.93Å; Q295-C299 VanDerWaalsContact O-N 3.13Å; M296-C299 WeakPolarHBondContact O-CB 3.35Å; M296-C299 PolarHBondContact O-N 2.75Å; C299-K301 PolarHBondContact O-N 2.72Å; C299-K302 VanDerWaalsContact O-CB 3.24Å; C299-K302 WeakPolarHBondContact O-CB 3.38Å; C299-K302 PolarHBondContact O-N 3.18Å
300	S	75.3	Confident	73.4	Confident	121 Å²	121	86.4 Å²	86.4	85%	0.846	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-18	174.2	57.4	0	0	0	0	113.7	E298	E298-S300 PolarHBondContact O-N 2.91Å
301	K	74.7	Confident	73.1	Confident	143 Å²	143	88.2 Å²	88.2	62%	0.622	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	7.1	176.8	-59.3	-171.3	-177.9	178.6	0	113.9	L288 C289 C299 V303	L288-K301 VanDerWaalsContact CD2-C 3.47Å; L288-K301 HydrophobicContact CD2-CB 4.02Å; L288-K301 WeakPolarHBondContact CD2-O 3.33Å; C289-K301 HydrophobicContact CB-CD 3.9Å; C299-K301 PolarHBondContact O-N 2.72Å; K301-V303 PolarHBondContact O-N 2.64Å
302	K	65.2	Low	73.4	Confident	122 Å²	122	87.3 Å²	87.3	53%	0.53	49%	0.489	S	S	.	.			trans	-67.1	122.8	-178.4	-170.8	177.7	-179	-177.9	0	111.2	C299	C299-K302 VanDerWaalsContact O-CB 3.24Å; C299-K302 WeakPolarHBondContact O-CB 3.38Å; C299-K302 PolarHBondContact O-N 3.18Å
303	V	71	Confident	73.5	Confident	81 Å²	81	86.8 Å²	86.8	49%	0.491	48%	0.482	S	S	.	.			trans	-121.4	139	177.3	-172.1	0	0	0	0	108.9	K301 G305 V306	K301-V303 PolarHBondContact O-N 2.64Å; V303-G305 PolarHBondContact O-N 3.31Å; V303-V306 PolarHBondContact O-N 3.42Å
304	E	56.5	Low	72.7	Confident	199 Å²	199	91.5 Å²	91.5	93%	0.93	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	128	175.6	-91.4	-179.3	155.2	0	0	111.3
305	G	58.8	Low	70.8	Confident	82 Å²	82	96.2 Å²	96.2	85%	0.845	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.3	-14	178.7	0	0	0	0	0	116.1	V303	V303-G305 PolarHBondContact O-N 3.31Å
306	V	59.4	Low	68.6	Low	74 Å²	74	101.5 Å²	101.5	45%	0.448	51%	0.513	S	S	.	.			trans	-102.6	109.1	177.2	-176.7	0	0	0	0	109.9	L288 V303	L288-V306 WeakPolarHBondContact CD1-O 3.4Å; V303-V306 PolarHBondContact O-N 3.42Å
307	Q	69.6	Low	66.3	Low	130 Å²	130	111.1 Å²	111.1	61%	0.607	55%	0.547	S	S	*	.			trans	-87.3	-36.3	-177.7	-72.2	-177.2	-18	0	0	113.7	M296	M296-Q307 WeakPolarHBondContact CE-O 3.33Å
308	Y	83	Confident	64	Low	94 Å²	94	118.1 Å²	118.1	37%	0.369	57%	0.565	S	S	.	*	S	Bend	trans	-140.4	156.2	-175.2	-50.6	-66.9	0	0	0	111.5	W277 F287 M296 V313	W277-Y308 AromaticContact CH2-CD1 3.54Å; W277-Y308 HydrophobicContact CH2-CD1 3.54Å; W277-Y308 AromaticContact CH2-CE1 3.73Å; W277-Y308 HydrophobicContact CH2-CE1 3.73Å; W277-Y308 HydrophobicContact CH2-CG 4.03Å; W277-Y308 HydrophobicContact CZ2-CD1 4.03Å; W277-Y308 HydrophobicContact CZ2-CD2 4.39Å; W277-Y308 HydrophobicContact CZ2-CE1 4.38Å; W277-Y308 HydrophobicContact CZ2-CG 4.02Å; F287-Y308 HydrophobicContact CB-CD1 4.23Å; M296-Y308 HydrophobicContact SD-CD1 4.46Å; Y308-V313 HydrophobicContact CD2-CG2 4.4Å
309	H	83.6	Confident	61.9	Low	32 Å²	32	121.1 Å²	121.1	15%	0.148	58%	0.579	C	S	.	*			trans	-58.3	137.3	177.7	-173.4	-94.7	0	0	0	110	F287 L288 L290 M311 L312	F287-H309 WeakPolarHBondContact O-CB 3.42Å; F287-H309 PolarHBondContact O-N 3.17Å; L288-H309 WeakPolarHBondContact O-CB 3.44Å; L288-H309 PolarHBondContact O-CD2 3.4Å; L288-H309 VanDerWaalsContact O-CD2 3.25Å; L290-H309 VanDerWaalsContact CD1-CE1 3.45Å; L290-H309 WeakPolarHBondContact CD1-CE1 3.49Å; L290-H309 WeakPolarHBondContact CD1-ND1 3.4Å; L290-H309 HydrophobicContact CD2-CB 4.14Å; L290-H309 HydrophobicContact CG-CB 4.1Å; H309-M311 PolarHBondContact ND1-N 3.45Å; H309-M311 PolarHBondContact O-N 3.13Å; H309-L312 HydrophobicContact CB-CD1 4.39Å; H309-L312 WeakPolarHBondContact O-CB 3.25Å; H309-L312 PolarHBondContact O-N 3.45Å
310	P	78.8	Confident	59.3	Low	73 Å²	73	130 Å²	130	47%	0.474	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57	-16.5	-173.9	-27.5	34.1	0	0	0	116.2
311	M	81.9	Confident	56.9	Low	39 Å²	39	128 Å²	128	19%	0.192	62%	0.615	C	S	.	*	T	Hydrogen-bonded Turn	trans	-84.3	-14.3	175.1	-68.9	-158.1	163.4	0	0	114.6	F268 K269 R276 H309	F268-M311 HydrophobicContact CD1-SD 4.4Å; F268-M311 HydrophobicContact CE1-CB 4.17Å; F268-M311 HydrophobicContact CE1-SD 4.37Å; K269-M311 HydrophobicContact CD-CE 4.4Å; K269-M311 HydrophobicContact CG-CE 4Å; K269-M311 HydrophobicContact CG-SD 4.18Å; R276-M311 WeakPolarHBondContact CD-O 3.43Å; R276-M311 PolarHBondContact NH1-O 2.99Å; H309-M311 PolarHBondContact ND1-N 3.45Å; H309-M311 PolarHBondContact O-N 3.13Å
312	L	84.8	Confident	54.6	Low	4 Å²	4	131 Å²	131	2%	0.021	63%	0.632	C	S	.	*	T	Hydrogen-bonded Turn	trans	-93.1	-7.2	176.1	-66.3	176.6	0	0	0	112.7	F268 V273 R276 W277 V280 L290 H309	F268-L312 HydrophobicContact CZ-CD2 4.12Å; V273-L312 VanDerWaalsContact CG1-O 3.31Å; V273-L312 WeakPolarHBondContact CG1-O 3.42Å; R276-L312 HydrophobicContact CB-CD2 3.88Å; W277-L312 HydrophobicContact CD2-CD2 4.24Å; W277-L312 HydrophobicContact CG-CD2 4.21Å; W277-L312 HydrophobicContact CH2-CD1 4.37Å; W277-L312 HydrophobicContact CZ2-CB 4Å; W277-L312 HydrophobicContact CZ2-CD1 4.34Å; W277-L312 HydrophobicContact CZ3-CD1 4.5Å; W277-L312 PolarHBondContact NE1-O 2.97Å; V280-L312 HydrophobicContact CG1-CD1 4.43Å; V280-L312 HydrophobicContact CG2-CD1 4.34Å; V280-L312 HydrophobicContact CG2-CD2 4Å; L290-L312 HydrophobicContact CD2-CD1 4.12Å; L290-L312 HydrophobicContact CD2-CG 4.4Å; H309-L312 HydrophobicContact CB-CD1 4.39Å; H309-L312 WeakPolarHBondContact O-CB 3.25Å; H309-L312 PolarHBondContact O-N 3.45Å
313	V	79.2	Confident	52.7	Low	70 Å²	70	129.4 Å²	129.4	42%	0.424	64%	0.641	S	S	.	*	S	Bend	trans	-117.5	136.5	-176.1	-164	0	0	0	0	108.8	Y308 K315	Y308-V313 HydrophobicContact CD2-CG2 4.4Å; V313-K315 PolarHBondContact O-N 2.96Å
314	K	56.7	Low	50.6	Low	184 Å²	184	130.1 Å²	130.1	80%	0.8	65%	0.65	S	S	*	*			trans	-60.8	110.6	174.5	-87.6	-176.1	174.5	-178.9	0	109	R316	K314-R316 PolarHBondContact O-N 3.47Å
315	K	39.3	Very low	49.2	Very low	149 Å²	149	128.2 Å²	128.2	65%	0.648	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-62.1	117.3	-178.7	-87.2	-178.1	172.9	179.3	0	111.6	V313	V313-K315 PolarHBondContact O-N 2.96Å
316	R	30.4	Very low	47.9	Very low	246 Å²	246	128.9 Å²	128.9	93%	0.928	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-81.6	130	146.4	-88.7	-179.7	153.2	178.4	-6.6	107.9	K314 R318	K314-R316 PolarHBondContact O-N 3.47Å; R316-R318 PolarHBondContact O-N 3.13Å
317	R	24.1	Very low	46.5	Very low	249 Å²	249	133.4 Å²	133.4	94%	0.94	63%	0.628	S	S	*	*	S	Bend	trans	-55.3	122.3	-175.4	-92.9	173.9	151.7	167	-7	112.5
318	R	24.6	Very low	44.7	Very low	247 Å²	247	134.8 Å²	134.8	93%	0.932	63%	0.632	S	S	*	*				-179.2	159.6	126.3	-97	173.8	176.7	-179.4	-0.3	110.6	R316	R316-R318 PolarHBondContact O-N 3.13Å
319	E	25.4	Very low	42.6	Very low	197 Å²	197	131.9 Å²	131.9	92%	0.921	62%	0.624	S	S	*	*			trans	-83.8	166.8	-143.4	-73.7	162.7	158.8	0	0	117.9
320	K	23.6	Very low	40.6	Very low	193 Å²	193	135.8 Å²	135.8	84%	0.839	64%	0.642	S	S	*	*			trans	-84.3	151.5	-167	-71.3	172	168.5	179.9	0	113.9
321	G	24.7	Very low	38.7	Very low	79 Å²	79	132.5 Å²	132.5	81%	0.814	62%	0.621	S	S	*	*			trans	-168.5	131.5	156.8	0	0	0	0	0	111.6
322	Q	25.8	Very low	36.4	Very low	206 Å²	206	133.6 Å²	133.6	96%	0.963	63%	0.627	S	S	*	*			trans	-79.1	166.2	-166.8	-80.9	163.7	-42.4	0	0	115.3
323	A	24.9	Very low	34	Very low	89 Å²	89	136 Å²	136	74%	0.736	64%	0.64	S	S	*	*			trans	-100.4	140.5	-164.6	0	0	0	0	0	114.8
324	S	27.1	Very low	31.8	Very low	96 Å²	96	137.6 Å²	137.6	67%	0.671	65%	0.649	S	S	*	*			trans	-140.6	152.4	161.7	57	0	0	0	0	109.6	Y326	S324-Y326 WeakPolarHBondContact O-CE1 3.48Å; S324-Y326 VanDerWaalsContact O-CE2 3.26Å; S324-Y326 WeakPolarHBondContact O-CE2 3.48Å
325	E	28.4	Very low	30.7	Very low	160 Å²	160	132.2 Å²	132.2	75%	0.748	65%	0.646	S	S	*	*			trans	-53.2	145.7	-173.4	-87.1	170	132.9	0	0	115.3
326	Y	30.8	Very low	30.3	Very low	96 Å²	96	132.5 Å²	132.5	38%	0.376	65%	0.652	S	S	.	*			trans	-121.3	127.8	-162.5	-56.4	-79.2	0	0	0	114.8	S324 Y384	S324-Y326 WeakPolarHBondContact O-CE1 3.48Å; S324-Y326 VanDerWaalsContact O-CE2 3.26Å; S324-Y326 WeakPolarHBondContact O-CE2 3.48Å; Y326-Y384 HydrophobicContact CD1-CE2 4.45Å; Y326-Y384 HydrophobicContact CG-CD2 4.42Å; Y326-Y384 HydrophobicContact CG-CE2 4.38Å
327	R	30	Very low	30.5	Very low	169 Å²	169	127 Å²	127	64%	0.638	65%	0.648	S	S	*	*			trans	-83.1	136.1	166.7	-82.3	-179.3	175.3	176.3	-0.4	112.2	E224 Y384	E224-R327 VanDerWaalsContact OE1-CG 3.26Å; E224-R327 WeakPolarHBondContact OE1-CG 2.92Å; E224-R327 VanDerWaalsContact OE2-CG 3.28Å; E224-R327 WeakPolarHBondContact OE2-CG 3.44Å; E224-R327 IonicContact OE2-CZ 3.29Å; E224-R327 IonicContact OE2-NE 3.94Å; E224-R327 PolarHBondContact OE2-NE 3.34Å; E224-R327 IonicContact OE2-NH2 3.87Å; E224-R327 PolarHBondContact OE2-NH2 3.24Å; R327-Y384 PolarHBondContact O-N 3.47Å
328	K	31.2	Very low	31	Very low	159 Å²	159	119.3 Å²	119.3	69%	0.691	63%	0.629	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-98.1	135.7	172	-92	-173.5	174.5	-172	0	110.7	Y384	K328-Y384 WeakPolarHBondContact CA-O 3.2Å
329	V	38.9	Very low	31.6	Very low	32 Å²	32	117.3 Å²	117.3	19%	0.194	63%	0.627	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-132.2	138.1	177.6	-171.1	0	0	0	0	110.5	R365 Y384 V385 E386	V329-R365 VanDerWaalsContact CG1-NH1 3.33Å; V329-Y384 PolarHBondContact N-O 3.46Å; V329-V385 CarbonylContact O-C 3.6Å; V329-V385 VanDerWaalsContact O-CA 3.29Å; V329-V385 WeakPolarHBondContact O-CA 3.49Å; V329-E386 PolarHBondContact O-N 2.74Å
330	Q	41	Very low	32.7	Very low	115 Å²	115	110 Å²	110	54%	0.537	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.1	141.4	178.9	-172.7	-175.1	-20.4	0	0	111.3	E386	Q330-E386 CarbonylContact C-O 3.47Å; Q330-E386 WeakPolarHBondContact CA-O 3.3Å
331	V	39.5	Very low	34.2	Very low	3 Å²	3	110.1 Å²	110.1	2%	0.018	60%	0.6	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-141.6	134.3	180	-172.6	0	0	0	0	111.2	Q364 R365 F367 V385 E386 I387 S388	V331-Q364 HydrophobicContact CG1-CB 4.06Å; V331-R365 HydrophobicContact CG1-CB 4.13Å; V331-R365 HydrophobicContact CG2-CB 4.17Å; V331-R365 HydrophobicContact CG2-CG 4.24Å; V331-F367 HydrophobicContact CB-CZ 4.15Å; V331-F367 HydrophobicContact CG1-CE2 3.98Å; V331-F367 HydrophobicContact CG1-CZ 3.83Å; V331-F367 HydrophobicContact CG2-CZ 4.19Å; V331-V385 HydrophobicContact CG2-CG1 3.92Å; V331-E386 PolarHBondContact N-O 2.81Å; V331-I387 WeakPolarHBondContact O-CA 3.33Å; V331-S388 PolarHBondContact O-N 2.8Å; V331-S388 PolarHBondContact O-OG 2.98Å
332	D	34.6	Very low	35.9	Very low	62 Å²	62	108.8 Å²	108.8	33%	0.332	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107	139	177.6	-61.2	-42.3	0	0	0	112.2	Q364 S388	D332-Q364 VanDerWaalsContact O-CG 3.31Å; D332-Q364 WeakPolarHBondContact O-CG 3.37Å; D332-Q364 PolarHBondContact O-OE1 3.32Å; D332-S388 WeakPolarHBondContact CA-O 3.36Å; D332-S388 WeakPolarHBondContact OD1-CB 3.33Å; D332-S388 PolarHBondContact OD1-OG 3.42Å
333	L	33.2	Very low	37.9	Very low	55 Å²	55	100 Å²	100	29%	0.288	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	135.8	179.1	-76.2	164.3	0	0	0	112.2	I387 S388 L390	L333-I387 HydrophobicContact CD1-CG2 3.8Å; L333-S388 PolarHBondContact N-O 3.09Å; L333-L390 PolarHBondContact O-N 3.12Å
334	V	34.4	Very low	40.3	Very low	103 Å²	103	101.1 Å²	101.1	62%	0.624	53%	0.528	S	S	*	.			trans	-106.1	124.5	-178.6	-171.7	0	0	0	0	109.9	L390	V334-L390 HydrophobicContact CG2-CD1 3.77Å
335	G	33.3	Very low	42.7	Very low	71 Å²	71	98.6 Å²	98.6	73%	0.732	51%	0.506	S	S	*	.			trans	-129.6	117.1	168.8	0	0	0	0	0	109.6
336	M	31.5	Very low	45.2	Very low	155 Å²	155	92.2 Å²	92.2	76%	0.764	48%	0.478	S	S	*	.			trans	-106.4	127.5	171.3	-66.4	-156.5	85.3	0	0	109.8	T338	M336-T338 PolarHBondContact O-N 2.91Å
337	P	33.7	Very low	47.4	Very low	131 Å²	131	88 Å²	88	85%	0.851	46%	0.462	S	S	*	.			trans	-75.4	107.1	169.6	28.4	-28.7	0	0	0	109
338	T	34.5	Very low	49.6	Very low	87 Å²	87	83.4 Å²	83.4	53%	0.534	45%	0.445	S	S	.	.			trans	-98.8	141.6	179.7	45.5	0	0	0	0	112	M336 G340 V342	M336-T338 PolarHBondContact O-N 2.91Å; T338-G340 PolarHBondContact O-N 3.32Å; T338-V342 VanDerWaalsContact OG1-CG2 3.31Å; T338-V342 WeakPolarHBondContact OG1-CG2 3.27Å
339	K	37.7	Very low	51.6	Low	206 Å²	206	76 Å²	76	90%	0.896	41%	0.414	S	S	*	.	S	Bend	trans	-77.6	99.8	176.4	-70.1	176.3	179	173.9	0	109.3
340	G	47.9	Very low	53	Low	44 Å²	44	75.9 Å²	75.9	45%	0.454	41%	0.413	S	S	.	.	S	Bend	trans	127.2	161.6	177.2	0	0	0	0	0	112.7	T338 V342	T338-G340 PolarHBondContact O-N 3.32Å; G340-V342 PolarHBondContact O-N 3.05Å
341	R	54.5	Low	54.3	Low	194 Å²	194	70.4 Å²	70.4	73%	0.732	39%	0.387	S	S	*	.			trans	-70.3	103.8	172.5	-74.5	-173.4	174.1	-176.7	-1.6	108.5	M491	R341-M491 HydrophobicContact CB-CE 3.55Å; R341-M491 HydrophobicContact CG-CE 4.37Å; R341-M491 PolarHBondContact O-N 3.31Å
342	V	62	Low	55.3	Low	51 Å²	51	77.1 Å²	77.1	31%	0.309	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	124.2	172.2	179.8	0	0	0	0	108.4	T338 G340 L344 G489 T490	T338-V342 VanDerWaalsContact OG1-CG2 3.31Å; T338-V342 WeakPolarHBondContact OG1-CG2 3.27Å; G340-V342 PolarHBondContact O-N 3.05Å; V342-L344 PolarHBondContact O-N 2.79Å; V342-G489 WeakPolarHBondContact CA-O 3.09Å; V342-T490 HydrophobicContact CG2-CG2 4.12Å
343	L	67.7	Low	56.2	Low	21 Å²	21	75.3 Å²	75.3	11%	0.11	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	119.4	168.4	-69.2	173.1	0	0	0	108.4	F444 V487 C488 G489 M491	L343-F444 HydrophobicContact CD2-CD1 4.36Å; L343-F444 HydrophobicContact CD2-CE1 3.81Å; L343-V487 HydrophobicContact CD1-CB 4.48Å; L343-V487 HydrophobicContact CD1-CG1 3.8Å; L343-C488 CarbonylContact O-C 3.51Å; L343-C488 VanDerWaalsContact O-CA 3.26Å; L343-C488 WeakPolarHBondContact O-CA 3.28Å; L343-C488 WeakPolarHBondContact O-CB 3.28Å; L343-G489 PolarHBondContact N-O 2.95Å; L343-G489 PolarHBondContact O-N 3.23Å; L343-M491 HydrophobicContact CD1-CG 3.73Å; L343-M491 HydrophobicContact CD1-SD 3.64Å; L343-M491 HydrophobicContact CD2-CE 3.87Å; L343-M491 HydrophobicContact CD2-CG 4.5Å; L343-M491 HydrophobicContact CD2-SD 3.83Å; L343-M491 HydrophobicContact CG-CE 4.05Å; L343-M491 HydrophobicContact CG-CG 3.7Å; L343-M491 HydrophobicContact CG-SD 3.64Å
344	L	73.7	Confident	57	Low	113 Å²	113	81.9 Å²	81.9	59%	0.592	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-79.6	155.6	168.7	-62.7	176.7	0	0	0	109.4	V342 T346	V342-L344 PolarHBondContact O-N 2.79Å; L344-T346 HydrophobicContact CB-CG2 4.5Å; L344-T346 PolarHBondContact O-N 3.03Å
345	Q	78.9	Confident	56.9	Low	43 Å²	43	82.5 Å²	82.5	20%	0.201	44%	0.439	C	S	.	.			trans	-69.9	96.6	178.1	-69.6	178.1	17.5	0	0	110.5	V361 I362 Y460 L479 I486 C488	Q345-V361 WeakPolarHBondContact O-CG1 3.43Å; Q345-I362 HydrophobicContact CB-CD1 3.58Å; Q345-I362 HydrophobicContact CG-CD1 4.29Å; Q345-Y460 PolarHBondContact NE2-OH 2.95Å; Q345-Y460 VanDerWaalsContact OE1-CE2 3.24Å; Q345-Y460 PolarHBondContact OE1-OH 3.43Å; Q345-L479 HydrophobicContact CG-CD1 4.15Å; Q345-I486 VanDerWaalsContact CA-CG2 3.46Å; Q345-I486 HydrophobicContact CB-CG2 3.71Å; Q345-I486 HydrophobicContact CG-CG2 3.97Å; Q345-C488 HydrophobicContact CB-CB 4.46Å; Q345-C488 HydrophobicContact CG-CB 3.46Å; Q345-C488 VanDerWaalsContact CG-CB 3.46Å
346	T	79.7	Confident	56.9	Low	27 Å²	27	81 Å²	81	17%	0.166	42%	0.423	C	S	.	.			trans	-115	141.9	178.8	69	0	0	0	0	111.4	L344 V361 D442	L344-T346 HydrophobicContact CB-CG2 4.5Å; L344-T346 PolarHBondContact O-N 3.03Å; T346-V361 HydrophobicContact CG2-CG2 3.39Å; T346-D442 WeakPolarHBondContact CB-OD2 3.29Å; T346-D442 PolarHBondContact OG1-OD2 3.46Å
347	A	77.1	Confident	56.8	Low	6 Å²	6	77.4 Å²	77.4	5%	0.05	41%	0.407	C	S	.	.	B	Isolated β-bridge	trans	-147.2	130.5	180	0	0	0	0	0	111.8	A349 T359 V360 A441 F483 I486	A347-A349 PolarHBondContact O-N 2.83Å; A347-T359 WeakPolarHBondContact O-CG2 3.33Å; A347-V360 PolarHBondContact N-O 3.25Å; A347-V360 PolarHBondContact O-N 2.9Å; A347-A441 HydrophobicContact CB-CB 3.71Å; A347-F483 HydrophobicContact CB-CB 4.15Å; A347-F483 HydrophobicContact CB-CD2 4.11Å; A347-F483 HydrophobicContact CB-CG 4.48Å; A347-I486 HydrophobicContact CB-CD1 3.73Å; A347-I486 HydrophobicContact CB-CG1 3.99Å
348	R	76.2	Confident	57	Low	74 Å²	74	78.1 Å²	78.1	28%	0.279	39%	0.393	S	S	.	.			trans	-79.4	110.8	169.1	-67.7	178.1	68.6	167.2	-3.1	110.1	T359 L410 A441 D442	R348-T359 HydrophobicContact CB-CG2 4.2Å; R348-T359 HydrophobicContact CG-CG2 3.64Å; R348-L410 HydrophobicContact CB-CD1 3.9Å; R348-A441 WeakPolarHBondContact CA-O 3.48Å; R348-A441 WeakPolarHBondContact CB-O 3.29Å; R348-A441 PolarHBondContact N-O 3.1Å; R348-D442 WeakPolarHBondContact CD-OD1 3.44Å; R348-D442 WeakPolarHBondContact CG-OD1 3.48Å
349	A	73.7	Confident	56.8	Low	4 Å²	4	74.8 Å²	74.8	3%	0.033	37%	0.372	C	S	.	.			trans	-115	153.3	169.5	0	0	0	0	0	110.4	A347 F407 F483	A347-A349 PolarHBondContact O-N 2.83Å; A349-F407 HydrophobicContact CB-CB 3.96Å; A349-F407 HydrophobicContact CB-CD1 3.84Å; A349-F407 HydrophobicContact CB-CG 4.15Å; A349-F483 HydrophobicContact CB-CD1 3.61Å; A349-F483 HydrophobicContact CB-CE1 3.7Å; A349-F483 HydrophobicContact CB-CG 4.13Å; A349-F483 HydrophobicContact CB-CZ 4.26Å
350	V	68.3	Low	56.7	Low	28 Å²	28	65.4 Å²	65.4	17%	0.17	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	120.3	166.1	169.8	0	0	0	0	106.4	R352 D357 F407 S408 L410	V350-R352 HydrophobicContact CG1-CG 4.17Å; V350-R352 PolarHBondContact O-N 2.93Å; V350-D357 WeakPolarHBondContact CA-OD1 3.13Å; V350-D357 VanDerWaalsContact CB-OD1 3.25Å; V350-D357 WeakPolarHBondContact CB-OD1 3.18Å; V350-D357 WeakPolarHBondContact CG1-OD1 3.3Å; V350-D357 WeakPolarHBondContact CG2-OD1 3.29Å; V350-F407 CarbonylContact O-C 3.57Å; V350-F407 VanDerWaalsContact O-CA 3.3Å; V350-F407 WeakPolarHBondContact O-CA 3.32Å; V350-S408 PolarHBondContact N-O 3.49Å; V350-S408 PolarHBondContact O-N 3.16Å; V350-L410 HydrophobicContact CG2-CD2 3.83Å; V350-L410 HydrophobicContact CG2-CG 4.39Å
351	M	68	Low	56.1	Low	1 Å²	1	64.1 Å²	64.1	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	106.1	173	-164.9	168.4	88.4	0	0	107.4	T353 G356 I368 L372 M376 L378 F405 A406 F407 V453	M351-T353 HydrophobicContact CE-CG2 3.46Å; M351-T353 VanDerWaalsContact CE-CG2 3.46Å; M351-T353 HydrophobicContact CG-CG2 4.24Å; M351-T353 PolarHBondContact O-N 3.14Å; M351-G356 CarbonylContact O-C 3.53Å; M351-I368 HydrophobicContact CE-CD1 4.06Å; M351-I368 HydrophobicContact SD-CD1 4.11Å; M351-L372 HydrophobicContact CE-CD2 3.97Å; M351-L372 HydrophobicContact CE-CG 4.18Å; M351-L372 HydrophobicContact SD-CD2 4.02Å; M351-M376 HydrophobicContact CE-CB 3.89Å; M351-M376 HydrophobicContact CE-CE 3.77Å; M351-M376 HydrophobicContact CE-CG 3.48Å; M351-M376 VanDerWaalsContact CE-CG 3.48Å; M351-M376 HydrophobicContact CE-SD 4.26Å; M351-L378 HydrophobicContact CE-CD1 3.81Å; M351-F405 HydrophobicContact CE-CB 4.49Å; M351-F405 HydrophobicContact CG-CB 4.09Å; M351-F405 HydrophobicContact CG-CD2 4.13Å; M351-F405 HydrophobicContact CG-CG 4.33Å; M351-F405 HydrophobicContact SD-CB 4.09Å; M351-F405 HydrophobicContact SD-CD1 4.45Å; M351-F405 HydrophobicContact SD-CD2 3.77Å; M351-F405 HydrophobicContact SD-CE2 4.34Å; M351-F405 HydrophobicContact SD-CG 3.84Å; M351-A406 CarbonylContact C-O 3.54Å; M351-F407 HydrophobicContact CB-CD1 4.03Å; M351-F407 HydrophobicContact CB-CE1 3.78Å; M351-F407 HydrophobicContact CG-CD1 4.05Å; M351-F407 HydrophobicContact CG-CE1 3.6Å; M351-F407 HydrophobicContact CG-CZ 4.35Å; M351-F407 HydrophobicContact SD-CE1 3.91Å; M351-F407 HydrophobicContact SD-CZ 4.24Å; M351-V453 HydrophobicContact SD-CG2 4.46Å
352	R	61.9	Low	55.1	Low	144 Å²	144	57.4 Å²	57.4	54%	0.543	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	95.7	167.1	-69.5	-166.5	-171.1	-153.6	2.5	107.6	V350 A406 S408 S412	V350-R352 HydrophobicContact CG1-CG 4.17Å; V350-R352 PolarHBondContact O-N 2.93Å; R352-A406 PolarHBondContact N-O 2.86Å; R352-A406 PolarHBondContact O-N 3.46Å; R352-A406 VanDerWaalsContact O-N 3.1Å; R352-S408 PolarHBondContact NE-OG 3.4Å; R352-S412 PolarHBondContact NH2-OG 2.95Å; R352-S412 VanDerWaalsContact NH2-OG 3.13Å
353	T	53.4	Low	54	Low	24 Å²	24	55.5 Å²	55.5	15%	0.147	28%	0.283	C	S	.	.	S	Bend	trans	-85.4	-176.2	145.2	66.8	0	0	0	0	106.8	M351 T355 M376 L378 F405	M351-T353 HydrophobicContact CE-CG2 3.46Å; M351-T353 VanDerWaalsContact CE-CG2 3.46Å; M351-T353 HydrophobicContact CG-CG2 4.24Å; M351-T353 PolarHBondContact O-N 3.14Å; T353-T355 PolarHBondContact O-N 3.41Å; T353-T355 WeakPolarHBondContact OG1-CA 3.39Å; T353-T355 PolarHBondContact OG1-N 3.21Å; T353-T355 PolarHBondContact OG1-O 3.34Å; T353-T355 VanDerWaalsContact OG1-O 3.05Å; T353-M376 HydrophobicContact CG2-CB 4.23Å; T353-M376 HydrophobicContact CG2-CE 3.31Å; T353-M376 WeakPolarHBondContact OG1-CE 3.5Å; T353-L378 HydrophobicContact CG2-CD1 4.04Å; T353-L378 HydrophobicContact CG2-CD2 3.53Å; T353-L378 HydrophobicContact CG2-CG 3.97Å; T353-F405 HydrophobicContact CG2-CB 4.12Å
354	M	49.4	Very low	53	Low	193 Å²	193	58.5 Å²	58.5	95%	0.951	30%	0.296	S	S	*	.	S	Bend	trans	-60.2	16.1	160.1	-71.4	-71.6	-157.7	0	0	113.6
355	T	32.3	Very low	52.4	Low	116 Å²	116	57.2 Å²	57.2	71%	0.712	28%	0.284	S	S	*	.	S	Bend	trans	170.6	102.9	162.4	26.9	0	0	0	0	113.6	T353 M376	T353-T355 PolarHBondContact O-N 3.41Å; T353-T355 WeakPolarHBondContact OG1-CA 3.39Å; T353-T355 PolarHBondContact OG1-N 3.21Å; T353-T355 PolarHBondContact OG1-O 3.34Å; T353-T355 VanDerWaalsContact OG1-O 3.05Å; T355-M376 WeakPolarHBondContact O-CE 3.41Å
356	G	32.6	Very low	52.2	Low	38 Å²	38	57.2 Å²	57.2	39%	0.392	29%	0.288	S	S	.	.			trans	116.2	151.5	146.6	0	0	0	0	0	123.5	M351 M376	M351-G356 CarbonylContact O-C 3.53Å; G356-M376 VanDerWaalsContact C-CE 3.49Å; G356-M376 WeakPolarHBondContact O-CE 3.47Å
357	D	29.5	Very low	52.2	Low	81 Å²	81	58.7 Å²	58.7	43%	0.433	29%	0.293	S	S	.	.			trans	-81.4	152.9	-163.2	-78.2	-24.8	0	0	0	120.3	V350	V350-D357 WeakPolarHBondContact CA-OD1 3.13Å; V350-D357 VanDerWaalsContact CB-OD1 3.25Å; V350-D357 WeakPolarHBondContact CB-OD1 3.18Å; V350-D357 WeakPolarHBondContact CG1-OD1 3.3Å; V350-D357 WeakPolarHBondContact CG2-OD1 3.29Å
358	R	37.3	Very low	52.3	Low	146 Å²	146	60.2 Å²	60.2	55%	0.551	30%	0.299	S	S	*	.			trans	159.9	-179.8	131.9	-83.1	174	-168.5	-164.7	5.3	113.8
359	T	31.5	Very low	52.5	Low	16 Å²	16	58.3 Å²	58.3	10%	0.098	30%	0.296	C	S	.	.			trans	-112	161.5	-132.3	-56.7	0	0	0	0	117.5	A347 R348 D452 V453	A347-T359 WeakPolarHBondContact O-CG2 3.33Å; R348-T359 HydrophobicContact CB-CG2 4.2Å; R348-T359 HydrophobicContact CG-CG2 3.64Å; T359-D452 PolarHBondContact O-N 2.81Å; T359-V453 PolarHBondContact O-N 2.87Å
360	V	35	Very low	52.8	Low	9 Å²	9	63.5 Å²	63.5	6%	0.055	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	154.7	-152	-165.4	0	0	0	0	117.9	A347 F407 V453 I455	A347-V360 PolarHBondContact N-O 3.25Å; A347-V360 PolarHBondContact O-N 2.9Å; V360-F407 HydrophobicContact CG2-CD1 4.26Å; V360-F407 HydrophobicContact CG2-CE1 3.54Å; V360-F407 HydrophobicContact CG2-CE2 4.06Å; V360-F407 HydrophobicContact CG2-CZ 3.43Å; V360-F407 VanDerWaalsContact CG2-CZ 3.43Å; V360-V453 CarbonylContact C-O 3.29Å; V360-V453 WeakPolarHBondContact CA-O 3.24Å; V360-V453 HydrophobicContact CB-CB 3.97Å; V360-V453 HydrophobicContact CB-CG1 4.46Å; V360-V453 HydrophobicContact CG1-CB 3.55Å; V360-V453 HydrophobicContact CG1-CG1 3.59Å; V360-V453 WeakPolarHBondContact CG1-O 3.49Å; V360-V453 HydrophobicContact CG2-CB 3.71Å; V360-V453 HydrophobicContact CG2-CG1 4.26Å; V360-V453 HydrophobicContact CG2-CG2 4.17Å; V360-I455 HydrophobicContact CB-CD1 4.18Å; V360-I455 HydrophobicContact CG1-CB 4.22Å; V360-I455 HydrophobicContact CG1-CD1 3.34Å; V360-I455 HydrophobicContact CG1-CG1 3.39Å
361	V	35.5	Very low	53.3	Low	18 Å²	18	67 Å²	67	11%	0.109	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	-169.4	173.4	-175.2	0	0	0	0	112.6	Q345 T346 I451 V453 L454 I455	Q345-V361 WeakPolarHBondContact O-CG1 3.43Å; T346-V361 HydrophobicContact CG2-CG2 3.39Å; V361-I451 HydrophobicContact CB-CD1 4.31Å; V361-I451 HydrophobicContact CB-CG2 4.32Å; V361-I451 HydrophobicContact CG2-CD1 3.87Å; V361-I451 HydrophobicContact CG2-CG1 4.29Å; V361-I451 HydrophobicContact CG2-CG2 4.16Å; V361-V453 PolarHBondContact N-O 2.84Å; V361-L454 CarbonylContact O-C 3.19Å; V361-L454 WeakPolarHBondContact O-CA 3.07Å; V361-I455 PolarHBondContact O-N 3.05Å
362	I	32.6	Very low	53.8	Low	52 Å²	52	67 Å²	67	27%	0.267	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	143.2	-159.6	-56.9	147.7	0	0	0	117.6	Q345 L454 I455 Y460	Q345-I362 HydrophobicContact CB-CD1 3.58Å; Q345-I362 HydrophobicContact CG-CD1 4.29Å; I362-L454 WeakPolarHBondContact O-CD2 3.2Å; I362-I455 CarbonylContact C-O 3.56Å; I362-I455 WeakPolarHBondContact CA-O 3.1Å; I362-I455 WeakPolarHBondContact CG2-O 3.45Å; I362-Y460 HydrophobicContact CD1-CD2 3.88Å; I362-Y460 HydrophobicContact CD1-CE2 3.4Å; I362-Y460 HydrophobicContact CG1-CD2 4Å; I362-Y460 HydrophobicContact CG1-CE2 4.04Å; I362-Y460 HydrophobicContact CG2-CD2 4.1Å
363	S	40.6	Very low	54.6	Low	11 Å²	11	60.5 Å²	60.5	8%	0.077	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	-173.2	177.9	146.1	0	0	0	0	112.1	R365 F367 I455 G456 L457	S363-R365 WeakPolarHBondContact CB-O 3.48Å; S363-R365 PolarHBondContact OG-N 2.94Å; S363-R365 VanDerWaalsContact OG-N 3.13Å; S363-R365 PolarHBondContact OG-O 3.26Å; S363-F367 WeakPolarHBondContact OG-CD2 3.36Å; S363-F367 VanDerWaalsContact OG-CE2 3.26Å; S363-F367 WeakPolarHBondContact OG-CE2 3.39Å; S363-I455 PolarHBondContact N-O 3.33Å; S363-G456 CarbonylContact O-C 3.52Å; S363-G456 WeakPolarHBondContact O-CA 3.47Å; S363-L457 PolarHBondContact O-N 2.79Å
364	Q	45.3	Very low	55.9	Low	85 Å²	85	62.9 Å²	62.9	40%	0.397	32%	0.323	S	S	.	.	S	Bend	trans	-74.4	-31.4	166	-77.3	-172.2	-10.4	0	0	113.4	V331 D332 L457	V331-Q364 HydrophobicContact CG1-CB 4.06Å; D332-Q364 VanDerWaalsContact O-CG 3.31Å; D332-Q364 WeakPolarHBondContact O-CG 3.37Å; D332-Q364 PolarHBondContact O-OE1 3.32Å; Q364-L457 PolarHBondContact O-N 2.98Å
365	R	61.4	Low	57.2	Low	86 Å²	86	59.3 Å²	59.3	33%	0.325	30%	0.299	S	S	.	.	S	Bend	trans	-127.4	156	171.3	-99.7	-163.7	175.7	-165.6	-2.1	110.5	V329 V331 S363 F367 E383	V329-R365 VanDerWaalsContact CG1-NH1 3.33Å; V331-R365 HydrophobicContact CG1-CB 4.13Å; V331-R365 HydrophobicContact CG2-CB 4.17Å; V331-R365 HydrophobicContact CG2-CG 4.24Å; S363-R365 WeakPolarHBondContact CB-O 3.48Å; S363-R365 PolarHBondContact OG-N 2.94Å; S363-R365 VanDerWaalsContact OG-N 3.13Å; S363-R365 PolarHBondContact OG-O 3.26Å; R365-F367 HydrophobicContact CB-CE2 4.39Å; R365-F367 HydrophobicContact CB-CZ 4.49Å; R365-F367 VanDerWaalsContact O-CD2 3.3Å; R365-F367 WeakPolarHBondContact O-CD2 3.38Å; R365-E383 IonicContact NH1-OE1 2.7Å; R365-E383 PolarHBondContact NH1-OE1 3.24Å
366	S	73.8	Confident	59.2	Low	42 Å²	42	54.6 Å²	54.6	29%	0.294	27%	0.269	S	S	.	.			trans	-74.1	129.6	174.9	-55.3	0	0	0	0	111.8	L454 I455 G456	S366-L454 CarbonylContact C-O 3.47Å; S366-L454 VanDerWaalsContact C-O 3.29Å; S366-L454 WeakPolarHBondContact CA-O 3.1Å; S366-L454 WeakPolarHBondContact CB-O 3.36Å; S366-I455 WeakPolarHBondContact OG-CA 3.21Å; S366-G456 PolarHBondContact OG-N 3.01Å
367	F	80.6	Confident	61.2	Low	59 Å²	59	63 Å²	63	26%	0.259	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	145.4	175.7	-66.6	-76.3	0	0	0	110.2	V331 S363 R365 V385 I387 V453 L454	V331-F367 HydrophobicContact CB-CZ 4.15Å; V331-F367 HydrophobicContact CG1-CE2 3.98Å; V331-F367 HydrophobicContact CG1-CZ 3.83Å; V331-F367 HydrophobicContact CG2-CZ 4.19Å; S363-F367 WeakPolarHBondContact OG-CD2 3.36Å; S363-F367 VanDerWaalsContact OG-CE2 3.26Å; S363-F367 WeakPolarHBondContact OG-CE2 3.39Å; R365-F367 HydrophobicContact CB-CE2 4.39Å; R365-F367 HydrophobicContact CB-CZ 4.49Å; R365-F367 VanDerWaalsContact O-CD2 3.3Å; R365-F367 WeakPolarHBondContact O-CD2 3.38Å; F367-V385 HydrophobicContact CE1-CG1 4.43Å; F367-I387 HydrophobicContact CE1-CD1 4.28Å; F367-I387 HydrophobicContact CZ-CD1 4.48Å; F367-V453 CarbonylContact O-C 3.58Å; F367-V453 VanDerWaalsContact O-CA 3.26Å; F367-V453 WeakPolarHBondContact O-CA 3.39Å; F367-V453 VanDerWaalsContact O-CG1 3.29Å; F367-V453 WeakPolarHBondContact O-CG1 3.43Å; F367-L454 HydrophobicContact CB-CB 4.26Å; F367-L454 PolarHBondContact N-O 2.62Å; F367-L454 PolarHBondContact O-N 2.86Å
368	I	79	Confident	63.3	Low	37 Å²	37	59.9 Å²	59.9	19%	0.19	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	142.5	173.4	-179.1	162.5	0	0	0	108.8	M351 E370 L372 A373 L378 V403 F405 D452 V453	M351-I368 HydrophobicContact CE-CD1 4.06Å; M351-I368 HydrophobicContact SD-CD1 4.11Å; I368-E370 PolarHBondContact O-N 3.31Å; I368-L372 HydrophobicContact CD1-CB 4.3Å; I368-L372 HydrophobicContact CD1-CD2 3.72Å; I368-L372 HydrophobicContact CD1-CG 3.97Å; I368-L372 HydrophobicContact CG1-CB 4.13Å; I368-L372 HydrophobicContact CG1-CD2 4.05Å; I368-L372 HydrophobicContact CG1-CG 4.31Å; I368-A373 HydrophobicContact CD1-CB 4.28Å; I368-A373 HydrophobicContact CG1-CB 4.25Å; I368-A373 HydrophobicContact CG2-CB 4.11Å; I368-L378 HydrophobicContact CD1-CD1 3.91Å; I368-V403 HydrophobicContact CG2-CG2 3.64Å; I368-F405 HydrophobicContact CB-CE1 4.16Å; I368-F405 HydrophobicContact CB-CZ 4.36Å; I368-F405 HydrophobicContact CD1-CD1 4.24Å; I368-F405 HydrophobicContact CD1-CE1 3.88Å; I368-F405 HydrophobicContact CD1-CZ 4.34Å; I368-F405 HydrophobicContact CG2-CE1 4.18Å; I368-D452 CarbonylContact C-O 3.59Å; I368-D452 WeakPolarHBondContact CA-O 3.16Å; I368-V453 HydrophobicContact CB-CG2 4.33Å; I368-V453 HydrophobicContact CD1-CG2 4.07Å; I368-V453 HydrophobicContact CG1-CG2 3.98Å
369	T	81.7	Confident	64.8	Low	34 Å²	34	59.4 Å²	59.4	21%	0.209	28%	0.281	C	S	.	.			trans	-61.9	139.4	174.2	63.3	0	0	0	0	109.6	E371 L372 A373 I451 D452	T369-E371 PolarHBondContact O-N 3.36Å; T369-L372 PolarHBondContact O-N 3.49Å; T369-L372 VanDerWaalsContact OG1-CB 3.31Å; T369-L372 WeakPolarHBondContact OG1-CB 3.43Å; T369-L372 PolarHBondContact OG1-N 2.95Å; T369-A373 WeakPolarHBondContact O-CB 3.3Å; T369-A373 PolarHBondContact O-N 2.83Å; T369-I451 WeakPolarHBondContact CG2-O 3.3Å; T369-D452 WeakPolarHBondContact CG2-O 3.38Å; T369-D452 PolarHBondContact N-O 3.28Å
370	E	78.8	Confident	66.5	Low	114 Å²	114	60.3 Å²	60.3	53%	0.533	29%	0.293	S	S	.	.	H	α-helix	trans	-60.7	-31	177.7	-177.8	160.1	-151.5	0	0	111.5	I368 N374 R401	I368-E370 PolarHBondContact O-N 3.31Å; E370-N374 WeakPolarHBondContact CG-ND2 3.48Å; E370-N374 WeakPolarHBondContact O-CB 3.2Å; E370-N374 PolarHBondContact O-N 2.89Å; E370-N374 PolarHBondContact O-ND2 3.37Å; E370-R401 IonicContact OE1-NH2 3.64Å; E370-R401 PolarHBondContact OE1-NH2 3.37Å
371	E	79.2	Confident	68	Low	102 Å²	102	63.4 Å²	63.4	48%	0.477	31%	0.313	S	S	.	.	H	α-helix	trans	-61.7	-51.7	173.2	-172.2	-175.4	163.1	0	0	112.3	T369 N374 R375 K450	T369-E371 PolarHBondContact O-N 3.36Å; E371-N374 PolarHBondContact O-N 3.37Å; E371-R375 WeakPolarHBondContact O-CB 3.32Å; E371-R375 PolarHBondContact O-N 2.79Å; E371-K450 IonicContact OE2-NZ 3.35Å; E371-K450 PolarHBondContact OE2-NZ 3.2Å
372	L	78.1	Confident	69.4	Low	0 Å²	0	66 Å²	66	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-65.2	-46.6	177.5	-179.2	68.4	0	0	0	110.4	M351 I368 T369 N374 R375 M376 D452 V453	M351-L372 HydrophobicContact CE-CD2 3.97Å; M351-L372 HydrophobicContact CE-CG 4.18Å; M351-L372 HydrophobicContact SD-CD2 4.02Å; I368-L372 HydrophobicContact CD1-CB 4.3Å; I368-L372 HydrophobicContact CD1-CD2 3.72Å; I368-L372 HydrophobicContact CD1-CG 3.97Å; I368-L372 HydrophobicContact CG1-CB 4.13Å; I368-L372 HydrophobicContact CG1-CD2 4.05Å; I368-L372 HydrophobicContact CG1-CG 4.31Å; T369-L372 PolarHBondContact O-N 3.49Å; T369-L372 VanDerWaalsContact OG1-CB 3.31Å; T369-L372 WeakPolarHBondContact OG1-CB 3.43Å; T369-L372 PolarHBondContact OG1-N 2.95Å; L372-N374 VanDerWaalsContact C-N 3.27Å; L372-N374 PolarHBondContact O-N 3.13Å; L372-R375 PolarHBondContact O-N 3.2Å; L372-R375 VanDerWaalsContact O-N 3.15Å; L372-M376 HydrophobicContact CD1-CG 3.54Å; L372-M376 HydrophobicContact CD1-SD 4.23Å; L372-M376 HydrophobicContact CG-CG 3.87Å; L372-M376 WeakPolarHBondContact O-CB 3.28Å; L372-M376 WeakPolarHBondContact O-CG 3.39Å; L372-M376 PolarHBondContact O-N 3.19Å; L372-D452 HydrophobicContact CB-CB 4.19Å; L372-D452 HydrophobicContact CD2-CB 3.53Å; L372-D452 HydrophobicContact CG-CB 4.33Å; L372-V453 HydrophobicContact CD2-CG2 3.78Å
373	A	79.6	Confident	71.2	Confident	7 Å²	7	64.5 Å²	64.5	6%	0.058	32%	0.318	C	S	.	.	H	α-helix	trans	-56.4	-42.2	179.1	0	0	0	0	0	112.1	I368 T369 R377 L378	I368-A373 HydrophobicContact CD1-CB 4.28Å; I368-A373 HydrophobicContact CG1-CB 4.25Å; I368-A373 HydrophobicContact CG2-CB 4.11Å; T369-A373 WeakPolarHBondContact O-CB 3.3Å; T369-A373 PolarHBondContact O-N 2.83Å; A373-R377 PolarHBondContact O-N 2.83Å; A373-R377 VanDerWaalsContact O-N 3.16Å; A373-L378 HydrophobicContact CB-CB 4.49Å; A373-L378 PolarHBondContact O-N 3.33Å
374	N	80	Confident	72.6	Confident	75 Å²	75	67 Å²	67	40%	0.401	33%	0.326	S	S	.	.	H	α-helix	trans	-68.5	-45	175.7	-70.8	-25.3	0	0	0	112.2	E370 E371 L372 M376 R377 R401	E370-N374 WeakPolarHBondContact CG-ND2 3.48Å; E370-N374 WeakPolarHBondContact O-CB 3.2Å; E370-N374 PolarHBondContact O-N 2.89Å; E370-N374 PolarHBondContact O-ND2 3.37Å; E371-N374 PolarHBondContact O-N 3.37Å; L372-N374 VanDerWaalsContact C-N 3.27Å; L372-N374 PolarHBondContact O-N 3.13Å; N374-M376 PolarHBondContact O-N 2.99Å; N374-R377 PolarHBondContact O-N 2.99Å; N374-R401 VanDerWaalsContact OD1-CZ 3.3Å; N374-R401 PolarHBondContact OD1-NH1 3.31Å; N374-R401 PolarHBondContact OD1-NH2 3.2Å
375	R	76.5	Confident	73.6	Confident	117 Å²	117	63.1 Å²	63.1	44%	0.442	31%	0.308	S	S	.	.	H	α-helix	trans	-58.3	-36.8	177.5	-175.1	168.3	69.8	-151.2	0	111.7	E371 L372 R377 D452	E371-R375 WeakPolarHBondContact O-CB 3.32Å; E371-R375 PolarHBondContact O-N 2.79Å; L372-R375 PolarHBondContact O-N 3.2Å; L372-R375 VanDerWaalsContact O-N 3.15Å; R375-R377 VanDerWaalsContact C-N 3.28Å; R375-D452 IonicContact NH2-OD2 2.89Å
376	M	74.4	Confident	73.8	Confident	18 Å²	18	61.8 Å²	61.8	9%	0.089	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	2.9	-179.2	-64.6	-58.7	-51	0	0	113.5	M351 T353 T355 G356 L372 N374 L378	M351-M376 HydrophobicContact CE-CB 3.89Å; M351-M376 HydrophobicContact CE-CE 3.77Å; M351-M376 HydrophobicContact CE-CG 3.48Å; M351-M376 VanDerWaalsContact CE-CG 3.48Å; M351-M376 HydrophobicContact CE-SD 4.26Å; T353-M376 HydrophobicContact CG2-CB 4.23Å; T353-M376 HydrophobicContact CG2-CE 3.31Å; T353-M376 WeakPolarHBondContact OG1-CE 3.5Å; T355-M376 WeakPolarHBondContact O-CE 3.41Å; G356-M376 VanDerWaalsContact C-CE 3.49Å; G356-M376 WeakPolarHBondContact O-CE 3.47Å; L372-M376 HydrophobicContact CD1-CG 3.54Å; L372-M376 HydrophobicContact CD1-SD 4.23Å; L372-M376 HydrophobicContact CG-CG 3.87Å; L372-M376 WeakPolarHBondContact O-CB 3.28Å; L372-M376 WeakPolarHBondContact O-CG 3.39Å; L372-M376 PolarHBondContact O-N 3.19Å; N374-M376 PolarHBondContact O-N 2.99Å; M376-L378 HydrophobicContact CB-CD1 4.1Å; M376-L378 HydrophobicContact CB-CG 3.88Å; M376-L378 PolarHBondContact O-N 3.49Å; M376-L378 VanDerWaalsContact O-N 3.1Å
377	R	74.2	Confident	73.4	Confident	214 Å²	214	61.9 Å²	61.9	81%	0.808	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	33.9	-179.4	-56.5	-178.8	-179.3	-175.4	0.3	113.1	A373 N374 R375 N379	A373-R377 PolarHBondContact O-N 2.83Å; A373-R377 VanDerWaalsContact O-N 3.16Å; N374-R377 PolarHBondContact O-N 2.99Å; R375-R377 VanDerWaalsContact C-N 3.28Å; R377-N379 PolarHBondContact O-N 2.9Å
378	L	74.7	Confident	72.4	Confident	16 Å²	16	59.4 Å²	59.4	8%	0.084	29%	0.293	C	S	.	.			trans	-75.4	115.4	-179.1	-71.7	177.3	0	0	0	110.1	M351 T353 I368 A373 M376 V403 Q404 F405	M351-L378 HydrophobicContact CE-CD1 3.81Å; T353-L378 HydrophobicContact CG2-CD1 4.04Å; T353-L378 HydrophobicContact CG2-CD2 3.53Å; T353-L378 HydrophobicContact CG2-CG 3.97Å; I368-L378 HydrophobicContact CD1-CD1 3.91Å; A373-L378 HydrophobicContact CB-CB 4.49Å; A373-L378 PolarHBondContact O-N 3.33Å; M376-L378 HydrophobicContact CB-CD1 4.1Å; M376-L378 HydrophobicContact CB-CG 3.88Å; M376-L378 PolarHBondContact O-N 3.49Å; M376-L378 VanDerWaalsContact O-N 3.1Å; L378-V403 HydrophobicContact CB-CB 3.98Å; L378-V403 HydrophobicContact CB-CG1 3.79Å; L378-V403 HydrophobicContact CD1-CB 4.42Å; L378-V403 HydrophobicContact CD1-CG2 4.3Å; L378-Q404 WeakPolarHBondContact CD2-O 3.4Å; L378-F405 HydrophobicContact CD1-CB 4.25Å; L378-F405 HydrophobicContact CD1-CD1 3.77Å; L378-F405 HydrophobicContact CD1-CG 4.35Å
379	N	67.8	Low	71.2	Confident	136 Å²	136	60.1 Å²	60.1	73%	0.727	30%	0.299	S	S	*	.			trans	-108	152.2	178.8	-73	-36.2	0	0	0	110.8	R377	R377-N379 PolarHBondContact O-N 2.9Å
380	G	68.6	Low	69.4	Low	34 Å²	34	64.9 Å²	64.9	35%	0.351	32%	0.322	S	S	.	.			trans	172.7	178	172.7	0	0	0	0	0	112.2	R402	G380-R402 CarbonylContact C-O 3.57Å; G380-R402 WeakPolarHBondContact CA-O 3.16Å
381	P	65.6	Low	68.1	Low	75 Å²	75	62.6 Å²	62.6	49%	0.487	33%	0.329	S	S	.	.			trans	-67	145.9	-170.1	25.8	-32.6	0	0	0	112	R402	P381-R402 HydrophobicContact CG-CB 4.33Å; P381-R402 PolarHBondContact O-N 3.4Å
382	L	65.6	Low	66.6	Low	71 Å²	71	60.3 Å²	60.3	37%	0.372	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	126.3	173.2	-73.7	164.8	0	0	0	109.8	R399 T400 R401	L382-R399 HydrophobicContact CB-CG 4.29Å; L382-R399 HydrophobicContact CD2-CG 4.37Å; L382-T400 CarbonylContact C-O 3.52Å; L382-T400 WeakPolarHBondContact CA-O 3.19Å; L382-R401 HydrophobicContact CD2-CB 4.5Å; L382-R401 HydrophobicContact CD2-CG 3.49Å; L382-R401 VanDerWaalsContact CD2-CG 3.49Å; L382-R401 HydrophobicContact CG-CG 4.22Å
383	E	70	Confident	65.3	Low	22 Å²	22	69.2 Å²	69.2	10%	0.103	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	158.1	172.8	60.7	179.1	-153.2	0	0	111	R365 V385 R399 T400 R402	R365-E383 IonicContact NH1-OE1 2.7Å; R365-E383 PolarHBondContact NH1-OE1 3.24Å; E383-V385 HydrophobicContact CG-CG2 4.09Å; E383-R399 CarbonylContact O-C 3.56Å; E383-R399 WeakPolarHBondContact O-CA 3.38Å; E383-T400 PolarHBondContact N-O 3.27Å; E383-T400 PolarHBondContact O-N 2.89Å; E383-T400 VanDerWaalsContact O-O 3.14Å; E383-R402 HydrophobicContact CG-CB 4.36Å
384	Y	69.6	Low	63.8	Low	63 Å²	63	70.6 Å²	70.6	25%	0.247	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	118.9	173.5	-84.1	-92.7	0	0	0	109.3	Y326 R327 K328 V329 R399	Y326-Y384 HydrophobicContact CD1-CE2 4.45Å; Y326-Y384 HydrophobicContact CG-CD2 4.42Å; Y326-Y384 HydrophobicContact CG-CE2 4.38Å; R327-Y384 PolarHBondContact O-N 3.47Å; K328-Y384 WeakPolarHBondContact CA-O 3.2Å; V329-Y384 PolarHBondContact N-O 3.46Å; Y384-R399 HydrophobicContact CD1-CB 4.1Å; Y384-R399 HydrophobicContact CD1-CG 4.5Å; Y384-R399 HydrophobicContact CD2-CG 4.05Å; Y384-R399 HydrophobicContact CE1-CB 3.82Å; Y384-R399 HydrophobicContact CE1-CG 4.27Å; Y384-R399 HydrophobicContact CE2-CB 4.26Å; Y384-R399 HydrophobicContact CE2-CG 3.78Å; Y384-R399 HydrophobicContact CG-CB 4.46Å; Y384-R399 HydrophobicContact CG-CG 4.41Å
385	V	66.1	Low	62.5	Low	4 Å²	4	73.5 Å²	73.5	2%	0.024	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	124.9	178.2	-174.5	0	0	0	0	109.3	V329 V331 F367 E383 I387 C397 K398 T400	V329-V385 CarbonylContact O-C 3.6Å; V329-V385 VanDerWaalsContact O-CA 3.29Å; V329-V385 WeakPolarHBondContact O-CA 3.49Å; V331-V385 HydrophobicContact CG2-CG1 3.92Å; F367-V385 HydrophobicContact CE1-CG1 4.43Å; E383-V385 HydrophobicContact CG-CG2 4.09Å; V385-I387 HydrophobicContact CG1-CG1 4Å; V385-C397 WeakPolarHBondContact O-CA 3.06Å; V385-K398 PolarHBondContact N-O 3.37Å; V385-K398 PolarHBondContact O-N 2.98Å; V385-T400 VanDerWaalsContact CG2-OG1 3.28Å; V385-T400 WeakPolarHBondContact CG2-OG1 3.24Å
386	E	65.5	Low	61.8	Low	57 Å²	57	74.2 Å²	74.2	27%	0.266	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	115.4	170.8	-175.4	174.5	-174.4	0	0	108.9	V329 Q330 V331 F396	V329-E386 PolarHBondContact O-N 2.74Å; Q330-E386 CarbonylContact C-O 3.47Å; Q330-E386 WeakPolarHBondContact CA-O 3.3Å; V331-E386 PolarHBondContact N-O 2.81Å; E386-F396 WeakPolarHBondContact CA-O 3.23Å
387	I	65.3	Low	61.1	Low	44 Å²	44	76.6 Å²	76.6	23%	0.226	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	119.1	-179.2	-55.9	173.7	0	0	0	107.9	V331 L333 F367 V385 K395 F396	V331-I387 WeakPolarHBondContact O-CA 3.33Å; L333-I387 HydrophobicContact CD1-CG2 3.8Å; F367-I387 HydrophobicContact CE1-CD1 4.28Å; F367-I387 HydrophobicContact CZ-CD1 4.48Å; V385-I387 HydrophobicContact CG1-CG1 4Å; I387-K395 WeakPolarHBondContact O-CA 3.14Å; I387-F396 PolarHBondContact N-O 3.28Å; I387-F396 PolarHBondContact O-N 2.97Å
388	S	59.1	Low	61	Low	8 Å²	8	72.1 Å²	72.1	6%	0.056	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	135.3	174.9	6.8	0	0	0	0	110.9	V331 D332 L333	V331-S388 PolarHBondContact O-N 2.8Å; V331-S388 PolarHBondContact O-OG 2.98Å; D332-S388 WeakPolarHBondContact CA-O 3.36Å; D332-S388 WeakPolarHBondContact OD1-CB 3.33Å; D332-S388 PolarHBondContact OD1-OG 3.42Å; L333-S388 PolarHBondContact N-O 3.09Å
389	T	54.3	Low	61	Low	51 Å²	51	77.3 Å²	77.3	31%	0.313	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	141.8	171.1	50.9	0	0	0	0	110.6	G391 G392 S394	T389-G391 PolarHBondContact O-N 3.15Å; T389-G392 PolarHBondContact O-N 3.46Å; T389-S394 PolarHBondContact N-O 3.49Å; T389-S394 PolarHBondContact OG1-N 3.15Å; T389-S394 PolarHBondContact OG1-O 3.5Å; T389-S394 PolarHBondContact OG1-OG 3.14Å
390	L	43.7	Very low	61.3	Low	134 Å²	134	73 Å²	73	70%	0.702	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	130.3	178.7	-146.2	138.7	0	0	0	110.2	L333 V334	L333-L390 PolarHBondContact O-N 3.12Å; V334-L390 HydrophobicContact CG2-CD1 3.77Å
391	G	52.6	Low	61.6	Low	66 Å²	66	75.3 Å²	75.3	68%	0.68	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.4	-5.8	-166.9	0	0	0	0	0	114.3	T389 Q393	T389-G391 PolarHBondContact O-N 3.15Å; G391-Q393 PolarHBondContact O-N 2.92Å; G391-Q393 VanDerWaalsContact O-N 3.13Å
392	G	46.2	Very low	62	Low	55 Å²	55	78.5 Å²	78.5	57%	0.567	40%	0.401	S	S	*	.	S	Bend	trans	69.2	9	172.2	0	0	0	0	0	114.8	T389 S394	T389-G392 PolarHBondContact O-N 3.46Å; G392-S394 PolarHBondContact O-N 2.95Å
393	Q	51	Low	62.4	Low	186 Å²	186	76.6 Å²	76.6	87%	0.869	39%	0.392	S	S	*	.	S	Bend	trans	-70.3	-20.6	-174.1	-66.8	-161.7	-10.8	0	0	113	G391	G391-Q393 PolarHBondContact O-N 2.92Å; G391-Q393 VanDerWaalsContact O-N 3.13Å
394	S	48.9	Very low	62.4	Low	36 Å²	36	84 Å²	84	25%	0.252	43%	0.427	S	S	.	.			trans	-152.9	134.8	172	56.7	0	0	0	0	113.3	T389 G392 F396	T389-S394 PolarHBondContact N-O 3.49Å; T389-S394 PolarHBondContact OG1-N 3.15Å; T389-S394 PolarHBondContact OG1-O 3.5Å; T389-S394 PolarHBondContact OG1-OG 3.14Å; G392-S394 PolarHBondContact O-N 2.95Å; S394-F396 WeakPolarHBondContact OG-CE2 3.46Å
395	K	53.3	Low	62.6	Low	136 Å²	136	83.2 Å²	83.2	59%	0.591	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.3	170.6	-69.1	-172.1	175.7	-168.7	0	108	I387	I387-K395 WeakPolarHBondContact O-CA 3.14Å
396	F	61.3	Low	63	Low	133 Å²	133	85.6 Å²	85.6	58%	0.583	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.3	123.4	178	-57.1	-76.8	0	0	0	109.9	E386 I387 S394	E386-F396 WeakPolarHBondContact CA-O 3.23Å; I387-F396 PolarHBondContact N-O 3.28Å; I387-F396 PolarHBondContact O-N 2.97Å; S394-F396 WeakPolarHBondContact OG-CE2 3.46Å
397	C	60.2	Low	63.6	Low	68 Å²	68	85.2 Å²	85.2	46%	0.459	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	112.1	169.9	-167.2	0	0	0	0	108.5	V385	V385-C397 WeakPolarHBondContact O-CA 3.06Å
398	K	71.3	Confident	63.8	Low	120 Å²	120	84.2 Å²	84.2	52%	0.522	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	138.1	-177.3	-166.8	175.4	179.7	-175.7	0	110.1	V385 T400	V385-K398 PolarHBondContact N-O 3.37Å; V385-K398 PolarHBondContact O-N 2.98Å; K398-T400 HydrophobicContact CB-CG2 4.33Å; K398-T400 HydrophobicContact CD-CG2 4.3Å; K398-T400 HydrophobicContact CG-CG2 4.11Å
399	R	74.1	Confident	64.4	Low	124 Å²	124	85.5 Å²	85.5	47%	0.468	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	119	171.6	-160.5	177.3	77.1	-177	7.5	109	L382 E383 Y384	L382-R399 HydrophobicContact CB-CG 4.29Å; L382-R399 HydrophobicContact CD2-CG 4.37Å; E383-R399 CarbonylContact O-C 3.56Å; E383-R399 WeakPolarHBondContact O-CA 3.38Å; Y384-R399 HydrophobicContact CD1-CB 4.1Å; Y384-R399 HydrophobicContact CD1-CG 4.5Å; Y384-R399 HydrophobicContact CD2-CG 4.05Å; Y384-R399 HydrophobicContact CE1-CB 3.82Å; Y384-R399 HydrophobicContact CE1-CG 4.27Å; Y384-R399 HydrophobicContact CE2-CB 4.26Å; Y384-R399 HydrophobicContact CE2-CG 3.78Å; Y384-R399 HydrophobicContact CG-CB 4.46Å; Y384-R399 HydrophobicContact CG-CG 4.41Å
400	T	74.3	Confident	65.1	Low	45 Å²	45	87.3 Å²	87.3	28%	0.276	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	155.1	-174.5	55	0	0	0	0	111	L382 E383 V385 K398	L382-T400 CarbonylContact C-O 3.52Å; L382-T400 WeakPolarHBondContact CA-O 3.19Å; E383-T400 PolarHBondContact N-O 3.27Å; E383-T400 PolarHBondContact O-N 2.89Å; E383-T400 VanDerWaalsContact O-O 3.14Å; V385-T400 VanDerWaalsContact CG2-OG1 3.28Å; V385-T400 WeakPolarHBondContact CG2-OG1 3.24Å; K398-T400 HydrophobicContact CB-CG2 4.33Å; K398-T400 HydrophobicContact CD-CG2 4.3Å; K398-T400 HydrophobicContact CG-CG2 4.11Å
401	R	76.1	Confident	65.8	Low	84 Å²	84	86.2 Å²	86.2	32%	0.317	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	128.9	176.1	-71.9	175	-95.8	164.9	-1.3	109.4	E370 N374 L382 V403	E370-R401 IonicContact OE1-NH2 3.64Å; E370-R401 PolarHBondContact OE1-NH2 3.37Å; N374-R401 VanDerWaalsContact OD1-CZ 3.3Å; N374-R401 PolarHBondContact OD1-NH1 3.31Å; N374-R401 PolarHBondContact OD1-NH2 3.2Å; L382-R401 HydrophobicContact CD2-CB 4.5Å; L382-R401 HydrophobicContact CD2-CG 3.49Å; L382-R401 VanDerWaalsContact CD2-CG 3.49Å; L382-R401 HydrophobicContact CG-CG 4.22Å; R401-V403 HydrophobicContact CB-CG1 4.34Å
402	R	74	Confident	65.5	Low	142 Å²	142	86.3 Å²	86.3	54%	0.536	44%	0.443	S	S	.	.			trans	-81.1	122.3	166.2	-171.8	177.4	75	-167.5	7.1	108.1	G380 P381 E383	G380-R402 CarbonylContact C-O 3.57Å; G380-R402 WeakPolarHBondContact CA-O 3.16Å; P381-R402 HydrophobicContact CG-CB 4.33Å; P381-R402 PolarHBondContact O-N 3.4Å; E383-R402 HydrophobicContact CG-CB 4.36Å
403	V	74.4	Confident	65	Low	30 Å²	30	87.2 Å²	87.2	18%	0.182	45%	0.452	C	S	.	.			trans	-122.6	158.9	-179.3	-64	0	0	0	0	109.9	I368 L378 R401 F405	I368-V403 HydrophobicContact CG2-CG2 3.64Å; L378-V403 HydrophobicContact CB-CB 3.98Å; L378-V403 HydrophobicContact CB-CG1 3.79Å; L378-V403 HydrophobicContact CD1-CB 4.42Å; L378-V403 HydrophobicContact CD1-CG2 4.3Å; R401-V403 HydrophobicContact CB-CG1 4.34Å; V403-F405 HydrophobicContact CG2-CD1 3.91Å; V403-F405 HydrophobicContact CG2-CE1 3.73Å
404	Q	69.1	Low	64	Low	177 Å²	177	85.3 Å²	85.3	83%	0.827	44%	0.443	S	S	*	.			trans	-123.3	136	175.6	-171.2	175.6	0.8	0	0	109.1	L378	L378-Q404 WeakPolarHBondContact CD2-O 3.4Å
405	F	74.9	Confident	62.9	Low	47 Å²	47	93.4 Å²	93.4	21%	0.206	48%	0.477	C	S	.	.			trans	-154.3	159.6	177.6	49	-94.3	0	0	0	108.2	M351 T353 I368 L378 V403 F407 V453	M351-F405 HydrophobicContact CE-CB 4.49Å; M351-F405 HydrophobicContact CG-CB 4.09Å; M351-F405 HydrophobicContact CG-CD2 4.13Å; M351-F405 HydrophobicContact CG-CG 4.33Å; M351-F405 HydrophobicContact SD-CB 4.09Å; M351-F405 HydrophobicContact SD-CD1 4.45Å; M351-F405 HydrophobicContact SD-CD2 3.77Å; M351-F405 HydrophobicContact SD-CE2 4.34Å; M351-F405 HydrophobicContact SD-CG 3.84Å; T353-F405 HydrophobicContact CG2-CB 4.12Å; I368-F405 HydrophobicContact CB-CE1 4.16Å; I368-F405 HydrophobicContact CB-CZ 4.36Å; I368-F405 HydrophobicContact CD1-CD1 4.24Å; I368-F405 HydrophobicContact CD1-CE1 3.88Å; I368-F405 HydrophobicContact CD1-CZ 4.34Å; I368-F405 HydrophobicContact CG2-CE1 4.18Å; L378-F405 HydrophobicContact CD1-CB 4.25Å; L378-F405 HydrophobicContact CD1-CD1 3.77Å; L378-F405 HydrophobicContact CD1-CG 4.35Å; V403-F405 HydrophobicContact CG2-CD1 3.91Å; V403-F405 HydrophobicContact CG2-CE1 3.73Å; F405-F407 HydrophobicContact CD2-CD2 4.45Å; F405-F407 HydrophobicContact CD2-CE1 4.2Å; F405-F407 AromaticContact CD2-CE2 3.71Å; F405-F407 HydrophobicContact CD2-CE2 3.71Å; F405-F407 AromaticContact CD2-CZ 3.53Å; F405-F407 HydrophobicContact CD2-CZ 3.53Å; F405-F407 HydrophobicContact CE2-CD2 4.42Å; F405-F407 HydrophobicContact CE2-CE1 4.3Å; F405-F407 AromaticContact CE2-CE2 3.36Å; F405-F407 HydrophobicContact CE2-CE2 3.36Å; F405-F407 AromaticContact CE2-CZ 3.25Å; F405-F407 HydrophobicContact CE2-CZ 3.25Å; F405-F407 HydrophobicContact CZ-CZ 4.38Å; F405-V453 HydrophobicContact CE2-CG1 4.03Å; F405-V453 HydrophobicContact CZ-CG1 3.86Å
406	A	74.5	Confident	61.6	Low	55 Å²	55	96.8 Å²	96.8	46%	0.455	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	158.7	175.7	0	0	0	0	0	110.4	M351 R352	M351-A406 CarbonylContact C-O 3.54Å; R352-A406 PolarHBondContact N-O 2.86Å; R352-A406 PolarHBondContact O-N 3.46Å; R352-A406 VanDerWaalsContact O-N 3.1Å
407	F	77.5	Confident	60	Low	49 Å²	49	95 Å²	95	22%	0.215	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	143.8	174.9	-66	-66.2	0	0	0	111	A349 V350 M351 V360 F405 V453 I455 F483	A349-F407 HydrophobicContact CB-CB 3.96Å; A349-F407 HydrophobicContact CB-CD1 3.84Å; A349-F407 HydrophobicContact CB-CG 4.15Å; V350-F407 CarbonylContact O-C 3.57Å; V350-F407 VanDerWaalsContact O-CA 3.3Å; V350-F407 WeakPolarHBondContact O-CA 3.32Å; M351-F407 HydrophobicContact CB-CD1 4.03Å; M351-F407 HydrophobicContact CB-CE1 3.78Å; M351-F407 HydrophobicContact CG-CD1 4.05Å; M351-F407 HydrophobicContact CG-CE1 3.6Å; M351-F407 HydrophobicContact CG-CZ 4.35Å; M351-F407 HydrophobicContact SD-CE1 3.91Å; M351-F407 HydrophobicContact SD-CZ 4.24Å; V360-F407 HydrophobicContact CG2-CD1 4.26Å; V360-F407 HydrophobicContact CG2-CE1 3.54Å; V360-F407 HydrophobicContact CG2-CE2 4.06Å; V360-F407 HydrophobicContact CG2-CZ 3.43Å; V360-F407 VanDerWaalsContact CG2-CZ 3.43Å; F405-F407 HydrophobicContact CD2-CD2 4.45Å; F405-F407 HydrophobicContact CD2-CE1 4.2Å; F405-F407 AromaticContact CD2-CE2 3.71Å; F405-F407 HydrophobicContact CD2-CE2 3.71Å; F405-F407 AromaticContact CD2-CZ 3.53Å; F405-F407 HydrophobicContact CD2-CZ 3.53Å; F405-F407 HydrophobicContact CE2-CD2 4.42Å; F405-F407 HydrophobicContact CE2-CE1 4.3Å; F405-F407 AromaticContact CE2-CE2 3.36Å; F405-F407 HydrophobicContact CE2-CE2 3.36Å; F405-F407 AromaticContact CE2-CZ 3.25Å; F405-F407 HydrophobicContact CE2-CZ 3.25Å; F405-F407 HydrophobicContact CZ-CZ 4.38Å; F407-V453 HydrophobicContact CE2-CG1 4.47Å; F407-V453 HydrophobicContact CZ-CB 4.33Å; F407-V453 HydrophobicContact CZ-CG1 4.01Å; F407-V453 HydrophobicContact CZ-CG2 4.14Å; F407-I455 HydrophobicContact CD2-CD1 4.39Å; F407-I455 HydrophobicContact CE2-CD1 4.14Å; F407-I455 HydrophobicContact CE2-CG1 4.38Å; F407-F483 HydrophobicContact CB-CE1 3.59Å; F407-F483 HydrophobicContact CB-CZ 3.7Å; F407-F483 HydrophobicContact CG-CZ 4.41Å
408	S	69.7	Low	58.4	Low	22 Å²	22	96.7 Å²	96.7	15%	0.154	52%	0.515	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	156.9	168	60.6	0	0	0	0	110.8	V350 R352	V350-S408 PolarHBondContact N-O 3.49Å; V350-S408 PolarHBondContact O-N 3.16Å; R352-S408 PolarHBondContact NE-OG 3.4Å
409	A	72.1	Confident	56.3	Low	36 Å²	36	99.5 Å²	99.5	30%	0.298	53%	0.528	S	S	.	.			trans	-60.1	155.7	169	0	0	0	0	0	110.8	D411 L482	A409-D411 PolarHBondContact O-N 3.48Å; A409-D411 VanDerWaalsContact O-N 3.15Å; A409-L482 WeakPolarHBondContact CB-O 3.43Å
410	L	68.6	Low	54	Low	89 Å²	89	102.2 Å²	102.2	47%	0.466	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-16.9	178.6	-75.9	158.6	0	0	0	113.9	R348 V350	R348-L410 HydrophobicContact CB-CD1 3.9Å; V350-L410 HydrophobicContact CG2-CD2 3.83Å; V350-L410 HydrophobicContact CG2-CG 4.39Å
411	D	57	Low	51.7	Low	111 Å²	111	111.1 Å²	111.1	59%	0.594	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.6	15.6	-166	-85.9	68.1	0	0	0	115.8	A409 G413 K439	A409-D411 PolarHBondContact O-N 3.48Å; A409-D411 VanDerWaalsContact O-N 3.15Å; D411-G413 VanDerWaalsContact C-N 3.32Å; D411-G413 PolarHBondContact O-N 3.11Å; D411-K439 IonicContact OD1-NZ 3.71Å; D411-K439 PolarHBondContact OD1-NZ 2.87Å; D411-K439 VanDerWaalsContact OD1-NZ 3.14Å; D411-K439 IonicContact OD2-NZ 3.58Å; D411-K439 PolarHBondContact OD2-NZ 3.33Å
412	S	47.3	Very low	49.3	Very low	68 Å²	68	117.8 Å²	117.8	48%	0.476	60%	0.599	S	S	.	*	S	Bend	trans	-78	80.1	174.2	69.5	0	0	0	0	111.7	R352 E414	R352-S412 PolarHBondContact NH2-OG 2.95Å; R352-S412 VanDerWaalsContact NH2-OG 3.13Å; S412-E414 PolarHBondContact O-N 3.2Å
413	G	36	Very low	47.5	Very low	73 Å²	73	117.6 Å²	117.6	75%	0.753	61%	0.614	S	S	*	*	S	Bend	trans	54.6	57.4	143	0	0	0	0	0	120.5	D411	D411-G413 VanDerWaalsContact C-N 3.32Å; D411-G413 PolarHBondContact O-N 3.11Å
414	E	29.3	Very low	45.6	Very low	146 Å²	146	118.5 Å²	118.5	68%	0.682	63%	0.625	S	S	*	*			trans	-137.8	100.3	148.2	-88.7	-163.3	-169.4	0	0	109.5	S412 R416	S412-E414 PolarHBondContact O-N 3.2Å; E414-R416 PolarHBondContact O-N 3.33Å; E414-R416 IonicContact OE2-CZ 3.38Å; E414-R416 IonicContact OE2-NE 3.18Å; E414-R416 PolarHBondContact OE2-NE 3.37Å; E414-R416 IonicContact OE2-NH2 3.95Å
415	Q	25.5	Very low	44.8	Very low	207 Å²	207	111.1 Å²	111.1	97%	0.967	59%	0.591	S	S	*	*			trans	-68.2	77.6	165.7	-79.9	-176.1	-24.3	0	0	109.2	A417	Q415-A417 PolarHBondContact O-N 3.01Å
416	R	26	Very low	43.6	Very low	206 Å²	206	112.8 Å²	112.8	78%	0.777	61%	0.606	S	S	*	*			trans	-88.4	105.3	164	-75.3	-171.7	-172.6	-147.1	-6.2	109.3	E414	E414-R416 PolarHBondContact O-N 3.33Å; E414-R416 IonicContact OE2-CZ 3.38Å; E414-R416 IonicContact OE2-NE 3.18Å; E414-R416 PolarHBondContact OE2-NE 3.37Å; E414-R416 IonicContact OE2-NH2 3.95Å
417	A	27.8	Very low	42.7	Very low	96 Å²	96	115.5 Å²	115.5	79%	0.793	61%	0.613	S	S	*	*			trans	34.8	97	158.9	0	0	0	0	0	115.9	Q415 K419	Q415-A417 PolarHBondContact O-N 3.01Å; A417-K419 PolarHBondContact O-N 3.22Å
418	A	26.6	Very low	42	Very low	104 Å²	104	114.1 Å²	114.1	86%	0.86	61%	0.607	S	S	*	*			trans	-26.9	89.6	168.3	0	0	0	0	0	115.8
419	K	27.7	Very low	41.6	Very low	179 Å²	179	115 Å²	115	78%	0.778	61%	0.609	S	S	*	*			trans	-93.9	104	137.3	-105.3	178.7	178	176	0	106.3	A417 W421	A417-K419 PolarHBondContact O-N 3.22Å; K419-W421 PolarHBondContact O-N 3.03Å; K419-W421 PolarHBondContact O-NE1 3Å
420	Q	26.5	Very low	41.1	Very low	180 Å²	180	123.8 Å²	123.8	84%	0.841	64%	0.635	S	S	*	*			trans	-53.6	98	-176.4	-129.9	173.3	6.4	0	0	110.9	R422	Q420-R422 PolarHBondContact O-N 3.46Å
421	W	24.7	Very low	41.2	Very low	233 Å²	233	127.8 Å²	127.8	88%	0.883	64%	0.643	S	S	*	*			trans	-78.6	99.9	171.5	-65.3	88.2	0	0	0	108.1	K419 T423	K419-W421 PolarHBondContact O-N 3.03Å; K419-W421 PolarHBondContact O-NE1 3Å; W421-T423 PolarHBondContact O-N 3.46Å
422	R	27.3	Very low	42.2	Very low	223 Å²	223	123.2 Å²	123.2	84%	0.842	62%	0.618	S	S	*	*			trans	-58.2	136	172.8	-70.8	-173.7	176.7	-153.9	-0.4	109.7	Q420 A424	Q420-R422 PolarHBondContact O-N 3.46Å; R422-A424 PolarHBondContact O-N 3.4Å
423	T	34.5	Very low	43.6	Very low	138 Å²	138	129.5 Å²	129.5	85%	0.847	64%	0.637	S	S	*	*			trans	-50.5	93.5	-177.1	34.9	0	0	0	0	112.7	W421 N425	W421-T423 PolarHBondContact O-N 3.46Å; T423-N425 PolarHBondContact O-N 3.48Å; T423-N425 VanDerWaalsContact O-N 3.1Å
424	A	35.1	Very low	45.9	Very low	50 Å²	50	127.6 Å²	127.6	41%	0.413	61%	0.608	S	S	.	*			trans	-83.3	77	-178.9	0	0	0	0	0	111.1	R422 Q443	R422-A424 PolarHBondContact O-N 3.4Å; A424-Q443 HydrophobicContact CB-CG 4.27Å
425	N	53.2	Low	48.4	Very low	22 Å²	22	120.6 Å²	120.6	12%	0.118	58%	0.576	C	S	.	*			trans	-166.1	25.4	163.5	-90.4	-32.3	0	0	0	117.4	T423 L427 L440 D442 F444	T423-N425 PolarHBondContact O-N 3.48Å; T423-N425 VanDerWaalsContact O-N 3.1Å; N425-L427 PolarHBondContact O-N 3.47Å; N425-L440 HydrophobicContact CB-CD1 4.3Å; N425-L440 WeakPolarHBondContact ND2-CB 3.49Å; N425-D442 PolarHBondContact ND2-O 3.46Å; N425-F444 PolarHBondContact OD1-N 2.96Å; N425-F444 PolarHBondContact OD1-O 3.32Å
426	P	49.5	Very low	51	Low	81 Å²	81	116.7 Å²	116.7	53%	0.526	56%	0.557	S	S	.	*	H	α-helix	trans	-69.7	-20.5	-168.7	26.7	-34.3	0	0	0	116	R430	P426-R430 WeakPolarHBondContact O-CB 3.28Å; P426-R430 PolarHBondContact O-N 3.01Å
427	L	54.8	Low	53.4	Low	113 Å²	113	110 Å²	110	59%	0.592	55%	0.552	S	S	*	*	H	α-helix	trans	-76.1	-41.4	-171.3	-75.8	169	0	0	0	114	N425 P445	N425-L427 PolarHBondContact O-N 3.47Å; L427-P445 HydrophobicContact CD1-CG 3.89Å
428	L	62.8	Low	56	Low	19 Å²	19	105.9 Å²	105.9	10%	0.099	52%	0.517	C	S	.	.	H	α-helix	trans	-71.5	-41.7	178.9	-61.1	178.9	0	0	0	111.3	R430 R431 W432 L435 L440 F444	L428-R430 VanDerWaalsContact C-N 3.28Å; L428-R430 PolarHBondContact O-N 3.03Å; L428-R431 PolarHBondContact O-N 3.19Å; L428-W432 HydrophobicContact CB-CZ3 4.46Å; L428-W432 HydrophobicContact CD2-CE3 4.48Å; L428-W432 HydrophobicContact CD2-CH2 4.48Å; L428-W432 HydrophobicContact CD2-CZ3 3.62Å; L428-W432 PolarHBondContact O-N 3.17Å; L428-L435 HydrophobicContact CB-CD1 4.44Å; L428-L440 HydrophobicContact CD1-CD1 4.09Å; L428-F444 HydrophobicContact CD1-CB 3.36Å; L428-F444 HydrophobicContact CD1-CD1 4.21Å; L428-F444 HydrophobicContact CD1-CD2 3.6Å; L428-F444 HydrophobicContact CD1-CE2 4.42Å; L428-F444 HydrophobicContact CD1-CG 3.47Å; L428-F444 VanDerWaalsContact CD1-CG 3.47Å; L428-F444 HydrophobicContact CG-CB 3.92Å; L428-F444 HydrophobicContact CG-CG 4.49Å
429	Q	60.7	Low	58.7	Low	40 Å²	40	106.9 Å²	106.9	19%	0.187	50%	0.502	C	S	.	.	H	α-helix	trans	-70.8	-21.1	-177.5	-61.3	-169.8	-19.7	0	0	113.7	L435 H436 L438	Q429-L435 WeakPolarHBondContact CG-O 3.31Å; Q429-H436 PolarHBondContact O-ND1 3.06Å; Q429-L438 PolarHBondContact NE2-O 2.94Å
430	R	62.4	Low	61.3	Low	222 Å²	222	99.2 Å²	99.2	84%	0.838	47%	0.469	S	S	*	.	H	α-helix	trans	-76.5	-35.5	170.4	-94.8	-179.7	117.7	170.8	1.1	112.6	P426 L428	P426-R430 WeakPolarHBondContact O-CB 3.28Å; P426-R430 PolarHBondContact O-N 3.01Å; L428-R430 VanDerWaalsContact C-N 3.28Å; L428-R430 PolarHBondContact O-N 3.03Å
431	R	70	Confident	63.8	Low	172 Å²	172	90.8 Å²	90.8	65%	0.649	43%	0.43	S	S	*	.	H	α-helix	trans	-80.5	-35	-172.3	-168.6	171.4	-178.2	174.7	-1.5	112.9	L428	L428-R431 PolarHBondContact O-N 3.19Å
432	W	78.4	Confident	66.3	Low	16 Å²	16	79.9 Å²	79.9	6%	0.061	39%	0.389	C	S	.	.			trans	-127.6	117.8	-176.9	-60.9	-72.4	0	0	0	111.9	L428 H434 L435 P476 M491	L428-W432 HydrophobicContact CB-CZ3 4.46Å; L428-W432 HydrophobicContact CD2-CE3 4.48Å; L428-W432 HydrophobicContact CD2-CH2 4.48Å; L428-W432 HydrophobicContact CD2-CZ3 3.62Å; L428-W432 PolarHBondContact O-N 3.17Å; W432-H434 VanDerWaalsContact C-N 3.3Å; W432-H434 PolarHBondContact O-N 3.4Å; W432-L435 HydrophobicContact CB-CD1 4.11Å; W432-L435 HydrophobicContact CB-CG 4.08Å; W432-L435 HydrophobicContact CD2-CD1 4.43Å; W432-L435 HydrophobicContact CE3-CD1 3.82Å; W432-L435 PolarHBondContact O-N 3.27Å; W432-L435 VanDerWaalsContact O-N 3.11Å; W432-P476 HydrophobicContact CD2-CG 3.87Å; W432-P476 HydrophobicContact CE3-CG 3.87Å; W432-P476 HydrophobicContact CH2-CG 4.04Å; W432-P476 HydrophobicContact CZ2-CG 4.06Å; W432-P476 HydrophobicContact CZ3-CG 3.95Å; W432-M491 HydrophobicContact CH2-CB 4.49Å; W432-M491 HydrophobicContact CH2-CG 4.45Å
433	K	76.4	Confident	68.2	Low	199 Å²	199	73 Å²	73	87%	0.865	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-59.3	-36.4	-173.6	-67.6	-177.2	179.9	178.8	0	113	L435 H436	K433-L435 PolarHBondContact O-N 3.19Å; K433-H436 VanDerWaalsContact O-CB 3.26Å; K433-H436 WeakPolarHBondContact O-CB 3.4Å; K433-H436 PolarHBondContact O-N 3.09Å; K433-H436 VanDerWaalsContact O-N 3.16Å
434	H	84.1	Confident	69.7	Low	33 Å²	33	67.7 Å²	67.7	15%	0.153	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-69.4	-17.7	-179	67.7	-67.4	0	0	0	113.7	W432 G471 P476	W432-H434 VanDerWaalsContact C-N 3.3Å; W432-H434 PolarHBondContact O-N 3.4Å; H434-G471 PolarHBondContact NE2-N 2.57Å; H434-P476 PolarHBondContact NE2-O 2.97Å
435	L	83.2	Confident	70.7	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-88.5	-6	176	-57	-173.5	0	0	0	113.3	L428 Q429 W432 K433 L438 P476 A478 V487	L428-L435 HydrophobicContact CB-CD1 4.44Å; Q429-L435 WeakPolarHBondContact CG-O 3.31Å; W432-L435 HydrophobicContact CB-CD1 4.11Å; W432-L435 HydrophobicContact CB-CG 4.08Å; W432-L435 HydrophobicContact CD2-CD1 4.43Å; W432-L435 HydrophobicContact CE3-CD1 3.82Å; W432-L435 PolarHBondContact O-N 3.27Å; W432-L435 VanDerWaalsContact O-N 3.11Å; K433-L435 PolarHBondContact O-N 3.19Å; L435-L438 HydrophobicContact CD2-CD1 4.14Å; L435-L438 WeakPolarHBondContact O-CB 3.41Å; L435-L438 WeakPolarHBondContact O-CG 3.22Å; L435-L438 PolarHBondContact O-N 2.95Å; L435-P476 HydrophobicContact CD1-CG 4.18Å; L435-A478 HydrophobicContact CD2-CB 3.56Å; L435-V487 HydrophobicContact CD1-CG1 4.14Å; L435-V487 HydrophobicContact CD1-CG2 4.47Å; L435-V487 HydrophobicContact CD2-CG2 4.4Å
436	H	78.7	Confident	70.8	Confident	124 Å²	124	74.8 Å²	74.8	57%	0.574	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	137.4	-175.3	-153.5	81.4	0	0	0	112	Q429 K433 L438	Q429-H436 PolarHBondContact O-ND1 3.06Å; K433-H436 VanDerWaalsContact O-CB 3.26Å; K433-H436 WeakPolarHBondContact O-CB 3.4Å; K433-H436 PolarHBondContact O-N 3.09Å; K433-H436 VanDerWaalsContact O-N 3.16Å; H436-L438 PolarHBondContact O-N 3.04Å
437	G	77.3	Confident	70.8	Confident	66 Å²	66	79.3 Å²	79.3	68%	0.68	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	0.6	-179.8	0	0	0	0	0	115.5
438	L	82.7	Confident	70.7	Confident	9 Å²	9	80.9 Å²	80.9	5%	0.047	39%	0.393	C	S	.	.			trans	-77.4	127.8	-180	-61.4	-172.9	0	0	0	111.7	Q429 L435 H436 L440 A478 W485	Q429-L438 PolarHBondContact NE2-O 2.94Å; L435-L438 HydrophobicContact CD2-CD1 4.14Å; L435-L438 WeakPolarHBondContact O-CB 3.41Å; L435-L438 WeakPolarHBondContact O-CG 3.22Å; L435-L438 PolarHBondContact O-N 2.95Å; H436-L438 PolarHBondContact O-N 3.04Å; L438-L440 HydrophobicContact CB-CD2 3.9Å; L438-L440 PolarHBondContact O-N 3.33Å; L438-A478 HydrophobicContact CD1-CB 3.81Å; L438-W485 HydrophobicContact CB-CB 4.16Å; L438-W485 HydrophobicContact CB-CD2 4.49Å; L438-W485 HydrophobicContact CB-CG 3.95Å; L438-W485 HydrophobicContact CD1-CB 4.37Å; L438-W485 HydrophobicContact CD1-CD2 3.92Å; L438-W485 HydrophobicContact CD1-CE3 3.98Å; L438-W485 HydrophobicContact CD1-CG 4.11Å; L438-W485 HydrophobicContact CD2-CD2 3.89Å; L438-W485 HydrophobicContact CD2-CE3 4.49Å; L438-W485 HydrophobicContact CD2-CG 4.16Å; L438-W485 HydrophobicContact CD2-CZ2 4.02Å; L438-W485 HydrophobicContact CG-CD2 4.33Å; L438-W485 HydrophobicContact CG-CG 4.31Å
439	K	82.6	Confident	70.5	Confident	125 Å²	125	82.4 Å²	82.4	54%	0.543	41%	0.405	S	S	.	.			trans	-75.6	95.1	170.3	-169.9	177.8	-173.9	171.8	0	110.1	D411 W485	D411-K439 IonicContact OD1-NZ 3.71Å; D411-K439 PolarHBondContact OD1-NZ 2.87Å; D411-K439 VanDerWaalsContact OD1-NZ 3.14Å; D411-K439 IonicContact OD2-NZ 3.58Å; D411-K439 PolarHBondContact OD2-NZ 3.33Å; K439-W485 PolarHBondContact O-N 2.72Å
440	L	82.5	Confident	70.8	Confident	18 Å²	18	86.7 Å²	86.7	9%	0.094	42%	0.423	C	S	.	.	B	Isolated β-bridge	trans	-69.7	141.2	-176	-52.2	-174.4	0	0	0	111.3	N425 L428 L438 D442 F444 W485 V487	N425-L440 HydrophobicContact CB-CD1 4.3Å; N425-L440 WeakPolarHBondContact ND2-CB 3.49Å; L428-L440 HydrophobicContact CD1-CD1 4.09Å; L438-L440 HydrophobicContact CB-CD2 3.9Å; L438-L440 PolarHBondContact O-N 3.33Å; L440-D442 WeakPolarHBondContact CB-O 3.39Å; L440-D442 PolarHBondContact O-N 3.48Å; L440-F444 HydrophobicContact CD1-CD2 4.16Å; L440-W485 CarbonylContact C-O 3.59Å; L440-W485 VanDerWaalsContact CA-O 3.22Å; L440-W485 WeakPolarHBondContact CA-O 3.43Å; L440-W485 HydrophobicContact CD2-CB 3.93Å; L440-V487 HydrophobicContact CD1-CG2 4.12Å; L440-V487 HydrophobicContact CD2-CG2 3.67Å; L440-V487 HydrophobicContact CG-CG2 4.49Å
441	A	80	Confident	71.3	Confident	3 Å²	3	79.7 Å²	79.7	3%	0.025	40%	0.402	C	S	.	.	S	Bend	trans	-71.3	-16.6	177.6	0	0	0	0	0	112.8	A347 R348 F483 W485 I486	A347-A441 HydrophobicContact CB-CB 3.71Å; R348-A441 WeakPolarHBondContact CA-O 3.48Å; R348-A441 WeakPolarHBondContact CB-O 3.29Å; R348-A441 PolarHBondContact N-O 3.1Å; A441-F483 WeakPolarHBondContact CA-O 3.47Å; A441-F483 HydrophobicContact CB-CB 4.15Å; A441-F483 WeakPolarHBondContact CB-O 3.22Å; A441-W485 PolarHBondContact N-O 2.97Å; A441-I486 HydrophobicContact CB-CG1 3.94Å
442	D	76.8	Confident	71.7	Confident	4 Å²	4	72.3 Å²	72.3	2%	0.021	38%	0.375	C	S	.	.	S	Bend	trans	-132.8	165.4	178.5	-154.5	-8.1	0	0	0	110.8	T346 R348 N425 L440 F444 R446	T346-D442 WeakPolarHBondContact CB-OD2 3.29Å; T346-D442 PolarHBondContact OG1-OD2 3.46Å; R348-D442 WeakPolarHBondContact CD-OD1 3.44Å; R348-D442 WeakPolarHBondContact CG-OD1 3.48Å; N425-D442 PolarHBondContact ND2-O 3.46Å; L440-D442 WeakPolarHBondContact CB-O 3.39Å; L440-D442 PolarHBondContact O-N 3.48Å; D442-F444 HydrophobicContact CB-CE2 3.85Å; D442-F444 HydrophobicContact CB-CZ 4.23Å; D442-R446 IonicContact OD2-NH1 2.68Å
443	Q	67.5	Low	71.7	Confident	80 Å²	80	71.6 Å²	71.6	37%	0.374	37%	0.373	S	S	.	.			trans	-96.7	132.5	177.2	-71.8	179	-12	0	0	110.5	A424	A424-Q443 HydrophobicContact CB-CG 4.27Å
444	F	64.9	Low	71.9	Confident	26 Å²	26	64.5 Å²	64.5	11%	0.114	34%	0.344	C	S	.	.	S	Bend	trans	-134.3	139.7	178.9	-65.8	-82.5	0	0	0	110.8	L343 N425 L428 L440 D442	L343-F444 HydrophobicContact CD2-CD1 4.36Å; L343-F444 HydrophobicContact CD2-CE1 3.81Å; N425-F444 PolarHBondContact OD1-N 2.96Å; N425-F444 PolarHBondContact OD1-O 3.32Å; L428-F444 HydrophobicContact CD1-CB 3.36Å; L428-F444 HydrophobicContact CD1-CD1 4.21Å; L428-F444 HydrophobicContact CD1-CD2 3.6Å; L428-F444 HydrophobicContact CD1-CE2 4.42Å; L428-F444 HydrophobicContact CD1-CG 3.47Å; L428-F444 VanDerWaalsContact CD1-CG 3.47Å; L428-F444 HydrophobicContact CG-CB 3.92Å; L428-F444 HydrophobicContact CG-CG 4.49Å; L440-F444 HydrophobicContact CD1-CD2 4.16Å; D442-F444 HydrophobicContact CB-CE2 3.85Å; D442-F444 HydrophobicContact CB-CZ 4.23Å
445	P	56.3	Low	71.6	Confident	106 Å²	106	63.4 Å²	63.4	69%	0.688	34%	0.339	S	S	*	.	S	Bend	cis	-77.4	144.9	-1.9	30.4	-33.3	0	0	0	112.7	L427	L427-P445 HydrophobicContact CD1-CG 3.89Å
446	R	54.8	Low	71.1	Confident	115 Å²	115	63.4 Å²	63.4	43%	0.434	34%	0.339	S	S	.	.			trans	-112.3	142.3	-179.4	-153	178.9	-175.6	-162.9	-5.8	111.2	D442 S449	D442-R446 IonicContact OD2-NH1 2.68Å; R446-S449 VanDerWaalsContact CD-OG 3.23Å; R446-S449 WeakPolarHBondContact CD-OG 3.23Å; R446-S449 PolarHBondContact NE-OG 3.3Å
447	E	50.9	Low	70.7	Confident	176 Å²	176	61.9 Å²	61.9	82%	0.822	34%	0.335	S	S	*	.			trans	-67.5	147.7	162.9	-69.5	-177.2	169.1	0	0	110.3	S449	E447-S449 WeakPolarHBondContact O-CB 3.42Å; E447-S449 PolarHBondContact O-N 3.5Å; E447-S449 PolarHBondContact O-OG 2.99Å
448	C	52.3	Low	70.2	Confident	146 Å²	146	62.6 Å²	62.6	99%	0.986	32%	0.323	S	S	*	.			trans	-56.7	103.6	-177.2	-168.5	0	0	0	0	110.2
449	S	58.1	Low	69.7	Low	50 Å²	50	68.4 Å²	68.4	35%	0.35	35%	0.345	S	S	.	.			trans	-117.1	145.3	-169.5	23.4	0	0	0	0	110.9	R446 E447 I451	R446-S449 VanDerWaalsContact CD-OG 3.23Å; R446-S449 WeakPolarHBondContact CD-OG 3.23Å; R446-S449 PolarHBondContact NE-OG 3.3Å; E447-S449 WeakPolarHBondContact O-CB 3.42Å; E447-S449 PolarHBondContact O-N 3.5Å; E447-S449 PolarHBondContact O-OG 2.99Å; S449-I451 PolarHBondContact O-N 3Å
450	K	66.9	Low	69.5	Low	130 Å²	130	63.9 Å²	63.9	57%	0.565	33%	0.325	S	S	*	.			trans	-65.1	131.4	-178.1	-168.9	176.7	-179.7	177.6	0	110.2	E371	E371-K450 IonicContact OE2-NZ 3.35Å; E371-K450 PolarHBondContact OE2-NZ 3.2Å
451	I	73.2	Confident	69.3	Low	76 Å²	76	71.5 Å²	71.5	39%	0.39	35%	0.353	S	S	.	.			trans	-83.3	125.5	174.8	-61.7	171.3	0	0	0	108	V361 T369 S449 V453 L454	V361-I451 HydrophobicContact CB-CD1 4.31Å; V361-I451 HydrophobicContact CB-CG2 4.32Å; V361-I451 HydrophobicContact CG2-CD1 3.87Å; V361-I451 HydrophobicContact CG2-CG1 4.29Å; V361-I451 HydrophobicContact CG2-CG2 4.16Å; T369-I451 WeakPolarHBondContact CG2-O 3.3Å; S449-I451 PolarHBondContact O-N 3Å; I451-V453 WeakPolarHBondContact CG2-O 3.47Å; I451-L454 HydrophobicContact CG2-CD1 4.11Å
452	D	79.3	Confident	69.1	Low	17 Å²	17	76.6 Å²	76.6	9%	0.091	38%	0.38	C	S	.	.			trans	-91.9	-32.9	-176.5	-73.5	-43.9	0	0	0	112.9	T359 I368 T369 L372 R375	T359-D452 PolarHBondContact O-N 2.81Å; I368-D452 CarbonylContact C-O 3.59Å; I368-D452 WeakPolarHBondContact CA-O 3.16Å; T369-D452 WeakPolarHBondContact CG2-O 3.38Å; T369-D452 PolarHBondContact N-O 3.28Å; L372-D452 HydrophobicContact CB-CB 4.19Å; L372-D452 HydrophobicContact CD2-CB 3.53Å; L372-D452 HydrophobicContact CG-CB 4.33Å; R375-D452 IonicContact NH2-OD2 2.89Å
453	V	77.8	Confident	69.2	Low	1 Å²	1	77.2 Å²	77.2	1%	0.006	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	144.5	179.5	-172.6	0	0	0	0	110.2	M351 T359 V360 V361 F367 I368 L372 F405 F407 I451	M351-V453 HydrophobicContact SD-CG2 4.46Å; T359-V453 PolarHBondContact O-N 2.87Å; V360-V453 CarbonylContact C-O 3.29Å; V360-V453 WeakPolarHBondContact CA-O 3.24Å; V360-V453 HydrophobicContact CB-CB 3.97Å; V360-V453 HydrophobicContact CB-CG1 4.46Å; V360-V453 HydrophobicContact CG1-CB 3.55Å; V360-V453 HydrophobicContact CG1-CG1 3.59Å; V360-V453 WeakPolarHBondContact CG1-O 3.49Å; V360-V453 HydrophobicContact CG2-CB 3.71Å; V360-V453 HydrophobicContact CG2-CG1 4.26Å; V360-V453 HydrophobicContact CG2-CG2 4.17Å; V361-V453 PolarHBondContact N-O 2.84Å; F367-V453 CarbonylContact O-C 3.58Å; F367-V453 VanDerWaalsContact O-CA 3.26Å; F367-V453 WeakPolarHBondContact O-CA 3.39Å; F367-V453 VanDerWaalsContact O-CG1 3.29Å; F367-V453 WeakPolarHBondContact O-CG1 3.43Å; I368-V453 HydrophobicContact CB-CG2 4.33Å; I368-V453 HydrophobicContact CD1-CG2 4.07Å; I368-V453 HydrophobicContact CG1-CG2 3.98Å; L372-V453 HydrophobicContact CD2-CG2 3.78Å; F405-V453 HydrophobicContact CE2-CG1 4.03Å; F405-V453 HydrophobicContact CZ-CG1 3.86Å; F407-V453 HydrophobicContact CE2-CG1 4.47Å; F407-V453 HydrophobicContact CZ-CB 4.33Å; F407-V453 HydrophobicContact CZ-CG1 4.01Å; F407-V453 HydrophobicContact CZ-CG2 4.14Å; I451-V453 WeakPolarHBondContact CG2-O 3.47Å
454	L	81.3	Confident	69.9	Low	49 Å²	49	74.6 Å²	74.6	26%	0.257	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	138.8	160.2	-106.6	91.5	0	0	0	108.7	V361 I362 S366 F367 I451	V361-L454 CarbonylContact O-C 3.19Å; V361-L454 WeakPolarHBondContact O-CA 3.07Å; I362-L454 WeakPolarHBondContact O-CD2 3.2Å; S366-L454 CarbonylContact C-O 3.47Å; S366-L454 VanDerWaalsContact C-O 3.29Å; S366-L454 WeakPolarHBondContact CA-O 3.1Å; S366-L454 WeakPolarHBondContact CB-O 3.36Å; F367-L454 HydrophobicContact CB-CB 4.26Å; F367-L454 PolarHBondContact N-O 2.62Å; F367-L454 PolarHBondContact O-N 2.86Å; I451-L454 HydrophobicContact CG2-CD1 4.11Å
455	I	76.3	Confident	70.6	Confident	11 Å²	11	75.6 Å²	75.6	6%	0.056	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128.8	176.1	-76.5	160.9	0	0	0	108.6	V360 V361 I362 S363 S366 F407 F463	V360-I455 HydrophobicContact CB-CD1 4.18Å; V360-I455 HydrophobicContact CG1-CB 4.22Å; V360-I455 HydrophobicContact CG1-CD1 3.34Å; V360-I455 HydrophobicContact CG1-CG1 3.39Å; V361-I455 PolarHBondContact O-N 3.05Å; I362-I455 CarbonylContact C-O 3.56Å; I362-I455 WeakPolarHBondContact CA-O 3.1Å; I362-I455 WeakPolarHBondContact CG2-O 3.45Å; S363-I455 PolarHBondContact N-O 3.33Å; S366-I455 WeakPolarHBondContact OG-CA 3.21Å; F407-I455 HydrophobicContact CD2-CD1 4.39Å; F407-I455 HydrophobicContact CE2-CD1 4.14Å; F407-I455 HydrophobicContact CE2-CG1 4.38Å; I455-F463 HydrophobicContact CB-CE1 4.48Å; I455-F463 HydrophobicContact CD1-CE1 4.06Å; I455-F463 HydrophobicContact CD1-CZ 4.41Å; I455-F463 HydrophobicContact CG2-CE1 3.75Å
456	G	74.3	Confident	71.7	Confident	0 Å²	0	79.9 Å²	79.9	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	167.5	178.1	0	0	0	0	0	113.9	S363 S366 D458 Y459 Y460	S363-G456 CarbonylContact O-C 3.52Å; S363-G456 WeakPolarHBondContact O-CA 3.47Å; S366-G456 PolarHBondContact OG-N 3.01Å; G456-D458 WeakPolarHBondContact CA-OD1 3.48Å; G456-D458 PolarHBondContact O-N 3.3Å; G456-Y459 PolarHBondContact O-N 2.83Å; G456-Y459 VanDerWaalsContact O-N 3.15Å; G456-Y460 PolarHBondContact O-N 3.05Å; G456-Y460 VanDerWaalsContact O-N 3.12Å
457	L	68.9	Low	73.1	Confident	92 Å²	92	78.9 Å²	78.9	48%	0.482	39%	0.394	S	S	.	.	H	α-helix	trans	-60.3	-22.1	166.8	-78.3	168.4	0	0	0	112.2	S363 Q364 Y459 Y460	S363-L457 PolarHBondContact O-N 2.79Å; Q364-L457 PolarHBondContact O-N 2.98Å; L457-Y459 PolarHBondContact O-N 3.12Å; L457-Y460 HydrophobicContact CD2-CD1 4.41Å; L457-Y460 HydrophobicContact CD2-CG 4.33Å; L457-Y460 PolarHBondContact O-N 2.96Å
458	D	67.5	Low	74.9	Confident	80 Å²	80	73.2 Å²	73.2	43%	0.428	37%	0.371	S	S	.	.	H	α-helix	trans	-60.3	-24.7	173.5	54.9	-12.3	0	0	0	113.8	G456	G456-D458 WeakPolarHBondContact CA-OD1 3.48Å; G456-D458 PolarHBondContact O-N 3.3Å
459	Y	72.1	Confident	76.5	Confident	131 Å²	131	71.8 Å²	71.8	51%	0.514	34%	0.344	S	S	.	.	H	α-helix	trans	-122.8	3.2	175.2	-62.2	-81.8	0	0	0	113.3	G456 L457 Y461 D462 F463	G456-Y459 PolarHBondContact O-N 2.83Å; G456-Y459 VanDerWaalsContact O-N 3.15Å; L457-Y459 PolarHBondContact O-N 3.12Å; Y459-Y461 PolarHBondContact O-N 2.57Å; Y459-D462 WeakPolarHBondContact CD1-OD2 3.07Å; Y459-D462 WeakPolarHBondContact O-CB 3.31Å; Y459-D462 PolarHBondContact O-N 3.33Å; Y459-F463 VanDerWaalsContact O-CD1 3.27Å; Y459-F463 WeakPolarHBondContact O-CD1 3.39Å
460	Y	77.8	Confident	77.6	Confident	31 Å²	31	75.6 Å²	75.6	12%	0.122	36%	0.357	C	S	.	.	H	α-helix	trans	-60.9	-44.1	-173	-178.4	-104.2	0	0	0	112.6	Q345 I362 G456 L457 D462 F463 V464	Q345-Y460 PolarHBondContact NE2-OH 2.95Å; Q345-Y460 VanDerWaalsContact OE1-CE2 3.24Å; Q345-Y460 PolarHBondContact OE1-OH 3.43Å; I362-Y460 HydrophobicContact CD1-CD2 3.88Å; I362-Y460 HydrophobicContact CD1-CE2 3.4Å; I362-Y460 HydrophobicContact CG1-CD2 4Å; I362-Y460 HydrophobicContact CG1-CE2 4.04Å; I362-Y460 HydrophobicContact CG2-CD2 4.1Å; G456-Y460 PolarHBondContact O-N 3.05Å; G456-Y460 VanDerWaalsContact O-N 3.12Å; L457-Y460 HydrophobicContact CD2-CD1 4.41Å; L457-Y460 HydrophobicContact CD2-CG 4.33Å; L457-Y460 PolarHBondContact O-N 2.96Å; Y460-D462 PolarHBondContact O-N 3.47Å; Y460-F463 HydrophobicContact CD2-CE1 4.31Å; Y460-F463 HydrophobicContact CD2-CZ 4.04Å; Y460-F463 HydrophobicContact CE2-CZ 4.38Å; Y460-V464 HydrophobicContact CD2-CG2 4.15Å; Y460-V464 HydrophobicContact CE1-CB 4.5Å; Y460-V464 HydrophobicContact CE1-CG2 4.2Å; Y460-V464 HydrophobicContact CE2-CG2 3.75Å; Y460-V464 WeakPolarHBondContact O-CB 3.42Å; Y460-V464 VanDerWaalsContact O-CG2 3.3Å; Y460-V464 WeakPolarHBondContact O-CG2 3.38Å; Y460-V464 PolarHBondContact O-N 2.92Å
461	Y	78.5	Confident	78.2	Confident	177 Å²	177	70.7 Å²	70.7	69%	0.694	34%	0.343	S	S	*	.	H	α-helix	trans	-78.1	-6.8	-178.9	-61.3	-72.4	0	0	0	113.8	Y459	Y459-Y461 PolarHBondContact O-N 2.57Å
462	D	76.5	Confident	78.3	Confident	110 Å²	110	74.3 Å²	74.3	59%	0.588	36%	0.357	S	S	*	.	H	α-helix	trans	-78.8	-26.3	179.7	-65.1	-14.8	0	0	0	112.3	Y459 Y460 L482	Y459-D462 WeakPolarHBondContact CD1-OD2 3.07Å; Y459-D462 WeakPolarHBondContact O-CB 3.31Å; Y459-D462 PolarHBondContact O-N 3.33Å; Y460-D462 PolarHBondContact O-N 3.47Å; D462-L482 WeakPolarHBondContact O-CD1 3.49Å
463	F	79	Confident	77.8	Confident	18 Å²	18	78.6 Å²	78.6	8%	0.079	40%	0.396	C	S	.	.	H	α-helix	trans	-116.5	-16.2	-178.4	73.8	-89.4	0	0	0	114.4	I455 Y459 Y460 T481 L482 F483 I486	I455-F463 HydrophobicContact CB-CE1 4.48Å; I455-F463 HydrophobicContact CD1-CE1 4.06Å; I455-F463 HydrophobicContact CD1-CZ 4.41Å; I455-F463 HydrophobicContact CG2-CE1 3.75Å; Y459-F463 VanDerWaalsContact O-CD1 3.27Å; Y459-F463 WeakPolarHBondContact O-CD1 3.39Å; Y460-F463 HydrophobicContact CD2-CE1 4.31Å; Y460-F463 HydrophobicContact CD2-CZ 4.04Å; Y460-F463 HydrophobicContact CE2-CZ 4.38Å; F463-T481 HydrophobicContact CD2-CG2 4.14Å; F463-T481 HydrophobicContact CE2-CG2 4.25Å; F463-T481 CarbonylContact O-C 3.58Å; F463-T481 WeakPolarHBondContact O-CA 3.49Å; F463-T481 VanDerWaalsContact O-CB 3.23Å; F463-T481 WeakPolarHBondContact O-CB 3.12Å; F463-L482 HydrophobicContact CB-CB 4.26Å; F463-L482 HydrophobicContact CB-CD1 3.99Å; F463-L482 HydrophobicContact CB-CG 4.23Å; F463-L482 PolarHBondContact O-N 3.21Å; F463-F483 HydrophobicContact CB-CE2 3.85Å; F463-F483 HydrophobicContact CB-CZ 4.19Å; F463-F483 HydrophobicContact CD1-CE2 4.4Å; F463-F483 AromaticContact CD2-CD2 3.77Å; F463-F483 HydrophobicContact CD2-CD2 3.77Å; F463-F483 AromaticContact CD2-CE2 3.46Å; F463-F483 HydrophobicContact CD2-CE2 3.46Å; F463-F483 VanDerWaalsContact CD2-CE2 3.46Å; F463-F483 HydrophobicContact CE2-CD2 4.33Å; F463-F483 HydrophobicContact CE2-CE2 4.11Å; F463-F483 HydrophobicContact CG-CD2 4.36Å; F463-F483 AromaticContact CG-CE2 3.65Å; F463-F483 HydrophobicContact CG-CE2 3.65Å; F463-F483 HydrophobicContact CG-CZ 4.37Å; F463-I486 HydrophobicContact CE2-CD1 4.28Å
464	V	82.5	Confident	77.4	Confident	25 Å²	25	80.6 Å²	80.6	15%	0.152	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	125.8	177.3	179.8	0	0	0	0	109.5	Y460 T481	Y460-V464 HydrophobicContact CD2-CG2 4.15Å; Y460-V464 HydrophobicContact CE1-CB 4.5Å; Y460-V464 HydrophobicContact CE1-CG2 4.2Å; Y460-V464 HydrophobicContact CE2-CG2 3.75Å; Y460-V464 WeakPolarHBondContact O-CB 3.42Å; Y460-V464 VanDerWaalsContact O-CG2 3.3Å; Y460-V464 WeakPolarHBondContact O-CG2 3.38Å; Y460-V464 PolarHBondContact O-N 2.92Å; V464-T481 HydrophobicContact CB-CG2 4.5Å; V464-T481 HydrophobicContact CG2-CG2 4.02Å
465	S	79	Confident	77.3	Confident	47 Å²	47	81 Å²	81	33%	0.329	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	172.2	176.3	89.2	0	0	0	0	111.7	E467 R480	S465-E467 PolarHBondContact O-N 3.26Å; S465-E467 PolarHBondContact OG-N 3.23Å; S465-R480 PolarHBondContact N-O 3.26Å; S465-R480 WeakPolarHBondContact OG-CB 3.23Å; S465-R480 PolarHBondContact OG-O 3.42Å
466	Q	78.2	Confident	77.6	Confident	196 Å²	196	80.5 Å²	80.5	92%	0.916	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.8	-4.8	176.4	-61.7	-170.6	10.3	0	0	113.6	V468	Q466-V468 PolarHBondContact O-N 3.41Å
467	E	84.8	Confident	78.1	Confident	94 Å²	94	82.2 Å²	82.2	44%	0.439	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	115.3	-178.4	-73.9	178.8	-145.4	0	0	111.6	S465 R480 W485	S465-E467 PolarHBondContact O-N 3.26Å; S465-E467 PolarHBondContact OG-N 3.23Å; E467-R480 HydrophobicContact CB-CB 3.86Å; E467-R480 PolarHBondContact O-N 3.02Å; E467-R480 IonicContact OE1-CZ 3.44Å; E467-R480 IonicContact OE1-NH1 2.74Å; E467-R480 PolarHBondContact OE1-NH1 3.39Å; E467-R480 WeakPolarHBondContact OE2-CD 3.25Å; E467-R480 IonicContact OE2-CZ 3.7Å; E467-R480 IonicContact OE2-NE 3.96Å; E467-R480 IonicContact OE2-NH1 3.72Å; E467-R480 PolarHBondContact OE2-NH1 2.84Å; E467-W485 HydrophobicContact CB-CH2 4.33Å
468	V	89.3	Confident	79	Confident	56 Å²	56	77.8 Å²	77.8	34%	0.339	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	131.4	179.3	-169.6	0	0	0	0	109.9	Q466 H470 V477 A478 L479	Q466-V468 PolarHBondContact O-N 3.41Å; V468-H470 WeakPolarHBondContact CG1-CE1 3.36Å; V468-V477 HydrophobicContact CG1-CG1 3.4Å; V468-A478 WeakPolarHBondContact CA-O 3.36Å; V468-L479 HydrophobicContact CB-CD2 4.15Å; V468-L479 HydrophobicContact CG1-CD2 3.7Å; V468-L479 HydrophobicContact CG2-CD2 3.57Å
469	R	84.6	Confident	80	Confident	116 Å²	116	75 Å²	75	44%	0.438	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	114.1	172	-70.6	-173.5	177.7	-162.6	0.8	110	A478 W485	R469-A478 HydrophobicContact CB-CB 4.35Å; R469-A478 PolarHBondContact N-O 3.4Å; R469-A478 PolarHBondContact O-N 3.03Å; R469-W485 HydrophobicContact CB-CZ3 4.29Å; R469-W485 HydrophobicContact CG-CH2 3.91Å; R469-W485 HydrophobicContact CG-CZ3 3.88Å
470	H	82	Confident	80.8	Confident	131 Å²	131	74 Å²	74	61%	0.606	38%	0.382	S	S	*	.			trans	-92.5	142.1	178	-62.6	87.7	0	0	0	110.6	V468	V468-H470 WeakPolarHBondContact CG1-CE1 3.36Å
471	G	78.8	Confident	81.2	Confident	26 Å²	26	73.1 Å²	73.1	27%	0.268	38%	0.379	S	S	.	.			trans	-90.7	-169.7	161.7	0	0	0	0	0	111.1	H434 E475	H434-G471 PolarHBondContact NE2-N 2.57Å; G471-E475 WeakPolarHBondContact CA-OE2 3.42Å
472	H	75.3	Confident	81.3	Confident	152 Å²	152	70.4 Å²	70.4	70%	0.704	38%	0.376	S	S	*	.	S	Bend	trans	-68.9	169.3	170.4	-59.2	85.4	0	0	0	111.5	G474 E475	H472-G474 PolarHBondContact O-N 2.88Å; H472-E475 HydrophobicContact CB-CG 4.22Å; H472-E475 IonicContact CG-OE2 3.67Å; H472-E475 PolarHBondContact N-OE2 3.42Å; H472-E475 IonicContact ND1-OE2 3.57Å; H472-E475 PolarHBondContact ND1-OE2 2.99Å; H472-E475 VanDerWaalsContact O-CB 3.26Å; H472-E475 WeakPolarHBondContact O-CB 3.24Å; H472-E475 PolarHBondContact O-N 3.35Å
473	A	70	Confident	81.6	Confident	108 Å²	108	66.4 Å²	66.4	89%	0.893	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	125.4	177.7	0	0	0	0	0	111.6
474	G	69.1	Low	81.8	Confident	43 Å²	43	66.3 Å²	66.3	44%	0.443	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.9	-7	-176.9	0	0	0	0	0	115.1	H472 T490	H472-G474 PolarHBondContact O-N 2.88Å; G474-T490 VanDerWaalsContact O-O 3.1Å; G474-T490 PolarHBondContact O-OG1 3.26Å; G474-T490 VanDerWaalsContact O-OG1 3.11Å
475	E	79.9	Confident	82.1	Confident	58 Å²	58	66.5 Å²	66.5	27%	0.271	36%	0.356	S	S	.	.	S	Bend	trans	-89.6	156.7	174.6	-58.7	-171	148.1	0	0	112	G471 H472 T490	G471-E475 WeakPolarHBondContact CA-OE2 3.42Å; H472-E475 HydrophobicContact CB-CG 4.22Å; H472-E475 IonicContact CG-OE2 3.67Å; H472-E475 PolarHBondContact N-OE2 3.42Å; H472-E475 IonicContact ND1-OE2 3.57Å; H472-E475 PolarHBondContact ND1-OE2 2.99Å; H472-E475 VanDerWaalsContact O-CB 3.26Å; H472-E475 WeakPolarHBondContact O-CB 3.24Å; H472-E475 PolarHBondContact O-N 3.35Å; E475-T490 CarbonylContact C-O 3.59Å
476	P	82.3	Confident	82.5	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.342	C	S	.	.			trans	-70.3	154	177.8	28.2	-35.4	0	0	0	112.8	W432 H434 L435 V487 C488	W432-P476 HydrophobicContact CD2-CG 3.87Å; W432-P476 HydrophobicContact CE3-CG 3.87Å; W432-P476 HydrophobicContact CH2-CG 4.04Å; W432-P476 HydrophobicContact CZ2-CG 4.06Å; W432-P476 HydrophobicContact CZ3-CG 3.95Å; H434-P476 PolarHBondContact NE2-O 2.97Å; L435-P476 HydrophobicContact CD1-CG 4.18Å; P476-V487 HydrophobicContact CB-CG1 3.73Å; P476-V487 HydrophobicContact CG-CG1 4.28Å; P476-C488 CarbonylContact C-O 3.56Å; P476-C488 WeakPolarHBondContact CA-O 3.47Å
477	V	84.6	Confident	82.7	Confident	35 Å²	35	55.2 Å²	55.2	21%	0.212	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	139.8	177.1	-179.6	0	0	0	0	109.4	V468 V487 C488	V468-V477 HydrophobicContact CG1-CG1 3.4Å; V477-V487 WeakPolarHBondContact O-CA 3.41Å; V477-C488 PolarHBondContact N-O 3.38Å; V477-C488 PolarHBondContact O-N 3.34Å
478	A	87.8	Confident	82.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	129.2	173.8	0	0	0	0	0	111.5	L435 L438 V468 R469 W485 I486	L435-A478 HydrophobicContact CD2-CB 3.56Å; L438-A478 HydrophobicContact CD1-CB 3.81Å; V468-A478 WeakPolarHBondContact CA-O 3.36Å; R469-A478 HydrophobicContact CB-CB 4.35Å; R469-A478 PolarHBondContact N-O 3.4Å; R469-A478 PolarHBondContact O-N 3.03Å; A478-W485 HydrophobicContact CB-CE3 3.83Å; A478-W485 HydrophobicContact CB-CZ3 4.35Å; A478-I486 CarbonylContact C-O 3.55Å; A478-I486 VanDerWaalsContact CA-O 3.31Å; A478-I486 WeakPolarHBondContact CA-O 3.3Å
479	L	87.9	Confident	81.8	Confident	20 Å²	20	49.9 Å²	49.9	11%	0.105	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.9	179.5	-65.9	165.1	0	0	0	109.2	Q345 V468 W485 I486	Q345-L479 HydrophobicContact CG-CD1 4.15Å; V468-L479 HydrophobicContact CB-CD2 4.15Å; V468-L479 HydrophobicContact CG1-CD2 3.7Å; V468-L479 HydrophobicContact CG2-CD2 3.57Å; L479-W485 CarbonylContact O-C 3.52Å; L479-W485 WeakPolarHBondContact O-CA 3.39Å; L479-I486 PolarHBondContact N-O 3.09Å; L479-I486 PolarHBondContact O-N 3.04Å
480	R	88.6	Confident	81.1	Confident	112 Å²	112	47.4 Å²	47.4	42%	0.423	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	132.8	174.4	-175.1	172.2	-179.1	179.5	-3.6	109.9	S465 E467 W485	S465-R480 PolarHBondContact N-O 3.26Å; S465-R480 WeakPolarHBondContact OG-CB 3.23Å; S465-R480 PolarHBondContact OG-O 3.42Å; E467-R480 HydrophobicContact CB-CB 3.86Å; E467-R480 PolarHBondContact O-N 3.02Å; E467-R480 IonicContact OE1-CZ 3.44Å; E467-R480 IonicContact OE1-NH1 2.74Å; E467-R480 PolarHBondContact OE1-NH1 3.39Å; E467-R480 WeakPolarHBondContact OE2-CD 3.25Å; E467-R480 IonicContact OE2-CZ 3.7Å; E467-R480 IonicContact OE2-NE 3.96Å; E467-R480 IonicContact OE2-NH1 3.72Å; E467-R480 PolarHBondContact OE2-NH1 2.84Å; R480-W485 HydrophobicContact CB-CD2 4.09Å; R480-W485 HydrophobicContact CB-CE3 3.99Å; R480-W485 HydrophobicContact CB-CH2 3.78Å; R480-W485 HydrophobicContact CB-CZ2 3.87Å; R480-W485 HydrophobicContact CB-CZ3 3.84Å; R480-W485 HydrophobicContact CG-CZ2 4.12Å
481	T	86.9	Confident	80.1	Confident	11 Å²	11	43.2 Å²	43.2	7%	0.067	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	168.6	177.4	75.1	0	0	0	0	111.3	F463 V464 F483 G484 I486	F463-T481 HydrophobicContact CD2-CG2 4.14Å; F463-T481 HydrophobicContact CE2-CG2 4.25Å; F463-T481 CarbonylContact O-C 3.58Å; F463-T481 WeakPolarHBondContact O-CA 3.49Å; F463-T481 VanDerWaalsContact O-CB 3.23Å; F463-T481 WeakPolarHBondContact O-CB 3.12Å; V464-T481 HydrophobicContact CB-CG2 4.5Å; V464-T481 HydrophobicContact CG2-CG2 4.02Å; T481-F483 PolarHBondContact O-N 2.93Å; T481-F483 VanDerWaalsContact O-N 3.14Å; T481-F483 PolarHBondContact OG1-N 3.32Å; T481-G484 WeakPolarHBondContact CB-O 3.39Å; T481-G484 PolarHBondContact N-O 3.31Å; T481-G484 PolarHBondContact O-N 3.03Å; T481-G484 VanDerWaalsContact O-N 3.08Å; T481-G484 PolarHBondContact OG1-N 3.4Å; T481-G484 PolarHBondContact OG1-O 3.1Å; T481-I486 HydrophobicContact CG2-CB 4.45Å; T481-I486 HydrophobicContact CG2-CD1 3.51Å; T481-I486 HydrophobicContact CG2-CG1 3.79Å
482	L	79.6	Confident	78.7	Confident	121 Å²	121	44 Å²	44	63%	0.634	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-23	171.1	-67.2	178.4	0	0	0	112.9	A409 D462 F463	A409-L482 WeakPolarHBondContact CB-O 3.43Å; D462-L482 WeakPolarHBondContact O-CD1 3.49Å; F463-L482 HydrophobicContact CB-CB 4.26Å; F463-L482 HydrophobicContact CB-CD1 3.99Å; F463-L482 HydrophobicContact CB-CG 4.23Å; F463-L482 PolarHBondContact O-N 3.21Å
483	F	83.3	Confident	77.3	Confident	25 Å²	25	46.4 Å²	46.4	11%	0.11	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-2.7	-179.9	-48.2	-56.6	0	0	0	113.7	A347 A349 F407 A441 F463 T481	A347-F483 HydrophobicContact CB-CB 4.15Å; A347-F483 HydrophobicContact CB-CD2 4.11Å; A347-F483 HydrophobicContact CB-CG 4.48Å; A349-F483 HydrophobicContact CB-CD1 3.61Å; A349-F483 HydrophobicContact CB-CE1 3.7Å; A349-F483 HydrophobicContact CB-CG 4.13Å; A349-F483 HydrophobicContact CB-CZ 4.26Å; F407-F483 HydrophobicContact CB-CE1 3.59Å; F407-F483 HydrophobicContact CB-CZ 3.7Å; F407-F483 HydrophobicContact CG-CZ 4.41Å; A441-F483 WeakPolarHBondContact CA-O 3.47Å; A441-F483 HydrophobicContact CB-CB 4.15Å; A441-F483 WeakPolarHBondContact CB-O 3.22Å; F463-F483 HydrophobicContact CB-CE2 3.85Å; F463-F483 HydrophobicContact CB-CZ 4.19Å; F463-F483 HydrophobicContact CD1-CE2 4.4Å; F463-F483 AromaticContact CD2-CD2 3.77Å; F463-F483 HydrophobicContact CD2-CD2 3.77Å; F463-F483 AromaticContact CD2-CE2 3.46Å; F463-F483 HydrophobicContact CD2-CE2 3.46Å; F463-F483 VanDerWaalsContact CD2-CE2 3.46Å; F463-F483 HydrophobicContact CE2-CD2 4.33Å; F463-F483 HydrophobicContact CE2-CE2 4.11Å; F463-F483 HydrophobicContact CG-CD2 4.36Å; F463-F483 AromaticContact CG-CE2 3.65Å; F463-F483 HydrophobicContact CG-CE2 3.65Å; F463-F483 HydrophobicContact CG-CZ 4.37Å; T481-F483 PolarHBondContact O-N 2.93Å; T481-F483 VanDerWaalsContact O-N 3.14Å; T481-F483 PolarHBondContact OG1-N 3.32Å
484	G	83	Confident	75.9	Confident	17 Å²	17	43.2 Å²	43.2	18%	0.175	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	114.3	-167.7	-170.1	0	0	0	0	0	112.3	T481	T481-G484 WeakPolarHBondContact CB-O 3.39Å; T481-G484 PolarHBondContact N-O 3.31Å; T481-G484 PolarHBondContact O-N 3.03Å; T481-G484 VanDerWaalsContact O-N 3.08Å; T481-G484 PolarHBondContact OG1-N 3.4Å; T481-G484 PolarHBondContact OG1-O 3.1Å
485	W	88.2	Confident	74.4	Confident	28 Å²	28	49.3 Å²	49.3	11%	0.106	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	120	-178.7	-71.4	86.2	0	0	0	111.7	L438 K439 L440 A441 E467 R469 A478 L479 R480	L438-W485 HydrophobicContact CB-CB 4.16Å; L438-W485 HydrophobicContact CB-CD2 4.49Å; L438-W485 HydrophobicContact CB-CG 3.95Å; L438-W485 HydrophobicContact CD1-CB 4.37Å; L438-W485 HydrophobicContact CD1-CD2 3.92Å; L438-W485 HydrophobicContact CD1-CE3 3.98Å; L438-W485 HydrophobicContact CD1-CG 4.11Å; L438-W485 HydrophobicContact CD2-CD2 3.89Å; L438-W485 HydrophobicContact CD2-CE3 4.49Å; L438-W485 HydrophobicContact CD2-CG 4.16Å; L438-W485 HydrophobicContact CD2-CZ2 4.02Å; L438-W485 HydrophobicContact CG-CD2 4.33Å; L438-W485 HydrophobicContact CG-CG 4.31Å; K439-W485 PolarHBondContact O-N 2.72Å; L440-W485 CarbonylContact C-O 3.59Å; L440-W485 VanDerWaalsContact CA-O 3.22Å; L440-W485 WeakPolarHBondContact CA-O 3.43Å; L440-W485 HydrophobicContact CD2-CB 3.93Å; A441-W485 PolarHBondContact N-O 2.97Å; E467-W485 HydrophobicContact CB-CH2 4.33Å; R469-W485 HydrophobicContact CB-CZ3 4.29Å; R469-W485 HydrophobicContact CG-CH2 3.91Å; R469-W485 HydrophobicContact CG-CZ3 3.88Å; A478-W485 HydrophobicContact CB-CE3 3.83Å; A478-W485 HydrophobicContact CB-CZ3 4.35Å; L479-W485 CarbonylContact O-C 3.52Å; L479-W485 WeakPolarHBondContact O-CA 3.39Å; R480-W485 HydrophobicContact CB-CD2 4.09Å; R480-W485 HydrophobicContact CB-CE3 3.99Å; R480-W485 HydrophobicContact CB-CH2 3.78Å; R480-W485 HydrophobicContact CB-CZ2 3.87Å; R480-W485 HydrophobicContact CB-CZ3 3.84Å; R480-W485 HydrophobicContact CG-CZ2 4.12Å
486	I	87.4	Confident	72.6	Confident	5 Å²	5	54 Å²	54	3%	0.026	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	127.2	174.2	-62.9	-177.7	0	0	0	108.8	Q345 A347 A441 F463 A478 L479 T481	Q345-I486 VanDerWaalsContact CA-CG2 3.46Å; Q345-I486 HydrophobicContact CB-CG2 3.71Å; Q345-I486 HydrophobicContact CG-CG2 3.97Å; A347-I486 HydrophobicContact CB-CD1 3.73Å; A347-I486 HydrophobicContact CB-CG1 3.99Å; A441-I486 HydrophobicContact CB-CG1 3.94Å; F463-I486 HydrophobicContact CE2-CD1 4.28Å; A478-I486 CarbonylContact C-O 3.55Å; A478-I486 VanDerWaalsContact CA-O 3.31Å; A478-I486 WeakPolarHBondContact CA-O 3.3Å; L479-I486 PolarHBondContact N-O 3.09Å; L479-I486 PolarHBondContact O-N 3.04Å; T481-I486 HydrophobicContact CG2-CB 4.45Å; T481-I486 HydrophobicContact CG2-CD1 3.51Å; T481-I486 HydrophobicContact CG2-CG1 3.79Å
487	V	82.6	Confident	70.9	Confident	1 Å²	1	58 Å²	58	1%	0.006	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	126.3	175.4	-174.3	0	0	0	0	109	L343 L435 L440 P476 V477	L343-V487 HydrophobicContact CD1-CB 4.48Å; L343-V487 HydrophobicContact CD1-CG1 3.8Å; L435-V487 HydrophobicContact CD1-CG1 4.14Å; L435-V487 HydrophobicContact CD1-CG2 4.47Å; L435-V487 HydrophobicContact CD2-CG2 4.4Å; L440-V487 HydrophobicContact CD1-CG2 4.12Å; L440-V487 HydrophobicContact CD2-CG2 3.67Å; L440-V487 HydrophobicContact CG-CG2 4.49Å; P476-V487 HydrophobicContact CB-CG1 3.73Å; P476-V487 HydrophobicContact CG-CG1 4.28Å; V477-V487 WeakPolarHBondContact O-CA 3.41Å
488	C	82.4	Confident	69.3	Low	14 Å²	14	58.8 Å²	58.8	10%	0.095	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	166.5	-179	65.4	0	0	0	0	112.1	L343 Q345 P476 V477	L343-C488 CarbonylContact O-C 3.51Å; L343-C488 VanDerWaalsContact O-CA 3.26Å; L343-C488 WeakPolarHBondContact O-CA 3.28Å; L343-C488 WeakPolarHBondContact O-CB 3.28Å; Q345-C488 HydrophobicContact CB-CB 4.46Å; Q345-C488 HydrophobicContact CG-CB 3.46Å; Q345-C488 VanDerWaalsContact CG-CB 3.46Å; P476-C488 CarbonylContact C-O 3.56Å; P476-C488 WeakPolarHBondContact CA-O 3.47Å; V477-C488 PolarHBondContact N-O 3.38Å; V477-C488 PolarHBondContact O-N 3.34Å
489	G	74.1	Confident	67.8	Low	24 Å²	24	63.1 Å²	63.1	25%	0.247	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	102.8	-174.7	-179.4	0	0	0	0	0	113.9	V342 L343	V342-G489 WeakPolarHBondContact CA-O 3.09Å; L343-G489 PolarHBondContact N-O 2.95Å; L343-G489 PolarHBondContact O-N 3.23Å
490	T	68.8	Low	66.1	Low	64 Å²	64	65.8 Å²	65.8	39%	0.393	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	139.1	-174.2	57.3	0	0	0	0	111.2	V342 G474 E475	V342-T490 HydrophobicContact CG2-CG2 4.12Å; G474-T490 VanDerWaalsContact O-O 3.1Å; G474-T490 PolarHBondContact O-OG1 3.26Å; G474-T490 VanDerWaalsContact O-OG1 3.11Å; E475-T490 CarbonylContact C-O 3.59Å
491	M	62	Low	64.4	Low	44 Å²	44	64.7 Å²	64.7	22%	0.217	36%	0.359	C	S	.	.			trans	-92	7.7	178	-70.9	-160	-76.1	0	0	115.3	R341 L343 W432	R341-M491 HydrophobicContact CB-CE 3.55Å; R341-M491 HydrophobicContact CG-CE 4.37Å; R341-M491 PolarHBondContact O-N 3.31Å; L343-M491 HydrophobicContact CD1-CG 3.73Å; L343-M491 HydrophobicContact CD1-SD 3.64Å; L343-M491 HydrophobicContact CD2-CE 3.87Å; L343-M491 HydrophobicContact CD2-CG 4.5Å; L343-M491 HydrophobicContact CD2-SD 3.83Å; L343-M491 HydrophobicContact CG-CE 4.05Å; L343-M491 HydrophobicContact CG-CG 3.7Å; L343-M491 HydrophobicContact CG-SD 3.64Å; W432-M491 HydrophobicContact CH2-CB 4.49Å; W432-M491 HydrophobicContact CH2-CG 4.45Å
492	G	50	Low	62.9	Low	42 Å²	42	64.9 Å²	64.9	43%	0.433	36%	0.36	S	S	.	.	S	Bend	trans	67.4	153.3	-171.7	0	0	0	0	0	113.3	G494	G492-G494 PolarHBondContact O-N 3.21Å
493	E	45.5	Very low	62	Low	203 Å²	203	67.3 Å²	67.3	95%	0.949	36%	0.361	S	S	*	.			trans	12.7	80.7	-179.5	-63.3	-170.4	167.5	0	0	117.4	N495	E493-N495 PolarHBondContact O-N 3.03Å
494	G	39.5	Very low	60.6	Low	40 Å²	40	70.9 Å²	70.9	41%	0.412	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-75.9	119.3	164.6	0	0	0	0	0	110.3	G492 K496	G492-G494 PolarHBondContact O-N 3.21Å; G494-K496 PolarHBondContact O-N 3.32Å
495	N	38.9	Very low	59.3	Low	171 Å²	171	72.5 Å²	72.5	91%	0.914	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-47	124.4	165.1	-97	-20.5	0	0	0	109.5	E493 D497	E493-N495 PolarHBondContact O-N 3.03Å; N495-D497 PolarHBondContact O-N 3.25Å
496	K	40.4	Very low	57.9	Low	158 Å²	158	74 Å²	74	69%	0.687	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-50.7	132	-176.8	-68.5	172.4	-177	170.6	0	110.3	G494 P498 I501	G494-K496 PolarHBondContact O-N 3.32Å; K496-P498 WeakPolarHBondContact O-CD 3.28Å; K496-I501 HydrophobicContact CB-CD1 3.8Å; K496-I501 HydrophobicContact CB-CG1 3.85Å
497	D	48	Very low	56.3	Low	82 Å²	82	76.1 Å²	76.1	44%	0.439	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-54	121.8	176.6	175.9	3.4	0	0	0	109.8	N495 N499 E500 I501	N495-D497 PolarHBondContact O-N 3.25Å; D497-N499 PolarHBondContact O-N 3.03Å; D497-N499 VanDerWaalsContact O-N 3.11Å; D497-N499 WeakPolarHBondContact OD1-CB 3.5Å; D497-N499 PolarHBondContact OD1-N 3.42Å; D497-E500 HydrophobicContact CB-CB 4.16Å; D497-E500 PolarHBondContact O-N 3.41Å; D497-I501 PolarHBondContact O-N 3.47Å
498	P	50.5	Low	54.5	Low	52 Å²	52	80.4 Å²	80.4	34%	0.338	42%	0.42	S	S	.	.	H	α-helix	trans	-51.5	-34.3	177.2	-26.8	33.9	0	0	0	113.3	K496 I501 L502	K496-P498 WeakPolarHBondContact O-CD 3.28Å; P498-I501 PolarHBondContact O-N 2.78Å; P498-L502 WeakPolarHBondContact O-CB 3.39Å; P498-L502 PolarHBondContact O-N 2.9Å
499	N	55.8	Low	52.9	Low	91 Å²	91	82.3 Å²	82.3	49%	0.487	43%	0.428	S	S	.	.	H	α-helix	trans	-70.2	-31.8	178.2	-70.2	-29.6	0	0	0	112.5	D497 R503	D497-N499 PolarHBondContact O-N 3.03Å; D497-N499 VanDerWaalsContact O-N 3.11Å; D497-N499 WeakPolarHBondContact OD1-CB 3.5Å; D497-N499 PolarHBondContact OD1-N 3.42Å; N499-R503 WeakPolarHBondContact O-CB 3.44Å; N499-R503 PolarHBondContact O-N 3.3Å
500	E	52.9	Low	51.8	Low	76 Å²	76	82.5 Å²	82.5	36%	0.355	43%	0.427	S	S	.	.	H	α-helix	trans	-75.1	-41.4	175.2	-163.8	-167.3	153.2	0	0	111.1	D497 L502 R503 K504	D497-E500 HydrophobicContact CB-CB 4.16Å; D497-E500 PolarHBondContact O-N 3.41Å; E500-L502 PolarHBondContact O-N 3.43Å; E500-R503 PolarHBondContact O-N 2.85Å; E500-K504 WeakPolarHBondContact O-CB 3.13Å; E500-K504 WeakPolarHBondContact O-CG 3.43Å; E500-K504 PolarHBondContact O-N 2.86Å; E500-K504 WeakPolarHBondContact OE1-CE 3.23Å; E500-K504 IonicContact OE1-NZ 3.46Å; E500-K504 PolarHBondContact OE1-NZ 2.81Å
501	I	53.3	Low	50.4	Low	89 Å²	89	84.9 Å²	84.9	46%	0.456	44%	0.436	S	S	.	.	H	α-helix	trans	-58.2	-43.9	171.7	-59.9	173.1	0	0	0	109.4	K496 D497 P498 K504 L505	K496-I501 HydrophobicContact CB-CD1 3.8Å; K496-I501 HydrophobicContact CB-CG1 3.85Å; D497-I501 PolarHBondContact O-N 3.47Å; P498-I501 PolarHBondContact O-N 2.78Å; I501-K504 CarbonylContact O-C 3.54Å; I501-K504 WeakPolarHBondContact O-CB 3.38Å; I501-K504 PolarHBondContact O-N 3.25Å; I501-L505 WeakPolarHBondContact O-CB 3.37Å; I501-L505 PolarHBondContact O-N 3.49Å
502	L	55.7	Low	49.8	Very low	16 Å²	16	84 Å²	84	8%	0.084	44%	0.438	C	S	.	.	H	α-helix	trans	-63.9	-47.2	177.2	-174.5	86.5	0	0	0	111.3	P498 E500 K504 L505 W506 L668 W696 W702	P498-L502 WeakPolarHBondContact O-CB 3.39Å; P498-L502 PolarHBondContact O-N 2.9Å; E500-L502 PolarHBondContact O-N 3.43Å; L502-K504 VanDerWaalsContact C-N 3.26Å; L502-K504 PolarHBondContact O-N 3.25Å; L502-L505 WeakPolarHBondContact O-CA 3.2Å; L502-L505 VanDerWaalsContact O-CB 3.27Å; L502-L505 WeakPolarHBondContact O-CB 3.5Å; L502-L505 PolarHBondContact O-N 3.45Å; L502-W506 PolarHBondContact O-N 2.89Å; L502-L668 HydrophobicContact CD1-CD1 3.79Å; L502-L668 HydrophobicContact CD1-CD2 3.43Å; L502-L668 VanDerWaalsContact CD1-CD2 3.43Å; L502-L668 HydrophobicContact CD1-CG 4.27Å; L502-W696 HydrophobicContact CD1-CZ2 4.17Å; L502-W696 HydrophobicContact CD2-CH2 3.6Å; L502-W696 HydrophobicContact CD2-CZ2 3.35Å; L502-W696 HydrophobicContact CG-CH2 4.44Å; L502-W696 HydrophobicContact CG-CZ2 4.32Å; L502-W702 HydrophobicContact CD1-CH2 4.25Å; L502-W702 HydrophobicContact CD2-CH2 4.35Å
503	R	59.8	Low	49.6	Very low	172 Å²	172	83.3 Å²	83.3	65%	0.649	43%	0.425	S	S	*	.	H	α-helix	trans	-58	-43.9	175.8	-159.8	-179	90.9	-163.8	6.7	110.5	N499 E500 L505 W506 D507	N499-R503 WeakPolarHBondContact O-CB 3.44Å; N499-R503 PolarHBondContact O-N 3.3Å; E500-R503 PolarHBondContact O-N 2.85Å; R503-L505 VanDerWaalsContact C-N 3.33Å; R503-L505 PolarHBondContact O-N 3.42Å; R503-W506 PolarHBondContact O-N 2.94Å; R503-D507 IonicContact NE-OD2 3.09Å; R503-D507 WeakPolarHBondContact O-CB 3.3Å; R503-D507 PolarHBondContact O-N 3.23Å
504	K	54.3	Low	49.5	Very low	100 Å²	100	77.2 Å²	77.2	44%	0.435	39%	0.393	S	S	.	.	H	α-helix	trans	-60.2	-38.3	172.6	-77.7	176.9	-174.1	157.7	0	112.7	E500 I501 L502 D507 L508	E500-K504 WeakPolarHBondContact O-CB 3.13Å; E500-K504 WeakPolarHBondContact O-CG 3.43Å; E500-K504 PolarHBondContact O-N 2.86Å; E500-K504 WeakPolarHBondContact OE1-CE 3.23Å; E500-K504 IonicContact OE1-NZ 3.46Å; E500-K504 PolarHBondContact OE1-NZ 2.81Å; I501-K504 CarbonylContact O-C 3.54Å; I501-K504 WeakPolarHBondContact O-CB 3.38Å; I501-K504 PolarHBondContact O-N 3.25Å; L502-K504 VanDerWaalsContact C-N 3.26Å; L502-K504 PolarHBondContact O-N 3.25Å; K504-D507 CarbonylContact O-C 3.57Å; K504-D507 WeakPolarHBondContact O-CB 3.32Å; K504-D507 PolarHBondContact O-N 2.86Å; K504-L508 VanDerWaalsContact O-CB 3.23Å; K504-L508 WeakPolarHBondContact O-CB 3.43Å; K504-L508 WeakPolarHBondContact O-CD1 3.44Å; K504-L508 WeakPolarHBondContact O-CG 3.15Å; K504-L508 PolarHBondContact O-N 3.26Å
505	L	54.9	Low	49.6	Very low	50 Å²	50	81.6 Å²	81.6	26%	0.262	41%	0.407	S	S	.	.	H	α-helix	trans	-62.5	-50.5	176	-172.5	84.8	0	0	0	110.7	I501 L502 R503 D507 L508 E509 L668 A672	I501-L505 WeakPolarHBondContact O-CB 3.37Å; I501-L505 PolarHBondContact O-N 3.49Å; L502-L505 WeakPolarHBondContact O-CA 3.2Å; L502-L505 VanDerWaalsContact O-CB 3.27Å; L502-L505 WeakPolarHBondContact O-CB 3.5Å; L502-L505 PolarHBondContact O-N 3.45Å; R503-L505 VanDerWaalsContact C-N 3.33Å; R503-L505 PolarHBondContact O-N 3.42Å; L505-D507 VanDerWaalsContact C-N 3.31Å; L505-D507 PolarHBondContact O-N 3.49Å; L505-L508 CarbonylContact O-C 3.5Å; L505-L508 PolarHBondContact O-N 2.93Å; L505-E509 PolarHBondContact O-N 2.97Å; L505-L668 HydrophobicContact CD2-CD1 3.69Å; L505-A672 HydrophobicContact CD1-CB 4.26Å
506	W	59.9	Low	50.1	Low	59 Å²	59	75.8 Å²	75.8	22%	0.223	38%	0.383	C	S	.	.	H	α-helix	trans	-68.5	-32.9	176.8	-66.1	101.3	0	0	0	112.4	L502 R503 L508 E509 A510 K689 L692 W696 L783	L502-W506 PolarHBondContact O-N 2.89Å; R503-W506 PolarHBondContact O-N 2.94Å; W506-L508 VanDerWaalsContact C-N 3.33Å; W506-E509 WeakPolarHBondContact CZ3-OE2 3.31Å; W506-E509 PolarHBondContact O-N 3.14Å; W506-A510 PolarHBondContact O-N 3.42Å; W506-A510 VanDerWaalsContact O-N 3.17Å; W506-K689 HydrophobicContact CH2-CB 4.27Å; W506-K689 HydrophobicContact CH2-CD 3.97Å; W506-K689 HydrophobicContact CH2-CG 4.08Å; W506-K689 HydrophobicContact CZ3-CD 4.04Å; W506-L692 HydrophobicContact CZ2-CD2 4.14Å; W506-W696 HydrophobicContact CZ2-CH2 4.4Å; W506-W696 AromaticContact NE1-CH2 3.92Å; W506-L783 HydrophobicContact CH2-CD1 3.49Å; W506-L783 VanDerWaalsContact CH2-CD1 3.49Å; W506-L783 HydrophobicContact CH2-CG 4.19Å; W506-L783 HydrophobicContact CZ2-CD1 4.19Å; W506-L783 HydrophobicContact CZ3-CD1 4.17Å; W506-L783 HydrophobicContact CZ3-CG 4.48Å
507	D	52.2	Low	50.5	Low	51 Å²	51	74 Å²	74	27%	0.273	38%	0.377	S	S	.	.	H	α-helix	trans	-64.1	-36.7	172.4	-86.7	-30.9	0	0	0	112	R503 K504 L505 A510 R514	R503-D507 IonicContact NE-OD2 3.09Å; R503-D507 WeakPolarHBondContact O-CB 3.3Å; R503-D507 PolarHBondContact O-N 3.23Å; K504-D507 CarbonylContact O-C 3.57Å; K504-D507 WeakPolarHBondContact O-CB 3.32Å; K504-D507 PolarHBondContact O-N 2.86Å; L505-D507 VanDerWaalsContact C-N 3.31Å; L505-D507 PolarHBondContact O-N 3.49Å; D507-A510 WeakPolarHBondContact O-CB 3.48Å; D507-R514 VanDerWaalsContact C-NH2 3.34Å; D507-R514 PolarHBondContact O-NE 2.97Å; D507-R514 PolarHBondContact O-NH2 3.38Å; D507-R514 IonicContact OD1-CZ 2.73Å; D507-R514 IonicContact OD1-NH2 2.78Å; D507-R514 PolarHBondContact OD1-NH2 3.42Å
508	L	45.2	Very low	50.6	Low	90 Å²	90	74.4 Å²	74.4	47%	0.471	38%	0.376	S	S	.	.	H	α-helix	trans	-77.6	-35.8	173.8	-76.5	164.7	0	0	0	111.4	K504 L505 W506 A510 L511	K504-L508 VanDerWaalsContact O-CB 3.23Å; K504-L508 WeakPolarHBondContact O-CB 3.43Å; K504-L508 WeakPolarHBondContact O-CD1 3.44Å; K504-L508 WeakPolarHBondContact O-CG 3.15Å; K504-L508 PolarHBondContact O-N 3.26Å; L505-L508 CarbonylContact O-C 3.5Å; L505-L508 PolarHBondContact O-N 2.93Å; W506-L508 VanDerWaalsContact C-N 3.33Å; L508-A510 PolarHBondContact O-N 3.11Å; L508-A510 VanDerWaalsContact O-N 3.17Å; L508-L511 WeakPolarHBondContact O-CA 3.43Å; L508-L511 WeakPolarHBondContact O-CB 3.33Å; L508-L511 WeakPolarHBondContact O-CD1 3.35Å; L508-L511 WeakPolarHBondContact O-CG 3.43Å; L508-L511 PolarHBondContact O-N 3.1Å
509	E	50.3	Low	50.6	Low	55 Å²	55	74.5 Å²	74.5	26%	0.257	38%	0.382	S	S	.	.	H	α-helix	trans	-61.8	-23.5	171.1	-75.7	-162.4	151.8	0	0	112.2	L505 W506 L511 K689	L505-E509 PolarHBondContact O-N 2.97Å; W506-E509 WeakPolarHBondContact CZ3-OE2 3.31Å; W506-E509 PolarHBondContact O-N 3.14Å; E509-L511 PolarHBondContact O-N 3.27Å; E509-K689 WeakPolarHBondContact OE1-CE 3.43Å; E509-K689 IonicContact OE1-NZ 3.48Å; E509-K689 PolarHBondContact OE1-NZ 3.06Å; E509-K689 IonicContact OE2-NZ 2.75Å; E509-K689 PolarHBondContact OE2-NZ 3.37Å
510	A	50.2	Low	50.5	Low	28 Å²	28	77.2 Å²	77.2	23%	0.231	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	12.4	168.7	0	0	0	0	0	114.3	W506 D507 L508 G512 I513	W506-A510 PolarHBondContact O-N 3.42Å; W506-A510 VanDerWaalsContact O-N 3.17Å; D507-A510 WeakPolarHBondContact O-CB 3.48Å; L508-A510 PolarHBondContact O-N 3.11Å; L508-A510 VanDerWaalsContact O-N 3.17Å; A510-G512 PolarHBondContact O-N 2.77Å; A510-I513 PolarHBondContact O-N 2.78Å
511	L	40.1	Very low	50.6	Low	113 Å²	113	81.8 Å²	81.8	59%	0.592	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.7	130.5	174	-94.3	158.9	0	0	0	111.4	L508 E509	L508-L511 WeakPolarHBondContact O-CA 3.43Å; L508-L511 WeakPolarHBondContact O-CB 3.33Å; L508-L511 WeakPolarHBondContact O-CD1 3.35Å; L508-L511 WeakPolarHBondContact O-CG 3.43Å; L508-L511 PolarHBondContact O-N 3.1Å; E509-L511 PolarHBondContact O-N 3.27Å
512	G	48.7	Very low	50.6	Low	25 Å²	25	84.2 Å²	84.2	26%	0.258	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.2	-17.9	177.4	0	0	0	0	0	115.8	A510 Y808	A510-G512 PolarHBondContact O-N 2.77Å; G512-Y808 VanDerWaalsContact CA-CD2 3.46Å; G512-Y808 VanDerWaalsContact CA-CE2 3.42Å; G512-Y808 WeakPolarHBondContact O-CD2 2.88Å
513	I	45.3	Very low	50.6	Low	29 Å²	29	89.5 Å²	89.5	15%	0.149	43%	0.427	C	S	.	.			trans	-112.1	24.5	-169	-59.6	-178.7	0	0	0	112.1	A510 R804	A510-I513 PolarHBondContact O-N 2.78Å; I513-R804 HydrophobicContact CB-CB 4.31Å; I513-R804 HydrophobicContact CD1-CB 3.91Å; I513-R804 HydrophobicContact CG1-CB 3.9Å; I513-R804 HydrophobicContact CG2-CB 3.59Å; I513-R804 HydrophobicContact CG2-CG 3.63Å
514	R	43.5	Very low	50.6	Low	74 Å²	74	84.4 Å²	84.4	28%	0.279	42%	0.418	S	S	.	.	S	Bend	trans	-105.1	148.3	178	-70.5	178.4	-177.9	-112.7	-16.1	111.1	D507 A516 E518	D507-R514 VanDerWaalsContact C-NH2 3.34Å; D507-R514 PolarHBondContact O-NE 2.97Å; D507-R514 PolarHBondContact O-NH2 3.38Å; D507-R514 IonicContact OD1-CZ 2.73Å; D507-R514 IonicContact OD1-NH2 2.78Å; D507-R514 PolarHBondContact OD1-NH2 3.42Å; R514-A516 PolarHBondContact O-N 3.23Å; R514-E518 WeakPolarHBondContact CD-OE2 3.43Å; R514-E518 IonicContact CZ-OE2 3.3Å; R514-E518 IonicContact NH1-OE1 3.2Å; R514-E518 IonicContact NH1-OE2 3.14Å; R514-E518 PolarHBondContact NH1-OE2 3.27Å
515	D	42.5	Very low	51.2	Low	132 Å²	132	83.4 Å²	83.4	71%	0.706	42%	0.42	S	S	*	.			trans	-52.2	128.3	169.1	-97.7	-42	0	0	0	109.9	E517 E518	D515-E517 PolarHBondContact O-N 2.9Å; D515-E518 PolarHBondContact O-N 3.35Å
516	A	48.9	Very low	51.7	Low	50 Å²	50	86 Å²	86	41%	0.413	43%	0.431	S	S	.	.	H	α-helix	trans	-53	-22.3	177.7	0	0	0	0	0	112.7	R514 R520	R514-A516 PolarHBondContact O-N 3.23Å; A516-R520 WeakPolarHBondContact O-CB 3.43Å; A516-R520 WeakPolarHBondContact O-CG 3.47Å; A516-R520 PolarHBondContact O-N 2.93Å; A516-R520 VanDerWaalsContact O-N 3.11Å; A516-R520 PolarHBondContact O-NE 3.46Å
517	E	49.5	Very low	52	Low	120 Å²	120	85.4 Å²	85.4	56%	0.561	44%	0.438	S	S	*	.	H	α-helix	trans	-59.9	-38.8	172	-107.6	-168.9	152.8	0	0	114.4	D515 R520 R521	D515-E517 PolarHBondContact O-N 2.9Å; E517-R520 PolarHBondContact O-N 3.24Å; E517-R521 PolarHBondContact O-N 3.43Å
518	E	49.5	Very low	52.9	Low	90 Å²	90	87.7 Å²	87.7	42%	0.421	45%	0.449	S	S	.	.	H	α-helix	trans	-74.7	-36	-175.4	-147.9	-178.4	-159.2	0	0	111.4	R514 D515 R521 R522	R514-E518 WeakPolarHBondContact CD-OE2 3.43Å; R514-E518 IonicContact CZ-OE2 3.3Å; R514-E518 IonicContact NH1-OE1 3.2Å; R514-E518 IonicContact NH1-OE2 3.14Å; R514-E518 PolarHBondContact NH1-OE2 3.27Å; D515-E518 PolarHBondContact O-N 3.35Å; E518-R521 PolarHBondContact O-N 3.39Å; E518-R522 PolarHBondContact O-N 3.18Å; E518-R522 VanDerWaalsContact O-N 3.15Å
519	A	49.9	Very low	54.3	Low	55 Å²	55	88.3 Å²	88.3	46%	0.455	45%	0.445	S	S	.	.	H	α-helix	trans	-64.7	-45	171.4	0	0	0	0	0	111.5	R521 R522 Q523	A519-R521 VanDerWaalsContact C-N 3.34Å; A519-R521 PolarHBondContact O-N 2.99Å; A519-R522 PolarHBondContact O-N 2.92Å; A519-Q523 PolarHBondContact O-N 3.45Å; A519-Q523 VanDerWaalsContact O-N 3.08Å
520	R	53.9	Low	55.4	Low	147 Å²	147	88.9 Å²	88.9	56%	0.555	45%	0.448	S	S	*	.	H	α-helix	trans	-59.5	-40.5	174.5	-76.7	-174.8	-73.2	-122.6	3.7	112.5	A516 E517 S524	A516-R520 WeakPolarHBondContact O-CB 3.43Å; A516-R520 WeakPolarHBondContact O-CG 3.47Å; A516-R520 PolarHBondContact O-N 2.93Å; A516-R520 VanDerWaalsContact O-N 3.11Å; A516-R520 PolarHBondContact O-NE 3.46Å; E517-R520 PolarHBondContact O-N 3.24Å; R520-S524 WeakPolarHBondContact O-CB 3.41Å; R520-S524 PolarHBondContact O-N 3.26Å; R520-S524 PolarHBondContact O-OG 2.92Å
521	R	55	Low	56.6	Low	172 Å²	172	93.5 Å²	93.5	65%	0.649	46%	0.46	S	S	*	.	H	α-helix	trans	-62	-42.4	174.3	-92.8	-174.6	-173.5	155.2	7.7	112.9	E517 E518 A519 S524 T525	E517-R521 PolarHBondContact O-N 3.43Å; E518-R521 PolarHBondContact O-N 3.39Å; A519-R521 VanDerWaalsContact C-N 3.34Å; A519-R521 PolarHBondContact O-N 2.99Å; R521-S524 WeakPolarHBondContact O-CB 3.48Å; R521-S524 PolarHBondContact O-N 3.01Å; R521-T525 PolarHBondContact O-N 3.27Å; R521-T525 PolarHBondContact O-OG1 3.36Å
522	R	52.6	Low	58.5	Low	140 Å²	140	93.4 Å²	93.4	53%	0.528	46%	0.459	S	S	.	.	H	α-helix	trans	-64.8	-45.9	178.2	-76.5	-175.3	-173.9	156.6	5.6	112	E518 A519 S524 T525 E526	E518-R522 PolarHBondContact O-N 3.18Å; E518-R522 VanDerWaalsContact O-N 3.15Å; A519-R522 PolarHBondContact O-N 2.92Å; R522-S524 VanDerWaalsContact C-N 3.27Å; R522-S524 PolarHBondContact O-N 2.88Å; R522-T525 PolarHBondContact O-N 3.2Å; R522-E526 PolarHBondContact O-N 3.04Å
523	Q	57.1	Low	59.9	Low	127 Å²	127	99.2 Å²	99.2	59%	0.593	48%	0.48	S	S	*	.	H	α-helix	trans	-57.8	-42	174.4	-72.9	176.9	-8.3	0	0	111.4	A519 T525 E526 A527	A519-Q523 PolarHBondContact O-N 3.45Å; A519-Q523 VanDerWaalsContact O-N 3.08Å; Q523-T525 VanDerWaalsContact C-N 3.31Å; Q523-T525 PolarHBondContact O-N 2.89Å; Q523-E526 PolarHBondContact O-N 3.48Å; Q523-A527 WeakPolarHBondContact O-CB 3.33Å; Q523-A527 PolarHBondContact O-N 3.34Å
524	S	59.8	Low	61.5	Low	66 Å²	66	98.5 Å²	98.5	46%	0.462	48%	0.478	S	S	.	.	H	α-helix	trans	-61.9	-39	175.3	-55.2	0	0	0	0	112.1	R520 R521 R522 I528	R520-S524 WeakPolarHBondContact O-CB 3.41Å; R520-S524 PolarHBondContact O-N 3.26Å; R520-S524 PolarHBondContact O-OG 2.92Å; R521-S524 WeakPolarHBondContact O-CB 3.48Å; R521-S524 PolarHBondContact O-N 3.01Å; R522-S524 VanDerWaalsContact C-N 3.27Å; R522-S524 PolarHBondContact O-N 2.88Å; S524-I528 WeakPolarHBondContact O-CB 3.4Å; S524-I528 WeakPolarHBondContact O-CD1 3.35Å; S524-I528 WeakPolarHBondContact O-CG1 3.26Å; S524-I528 PolarHBondContact O-N 3.33Å
525	T	66.7	Low	63.5	Low	79 Å²	79	97.8 Å²	97.8	49%	0.485	48%	0.478	S	S	.	.	H	α-helix	trans	-71.1	-35.4	-178.7	-44	0	0	0	0	111.8	R521 R522 Q523 R529	R521-T525 PolarHBondContact O-N 3.27Å; R521-T525 PolarHBondContact O-OG1 3.36Å; R522-T525 PolarHBondContact O-N 3.2Å; Q523-T525 VanDerWaalsContact C-N 3.31Å; Q523-T525 PolarHBondContact O-N 2.89Å; T525-R529 PolarHBondContact O-N 3.4Å
526	E	65.1	Low	65.5	Low	104 Å²	104	95.1 Å²	95.1	49%	0.486	47%	0.467	S	S	.	.	H	α-helix	trans	-70.6	-43.2	176.3	-157.9	63.8	-155.5	0	0	111.5	R522 Q523 I528 R529 H530	R522-E526 PolarHBondContact O-N 3.04Å; Q523-E526 PolarHBondContact O-N 3.48Å; E526-I528 VanDerWaalsContact C-N 3.31Å; E526-I528 PolarHBondContact O-N 3.27Å; E526-R529 PolarHBondContact O-N 2.94Å; E526-R529 VanDerWaalsContact O-N 3.15Å; E526-R529 IonicContact OE1-CZ 3.24Å; E526-R529 IonicContact OE1-NH1 3.46Å; E526-R529 PolarHBondContact OE1-NH1 3.08Å; E526-R529 IonicContact OE2-CZ 3.99Å; E526-R529 IonicContact OE2-NH1 2.82Å; E526-R529 PolarHBondContact OE2-NH1 2.95Å; E526-R529 IonicContact OE2-NH2 3.67Å; E526-R529 PolarHBondContact OE2-NH2 3.38Å; E526-H530 PolarHBondContact O-N 2.96Å
527	A	67.3	Low	67.2	Low	46 Å²	46	98.2 Å²	98.2	38%	0.38	47%	0.471	S	S	.	.	H	α-helix	trans	-60.5	-40.1	173.9	0	0	0	0	0	112	Q523 H530 Y531	Q523-A527 WeakPolarHBondContact O-CB 3.33Å; Q523-A527 PolarHBondContact O-N 3.34Å; A527-H530 PolarHBondContact O-N 2.61Å; A527-Y531 WeakPolarHBondContact O-CB 3.36Å; A527-Y531 PolarHBondContact O-N 3.04Å
528	I	71.2	Confident	68.7	Low	99 Å²	99	98.2 Å²	98.2	51%	0.508	47%	0.472	S	S	.	.	H	α-helix	trans	-64.9	-41.1	174.4	-69.8	164.4	0	0	0	111.1	S524 E526 Y531 I532	S524-I528 WeakPolarHBondContact O-CB 3.4Å; S524-I528 WeakPolarHBondContact O-CD1 3.35Å; S524-I528 WeakPolarHBondContact O-CG1 3.26Å; S524-I528 PolarHBondContact O-N 3.33Å; E526-I528 VanDerWaalsContact C-N 3.31Å; E526-I528 PolarHBondContact O-N 3.27Å; I528-Y531 WeakPolarHBondContact O-CB 3.09Å; I528-Y531 PolarHBondContact O-N 3.3Å; I528-I532 HydrophobicContact CG2-CD1 3.8Å; I528-I532 HydrophobicContact CG2-CG1 4.44Å; I528-I532 VanDerWaalsContact O-CG1 3.3Å; I528-I532 WeakPolarHBondContact O-CG1 3.45Å; I528-I532 PolarHBondContact O-N 2.78Å
529	R	73.2	Confident	69.9	Low	103 Å²	103	96.8 Å²	96.8	39%	0.389	48%	0.481	S	S	.	.	H	α-helix	trans	-63.2	-47.1	177.1	-166.5	-174.1	-50	122.7	24.5	111.3	T525 E526 Y531 I532 E533	T525-R529 PolarHBondContact O-N 3.4Å; E526-R529 PolarHBondContact O-N 2.94Å; E526-R529 VanDerWaalsContact O-N 3.15Å; E526-R529 IonicContact OE1-CZ 3.24Å; E526-R529 IonicContact OE1-NH1 3.46Å; E526-R529 PolarHBondContact OE1-NH1 3.08Å; E526-R529 IonicContact OE2-CZ 3.99Å; E526-R529 IonicContact OE2-NH1 2.82Å; E526-R529 PolarHBondContact OE2-NH1 2.95Å; E526-R529 IonicContact OE2-NH2 3.67Å; E526-R529 PolarHBondContact OE2-NH2 3.38Å; R529-Y531 VanDerWaalsContact C-N 3.3Å; R529-Y531 PolarHBondContact O-N 3.32Å; R529-I532 PolarHBondContact O-N 3.3Å; R529-I532 VanDerWaalsContact O-N 3.16Å; R529-E533 WeakPolarHBondContact CD-OE1 3.29Å; R529-E533 HydrophobicContact CG-CG 4.36Å; R529-E533 VanDerWaalsContact CG-OE1 3.31Å; R529-E533 WeakPolarHBondContact CG-OE1 3.44Å; R529-E533 WeakPolarHBondContact O-CB 3.38Å; R529-E533 WeakPolarHBondContact O-CG 3.42Å; R529-E533 PolarHBondContact O-N 3.18Å
530	H	73.6	Confident	71.3	Confident	67 Å²	67	103.2 Å²	103.2	31%	0.31	50%	0.502	S	S	.	.	H	α-helix	trans	-58.4	-41.7	175.4	-177.9	-83.4	0	0	0	112	E526 A527 E533 S534 R545	E526-H530 PolarHBondContact O-N 2.96Å; A527-H530 PolarHBondContact O-N 2.61Å; H530-E533 PolarHBondContact O-N 3.22Å; H530-S534 WeakPolarHBondContact O-CB 3.42Å; H530-S534 PolarHBondContact O-N 3.03Å; H530-S534 PolarHBondContact O-OG 2.83Å; H530-R545 PolarHBondContact CE1-O 3.47Å; H530-R545 VanDerWaalsContact CE1-O 3.25Å
531	Y	75.7	Confident	72.2	Confident	125 Å²	125	104 Å²	104	49%	0.49	50%	0.504	S	S	.	.	H	α-helix	trans	-59	-48	174.3	172.5	-95	0	0	0	112.1	A527 I528 R529 S534 I535 V544	A527-Y531 WeakPolarHBondContact O-CB 3.36Å; A527-Y531 PolarHBondContact O-N 3.04Å; I528-Y531 WeakPolarHBondContact O-CB 3.09Å; I528-Y531 PolarHBondContact O-N 3.3Å; R529-Y531 VanDerWaalsContact C-N 3.3Å; R529-Y531 PolarHBondContact O-N 3.32Å; Y531-S534 PolarHBondContact O-N 2.93Å; Y531-I535 PolarHBondContact O-N 3.12Å; Y531-V544 HydrophobicContact CD2-CG1 3.65Å; Y531-V544 HydrophobicContact CD2-CG2 4.45Å; Y531-V544 HydrophobicContact CE2-CG1 3.98Å; Y531-V544 HydrophobicContact CE2-CG2 3.97Å
532	I	79.3	Confident	73.6	Confident	111 Å²	111	103.4 Å²	103.4	57%	0.569	50%	0.503	S	S	*	.	H	α-helix	trans	-66.2	-39.4	-179.4	-66.9	168	0	0	0	111.6	I528 R529 S534 I535	I528-I532 HydrophobicContact CG2-CD1 3.8Å; I528-I532 HydrophobicContact CG2-CG1 4.44Å; I528-I532 VanDerWaalsContact O-CG1 3.3Å; I528-I532 WeakPolarHBondContact O-CG1 3.45Å; I528-I532 PolarHBondContact O-N 2.78Å; R529-I532 PolarHBondContact O-N 3.3Å; R529-I532 VanDerWaalsContact O-N 3.16Å; I532-S534 VanDerWaalsContact C-N 3.35Å; I532-I535 WeakPolarHBondContact O-CG2 3.26Å
533	E	79	Confident	74.8	Confident	148 Å²	148	99.1 Å²	99.1	69%	0.692	49%	0.493	S	S	*	.	H	α-helix	trans	-77	-21.7	-178.6	-71.9	173.4	-179	0	0	113.1	R529 H530	R529-E533 WeakPolarHBondContact CD-OE1 3.29Å; R529-E533 HydrophobicContact CG-CG 4.36Å; R529-E533 VanDerWaalsContact CG-OE1 3.31Å; R529-E533 WeakPolarHBondContact CG-OE1 3.44Å; R529-E533 WeakPolarHBondContact O-CB 3.38Å; R529-E533 WeakPolarHBondContact O-CG 3.42Å; R529-E533 PolarHBondContact O-N 3.18Å; H530-E533 PolarHBondContact O-N 3.22Å
534	S	78.4	Confident	75.6	Confident	14 Å²	14	95.6 Å²	95.6	10%	0.098	48%	0.48	C	S	.	.	H	α-helix	trans	-104.6	-2.3	-175	67.2	0	0	0	0	115.4	H530 Y531 I532 T536 R545	H530-S534 WeakPolarHBondContact O-CB 3.42Å; H530-S534 PolarHBondContact O-N 3.03Å; H530-S534 PolarHBondContact O-OG 2.83Å; Y531-S534 PolarHBondContact O-N 2.93Å; I532-S534 VanDerWaalsContact C-N 3.35Å; S534-T536 PolarHBondContact O-N 3.33Å; S534-R545 PolarHBondContact OG-N 2.81Å
535	I	84.6	Confident	75.7	Confident	58 Å²	58	101.6 Å²	101.6	30%	0.297	49%	0.492	S	S	.	.			trans	-79.3	118.9	178.6	-167.9	162.4	0	0	0	110.9	Y531 I532 Y542 V543 V544	Y531-I535 PolarHBondContact O-N 3.12Å; I532-I535 WeakPolarHBondContact O-CG2 3.26Å; I535-Y542 HydrophobicContact CD1-CD1 3.86Å; I535-Y542 HydrophobicContact CD1-CG 4.24Å; I535-Y542 HydrophobicContact CG1-CD1 3.82Å; I535-Y542 HydrophobicContact CG1-CG 4.41Å; I535-V543 WeakPolarHBondContact CA-O 3.44Å; I535-V544 HydrophobicContact CB-CG2 4.04Å; I535-V544 HydrophobicContact CD1-CG2 3.92Å; I535-V544 HydrophobicContact CG1-CG2 3.73Å
536	T	84.8	Confident	74.9	Confident	76 Å²	76	103.1 Å²	103.1	47%	0.466	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	142	173.8	53.4	0	0	0	0	109.8	S534 Y542 V543	S534-T536 PolarHBondContact O-N 3.33Å; T536-Y542 CarbonylContact O-C 3.48Å; T536-Y542 WeakPolarHBondContact O-CA 3.38Å; T536-V543 PolarHBondContact N-O 3.46Å; T536-V543 PolarHBondContact O-N 2.94Å
537	F	85.1	Confident	74.5	Confident	115 Å²	115	101.8 Å²	101.8	50%	0.504	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	112.3	177.7	-176.1	-109.2	0	0	0	109.5	G539 Y542	F537-G539 WeakPolarHBondContact CE1-O 3.29Å; F537-G539 VanDerWaalsContact CZ-O 3.26Å; F537-G539 WeakPolarHBondContact CZ-O 3.5Å; F537-G539 PolarHBondContact O-N 3.4Å; F537-Y542 HydrophobicContact CB-CD1 3.98Å; F537-Y542 HydrophobicContact CB-CE1 3.83Å; F537-Y542 AromaticContact CD2-CD1 3.76Å; F537-Y542 HydrophobicContact CD2-CD1 3.76Å; F537-Y542 HydrophobicContact CD2-CD2 4.02Å; F537-Y542 AromaticContact CD2-CE1 3.59Å; F537-Y542 HydrophobicContact CD2-CE1 3.59Å; F537-Y542 AromaticContact CD2-CE2 3.85Å; F537-Y542 HydrophobicContact CD2-CE2 3.85Å; F537-Y542 AromaticContact CD2-CG 3.98Å; F537-Y542 HydrophobicContact CD2-CG 3.98Å; F537-Y542 AromaticContact CD2-CZ 3.63Å; F537-Y542 HydrophobicContact CE2-CD2 4.37Å; F537-Y542 HydrophobicContact CE2-CE2 4.06Å; F537-Y542 HydrophobicContact CG-CD1 4.34Å; F537-Y542 HydrophobicContact CG-CE1 4.03Å
538	E	79.9	Confident	73.5	Confident	121 Å²	121	106.9 Å²	106.9	57%	0.565	51%	0.507	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	60.2	179.5	-70.4	-172.4	169.6	0	0	110.7	E540 R541 V543	E538-E540 PolarHBondContact O-N 2.84Å; E538-R541 PolarHBondContact N-O 3.33Å; E538-V543 HydrophobicContact CB-CG2 4.41Å; E538-V543 HydrophobicContact CG-CG2 4.06Å
539	G	75.8	Confident	72.7	Confident	60 Å²	60	110 Å²	110	62%	0.619	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	-43.5	169.7	0	0	0	0	0	116.6	F537	F537-G539 WeakPolarHBondContact CE1-O 3.29Å; F537-G539 VanDerWaalsContact CZ-O 3.26Å; F537-G539 WeakPolarHBondContact CZ-O 3.5Å; F537-G539 PolarHBondContact O-N 3.4Å
540	E	78.6	Confident	71.6	Confident	190 Å²	190	107.7 Å²	107.7	89%	0.888	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.1	-25.4	-179.9	-65.7	-170.5	157.1	0	0	113	E538	E538-E540 PolarHBondContact O-N 2.84Å
541	R	73.1	Confident	70.7	Confident	162 Å²	162	106.4 Å²	106.4	61%	0.611	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.8	155	-175.5	65.5	-176.1	-177.7	-177.7	-0.3	113	E538 V543	E538-R541 PolarHBondContact N-O 3.33Å; R541-V543 HydrophobicContact CG-CG2 4.46Å
542	Y	84.3	Confident	70.3	Confident	160 Å²	160	101.4 Å²	101.4	63%	0.627	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.6	128.4	167.9	-67.6	-81.8	0	0	0	110	I535 T536 F537	I535-Y542 HydrophobicContact CD1-CD1 3.86Å; I535-Y542 HydrophobicContact CD1-CG 4.24Å; I535-Y542 HydrophobicContact CG1-CD1 3.82Å; I535-Y542 HydrophobicContact CG1-CG 4.41Å; T536-Y542 CarbonylContact O-C 3.48Å; T536-Y542 WeakPolarHBondContact O-CA 3.38Å; F537-Y542 HydrophobicContact CB-CD1 3.98Å; F537-Y542 HydrophobicContact CB-CE1 3.83Å; F537-Y542 AromaticContact CD2-CD1 3.76Å; F537-Y542 HydrophobicContact CD2-CD1 3.76Å; F537-Y542 HydrophobicContact CD2-CD2 4.02Å; F537-Y542 AromaticContact CD2-CE1 3.59Å; F537-Y542 HydrophobicContact CD2-CE1 3.59Å; F537-Y542 AromaticContact CD2-CE2 3.85Å; F537-Y542 HydrophobicContact CD2-CE2 3.85Å; F537-Y542 AromaticContact CD2-CG 3.98Å; F537-Y542 HydrophobicContact CD2-CG 3.98Å; F537-Y542 AromaticContact CD2-CZ 3.63Å; F537-Y542 HydrophobicContact CE2-CD2 4.37Å; F537-Y542 HydrophobicContact CE2-CE2 4.06Å; F537-Y542 HydrophobicContact CG-CD1 4.34Å; F537-Y542 HydrophobicContact CG-CE1 4.03Å
543	V	78.5	Confident	70.2	Confident	50 Å²	50	101.1 Å²	101.1	30%	0.303	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	126.9	172.1	-178	0	0	0	0	107.4	I535 T536 E538 R541	I535-V543 WeakPolarHBondContact CA-O 3.44Å; T536-V543 PolarHBondContact N-O 3.46Å; T536-V543 PolarHBondContact O-N 2.94Å; E538-V543 HydrophobicContact CB-CG2 4.41Å; E538-V543 HydrophobicContact CG-CG2 4.06Å; R541-V543 HydrophobicContact CG-CG2 4.46Å
544	V	73.2	Confident	70.3	Confident	54 Å²	54	95 Å²	95	33%	0.327	46%	0.462	S	S	.	.			trans	-127.1	132.6	-178.6	179.7	0	0	0	0	107.7	Y531 I535	Y531-V544 HydrophobicContact CD2-CG1 3.65Å; Y531-V544 HydrophobicContact CD2-CG2 4.45Å; Y531-V544 HydrophobicContact CE2-CG1 3.98Å; Y531-V544 HydrophobicContact CE2-CG2 3.97Å; I535-V544 HydrophobicContact CB-CG2 4.04Å; I535-V544 HydrophobicContact CD1-CG2 3.92Å; I535-V544 HydrophobicContact CG1-CG2 3.73Å
545	R	63.3	Low	70.6	Confident	191 Å²	191	94.4 Å²	94.4	72%	0.721	46%	0.457	S	S	*	.			trans	-74.1	131.5	173.2	-64.1	-177.9	179.2	169.2	-0.4	109.6	H530 S534	H530-R545 PolarHBondContact CE1-O 3.47Å; H530-R545 VanDerWaalsContact CE1-O 3.25Å; S534-R545 PolarHBondContact OG-N 2.81Å
546	L	49.7	Very low	70.7	Confident	112 Å²	112	99.3 Å²	99.3	59%	0.586	47%	0.472	S	S	*	.			trans	-64.9	128.2	177	-71.1	169.4	0	0	0	110.2	W548	L546-W548 VanDerWaalsContact C-N 3.33Å; L546-W548 HydrophobicContact CB-CD2 4.45Å; L546-W548 HydrophobicContact CB-CG 4.5Å; L546-W548 HydrophobicContact CB-CZ2 4.44Å; L546-W548 HydrophobicContact CD1-CH2 4.23Å; L546-W548 HydrophobicContact CD1-CZ2 3.65Å; L546-W548 VanDerWaalsContact O-CD1 3.24Å; L546-W548 PolarHBondContact O-N 3.19Å
547	P	55	Low	70.8	Confident	76 Å²	76	101.1 Å²	101.1	49%	0.494	48%	0.478	S	S	.	.			trans	-76.1	89.3	170.2	29.8	-30.1	0	0	0	108.1
548	W	47.5	Very low	70.8	Confident	153 Å²	153	97.6 Å²	97.6	58%	0.58	46%	0.463	S	S	*	.			trans	-72.4	129.8	179.7	-66.5	100.6	0	0	0	111.3	L546 T550	L546-W548 VanDerWaalsContact C-N 3.33Å; L546-W548 HydrophobicContact CB-CD2 4.45Å; L546-W548 HydrophobicContact CB-CG 4.5Å; L546-W548 HydrophobicContact CB-CZ2 4.44Å; L546-W548 HydrophobicContact CD1-CH2 4.23Å; L546-W548 HydrophobicContact CD1-CZ2 3.65Å; L546-W548 VanDerWaalsContact O-CD1 3.24Å; L546-W548 PolarHBondContact O-N 3.19Å; W548-T550 HydrophobicContact CB-CG2 3.29Å; W548-T550 HydrophobicContact CD2-CG2 3.92Å; W548-T550 HydrophobicContact CE3-CG2 4.28Å; W548-T550 HydrophobicContact CG-CG2 3.52Å
549	K	53.3	Low	71.3	Confident	163 Å²	163	94.6 Å²	94.6	71%	0.709	45%	0.451	S	S	*	.			trans	-84.2	75.4	134.8	-88.8	-170.9	170	-166.5	0	105.1	D551 A552	K549-D551 PolarHBondContact O-N 3.14Å; K549-A552 HydrophobicContact CB-CB 4.44Å; K549-A552 PolarHBondContact O-N 3.38Å
550	T	51.1	Low	71.9	Confident	55 Å²	55	96.4 Å²	96.4	34%	0.337	46%	0.46	S	S	.	.	H	α-helix	trans	-51.3	-37.4	-168.6	24.5	0	0	0	0	111.3	W548 H553 H554	W548-T550 HydrophobicContact CB-CG2 3.29Å; W548-T550 HydrophobicContact CD2-CG2 3.92Å; W548-T550 HydrophobicContact CE3-CG2 4.28Å; W548-T550 HydrophobicContact CG-CG2 3.52Å; T550-H553 PolarHBondContact O-N 2.93Å; T550-H554 PolarHBondContact O-N 3.47Å
551	D	54	Low	72.5	Confident	41 Å²	41	92.1 Å²	92.1	22%	0.219	45%	0.447	C	S	.	.	H	α-helix	trans	-82.8	-33	-163	-32.3	-39.6	0	0	0	111.8	K549 H553 H554 A555 V569 M573	K549-D551 PolarHBondContact O-N 3.14Å; D551-H553 VanDerWaalsContact C-N 3.34Å; D551-H553 PolarHBondContact O-N 2.91Å; D551-H554 PolarHBondContact O-N 3.44Å; D551-A555 VanDerWaalsContact O-CB 3.27Å; D551-A555 WeakPolarHBondContact O-CB 3.43Å; D551-A555 PolarHBondContact O-N 2.9Å; D551-V569 HydrophobicContact CB-CG1 4.38Å; D551-M573 HydrophobicContact CB-CE 3.03Å; D551-M573 WeakPolarHBondContact OD2-CE 3.1Å
552	A	68.8	Low	73.4	Confident	19 Å²	19	86.7 Å²	86.7	16%	0.157	43%	0.426	C	S	.	.	H	α-helix	trans	-70.6	-31.2	177.1	0	0	0	0	0	112.5	K549 R556 L570	K549-A552 HydrophobicContact CB-CB 4.44Å; K549-A552 PolarHBondContact O-N 3.38Å; A552-R556 VanDerWaalsContact O-CB 3.32Å; A552-R556 WeakPolarHBondContact O-CB 3.23Å; A552-R556 WeakPolarHBondContact O-CD 3.35Å; A552-R556 WeakPolarHBondContact O-CG 3.3Å; A552-R556 PolarHBondContact O-N 2.82Å; A552-L570 HydrophobicContact CB-CD2 3.63Å
553	H	76.4	Confident	73.6	Confident	106 Å²	106	85.2 Å²	85.2	49%	0.491	42%	0.423	S	S	.	.	H	α-helix	trans	-72.1	-46.5	174.3	-177.7	63.9	0	0	0	110.7	T550 D551 R556 L557	T550-H553 PolarHBondContact O-N 2.93Å; D551-H553 VanDerWaalsContact C-N 3.34Å; D551-H553 PolarHBondContact O-N 2.91Å; H553-R556 PolarHBondContact O-N 2.96Å; H553-L557 WeakPolarHBondContact O-CB 3.31Å; H553-L557 PolarHBondContact O-N 2.84Å
554	H	81.3	Confident	74.1	Confident	20 Å²	20	86 Å²	86	9%	0.093	42%	0.421	C	S	.	.	H	α-helix	trans	-58.5	-50.1	178	-172.8	60.3	0	0	0	112.4	T550 D551 R556 L557 H558 L598 G602	T550-H554 PolarHBondContact O-N 3.47Å; D551-H554 PolarHBondContact O-N 3.44Å; H554-R556 PolarHBondContact O-N 3.36Å; H554-L557 PolarHBondContact O-N 3.06Å; H554-H558 AromaticContact CE1-CD2 3.31Å; H554-H558 PolarHBondContact CE1-CD2 3.49Å; H554-H558 AromaticContact CE1-NE2 3.46Å; H554-H558 PolarHBondContact CE1-NE2 3.44Å; H554-H558 AromaticContact ND1-CD2 3.62Å; H554-H558 AromaticContact ND1-NE2 3.82Å; H554-H558 AromaticContact NE2-CD2 3.9Å; H554-H558 PolarHBondContact O-CD2 3.39Å; H554-H558 PolarHBondContact O-N 3.05Å; H554-L598 PolarHBondContact NE2-O 2.76Å; H554-G602 WeakPolarHBondContact CE1-CA 3.27Å; H554-G602 PolarHBondContact CE1-N 3.42Å; H554-G602 PolarHBondContact NE2-N 2.7Å
555	A	84.6	Confident	75	Confident	1 Å²	1	83.5 Å²	83.5	1%	0.008	41%	0.405	C	S	.	.	H	α-helix	trans	-58.3	-45.2	175.5	0	0	0	0	0	111.9	D551 L557 H558 I559 A566 V569 L570	D551-A555 VanDerWaalsContact O-CB 3.27Å; D551-A555 WeakPolarHBondContact O-CB 3.43Å; D551-A555 PolarHBondContact O-N 2.9Å; A555-L557 PolarHBondContact O-N 2.7Å; A555-H558 PolarHBondContact O-N 3.17Å; A555-I559 PolarHBondContact O-N 3.27Å; A555-A566 HydrophobicContact CB-CB 4.14Å; A555-A566 VanDerWaalsContact O-CB 3.25Å; A555-A566 WeakPolarHBondContact O-CB 3.44Å; A555-V569 HydrophobicContact CB-CB 4.16Å; A555-V569 HydrophobicContact CB-CG1 3.94Å; A555-L570 HydrophobicContact CB-CD1 4.38Å; A555-L570 HydrophobicContact CB-CD2 4.21Å; A555-L570 HydrophobicContact CB-CG 3.88Å
556	R	86.2	Confident	76.3	Confident	161 Å²	161	74.4 Å²	74.4	61%	0.608	37%	0.371	S	S	*	.	H	α-helix	trans	-65.3	-35.6	178.1	-76.3	173.1	-173.7	149.4	1.6	113.5	A552 H553 H554 H558 I559 L570	A552-R556 VanDerWaalsContact O-CB 3.32Å; A552-R556 WeakPolarHBondContact O-CB 3.23Å; A552-R556 WeakPolarHBondContact O-CD 3.35Å; A552-R556 WeakPolarHBondContact O-CG 3.3Å; A552-R556 PolarHBondContact O-N 2.82Å; H553-R556 PolarHBondContact O-N 2.96Å; H554-R556 PolarHBondContact O-N 3.36Å; R556-H558 VanDerWaalsContact C-N 3.26Å; R556-H558 PolarHBondContact O-N 3.01Å; R556-I559 VanDerWaalsContact O-CG2 3.24Å; R556-I559 WeakPolarHBondContact O-CG2 3.46Å; R556-L570 HydrophobicContact CG-CD1 3.94Å; R556-L570 HydrophobicContact CG-CD2 4.12Å
557	L	86.5	Confident	78.2	Confident	113 Å²	113	73.4 Å²	73.4	59%	0.592	36%	0.363	S	S	*	.	H	α-helix	trans	-63.9	-36.4	179.3	-175.2	65.8	0	0	0	111.3	H553 H554 A555	H553-L557 WeakPolarHBondContact O-CB 3.31Å; H553-L557 PolarHBondContact O-N 2.84Å; H554-L557 PolarHBondContact O-N 3.06Å; A555-L557 PolarHBondContact O-N 2.7Å
558	H	86.8	Confident	79.9	Confident	41 Å²	41	71.6 Å²	71.6	19%	0.19	35%	0.348	C	S	.	.	H	α-helix	trans	-105.8	9.3	-175.3	-63.4	-66.7	0	0	0	114.2	H554 A555 R556 A560 T561 Y562 L598	H554-H558 AromaticContact CE1-CD2 3.31Å; H554-H558 PolarHBondContact CE1-CD2 3.49Å; H554-H558 AromaticContact CE1-NE2 3.46Å; H554-H558 PolarHBondContact CE1-NE2 3.44Å; H554-H558 AromaticContact ND1-CD2 3.62Å; H554-H558 AromaticContact ND1-NE2 3.82Å; H554-H558 AromaticContact NE2-CD2 3.9Å; H554-H558 PolarHBondContact O-CD2 3.39Å; H554-H558 PolarHBondContact O-N 3.05Å; A555-H558 PolarHBondContact O-N 3.17Å; R556-H558 VanDerWaalsContact C-N 3.26Å; R556-H558 PolarHBondContact O-N 3.01Å; H558-A560 PolarHBondContact O-N 3.48Å; H558-A560 VanDerWaalsContact O-N 3.17Å; H558-T561 PolarHBondContact O-N 2.66Å; H558-Y562 HydrophobicContact CB-CD2 4.23Å; H558-Y562 PolarHBondContact O-N 3.14Å; H558-L598 HydrophobicContact CB-CD1 3.47Å; H558-L598 VanDerWaalsContact CB-CD1 3.47Å
559	I	89.2	Confident	81.8	Confident	59 Å²	59	64.7 Å²	64.7	30%	0.303	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-28.2	-178	-162.9	166.8	0	0	0	113	A555 R556 T561 K563 A566 E567 L570	A555-I559 PolarHBondContact O-N 3.27Å; R556-I559 VanDerWaalsContact O-CG2 3.24Å; R556-I559 WeakPolarHBondContact O-CG2 3.46Å; I559-T561 VanDerWaalsContact C-N 3.31Å; I559-T561 PolarHBondContact O-N 3.36Å; I559-K563 WeakPolarHBondContact O-CA 3.23Å; I559-K563 VanDerWaalsContact O-CB 3.32Å; I559-K563 WeakPolarHBondContact O-CB 3.43Å; I559-K563 PolarHBondContact O-N 3.4Å; I559-A566 HydrophobicContact CB-CB 3.97Å; I559-A566 HydrophobicContact CG1-CB 3.89Å; I559-E567 HydrophobicContact CD1-CG 4.13Å; I559-L570 HydrophobicContact CD1-CD1 4.42Å
560	A	88.6	Confident	83.4	Confident	98 Å²	98	59.9 Å²	59.9	81%	0.81	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-30.9	176.3	0	0	0	0	0	112.7	H558	H558-A560 PolarHBondContact O-N 3.48Å; H558-A560 VanDerWaalsContact O-N 3.17Å
561	T	91.6	Very high	85	Confident	100 Å²	100	59.7 Å²	59.7	61%	0.613	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-42.6	-176.9	-48	0	0	0	0	112	H558 I559	H558-T561 PolarHBondContact O-N 2.66Å; I559-T561 VanDerWaalsContact C-N 3.31Å; I559-T561 PolarHBondContact O-N 3.36Å
562	Y	91	Very high	86.5	Confident	48 Å²	48	60.3 Å²	60.3	19%	0.188	31%	0.309	C	S	.	.	S	Bend	trans	-119.9	56.2	-177.3	-56.1	-73.7	0	0	0	110.6	H558 R564 A565 A566 Q594 K597 L598 L601	H558-Y562 HydrophobicContact CB-CD2 4.23Å; H558-Y562 PolarHBondContact O-N 3.14Å; Y562-R564 PolarHBondContact O-N 3.26Å; Y562-A565 PolarHBondContact O-N 3.18Å; Y562-A566 VanDerWaalsContact O-CB 3.25Å; Y562-A566 WeakPolarHBondContact O-CB 3.38Å; Y562-A566 PolarHBondContact O-N 3.31Å; Y562-Q594 HydrophobicContact CD1-CB 4.27Å; Y562-Q594 HydrophobicContact CD1-CG 4.31Å; Y562-K597 HydrophobicContact CD1-CB 4.42Å; Y562-K597 HydrophobicContact CE1-CB 3.64Å; Y562-K597 HydrophobicContact CE1-CD 4.08Å; Y562-L598 HydrophobicContact CD2-CB 4.15Å; Y562-L598 HydrophobicContact CD2-CD1 4.08Å; Y562-L598 HydrophobicContact CG-CB 4.15Å; Y562-L601 HydrophobicContact CD2-CD1 4.39Å; Y562-L601 HydrophobicContact CE2-CD1 3.59Å
563	K	89.8	Confident	87.2	Confident	128 Å²	128	61.5 Å²	61.5	56%	0.557	31%	0.312	S	S	*	.	H	α-helix	trans	-50.6	-55.3	-169.5	-173.4	-178.6	174.4	-173.4	0	113.4	I559 A566 E567	I559-K563 WeakPolarHBondContact O-CA 3.23Å; I559-K563 VanDerWaalsContact O-CB 3.32Å; I559-K563 WeakPolarHBondContact O-CB 3.43Å; I559-K563 PolarHBondContact O-N 3.4Å; K563-A566 PolarHBondContact O-N 3.1Å; K563-E567 WeakPolarHBondContact CE-OE1 3.05Å; K563-E567 WeakPolarHBondContact O-CB 3.49Å; K563-E567 WeakPolarHBondContact O-CG 3.04Å; K563-E567 PolarHBondContact O-N 2.6Å
564	R	89.4	Confident	87.4	Confident	68 Å²	68	62.5 Å²	62.5	26%	0.257	32%	0.315	S	S	.	.	H	α-helix	trans	-61.3	-51.5	-177.1	-169.8	-177.7	177.6	149.9	2.6	111.2	Y562 A566 E567 E568 E587 L591	Y562-R564 PolarHBondContact O-N 3.26Å; R564-A566 VanDerWaalsContact C-N 3.33Å; R564-A566 PolarHBondContact O-N 3.14Å; R564-E567 PolarHBondContact O-N 3.11Å; R564-E568 WeakPolarHBondContact O-CB 3.37Å; R564-E568 VanDerWaalsContact O-CG 3.24Å; R564-E568 WeakPolarHBondContact O-CG 3.42Å; R564-E568 PolarHBondContact O-N 3.25Å; R564-E587 IonicContact CZ-OE1 2.8Å; R564-E587 IonicContact CZ-OE2 3.15Å; R564-E587 IonicContact NH1-OE1 3.5Å; R564-E587 PolarHBondContact NH1-OE1 3.06Å; R564-E587 IonicContact NH1-OE2 3.56Å; R564-E587 VanDerWaalsContact NH2-CD 3.32Å; R564-E587 IonicContact NH2-OE1 3.47Å; R564-E587 IonicContact NH2-OE2 3.56Å; R564-E587 PolarHBondContact NH2-OE2 3.03Å; R564-L591 HydrophobicContact CG-CD1 4.15Å
565	A	91.3	Very high	87.3	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-61.8	-38.5	178.6	0	0	0	0	0	113.2	Y562 V569 L591 Q594 L595 L598	Y562-A565 PolarHBondContact O-N 3.18Å; A565-V569 WeakPolarHBondContact O-CB 3.13Å; A565-V569 VanDerWaalsContact O-CG2 3.25Å; A565-V569 WeakPolarHBondContact O-CG2 3.31Å; A565-V569 PolarHBondContact O-N 3.39Å; A565-L591 HydrophobicContact CB-CD1 4.22Å; A565-Q594 HydrophobicContact CB-CB 3.6Å; A565-L595 HydrophobicContact CB-CD2 3.87Å; A565-L595 HydrophobicContact CB-CG 3.9Å; A565-L598 HydrophobicContact CB-CB 4.49Å; A565-L598 HydrophobicContact CB-CD2 3.9Å
566	A	90.7	Very high	87	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-68.3	-42.5	177.9	0	0	0	0	0	112.3	A555 I559 Y562 K563 R564 V569 L570 L598	A555-A566 HydrophobicContact CB-CB 4.14Å; A555-A566 VanDerWaalsContact O-CB 3.25Å; A555-A566 WeakPolarHBondContact O-CB 3.44Å; I559-A566 HydrophobicContact CB-CB 3.97Å; I559-A566 HydrophobicContact CG1-CB 3.89Å; Y562-A566 VanDerWaalsContact O-CB 3.25Å; Y562-A566 WeakPolarHBondContact O-CB 3.38Å; Y562-A566 PolarHBondContact O-N 3.31Å; K563-A566 PolarHBondContact O-N 3.1Å; R564-A566 VanDerWaalsContact C-N 3.33Å; R564-A566 PolarHBondContact O-N 3.14Å; A566-V569 PolarHBondContact O-N 3.13Å; A566-L570 WeakPolarHBondContact O-CB 2.78Å; A566-L570 WeakPolarHBondContact O-CD1 3.42Å; A566-L570 WeakPolarHBondContact O-CG 3.27Å; A566-L570 PolarHBondContact O-N 3.49Å; A566-L598 HydrophobicContact CB-CD2 4.09Å
567	E	90.1	Very high	86.9	Confident	91 Å²	91	69.1 Å²	69.1	43%	0.425	37%	0.367	S	S	.	.	H	α-helix	trans	-60.7	-46.7	174.5	-74.1	171.3	169	0	0	110.6	I559 K563 R564 L570 S571	I559-E567 HydrophobicContact CD1-CG 4.13Å; K563-E567 WeakPolarHBondContact CE-OE1 3.05Å; K563-E567 WeakPolarHBondContact O-CB 3.49Å; K563-E567 WeakPolarHBondContact O-CG 3.04Å; K563-E567 PolarHBondContact O-N 2.6Å; R564-E567 PolarHBondContact O-N 3.11Å; E567-L570 WeakPolarHBondContact O-CB 3.31Å; E567-L570 PolarHBondContact O-N 3.39Å; E567-L570 VanDerWaalsContact O-N 3.17Å; E567-S571 PolarHBondContact O-N 2.94Å; E567-S571 VanDerWaalsContact O-N 3.09Å; E567-S571 PolarHBondContact O-OG 3.42Å; E567-S571 VanDerWaalsContact O-OG 3.14Å
568	E	89.8	Confident	86.9	Confident	39 Å²	39	66 Å²	66	18%	0.182	35%	0.349	C	S	.	.	H	α-helix	trans	-61.5	-44.3	175.6	-72.4	-70.5	153	0	0	112.6	R564 L570 S571 N572 F578 S580 L591	R564-E568 WeakPolarHBondContact O-CB 3.37Å; R564-E568 VanDerWaalsContact O-CG 3.24Å; R564-E568 WeakPolarHBondContact O-CG 3.42Å; R564-E568 PolarHBondContact O-N 3.25Å; E568-L570 PolarHBondContact O-N 3.21Å; E568-S571 PolarHBondContact O-N 2.94Å; E568-S571 PolarHBondContact O-OG 3.49Å; E568-N572 WeakPolarHBondContact O-CA 3.47Å; E568-N572 WeakPolarHBondContact O-CB 3.44Å; E568-N572 PolarHBondContact O-N 3.29Å; E568-N572 PolarHBondContact OE2-ND2 3.01Å; E568-F578 HydrophobicContact CB-CE2 3.83Å; E568-F578 HydrophobicContact CB-CZ 3.86Å; E568-S580 VanDerWaalsContact CD-OG 3.25Å; E568-S580 VanDerWaalsContact OE2-CB 3.22Å; E568-S580 WeakPolarHBondContact OE2-CB 3.16Å; E568-S580 PolarHBondContact OE2-OG 2.97Å; E568-L591 HydrophobicContact CB-CD1 4.36Å; E568-L591 HydrophobicContact CG-CD1 3.98Å; E568-L591 HydrophobicContact CG-CD2 4.23Å
569	V	88.3	Confident	86.9	Confident	8 Å²	8	66.7 Å²	66.7	5%	0.048	35%	0.353	C	S	.	.	H	α-helix	trans	-62.8	-33.7	176.5	168.1	0	0	0	0	111.3	D551 A555 A565 A566 M573 F578 L595 L598 M599	D551-V569 HydrophobicContact CB-CG1 4.38Å; A555-V569 HydrophobicContact CB-CB 4.16Å; A555-V569 HydrophobicContact CB-CG1 3.94Å; A565-V569 WeakPolarHBondContact O-CB 3.13Å; A565-V569 VanDerWaalsContact O-CG2 3.25Å; A565-V569 WeakPolarHBondContact O-CG2 3.31Å; A565-V569 PolarHBondContact O-N 3.39Å; A566-V569 PolarHBondContact O-N 3.13Å; V569-M573 HydrophobicContact CG1-CB 4.47Å; V569-M573 HydrophobicContact CG1-CE 4.07Å; V569-M573 HydrophobicContact CG1-SD 4.13Å; V569-M573 VanDerWaalsContact O-CB 3.26Å; V569-M573 WeakPolarHBondContact O-CB 3.5Å; V569-F578 HydrophobicContact CG2-CD2 4.41Å; V569-F578 HydrophobicContact CG2-CE2 4.4Å; V569-L595 HydrophobicContact CG2-CD2 3.55Å; V569-L598 HydrophobicContact CG2-CD2 4.28Å; V569-M599 HydrophobicContact CG2-SD 4.25Å
570	L	86.7	Confident	86.9	Confident	62 Å²	62	66 Å²	66	33%	0.325	35%	0.353	S	S	.	.	H	α-helix	trans	-72.2	-33.6	179.6	-73.7	166.8	0	0	0	113.4	A552 A555 R556 I559 A566 E567 E568	A552-L570 HydrophobicContact CB-CD2 3.63Å; A555-L570 HydrophobicContact CB-CD1 4.38Å; A555-L570 HydrophobicContact CB-CD2 4.21Å; A555-L570 HydrophobicContact CB-CG 3.88Å; R556-L570 HydrophobicContact CG-CD1 3.94Å; R556-L570 HydrophobicContact CG-CD2 4.12Å; I559-L570 HydrophobicContact CD1-CD1 4.42Å; A566-L570 WeakPolarHBondContact O-CB 2.78Å; A566-L570 WeakPolarHBondContact O-CD1 3.42Å; A566-L570 WeakPolarHBondContact O-CG 3.27Å; A566-L570 PolarHBondContact O-N 3.49Å; E567-L570 WeakPolarHBondContact O-CB 3.31Å; E567-L570 PolarHBondContact O-N 3.39Å; E567-L570 VanDerWaalsContact O-N 3.17Å; E568-L570 PolarHBondContact O-N 3.21Å
571	S	83.3	Confident	86.8	Confident	51 Å²	51	65.3 Å²	65.3	36%	0.357	34%	0.343	S	S	.	.	H	α-helix	trans	-91.9	-40.7	-179.9	54.1	0	0	0	0	113	E567 E568	E567-S571 PolarHBondContact O-N 2.94Å; E567-S571 VanDerWaalsContact O-N 3.09Å; E567-S571 PolarHBondContact O-OG 3.42Å; E567-S571 VanDerWaalsContact O-OG 3.14Å; E568-S571 PolarHBondContact O-N 2.94Å; E568-S571 PolarHBondContact O-OG 3.49Å
572	N	86	Confident	86.6	Confident	54 Å²	54	62.5 Å²	62.5	29%	0.289	33%	0.327	S	S	.	.	H	α-helix	trans	-115.2	8	-159	-73.9	-36.3	0	0	0	115.1	E568 F578 L579	E568-N572 WeakPolarHBondContact O-CA 3.47Å; E568-N572 WeakPolarHBondContact O-CB 3.44Å; E568-N572 PolarHBondContact O-N 3.29Å; E568-N572 PolarHBondContact OE2-ND2 3.01Å; N572-F578 HydrophobicContact CB-CE2 4.18Å; N572-L579 VanDerWaalsContact CB-O 3.25Å; N572-L579 WeakPolarHBondContact CB-O 3.43Å; N572-L579 PolarHBondContact O-N 3.43Å
573	M	84.3	Confident	86.2	Confident	44 Å²	44	64.4 Å²	64.4	22%	0.217	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	122	172.7	-158.6	146.1	90.8	0	0	112.1	D551 V569 F578 M599	D551-M573 HydrophobicContact CB-CE 3.03Å; D551-M573 WeakPolarHBondContact OD2-CE 3.1Å; V569-M573 HydrophobicContact CG1-CB 4.47Å; V569-M573 HydrophobicContact CG1-CE 4.07Å; V569-M573 HydrophobicContact CG1-SD 4.13Å; V569-M573 VanDerWaalsContact O-CB 3.26Å; V569-M573 WeakPolarHBondContact O-CB 3.5Å; M573-F578 HydrophobicContact SD-CB 4.49Å; M573-M599 HydrophobicContact CE-CE 4.38Å; M573-M599 HydrophobicContact SD-CE 4.47Å
574	F	78.9	Confident	86	Confident	127 Å²	127	62.6 Å²	62.6	56%	0.557	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	105.8	178.4	-177.5	-95.4	0	0	0	110.5	D576 D577 L637	F574-D576 PolarHBondContact O-N 3.16Å; F574-D577 PolarHBondContact N-O 3Å; F574-D577 PolarHBondContact O-N 2.86Å; F574-L637 HydrophobicContact CB-CD2 4.11Å; F574-L637 HydrophobicContact CD1-CD2 3.45Å; F574-L637 VanDerWaalsContact CD1-CD2 3.45Å; F574-L637 HydrophobicContact CE1-CD2 4.18Å; F574-L637 HydrophobicContact CG-CD2 4.03Å
575	V	79.9	Confident	85.9	Confident	110 Å²	110	61.4 Å²	61.4	67%	0.667	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	-104.3	-174.4	-169.8	0	0	0	0	109.7
576	D	78.9	Confident	85.7	Confident	133 Å²	133	62.8 Å²	62.8	71%	0.711	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	-4.9	-179.9	56.8	-37.6	0	0	0	113.3	F574	F574-D576 PolarHBondContact O-N 3.16Å
577	D	82.7	Confident	85.6	Confident	77 Å²	77	65.8 Å²	65.8	41%	0.412	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.9	179.3	-72.5	-34.6	0	0	0	111.1	F574 L579 L637	F574-D577 PolarHBondContact N-O 3Å; F574-D577 PolarHBondContact O-N 2.86Å; D577-L579 HydrophobicContact CB-CD1 3.88Å; D577-L637 HydrophobicContact CB-CD2 4.16Å
578	F	86.7	Confident	85.7	Confident	49 Å²	49	62.3 Å²	62.3	22%	0.215	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	130.7	171.8	172	-96.5	0	0	0	110.2	E568 V569 N572 M573 S580 L595	E568-F578 HydrophobicContact CB-CE2 3.83Å; E568-F578 HydrophobicContact CB-CZ 3.86Å; V569-F578 HydrophobicContact CG2-CD2 4.41Å; V569-F578 HydrophobicContact CG2-CE2 4.4Å; N572-F578 HydrophobicContact CB-CE2 4.18Å; M573-F578 HydrophobicContact SD-CB 4.49Å; F578-S580 VanDerWaalsContact CZ-CB 3.47Å; F578-L595 HydrophobicContact CD1-CD1 3.93Å; F578-L595 HydrophobicContact CE1-CD1 3.25Å; F578-L595 HydrophobicContact CE1-CD2 4.31Å; F578-L595 HydrophobicContact CE1-CG 4.43Å; F578-L595 HydrophobicContact CE2-CD1 4.45Å; F578-L595 HydrophobicContact CE2-CD2 4.14Å; F578-L595 HydrophobicContact CZ-CD1 3.56Å; F578-L595 HydrophobicContact CZ-CD2 4Å; F578-L595 HydrophobicContact CZ-CG 4.41Å
579	L	87.8	Confident	85.7	Confident	54 Å²	54	64 Å²	64	28%	0.283	38%	0.375	S	S	.	.			trans	-135.8	113.3	-177.8	-67.9	94	0	0	0	111.7	N572 D577 V636 L637	N572-L579 VanDerWaalsContact CB-O 3.25Å; N572-L579 WeakPolarHBondContact CB-O 3.43Å; N572-L579 PolarHBondContact O-N 3.43Å; D577-L579 HydrophobicContact CB-CD1 3.88Å; L579-V636 HydrophobicContact CD2-CG1 3.12Å; L579-V636 HydrophobicContact CG-CG1 4.33Å; L579-L637 HydrophobicContact CD1-CD1 3.97Å; L579-L637 HydrophobicContact CD1-CD2 3.66Å; L579-L637 HydrophobicContact CD1-CG 3.74Å; L579-L637 HydrophobicContact CD2-CD1 3.84Å; L579-L637 HydrophobicContact CD2-CG 3.76Å; L579-L637 HydrophobicContact CG-CG 4.46Å
580	S	89	Confident	85.8	Confident	44 Å²	44	69.4 Å²	69.4	31%	0.308	40%	0.399	S	S	.	.			trans	-131.7	166.6	177	-175	0	0	0	0	111.4	E568 F578	E568-S580 VanDerWaalsContact CD-OG 3.25Å; E568-S580 VanDerWaalsContact OE2-CB 3.22Å; E568-S580 WeakPolarHBondContact OE2-CB 3.16Å; E568-S580 PolarHBondContact OE2-OG 2.97Å; F578-S580 VanDerWaalsContact CZ-CB 3.47Å
581	S	87.4	Confident	86.1	Confident	84 Å²	84	66.7 Å²	66.7	59%	0.587	39%	0.385	S	S	*	.			trans	-130.7	135.8	175.1	55.2	0	0	0	0	109.8
582	C	86.8	Confident	86.5	Confident	42 Å²	42	65 Å²	65	28%	0.284	37%	0.372	S	S	.	.			trans	-117.6	156.1	177.8	-63.5	0	0	0	0	110.2	E587 A588	C582-E587 HydrophobicContact CB-CB 4.11Å; C582-A588 HydrophobicContact CB-CB 3.93Å
583	A	82.1	Confident	86.7	Confident	87 Å²	87	65.9 Å²	65.9	72%	0.719	38%	0.377	S	S	*	.	S	Bend	trans	-72	-34.5	-179.3	0	0	0	0	0	112.4
584	D	85.2	Confident	87.2	Confident	90 Å²	90	66.3 Å²	66.3	48%	0.481	38%	0.378	S	S	.	.	S	Bend	trans	-143.9	171	178.7	66	66.8	0	0	0	112.4	G586 E587 A588	D584-G586 PolarHBondContact O-N 3.14Å; D584-G586 WeakPolarHBondContact OD1-CA 3.31Å; D584-G586 PolarHBondContact OD1-N 3.25Å; D584-E587 PolarHBondContact OD1-N 3.27Å; D584-A588 PolarHBondContact O-N 3.28Å
585	S	87.1	Confident	87.8	Confident	43 Å²	43	60.3 Å²	60.3	30%	0.301	35%	0.352	S	S	.	.	H	α-helix	trans	-63.6	-36.4	-178.8	-57.3	0	0	0	0	113.3	A588 E589 S613 S615 V616	S585-A588 WeakPolarHBondContact O-CB 3.37Å; S585-A588 PolarHBondContact O-N 3.42Å; S585-E589 WeakPolarHBondContact O-CG 3.3Å; S585-E589 PolarHBondContact O-N 3.19Å; S585-S613 PolarHBondContact OG-OG 3.45Å; S585-S613 VanDerWaalsContact OG-OG 3.07Å; S585-S615 PolarHBondContact OG-OG 3.48Å; S585-V616 VanDerWaalsContact CB-CG2 3.48Å
586	G	88.6	Confident	88.3	Confident	30 Å²	30	59.9 Å²	59.9	31%	0.309	34%	0.339	S	S	.	.	H	α-helix	trans	-69.6	-40.8	-177.6	0	0	0	0	0	111.9	D584 A588 E589 Q590	D584-G586 PolarHBondContact O-N 3.14Å; D584-G586 WeakPolarHBondContact OD1-CA 3.31Å; D584-G586 PolarHBondContact OD1-N 3.25Å; G586-A588 VanDerWaalsContact C-N 3.31Å; G586-A588 PolarHBondContact O-N 3.32Å; G586-E589 PolarHBondContact O-N 3.27Å; G586-Q590 WeakPolarHBondContact O-CG 3.28Å; G586-Q590 PolarHBondContact O-N 3.34Å; G586-Q590 VanDerWaalsContact O-N 3.13Å
587	E	88.8	Confident	89	Confident	62 Å²	62	57.8 Å²	57.8	29%	0.29	32%	0.323	S	S	.	.	H	α-helix	trans	-60.8	-40.5	170.6	-73	-151.8	130.8	0	0	112.5	R564 C582 D584 Q590 L591	R564-E587 IonicContact CZ-OE1 2.8Å; R564-E587 IonicContact CZ-OE2 3.15Å; R564-E587 IonicContact NH1-OE1 3.5Å; R564-E587 PolarHBondContact NH1-OE1 3.06Å; R564-E587 IonicContact NH1-OE2 3.56Å; R564-E587 VanDerWaalsContact NH2-CD 3.32Å; R564-E587 IonicContact NH2-OE1 3.47Å; R564-E587 IonicContact NH2-OE2 3.56Å; R564-E587 PolarHBondContact NH2-OE2 3.03Å; C582-E587 HydrophobicContact CB-CB 4.11Å; D584-E587 PolarHBondContact OD1-N 3.27Å; E587-Q590 PolarHBondContact O-N 3.06Å; E587-L591 WeakPolarHBondContact O-CB 3.17Å; E587-L591 PolarHBondContact O-N 3.2Å
588	A	90.6	Very high	89.4	Confident	19 Å²	19	54.1 Å²	54.1	16%	0.157	30%	0.304	C	S	.	.	H	α-helix	trans	-64	-43.7	179	0	0	0	0	0	111.8	C582 D584 S585 G586 L591 V592 V616	C582-A588 HydrophobicContact CB-CB 3.93Å; D584-A588 PolarHBondContact O-N 3.28Å; S585-A588 WeakPolarHBondContact O-CB 3.37Å; S585-A588 PolarHBondContact O-N 3.42Å; G586-A588 VanDerWaalsContact C-N 3.31Å; G586-A588 PolarHBondContact O-N 3.32Å; A588-L591 PolarHBondContact O-N 3.41Å; A588-V592 WeakPolarHBondContact O-CG2 3.38Å; A588-V592 PolarHBondContact O-N 3Å; A588-V616 HydrophobicContact CB-CG1 4.18Å; A588-V616 HydrophobicContact CB-CG2 4.17Å
589	E	90.1	Very high	89.6	Confident	75 Å²	75	52.1 Å²	52.1	35%	0.35	30%	0.295	S	S	.	.	H	α-helix	trans	-60.8	-45.3	176.2	-73.1	170.4	-152.6	0	0	111.7	S585 G586 L591 V592 D593 V616 A619	S585-E589 WeakPolarHBondContact O-CG 3.3Å; S585-E589 PolarHBondContact O-N 3.19Å; G586-E589 PolarHBondContact O-N 3.27Å; E589-L591 PolarHBondContact O-N 3.05Å; E589-V592 PolarHBondContact O-N 3.47Å; E589-D593 PolarHBondContact O-N 3.14Å; E589-V616 HydrophobicContact CG-CG1 4.39Å; E589-V616 HydrophobicContact CG-CG2 4.32Å; E589-A619 HydrophobicContact CG-CB 3.89Å
590	Q	91	Very high	89.6	Confident	120 Å²	120	56.3 Å²	56.3	56%	0.561	31%	0.313	S	S	*	.	H	α-helix	trans	-62.7	-42.7	176.4	-71	178.9	13.6	0	0	112.3	G586 E587 V592 D593 Q594	G586-Q590 WeakPolarHBondContact O-CG 3.28Å; G586-Q590 PolarHBondContact O-N 3.34Å; G586-Q590 VanDerWaalsContact O-N 3.13Å; E587-Q590 PolarHBondContact O-N 3.06Å; Q590-V592 VanDerWaalsContact C-N 3.35Å; Q590-D593 PolarHBondContact O-N 2.93Å; Q590-Q594 WeakPolarHBondContact O-CG 3.33Å; Q590-Q594 PolarHBondContact O-N 3.31Å
591	L	92.8	Very high	89.5	Confident	5 Å²	5	58.8 Å²	58.8	3%	0.026	32%	0.323	C	S	.	.	H	α-helix	trans	-63	-43.2	177.4	176.7	58.7	0	0	0	111	R564 A565 E568 E587 A588 E589 Q594 L595	R564-L591 HydrophobicContact CG-CD1 4.15Å; A565-L591 HydrophobicContact CB-CD1 4.22Å; E568-L591 HydrophobicContact CB-CD1 4.36Å; E568-L591 HydrophobicContact CG-CD1 3.98Å; E568-L591 HydrophobicContact CG-CD2 4.23Å; E587-L591 WeakPolarHBondContact O-CB 3.17Å; E587-L591 PolarHBondContact O-N 3.2Å; A588-L591 PolarHBondContact O-N 3.41Å; E589-L591 PolarHBondContact O-N 3.05Å; L591-Q594 PolarHBondContact O-N 3.06Å; L591-L595 HydrophobicContact CD1-CD1 3.95Å; L591-L595 HydrophobicContact CD1-CG 4Å; L591-L595 HydrophobicContact CD2-CD1 4.45Å; L591-L595 HydrophobicContact CG-CD1 3.75Å; L591-L595 HydrophobicContact CG-CG 4.3Å; L591-L595 WeakPolarHBondContact O-CB 3.33Å; L591-L595 VanDerWaalsContact O-CG 3.25Å; L591-L595 WeakPolarHBondContact O-CG 3.18Å; L591-L595 PolarHBondContact O-N 2.71Å
592	V	91.2	Very high	89.4	Confident	15 Å²	15	56.3 Å²	56.3	9%	0.091	31%	0.31	C	S	.	.	H	α-helix	trans	-63.4	-43	178.7	171.7	0	0	0	0	111.5	A588 E589 Q590 L595 R596 W609 I620	A588-V592 WeakPolarHBondContact O-CG2 3.38Å; A588-V592 PolarHBondContact O-N 3Å; E589-V592 PolarHBondContact O-N 3.47Å; Q590-V592 VanDerWaalsContact C-N 3.35Å; V592-L595 PolarHBondContact O-N 3.11Å; V592-R596 WeakPolarHBondContact O-CG 3.43Å; V592-R596 PolarHBondContact O-N 3.48Å; V592-W609 HydrophobicContact CB-CH2 4.41Å; V592-W609 HydrophobicContact CB-CZ3 4.28Å; V592-W609 HydrophobicContact CG1-CE3 4.26Å; V592-W609 HydrophobicContact CG1-CH2 3.84Å; V592-W609 HydrophobicContact CG1-CZ2 4.15Å; V592-W609 HydrophobicContact CG1-CZ3 3.91Å; V592-W609 HydrophobicContact CG2-CE3 4.23Å; V592-W609 HydrophobicContact CG2-CH2 4.32Å; V592-W609 HydrophobicContact CG2-CZ3 3.72Å; V592-I620 HydrophobicContact CB-CD1 3.98Å; V592-I620 HydrophobicContact CB-CG1 4.27Å; V592-I620 HydrophobicContact CG1-CD1 3.78Å; V592-I620 HydrophobicContact CG1-CG1 3.81Å; V592-I620 HydrophobicContact CG1-CG2 4Å; V592-I620 HydrophobicContact CG2-CD1 3.55Å; V592-I620 HydrophobicContact CG2-CG1 4.38Å
593	D	91.1	Very high	89.3	Confident	74 Å²	74	57.6 Å²	57.6	40%	0.396	33%	0.33	S	S	.	.	H	α-helix	trans	-60.8	-47	175.5	177.3	64.1	0	0	0	111.6	E589 Q590 L595 R596 K597	E589-D593 PolarHBondContact O-N 3.14Å; Q590-D593 PolarHBondContact O-N 2.93Å; D593-L595 PolarHBondContact O-N 3.24Å; D593-R596 PolarHBondContact O-N 3.3Å; D593-K597 VanDerWaalsContact CG-NZ 3.28Å; D593-K597 WeakPolarHBondContact O-CG 3.5Å; D593-K597 PolarHBondContact O-N 3.19Å; D593-K597 VanDerWaalsContact O-N 3.11Å; D593-K597 WeakPolarHBondContact OD1-CE 3.22Å; D593-K597 IonicContact OD1-NZ 3.59Å; D593-K597 PolarHBondContact OD1-NZ 2.84Å; D593-K597 VanDerWaalsContact OD1-NZ 3.1Å; D593-K597 WeakPolarHBondContact OD2-CE 3.2Å; D593-K597 IonicContact OD2-NZ 2.75Å; D593-K597 PolarHBondContact OD2-NZ 2.87Å
594	Q	93.4	Very high	89.4	Confident	52 Å²	52	57.3 Å²	57.3	24%	0.243	31%	0.313	C	S	.	.	H	α-helix	trans	-62.8	-41.5	175.8	-71.3	-171.7	21	0	0	112.4	Y562 A565 Q590 L591 K597 L598	Y562-Q594 HydrophobicContact CD1-CB 4.27Å; Y562-Q594 HydrophobicContact CD1-CG 4.31Å; A565-Q594 HydrophobicContact CB-CB 3.6Å; Q590-Q594 WeakPolarHBondContact O-CG 3.33Å; Q590-Q594 PolarHBondContact O-N 3.31Å; L591-Q594 PolarHBondContact O-N 3.06Å; Q594-K597 PolarHBondContact O-N 3.19Å; Q594-L598 WeakPolarHBondContact O-CB 3.4Å; Q594-L598 PolarHBondContact O-N 2.94Å
595	L	92.8	Very high	89.3	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-63.3	-44.6	178.1	-78.4	165.6	0	0	0	111.8	A565 V569 F578 L591 V592 D593 L598 M599 L606 W609	A565-L595 HydrophobicContact CB-CD2 3.87Å; A565-L595 HydrophobicContact CB-CG 3.9Å; V569-L595 HydrophobicContact CG2-CD2 3.55Å; F578-L595 HydrophobicContact CD1-CD1 3.93Å; F578-L595 HydrophobicContact CE1-CD1 3.25Å; F578-L595 HydrophobicContact CE1-CD2 4.31Å; F578-L595 HydrophobicContact CE1-CG 4.43Å; F578-L595 HydrophobicContact CE2-CD1 4.45Å; F578-L595 HydrophobicContact CE2-CD2 4.14Å; F578-L595 HydrophobicContact CZ-CD1 3.56Å; F578-L595 HydrophobicContact CZ-CD2 4Å; F578-L595 HydrophobicContact CZ-CG 4.41Å; L591-L595 HydrophobicContact CD1-CD1 3.95Å; L591-L595 HydrophobicContact CD1-CG 4Å; L591-L595 HydrophobicContact CD2-CD1 4.45Å; L591-L595 HydrophobicContact CG-CD1 3.75Å; L591-L595 HydrophobicContact CG-CG 4.3Å; L591-L595 WeakPolarHBondContact O-CB 3.33Å; L591-L595 VanDerWaalsContact O-CG 3.25Å; L591-L595 WeakPolarHBondContact O-CG 3.18Å; L591-L595 PolarHBondContact O-N 2.71Å; V592-L595 PolarHBondContact O-N 3.11Å; D593-L595 PolarHBondContact O-N 3.24Å; L595-L598 PolarHBondContact O-N 3.36Å; L595-M599 VanDerWaalsContact O-CB 3.3Å; L595-M599 WeakPolarHBondContact O-CB 3.48Å; L595-M599 VanDerWaalsContact O-CG 3.24Å; L595-M599 WeakPolarHBondContact O-CG 3.24Å; L595-M599 PolarHBondContact O-N 3.32Å; L595-L606 HydrophobicContact CB-CD1 4.01Å; L595-W609 HydrophobicContact CB-CH2 4.21Å; L595-W609 HydrophobicContact CD1-CH2 4.27Å
596	R	91.1	Very high	89.2	Confident	101 Å²	101	59.5 Å²	59.5	38%	0.381	32%	0.321	S	S	.	.	H	α-helix	trans	-57.8	-51	176.1	-78.3	176.4	168.9	179.3	-5.9	110.7	V592 D593 Q600 W609 I620	V592-R596 WeakPolarHBondContact O-CG 3.43Å; V592-R596 PolarHBondContact O-N 3.48Å; D593-R596 PolarHBondContact O-N 3.3Å; R596-Q600 WeakPolarHBondContact O-CB 2.83Å; R596-Q600 PolarHBondContact O-N 2.65Å; R596-W609 HydrophobicContact CG-CZ2 3.96Å; R596-I620 PolarHBondContact NH1-O 2.74Å; R596-I620 PolarHBondContact NH2-O 2.8Å
597	K	93.4	Very high	89	Confident	89 Å²	89	62.6 Å²	62.6	39%	0.387	33%	0.334	S	S	.	.	H	α-helix	trans	-63.1	-46.8	179.7	-70.3	170.3	-179.7	165.2	0	112	Y562 D593 Q594 Q600 L601	Y562-K597 HydrophobicContact CD1-CB 4.42Å; Y562-K597 HydrophobicContact CE1-CB 3.64Å; Y562-K597 HydrophobicContact CE1-CD 4.08Å; D593-K597 VanDerWaalsContact CG-NZ 3.28Å; D593-K597 WeakPolarHBondContact O-CG 3.5Å; D593-K597 PolarHBondContact O-N 3.19Å; D593-K597 VanDerWaalsContact O-N 3.11Å; D593-K597 WeakPolarHBondContact OD1-CE 3.22Å; D593-K597 IonicContact OD1-NZ 3.59Å; D593-K597 PolarHBondContact OD1-NZ 2.84Å; D593-K597 VanDerWaalsContact OD1-NZ 3.1Å; D593-K597 WeakPolarHBondContact OD2-CE 3.2Å; D593-K597 IonicContact OD2-NZ 2.75Å; D593-K597 PolarHBondContact OD2-NZ 2.87Å; Q594-K597 PolarHBondContact O-N 3.19Å; K597-Q600 PolarHBondContact O-N 3.07Å; K597-L601 WeakPolarHBondContact O-CG 2.9Å; K597-L601 PolarHBondContact O-N 3.44Å
598	L	91.3	Very high	88.7	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-57.9	-55.2	177.5	173.8	62.2	0	0	0	110.5	H554 H558 Y562 A565 A566 V569 Q594 L595 Q600 L601	H554-L598 PolarHBondContact NE2-O 2.76Å; H558-L598 HydrophobicContact CB-CD1 3.47Å; H558-L598 VanDerWaalsContact CB-CD1 3.47Å; Y562-L598 HydrophobicContact CD2-CB 4.15Å; Y562-L598 HydrophobicContact CD2-CD1 4.08Å; Y562-L598 HydrophobicContact CG-CB 4.15Å; A565-L598 HydrophobicContact CB-CB 4.49Å; A565-L598 HydrophobicContact CB-CD2 3.9Å; A566-L598 HydrophobicContact CB-CD2 4.09Å; V569-L598 HydrophobicContact CG2-CD2 4.28Å; Q594-L598 WeakPolarHBondContact O-CB 3.4Å; Q594-L598 PolarHBondContact O-N 2.94Å; L595-L598 PolarHBondContact O-N 3.36Å; L598-Q600 VanDerWaalsContact C-N 3.33Å; L598-Q600 PolarHBondContact O-N 3.47Å; L598-L601 WeakPolarHBondContact O-CB 3.26Å; L598-L601 PolarHBondContact O-N 3.27Å
599	M	89.6	Confident	88.5	Confident	7 Å²	7	69.9 Å²	69.9	3%	0.034	36%	0.36	C	S	.	.	H	α-helix	trans	-67.9	-33.8	-175.2	-65.2	-54.5	-75.4	0	0	112.2	V569 M573 L595 L601 G602 G603 F604 L606	V569-M599 HydrophobicContact CG2-SD 4.25Å; M573-M599 HydrophobicContact CE-CE 4.38Å; M573-M599 HydrophobicContact SD-CE 4.47Å; L595-M599 VanDerWaalsContact O-CB 3.3Å; L595-M599 WeakPolarHBondContact O-CB 3.48Å; L595-M599 VanDerWaalsContact O-CG 3.24Å; L595-M599 WeakPolarHBondContact O-CG 3.24Å; L595-M599 PolarHBondContact O-N 3.32Å; M599-L601 VanDerWaalsContact C-N 3.29Å; M599-L601 PolarHBondContact O-N 3.37Å; M599-G602 WeakPolarHBondContact O-CA 2.97Å; M599-G602 PolarHBondContact O-N 2.82Å; M599-G603 PolarHBondContact O-N 3.06Å; M599-F604 CarbonylContact C-O 3.58Å; M599-F604 HydrophobicContact CB-CB 4.12Å; M599-F604 WeakPolarHBondContact CB-O 3.26Å; M599-F604 HydrophobicContact CE-CB 3.91Å; M599-F604 HydrophobicContact CE-CD2 4.02Å; M599-F604 HydrophobicContact CE-CG 4.11Å; M599-F604 PolarHBondContact O-N 3.25Å; M599-L606 HydrophobicContact CB-CD1 4.23Å; M599-L606 HydrophobicContact CB-CG 4.03Å; M599-L606 HydrophobicContact CE-CD2 4.44Å; M599-L606 HydrophobicContact CG-CD1 3.74Å; M599-L606 HydrophobicContact CG-CD2 4.22Å; M599-L606 HydrophobicContact CG-CG 3.9Å
600	Q	88.6	Confident	88.2	Confident	143 Å²	143	70.6 Å²	70.6	67%	0.668	36%	0.362	S	S	*	.	H	α-helix	trans	-61.7	-34.2	175.5	-174.1	175.7	17.6	0	0	112.8	R596 K597 L598 G602 G603 F604	R596-Q600 WeakPolarHBondContact O-CB 2.83Å; R596-Q600 PolarHBondContact O-N 2.65Å; K597-Q600 PolarHBondContact O-N 3.07Å; L598-Q600 VanDerWaalsContact C-N 3.33Å; L598-Q600 PolarHBondContact O-N 3.47Å; Q600-G602 PolarHBondContact O-N 3.44Å; Q600-G603 PolarHBondContact O-N 3.46Å; Q600-F604 PolarHBondContact N-O 2.89Å
601	L	87.1	Confident	87.9	Confident	96 Å²	96	65.9 Å²	65.9	50%	0.503	34%	0.342	S	S	.	.	H	α-helix	trans	-61.2	-28.9	174	-69.8	173.9	0	0	0	112.7	Y562 K597 L598 M599 G603	Y562-L601 HydrophobicContact CD2-CD1 4.39Å; Y562-L601 HydrophobicContact CE2-CD1 3.59Å; K597-L601 WeakPolarHBondContact O-CG 2.9Å; K597-L601 PolarHBondContact O-N 3.44Å; L598-L601 WeakPolarHBondContact O-CB 3.26Å; L598-L601 PolarHBondContact O-N 3.27Å; M599-L601 VanDerWaalsContact C-N 3.29Å; M599-L601 PolarHBondContact O-N 3.37Å; L601-G603 VanDerWaalsContact C-N 3.3Å
602	G	83.9	Confident	87.6	Confident	31 Å²	31	69.2 Å²	69.2	32%	0.32	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-0.4	174.7	0	0	0	0	0	113.4	H554 M599 Q600 F604	H554-G602 WeakPolarHBondContact CE1-CA 3.27Å; H554-G602 PolarHBondContact CE1-N 3.42Å; H554-G602 PolarHBondContact NE2-N 2.7Å; M599-G602 WeakPolarHBondContact O-CA 2.97Å; M599-G602 PolarHBondContact O-N 2.82Å; Q600-G602 PolarHBondContact O-N 3.44Å; G602-F604 VanDerWaalsContact C-N 3.3Å
603	G	84.5	Confident	87.3	Confident	69 Å²	69	69.8 Å²	69.8	71%	0.711	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	11.5	-172.1	0	0	0	0	0	114.2	M599 Q600 L601	M599-G603 PolarHBondContact O-N 3.06Å; Q600-G603 PolarHBondContact O-N 3.46Å; L601-G603 VanDerWaalsContact C-N 3.3Å
604	F	84.9	Confident	86.8	Confident	82 Å²	82	70.3 Å²	70.3	36%	0.36	37%	0.374	S	S	.	.			trans	-94.2	119.6	-179.3	-56.9	-71.5	0	0	0	110.8	M599 Q600 G602	M599-F604 CarbonylContact C-O 3.58Å; M599-F604 HydrophobicContact CB-CB 4.12Å; M599-F604 WeakPolarHBondContact CB-O 3.26Å; M599-F604 HydrophobicContact CE-CB 3.91Å; M599-F604 HydrophobicContact CE-CD2 4.02Å; M599-F604 HydrophobicContact CE-CG 4.11Å; M599-F604 PolarHBondContact O-N 3.25Å; Q600-F604 PolarHBondContact N-O 2.89Å; G602-F604 VanDerWaalsContact C-N 3.3Å
605	N	84.1	Confident	86.3	Confident	140 Å²	140	70.1 Å²	70.1	75%	0.749	38%	0.378	S	S	*	.			trans	-96.7	107.2	174.9	-170.7	13.8	0	0	0	110.3	T607	N605-T607 PolarHBondContact O-N 2.94Å
606	L	85.1	Confident	86	Confident	39 Å²	39	70.3 Å²	70.3	20%	0.204	38%	0.379	C	S	.	.			trans	-70.2	123.1	177.1	-68.1	179.5	0	0	0	110.6	L595 M599 W609	L595-L606 HydrophobicContact CB-CD1 4.01Å; M599-L606 HydrophobicContact CB-CD1 4.23Å; M599-L606 HydrophobicContact CB-CG 4.03Å; M599-L606 HydrophobicContact CE-CD2 4.44Å; M599-L606 HydrophobicContact CG-CD1 3.74Å; M599-L606 HydrophobicContact CG-CD2 4.22Å; M599-L606 HydrophobicContact CG-CG 3.9Å; L606-W609 HydrophobicContact CB-CH2 4.37Å; L606-W609 HydrophobicContact CB-CZ2 3.5Å; L606-W609 VanDerWaalsContact CB-CZ2 3.5Å; L606-W609 HydrophobicContact CD1-CH2 3.7Å; L606-W609 HydrophobicContact CD1-CZ2 3.6Å; L606-W609 HydrophobicContact CG-CZ2 4.23Å; L606-W609 PolarHBondContact O-NE1 3.46Å
607	T	83.6	Confident	85.6	Confident	95 Å²	95	65.6 Å²	65.6	58%	0.583	36%	0.362	S	S	*	.			trans	-125.6	174.3	-177.3	60.4	0	0	0	0	111.2	N605 W609	N605-T607 PolarHBondContact O-N 2.94Å; T607-W609 VanDerWaalsContact C-N 3.32Å; T607-W609 PolarHBondContact O-N 2.93Å
608	K	82.3	Confident	85.1	Confident	183 Å²	183	68.5 Å²	68.5	80%	0.796	38%	0.377	S	S	*	.			trans	59	38.1	177.6	-51.9	173.6	-173.3	166.1	0	113.9
609	W	85.4	Confident	84.7	Confident	50 Å²	50	71.4 Å²	71.4	19%	0.189	40%	0.401	C	S	.	.			trans	-55.7	137.5	174.9	-67.5	93.7	0	0	0	111.6	V592 L595 R596 L606 T607 I620 V622	V592-W609 HydrophobicContact CB-CH2 4.41Å; V592-W609 HydrophobicContact CB-CZ3 4.28Å; V592-W609 HydrophobicContact CG1-CE3 4.26Å; V592-W609 HydrophobicContact CG1-CH2 3.84Å; V592-W609 HydrophobicContact CG1-CZ2 4.15Å; V592-W609 HydrophobicContact CG1-CZ3 3.91Å; V592-W609 HydrophobicContact CG2-CE3 4.23Å; V592-W609 HydrophobicContact CG2-CH2 4.32Å; V592-W609 HydrophobicContact CG2-CZ3 3.72Å; L595-W609 HydrophobicContact CB-CH2 4.21Å; L595-W609 HydrophobicContact CD1-CH2 4.27Å; R596-W609 HydrophobicContact CG-CZ2 3.96Å; L606-W609 HydrophobicContact CB-CH2 4.37Å; L606-W609 HydrophobicContact CB-CZ2 3.5Å; L606-W609 VanDerWaalsContact CB-CZ2 3.5Å; L606-W609 HydrophobicContact CD1-CH2 3.7Å; L606-W609 HydrophobicContact CD1-CZ2 3.6Å; L606-W609 HydrophobicContact CG-CZ2 4.23Å; L606-W609 PolarHBondContact O-NE1 3.46Å; T607-W609 VanDerWaalsContact C-N 3.32Å; T607-W609 PolarHBondContact O-N 2.93Å; W609-I620 HydrophobicContact CG-CG2 4.3Å; W609-V622 HydrophobicContact CB-CG2 3.75Å
610	K	84.7	Confident	84.4	Confident	91 Å²	91	71.9 Å²	71.9	40%	0.396	40%	0.404	S	S	.	.			trans	-140.9	136.8	179.1	-63.4	165.1	-168.6	-176.2	0	108.5	S634 K635 W641	K610-S634 WeakPolarHBondContact CD-OG 3.48Å; K610-S634 WeakPolarHBondContact CE-OG 3.47Å; K610-S634 PolarHBondContact NZ-OG 3.3Å; K610-K635 PolarHBondContact NZ-O 2.81Å; K610-W641 HydrophobicContact CB-CZ3 4.45Å
611	C	85.7	Confident	83.8	Confident	21 Å²	21	67.8 Å²	67.8	14%	0.142	40%	0.4	C	S	.	.			trans	-149.5	159.5	172.7	64.6	0	0	0	0	110.1	S613 V616 A617	C611-S613 PolarHBondContact SG-O 3.47Å; C611-V616 HydrophobicContact CB-CG1 4.44Å; C611-A617 PolarHBondContact SG-N 2.96Å
612	N	85	Confident	82.9	Confident	74 Å²	74	64.5 Å²	64.5	40%	0.396	38%	0.384	S	S	.	.	S	Bend	trans	-89.1	-1.4	176.4	61.1	-26.3	0	0	0	113.1	W641 L643 D646	N612-W641 HydrophobicContact CB-CH2 4.29Å; N612-W641 HydrophobicContact CB-CZ2 3.81Å; N612-L643 WeakPolarHBondContact CB-O 3.4Å; N612-D646 HydrophobicContact CB-CB 4.43Å; N612-D646 VanDerWaalsContact ND2-CG 3.28Å; N612-D646 PolarHBondContact ND2-OD2 2.96Å
613	S	85	Confident	81.4	Confident	28 Å²	28	67.8 Å²	67.8	20%	0.196	40%	0.398	C	S	.	.			trans	-109	119	-177.4	-169.6	0	0	0	0	110.4	S585 C611 S615 V616 A617	S585-S613 PolarHBondContact OG-OG 3.45Å; S585-S613 VanDerWaalsContact OG-OG 3.07Å; C611-S613 PolarHBondContact SG-O 3.47Å; S613-S615 VanDerWaalsContact C-N 3.34Å; S613-S615 PolarHBondContact O-N 3.4Å; S613-S615 PolarHBondContact OG-OG 2.91Å; S613-V616 PolarHBondContact O-N 3Å; S613-A617 PolarHBondContact O-N 2.95Å
614	S	80.1	Confident	79.9	Confident	85 Å²	85	71.8 Å²	71.8	59%	0.594	40%	0.403	S	S	*	.	H	α-helix	trans	-61	-41.5	178.9	51.5	0	0	0	0	112.5	V616 A617 E618	S614-V616 PolarHBondContact O-N 3.4Å; S614-A617 WeakPolarHBondContact O-CB 3.36Å; S614-A617 PolarHBondContact O-N 3.18Å; S614-E618 WeakPolarHBondContact O-CG 3.16Å; S614-E618 PolarHBondContact O-N 2.97Å
615	S	84	Confident	78.2	Confident	47 Å²	47	69.7 Å²	69.7	33%	0.329	40%	0.397	S	S	.	.	H	α-helix	trans	-55.4	-48.6	175.7	51.1	0	0	0	0	112.6	S585 S613 E618 A619	S585-S615 PolarHBondContact OG-OG 3.48Å; S613-S615 VanDerWaalsContact C-N 3.34Å; S613-S615 PolarHBondContact O-N 3.4Å; S613-S615 PolarHBondContact OG-OG 2.91Å; S615-E618 PolarHBondContact O-N 3.26Å; S615-A619 WeakPolarHBondContact O-CB 3.49Å; S615-A619 PolarHBondContact O-N 3.15Å
616	V	85.9	Confident	75.9	Confident	5 Å²	5	67.3 Å²	67.3	3%	0.03	39%	0.388	C	S	.	.	H	α-helix	trans	-67	-39.3	179.2	179.9	0	0	0	0	110.5	S585 A588 E589 C611 S613 S614 E618 A619 I620	S585-V616 VanDerWaalsContact CB-CG2 3.48Å; A588-V616 HydrophobicContact CB-CG1 4.18Å; A588-V616 HydrophobicContact CB-CG2 4.17Å; E589-V616 HydrophobicContact CG-CG1 4.39Å; E589-V616 HydrophobicContact CG-CG2 4.32Å; C611-V616 HydrophobicContact CB-CG1 4.44Å; S613-V616 PolarHBondContact O-N 3Å; S614-V616 PolarHBondContact O-N 3.4Å; V616-E618 PolarHBondContact O-N 3.06Å; V616-A619 PolarHBondContact O-N 2.86Å; V616-I620 HydrophobicContact CG1-CD1 3.34Å; V616-I620 HydrophobicContact CG1-CG1 4.22Å; V616-I620 WeakPolarHBondContact O-CB 3.4Å; V616-I620 WeakPolarHBondContact O-CD1 3.48Å; V616-I620 WeakPolarHBondContact O-CG1 3.4Å; V616-I620 PolarHBondContact O-N 3.2Å
617	A	83.8	Confident	73.8	Confident	3 Å²	3	71.6 Å²	71.6	3%	0.025	42%	0.415	C	S	.	.	H	α-helix	trans	-60.7	-44.6	175.6	0	0	0	0	0	112	C611 S613 S614 G621 V622 V625	C611-A617 PolarHBondContact SG-N 2.96Å; S613-A617 PolarHBondContact O-N 2.95Å; S614-A617 WeakPolarHBondContact O-CB 3.36Å; S614-A617 PolarHBondContact O-N 3.18Å; A617-G621 PolarHBondContact O-N 3.31Å; A617-V622 PolarHBondContact O-N 3.34Å; A617-V625 HydrophobicContact CB-CB 4.01Å; A617-V625 HydrophobicContact CB-CG1 4.23Å; A617-V625 HydrophobicContact CB-CG2 3.78Å
618	E	83.2	Confident	71.7	Confident	149 Å²	149	73.3 Å²	73.3	70%	0.696	42%	0.42	S	S	*	.	H	α-helix	trans	-63.2	-49	175.7	-72.9	173.2	-166.5	0	0	111.3	S614 S615 V616 I620 G621	S614-E618 WeakPolarHBondContact O-CG 3.16Å; S614-E618 PolarHBondContact O-N 2.97Å; S615-E618 PolarHBondContact O-N 3.26Å; V616-E618 PolarHBondContact O-N 3.06Å; E618-I620 VanDerWaalsContact C-N 3.29Å; E618-I620 PolarHBondContact O-N 2.76Å; E618-G621 PolarHBondContact O-N 3.43Å; E618-G621 VanDerWaalsContact O-N 3.07Å
619	A	82.6	Confident	69.8	Low	61 Å²	61	72.7 Å²	72.7	50%	0.504	43%	0.426	S	S	.	.	H	α-helix	trans	-60.1	-36.1	180	0	0	0	0	0	113.1	E589 S615 V616 G621	E589-A619 HydrophobicContact CG-CB 3.89Å; S615-A619 WeakPolarHBondContact O-CB 3.49Å; S615-A619 PolarHBondContact O-N 3.15Å; V616-A619 PolarHBondContact O-N 2.86Å; A619-G621 VanDerWaalsContact C-N 3.32Å
620	I	82.3	Confident	67.9	Low	17 Å²	17	76.8 Å²	76.8	9%	0.087	45%	0.451	C	S	.	.	H	α-helix	trans	-82.4	-13	-179.3	-62.7	168.4	0	0	0	111.9	V592 R596 W609 V616 E618 V622	V592-I620 HydrophobicContact CB-CD1 3.98Å; V592-I620 HydrophobicContact CB-CG1 4.27Å; V592-I620 HydrophobicContact CG1-CD1 3.78Å; V592-I620 HydrophobicContact CG1-CG1 3.81Å; V592-I620 HydrophobicContact CG1-CG2 4Å; V592-I620 HydrophobicContact CG2-CD1 3.55Å; V592-I620 HydrophobicContact CG2-CG1 4.38Å; R596-I620 PolarHBondContact NH1-O 2.74Å; R596-I620 PolarHBondContact NH2-O 2.8Å; W609-I620 HydrophobicContact CG-CG2 4.3Å; V616-I620 HydrophobicContact CG1-CD1 3.34Å; V616-I620 HydrophobicContact CG1-CG1 4.22Å; V616-I620 WeakPolarHBondContact O-CB 3.4Å; V616-I620 WeakPolarHBondContact O-CD1 3.48Å; V616-I620 WeakPolarHBondContact O-CG1 3.4Å; V616-I620 PolarHBondContact O-N 3.2Å; E618-I620 VanDerWaalsContact C-N 3.29Å; E618-I620 PolarHBondContact O-N 2.76Å; I620-V622 HydrophobicContact CB-CG2 4.09Å; I620-V622 HydrophobicContact CG2-CG2 3.71Å
621	G	76.6	Confident	66.6	Low	57 Å²	57	80.9 Å²	80.9	59%	0.588	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	29.7	-177.5	0	0	0	0	0	113.7	A617 E618 A619 T623	A617-G621 PolarHBondContact O-N 3.31Å; E618-G621 PolarHBondContact O-N 3.43Å; E618-G621 VanDerWaalsContact O-N 3.07Å; A619-G621 VanDerWaalsContact C-N 3.32Å; G621-T623 PolarHBondContact O-N 2.88Å
622	V	68.7	Low	65.2	Low	27 Å²	27	82.9 Å²	82.9	16%	0.164	47%	0.473	C	S	.	.			trans	-91.3	92	178.5	-168.6	0	0	0	0	109	W609 A617 I620 D624 V625	W609-V622 HydrophobicContact CB-CG2 3.75Å; A617-V622 PolarHBondContact O-N 3.34Å; I620-V622 HydrophobicContact CB-CG2 4.09Å; I620-V622 HydrophobicContact CG2-CG2 3.71Å; V622-D624 VanDerWaalsContact C-N 3.3Å; V622-D624 HydrophobicContact CG1-CB 4.45Å; V622-D624 PolarHBondContact O-N 3.21Å; V622-V625 HydrophobicContact CB-CG2 4.16Å; V622-V625 HydrophobicContact CG1-CG2 3.75Å
623	T	52.3	Low	64.2	Low	101 Å²	101	83.4 Å²	83.4	62%	0.62	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-75	-16.8	177.3	50.4	0	0	0	0	113.5	G621 V625 T626	G621-T623 PolarHBondContact O-N 2.88Å; T623-V625 PolarHBondContact O-N 3.33Å; T623-T626 WeakPolarHBondContact O-CB 3.47Å; T623-T626 WeakPolarHBondContact O-CG2 3.48Å; T623-T626 PolarHBondContact O-N 3.11Å; T623-T626 PolarHBondContact O-OG1 2.92Å
624	D	52.4	Low	63.5	Low	152 Å²	152	83.2 Å²	83.2	81%	0.813	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-66.2	0.8	176.5	-85	-10.1	0	0	0	113.8	V622	V622-D624 VanDerWaalsContact C-N 3.3Å; V622-D624 HydrophobicContact CG1-CB 4.45Å; V622-D624 PolarHBondContact O-N 3.21Å
625	V	48.9	Very low	63.5	Low	39 Å²	39	85.1 Å²	85.1	24%	0.236	48%	0.475	C	S	.	.	G	3₁₀ helix	trans	-97.2	-3.4	171.9	-159.1	0	0	0	0	111.7	A617 V622 T623	A617-V625 HydrophobicContact CB-CB 4.01Å; A617-V625 HydrophobicContact CB-CG1 4.23Å; A617-V625 HydrophobicContact CB-CG2 3.78Å; V622-V625 HydrophobicContact CB-CG2 4.16Å; V622-V625 HydrophobicContact CG1-CG2 3.75Å; T623-V625 PolarHBondContact O-N 3.33Å
626	T	35.6	Very low	63.3	Low	90 Å²	90	84.5 Å²	84.5	55%	0.552	47%	0.469	S	S	*	.			trans	-85.2	128.4	-167.3	59.8	0	0	0	0	114.2	T623	T623-T626 WeakPolarHBondContact O-CB 3.47Å; T623-T626 WeakPolarHBondContact O-CG2 3.48Å; T623-T626 PolarHBondContact O-N 3.11Å; T623-T626 PolarHBondContact O-OG1 2.92Å
627	V	41	Very low	63.1	Low	128 Å²	128	87.6 Å²	87.6	78%	0.776	49%	0.485	S	S	*	.	S	Bend	trans	104.4	-20.9	148.2	-162.9	0	0	0	0	120.8
628	N	40.5	Very low	63	Low	131 Å²	131	89.3 Å²	89.3	70%	0.701	50%	0.503	S	S	*	.			trans	-117.7	99.4	173.4	-86.7	-14.5	0	0	0	112.6	D630	N628-D630 PolarHBondContact O-N 2.83Å
629	N	42	Very low	63.1	Low	170 Å²	170	83.1 Å²	83.1	91%	0.909	48%	0.476	S	S	*	.			trans	-59.3	-1	-179.9	-84.6	-15.2	0	0	0	115.8
630	D	46.6	Very low	63.4	Low	136 Å²	136	80.5 Å²	80.5	73%	0.727	45%	0.454	S	S	*	.	S	Bend	trans	-105.8	99.7	172.5	-84.2	-37.7	0	0	0	111.4	N628	N628-D630 PolarHBondContact O-N 2.83Å
631	R	55.8	Low	63.7	Low	178 Å²	178	81 Å²	81	67%	0.672	45%	0.454	S	S	*	.			trans	71.9	56.9	151.2	-49	172.6	-177.6	175.6	0.5	116.4	V633	R631-V633 PolarHBondContact O-N 2.73Å
632	I	58	Low	64.2	Low	63 Å²	63	78.6 Å²	78.6	32%	0.323	43%	0.428	S	S	.	.			trans	-68.6	101.2	161.4	-55.9	177.5	0	0	0	108.3	L643	I632-L643 HydrophobicContact CG2-CD1 4.12Å; I632-L643 PolarHBondContact O-N 3.23Å
633	V	63.1	Low	64.9	Low	84 Å²	84	77.9 Å²	77.9	51%	0.509	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	109	176.1	-179.3	0	0	0	0	108.8	R631 P640	R631-V633 PolarHBondContact O-N 2.73Å; V633-P640 HydrophobicContact CG1-CB 3.76Å
634	S	71.1	Confident	66.2	Low	25 Å²	25	76.3 Å²	76.3	18%	0.175	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	170	170.7	-151.7	0	0	0	0	111.4	K610 P640 W641	K610-S634 WeakPolarHBondContact CD-OG 3.48Å; K610-S634 WeakPolarHBondContact CE-OG 3.47Å; K610-S634 PolarHBondContact NZ-OG 3.3Å; S634-P640 CarbonylContact O-C 3.45Å; S634-P640 VanDerWaalsContact O-CA 3.24Å; S634-P640 WeakPolarHBondContact O-CA 3.43Å; S634-W641 PolarHBondContact N-O 3.2Å; S634-W641 PolarHBondContact O-N 2.97Å
635	K	79.2	Confident	67.8	Low	124 Å²	124	73.6 Å²	73.6	54%	0.539	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	138.2	168.9	-69.7	178.3	-178.9	175.5	0	110.7	K610 V639	K610-K635 PolarHBondContact NZ-O 2.81Å; K635-V639 CarbonylContact C-O 3.55Å; K635-V639 WeakPolarHBondContact CA-O 3.22Å
636	V	79	Confident	69.6	Low	34 Å²	34	72.8 Å²	72.8	21%	0.206	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	112.7	178	177.1	0	0	0	0	106.9	L579 G638 V639 W641	L579-V636 HydrophobicContact CD2-CG1 3.12Å; L579-V636 HydrophobicContact CG-CG1 4.33Å; V636-G638 PolarHBondContact O-N 2.79Å; V636-V639 PolarHBondContact N-O 3.3Å; V636-V639 PolarHBondContact O-N 3.43Å; V636-W641 HydrophobicContact CB-CB 4.39Å; V636-W641 HydrophobicContact CG2-CB 3.69Å; V636-W641 HydrophobicContact CG2-CD2 4.02Å; V636-W641 HydrophobicContact CG2-CE3 3.41Å; V636-W641 VanDerWaalsContact CG2-CE3 3.41Å; V636-W641 HydrophobicContact CG2-CG 4.2Å; V636-W641 HydrophobicContact CG2-CZ3 4.3Å
637	L	81.5	Confident	72.3	Confident	70 Å²	70	68.5 Å²	68.5	37%	0.366	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	33.4	-172.4	-60.5	177.8	0	0	0	113.9	F574 D577 L579 V639 F675	F574-L637 HydrophobicContact CB-CD2 4.11Å; F574-L637 HydrophobicContact CD1-CD2 3.45Å; F574-L637 VanDerWaalsContact CD1-CD2 3.45Å; F574-L637 HydrophobicContact CE1-CD2 4.18Å; F574-L637 HydrophobicContact CG-CD2 4.03Å; D577-L637 HydrophobicContact CB-CD2 4.16Å; L579-L637 HydrophobicContact CD1-CD1 3.97Å; L579-L637 HydrophobicContact CD1-CD2 3.66Å; L579-L637 HydrophobicContact CD1-CG 3.74Å; L579-L637 HydrophobicContact CD2-CD1 3.84Å; L579-L637 HydrophobicContact CD2-CG 3.76Å; L579-L637 HydrophobicContact CG-CG 4.46Å; L637-V639 VanDerWaalsContact C-N 3.34Å; L637-V639 PolarHBondContact O-N 3.26Å; L637-F675 WeakPolarHBondContact O-CE1 3.44Å; L637-F675 WeakPolarHBondContact O-CZ 3.28Å
638	G	81.9	Confident	74.7	Confident	39 Å²	39	63.9 Å²	63.9	40%	0.402	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	-11.4	-177.2	0	0	0	0	0	115.8	V636	V636-G638 PolarHBondContact O-N 2.79Å
639	V	86.8	Confident	77.1	Confident	20 Å²	20	58 Å²	58	12%	0.121	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	131.3	175.2	-172.1	0	0	0	0	110.2	K635 V636 L637 W641 L648 F675 P677	K635-V639 CarbonylContact C-O 3.55Å; K635-V639 WeakPolarHBondContact CA-O 3.22Å; V636-V639 PolarHBondContact N-O 3.3Å; V636-V639 PolarHBondContact O-N 3.43Å; L637-V639 VanDerWaalsContact C-N 3.34Å; L637-V639 PolarHBondContact O-N 3.26Å; V639-W641 PolarHBondContact O-N 3.45Å; V639-L648 HydrophobicContact CG1-CB 4.31Å; V639-L648 HydrophobicContact CG1-CD2 4.28Å; V639-F675 HydrophobicContact CG2-CD1 3.78Å; V639-F675 HydrophobicContact CG2-CE1 3.68Å; V639-P677 HydrophobicContact CG2-CG 4.06Å
640	P	88.2	Confident	79.4	Confident	6 Å²	6	50.3 Å²	50.3	4%	0.039	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	131.8	169.8	-22.9	31.4	0	0	0	112.8	V633 S634 L648 S649 I651	V633-P640 HydrophobicContact CG1-CB 3.76Å; S634-P640 CarbonylContact O-C 3.45Å; S634-P640 VanDerWaalsContact O-CA 3.24Å; S634-P640 WeakPolarHBondContact O-CA 3.43Å; P640-L648 CarbonylContact O-C 3.58Å; P640-L648 WeakPolarHBondContact O-CA 3.37Å; P640-S649 VanDerWaalsContact CD-O 3.25Å; P640-S649 WeakPolarHBondContact CD-O 3.33Å; P640-S649 WeakPolarHBondContact CG-O 3.46Å; P640-S649 PolarHBondContact O-N 2.98Å; P640-I651 HydrophobicContact CG-CB 4.45Å; P640-I651 HydrophobicContact CG-CD1 3.54Å; P640-I651 HydrophobicContact CG-CG1 3.5Å; P640-I651 VanDerWaalsContact CG-CG1 3.5Å
641	W	87.9	Confident	81.3	Confident	27 Å²	27	47.2 Å²	47.2	10%	0.102	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	118.7	173.8	-178.1	32.7	0	0	0	109	K610 N612 S634 V636 V639 L643 D646 L648	K610-W641 HydrophobicContact CB-CZ3 4.45Å; N612-W641 HydrophobicContact CB-CH2 4.29Å; N612-W641 HydrophobicContact CB-CZ2 3.81Å; S634-W641 PolarHBondContact N-O 3.2Å; S634-W641 PolarHBondContact O-N 2.97Å; V636-W641 HydrophobicContact CB-CB 4.39Å; V636-W641 HydrophobicContact CG2-CB 3.69Å; V636-W641 HydrophobicContact CG2-CD2 4.02Å; V636-W641 HydrophobicContact CG2-CE3 3.41Å; V636-W641 VanDerWaalsContact CG2-CE3 3.41Å; V636-W641 HydrophobicContact CG2-CG 4.2Å; V636-W641 HydrophobicContact CG2-CZ3 4.3Å; V639-W641 PolarHBondContact O-N 3.45Å; W641-L643 HydrophobicContact CD2-CD2 3.53Å; W641-L643 HydrophobicContact CE3-CD2 3.17Å; W641-L643 HydrophobicContact CE3-CG 4.49Å; W641-L643 HydrophobicContact CG-CD2 4.36Å; W641-L643 HydrophobicContact CH2-CD2 3.7Å; W641-L643 HydrophobicContact CZ2-CD2 3.98Å; W641-L643 HydrophobicContact CZ3-CD2 3.28Å; W641-L643 PolarHBondContact O-N 2.64Å; W641-D646 WeakPolarHBondContact CZ2-OD1 3.47Å; W641-D646 PolarHBondContact NE1-OD1 3.27Å; W641-L648 HydrophobicContact CB-CD2 4.25Å; W641-L648 HydrophobicContact CG-CD2 4.39Å
642	N	86.9	Confident	82.8	Confident	7 Å²	7	40.4 Å²	40.4	4%	0.037	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	105.1	169.9	-176.4	-16	0	0	0	108.3	G644 Q645 D646 A647	N642-G644 VanDerWaalsContact C-N 3.35Å; N642-G644 PolarHBondContact O-N 3.41Å; N642-G644 PolarHBondContact OD1-N 3.17Å; N642-Q645 PolarHBondContact ND2-OE1 3.42Å; N642-Q645 PolarHBondContact O-N 3.33Å; N642-Q645 PolarHBondContact OD1-N 3.49Å; N642-D646 WeakPolarHBondContact O-CA 3.18Å; N642-D646 PolarHBondContact O-N 3.49Å; N642-A647 WeakPolarHBondContact CB-O 3.21Å; N642-A647 PolarHBondContact N-O 3.41Å; N642-A647 PolarHBondContact O-N 2.8Å; N642-A647 VanDerWaalsContact O-N 3.17Å
643	L	83.9	Confident	84	Confident	12 Å²	12	37.9 Å²	37.9	6%	0.063	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-40.8	-176	-61.6	174.1	0	0	0	111.9	N612 I632 W641 Q645 D646	N612-L643 WeakPolarHBondContact CB-O 3.4Å; I632-L643 HydrophobicContact CG2-CD1 4.12Å; I632-L643 PolarHBondContact O-N 3.23Å; W641-L643 HydrophobicContact CD2-CD2 3.53Å; W641-L643 HydrophobicContact CE3-CD2 3.17Å; W641-L643 HydrophobicContact CE3-CG 4.49Å; W641-L643 HydrophobicContact CG-CD2 4.36Å; W641-L643 HydrophobicContact CH2-CD2 3.7Å; W641-L643 HydrophobicContact CZ2-CD2 3.98Å; W641-L643 HydrophobicContact CZ3-CD2 3.28Å; W641-L643 PolarHBondContact O-N 2.64Å; L643-Q645 VanDerWaalsContact C-N 3.33Å; L643-Q645 PolarHBondContact O-N 3.42Å; L643-D646 PolarHBondContact O-N 3.25Å
644	G	80.3	Confident	84.7	Confident	67 Å²	67	41.5 Å²	41.5	69%	0.691	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-28	-175.5	0	0	0	0	0	113.9	N642	N642-G644 VanDerWaalsContact C-N 3.35Å; N642-G644 PolarHBondContact O-N 3.41Å; N642-G644 PolarHBondContact OD1-N 3.17Å
645	Q	85.2	Confident	85	Confident	95 Å²	95	41.8 Å²	41.8	44%	0.444	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	1.1	178	-67.1	-177.5	-39.5	0	0	113.4	N642 L643 A647	N642-Q645 PolarHBondContact ND2-OE1 3.42Å; N642-Q645 PolarHBondContact O-N 3.33Å; N642-Q645 PolarHBondContact OD1-N 3.49Å; L643-Q645 VanDerWaalsContact C-N 3.33Å; L643-Q645 PolarHBondContact O-N 3.42Å; Q645-A647 HydrophobicContact CB-CB 4.22Å; Q645-A647 PolarHBondContact O-N 3.15Å
646	D	87.5	Confident	85	Confident	23 Å²	23	36.4 Å²	36.4	12%	0.123	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	42.8	43.1	-168.1	-164.2	24.3	0	0	0	114.4	N612 W641 N642 L643 R731 T732	N612-D646 HydrophobicContact CB-CB 4.43Å; N612-D646 VanDerWaalsContact ND2-CG 3.28Å; N612-D646 PolarHBondContact ND2-OD2 2.96Å; W641-D646 WeakPolarHBondContact CZ2-OD1 3.47Å; W641-D646 PolarHBondContact NE1-OD1 3.27Å; N642-D646 WeakPolarHBondContact O-CA 3.18Å; N642-D646 PolarHBondContact O-N 3.49Å; L643-D646 PolarHBondContact O-N 3.25Å; D646-R731 WeakPolarHBondContact O-CB 3.17Å; D646-R731 PolarHBondContact O-N 3.31Å; D646-R731 VanDerWaalsContact O-N 3.13Å; D646-R731 IonicContact OD1-CZ 3.62Å; D646-R731 IonicContact OD1-NE 2.98Å; D646-R731 PolarHBondContact OD1-NE 3.06Å; D646-R731 IonicContact OD1-NH2 3.79Å; D646-R731 PolarHBondContact OD1-NH2 3.5Å; D646-R731 IonicContact OD2-CZ 3.54Å; D646-R731 IonicContact OD2-NE 2.8Å; D646-R731 PolarHBondContact OD2-NE 3.13Å; D646-R731 IonicContact OD2-NH2 3.68Å; D646-R731 PolarHBondContact OD2-NH2 2.98Å; D646-T732 PolarHBondContact OD2-OG1 3.41Å
647	A	91.4	Very high	84.6	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	137.1	-173.5	0	0	0	0	0	111.6	N642 Q645 L728 V729	N642-A647 WeakPolarHBondContact CB-O 3.21Å; N642-A647 PolarHBondContact N-O 3.41Å; N642-A647 PolarHBondContact O-N 2.8Å; N642-A647 VanDerWaalsContact O-N 3.17Å; Q645-A647 HydrophobicContact CB-CB 4.22Å; Q645-A647 PolarHBondContact O-N 3.15Å; A647-L728 HydrophobicContact CB-CB 4.07Å; A647-L728 HydrophobicContact CB-CD2 4.32Å; A647-V729 CarbonylContact C-O 3.29Å; A647-V729 WeakPolarHBondContact CA-O 3.38Å
648	L	92.1	Very high	83.9	Confident	30 Å²	30	41.2 Å²	41.2	16%	0.157	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	145.5	167.8	-57.2	178	0	0	0	109.7	V639 P640 W641 F680 L728 V729 R731	V639-L648 HydrophobicContact CG1-CB 4.31Å; V639-L648 HydrophobicContact CG1-CD2 4.28Å; P640-L648 CarbonylContact O-C 3.58Å; P640-L648 WeakPolarHBondContact O-CA 3.37Å; W641-L648 HydrophobicContact CB-CD2 4.25Å; W641-L648 HydrophobicContact CG-CD2 4.39Å; L648-F680 HydrophobicContact CD1-CE2 4.17Å; L648-L728 WeakPolarHBondContact O-CA 3.45Å; L648-V729 HydrophobicContact CB-CB 4.49Å; L648-V729 PolarHBondContact N-O 2.95Å; L648-V729 PolarHBondContact O-N 3.47Å; L648-R731 HydrophobicContact CD2-CG 4.4Å; L648-R731 HydrophobicContact CG-CB 4.27Å; L648-R731 HydrophobicContact CG-CG 4.45Å
649	S	91	Very high	83.2	Confident	7 Å²	7	43.4 Å²	43.4	5%	0.049	25%	0.25	C	S	.	.			trans	-136.2	-179	178.7	-177.5	0	0	0	0	109.8	P640 P725	P640-S649 VanDerWaalsContact CD-O 3.25Å; P640-S649 WeakPolarHBondContact CD-O 3.33Å; P640-S649 WeakPolarHBondContact CG-O 3.46Å; P640-S649 PolarHBondContact O-N 2.98Å; S649-P725 PolarHBondContact OG-O 3.44Å
650	F	90.5	Very high	82	Confident	9 Å²	9	48.3 Å²	48.3	4%	0.039	29%	0.285	C	S	.	.			trans	-132	146.2	-175.7	-58.1	-88.5	0	0	0	111.1	F680 L681 L724 P725 L727 V729	F650-F680 HydrophobicContact CZ-CB 3.8Å; F650-F680 AromaticContact CZ-CD2 3.95Å; F650-F680 HydrophobicContact CZ-CD2 3.95Å; F650-F680 HydrophobicContact CZ-CG 4.34Å; F650-L681 HydrophobicContact CB-CD1 4.42Å; F650-L681 HydrophobicContact CD1-CD1 3.45Å; F650-L681 VanDerWaalsContact CD1-CD1 3.45Å; F650-L681 HydrophobicContact CD1-CG 4.02Å; F650-L681 HydrophobicContact CD2-CD1 4.43Å; F650-L681 HydrophobicContact CD2-CD2 4.3Å; F650-L681 HydrophobicContact CE1-CD1 3.72Å; F650-L681 HydrophobicContact CE1-CD2 4.41Å; F650-L681 HydrophobicContact CE1-CG 3.77Å; F650-L681 HydrophobicContact CE2-CD2 4.17Å; F650-L681 HydrophobicContact CE2-CG 4.41Å; F650-L681 HydrophobicContact CG-CD1 3.83Å; F650-L681 HydrophobicContact CG-CG 4.41Å; F650-L681 HydrophobicContact CZ-CD1 4.34Å; F650-L681 HydrophobicContact CZ-CD2 4.21Å; F650-L681 HydrophobicContact CZ-CG 3.99Å; F650-L724 HydrophobicContact CB-CB 4Å; F650-L724 HydrophobicContact CB-CD2 4.42Å; F650-L724 CarbonylContact O-C 3.59Å; F650-P725 WeakPolarHBondContact O-CA 3.49Å; F650-P725 WeakPolarHBondContact O-CG 3.46Å; F650-L727 HydrophobicContact CD2-CB 4.38Å; F650-L727 HydrophobicContact CD2-CD2 3.86Å; F650-L727 HydrophobicContact CE2-CD2 3.41Å; F650-L727 VanDerWaalsContact CE2-CD2 3.41Å; F650-L727 HydrophobicContact CZ-CD2 4.44Å; F650-V729 HydrophobicContact CE2-CG2 4.02Å; F650-V729 HydrophobicContact CZ-CG2 4.39Å
651	I	86.5	Confident	81.4	Confident	71 Å²	71	57 Å²	57	36%	0.364	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-96.7	136.3	177.7	-72.1	155.4	0	0	0	110	P640 P653	P640-I651 HydrophobicContact CG-CB 4.45Å; P640-I651 HydrophobicContact CG-CD1 3.54Å; P640-I651 HydrophobicContact CG-CG1 3.5Å; P640-I651 VanDerWaalsContact CG-CG1 3.5Å; I651-P653 VanDerWaalsContact O-CD 3.24Å; I651-P653 WeakPolarHBondContact O-CD 3.36Å
652	T	87.1	Confident	81.3	Confident	35 Å²	35	57.2 Å²	57.2	22%	0.215	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-62.1	116.9	165.6	-52.5	0	0	0	0	109.8	H654 I657 L721 P725	T652-H654 PolarHBondContact O-N 3.26Å; T652-I657 HydrophobicContact CG2-CD1 4.14Å; T652-L721 HydrophobicContact CG2-CB 4.16Å; T652-L721 PolarHBondContact OG1-O 2.8Å; T652-P725 WeakPolarHBondContact OG1-CD 3.36Å
653	P	83.7	Confident	81.5	Confident	10 Å²	10	57.3 Å²	57.3	7%	0.065	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-58.5	120.9	-178	-28.4	37.6	0	0	0	113.3	I651 V656 K673 I674	I651-P653 VanDerWaalsContact O-CD 3.24Å; I651-P653 WeakPolarHBondContact O-CD 3.36Å; P653-V656 HydrophobicContact CB-CB 4.46Å; P653-V656 HydrophobicContact CB-CG2 3.7Å; P653-K673 HydrophobicContact CB-CB 3.84Å; P653-K673 HydrophobicContact CB-CD 4.28Å; P653-K673 HydrophobicContact CG-CB 4.32Å; P653-I674 HydrophobicContact CG-CG1 3.74Å
654	H	77.9	Confident	81.8	Confident	161 Å²	161	57.4 Å²	57.4	75%	0.745	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	139.5	-179.7	-71.9	-77.1	0	0	0	112.9	T652 V656 K673	T652-H654 PolarHBondContact O-N 3.26Å; H654-V656 PolarHBondContact O-N 3.24Å; H654-K673 PolarHBondContact O-NZ 3.33Å
655	G	76.8	Confident	82.2	Confident	31 Å²	31	59 Å²	59	32%	0.32	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	21.7	174.7	0	0	0	0	0	114.5	K659	G655-K659 WeakPolarHBondContact O-CD 3.32Å; G655-K659 WeakPolarHBondContact O-CE 3.46Å; G655-K659 VanDerWaalsContact O-CG 3.28Å; G655-K659 WeakPolarHBondContact O-CG 3.34Å
656	V	78.2	Confident	82.4	Confident	10 Å²	10	56.3 Å²	56.3	6%	0.061	29%	0.293	C	S	.	.	S	Bend	trans	-89.9	-35.7	171.3	173.1	0	0	0	0	111.3	P653 H654 A670 K673 W714 K718 L721	P653-V656 HydrophobicContact CB-CB 4.46Å; P653-V656 HydrophobicContact CB-CG2 3.7Å; H654-V656 PolarHBondContact O-N 3.24Å; V656-A670 HydrophobicContact CB-CB 4.3Å; V656-A670 HydrophobicContact CG1-CB 3.53Å; V656-A670 HydrophobicContact CG2-CB 3.73Å; V656-K673 HydrophobicContact CG2-CD 4.03Å; V656-W714 HydrophobicContact CG1-CZ2 4.49Å; V656-K718 HydrophobicContact CG1-CD 4.07Å; V656-K718 HydrophobicContact CG1-CG 4.31Å; V656-L721 HydrophobicContact CB-CD1 4.39Å; V656-L721 HydrophobicContact CG1-CD1 3.75Å
657	I	72.3	Confident	82.5	Confident	101 Å²	101	55.2 Å²	55.2	52%	0.518	29%	0.287	S	S	.	.	S	Bend	trans	-81.2	-33.9	-176.4	-58.6	172.5	0	0	0	111.6	T652	T652-I657 HydrophobicContact CG2-CD1 4.14Å
658	S	64.8	Low	82.4	Confident	104 Å²	104	56.6 Å²	56.6	73%	0.727	29%	0.294	S	S	*	.	S	Bend	trans	-91	2.7	-169	56.6	0	0	0	0	116.1
659	K	67.3	Low	82.2	Confident	86 Å²	86	57.4 Å²	57.4	37%	0.374	30%	0.302	S	S	.	.			trans	-82.1	144.8	-176.1	-76.9	-175.4	166.2	-154.1	0	112.5	G655 E666	G655-K659 WeakPolarHBondContact O-CD 3.32Å; G655-K659 WeakPolarHBondContact O-CE 3.46Å; G655-K659 VanDerWaalsContact O-CG 3.28Å; G655-K659 WeakPolarHBondContact O-CG 3.34Å; K659-E666 HydrophobicContact CD-CG 4.4Å; K659-E666 WeakPolarHBondContact CD-OE1 3.41Å; K659-E666 WeakPolarHBondContact CD-OE2 3.32Å; K659-E666 IonicContact NZ-OE1 2.55Å; K659-E666 PolarHBondContact NZ-OE1 3.06Å; K659-E666 VanDerWaalsContact NZ-OE1 3.09Å
660	S	62.6	Low	82.1	Confident	122 Å²	122	57.1 Å²	57.1	85%	0.853	30%	0.3	S	S	*	.	S	Bend	trans	-87.5	-21.4	-175.6	57.4	0	0	0	0	114.9
661	R	74.8	Confident	82	Confident	190 Å²	190	57.4 Å²	57.4	72%	0.717	30%	0.302	S	S	*	.			trans	-119.2	93.4	-173.7	-78	-170.3	175.1	-174.4	-0.2	112.7	T663	R661-T663 PolarHBondContact O-N 3.05Å
662	E	85.8	Confident	82	Confident	30 Å²	30	56.6 Å²	56.6	14%	0.14	31%	0.307	C	S	.	.			trans	-67.6	103.1	176.5	-54.6	-60.9	157.5	0	0	111.6	S705 I706 W714 K718	E662-S705 WeakPolarHBondContact O-CA 3.26Å; E662-I706 HydrophobicContact CB-CD1 4.28Å; E662-I706 WeakPolarHBondContact O-CG1 2.89Å; E662-I706 PolarHBondContact O-N 3.12Å; E662-W714 PolarHBondContact OE2-NE1 2.96Å; E662-K718 IonicContact OE1-NZ 2.76Å; E662-K718 PolarHBondContact OE1-NZ 2.86Å; E662-K718 IonicContact OE2-NZ 3.48Å; E662-K718 PolarHBondContact OE2-NZ 2.91Å
663	T	90.9	Very high	82.1	Confident	9 Å²	9	59.4 Å²	59.4	6%	0.055	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-125.2	162.8	179.1	67.1	0	0	0	0	111.7	R661 R665 E666 L667 D703	R661-T663 PolarHBondContact O-N 3.05Å; T663-R665 PolarHBondContact O-N 3.26Å; T663-E666 PolarHBondContact O-N 3.32Å; T663-E666 WeakPolarHBondContact OG1-CG 3.4Å; T663-E666 PolarHBondContact OG1-N 3.36Å; T663-L667 PolarHBondContact O-N 3.36Å; T663-D703 WeakPolarHBondContact CG2-O 3.24Å
664	K	90.4	Very high	82.3	Confident	15 Å²	15	59.9 Å²	59.9	7%	0.065	32%	0.318	C	S	.	.	H	α-helix	trans	-56.1	-38.1	175.5	-173	177.9	67.8	-172.8	0	112.6	E666 L668 L692 L695 T700 G701 W702	K664-E666 VanDerWaalsContact C-N 3.33Å; K664-L668 PolarHBondContact O-N 3.43Å; K664-L668 VanDerWaalsContact O-N 3.12Å; K664-L692 HydrophobicContact CD-CD1 4.43Å; K664-L692 HydrophobicContact CG-CD1 3.71Å; K664-L695 HydrophobicContact CB-CD1 4.18Å; K664-L695 HydrophobicContact CD-CB 4.12Å; K664-L695 HydrophobicContact CG-CB 4.27Å; K664-L695 HydrophobicContact CG-CD1 4.09Å; K664-T700 PolarHBondContact NZ-O 2.9Å; K664-G701 WeakPolarHBondContact CE-O 3.41Å; K664-W702 HydrophobicContact CD-CE3 4.34Å; K664-W702 HydrophobicContact CD-CZ3 4.41Å; K664-W702 HydrophobicContact CG-CE3 4.23Å; K664-W702 HydrophobicContact CG-CZ3 4.24Å; K664-W702 PolarHBondContact N-O 3.4Å
665	R	89.8	Confident	82.7	Confident	100 Å²	100	57.5 Å²	57.5	38%	0.377	31%	0.306	S	S	.	.	H	α-helix	trans	-62.7	-41.2	176	-175.6	-174.3	-56	-78.1	-0.6	111.7	T663 L668 S669 W702 D703	T663-R665 PolarHBondContact O-N 3.26Å; R665-L668 PolarHBondContact O-N 3.07Å; R665-S669 WeakPolarHBondContact O-CB 3.24Å; R665-S669 PolarHBondContact O-N 3.15Å; R665-W702 HydrophobicContact CB-CE3 4.33Å; R665-W702 WeakPolarHBondContact CB-O 3.38Å; R665-W702 PolarHBondContact N-O 3.14Å; R665-D703 IonicContact CZ-OD1 3.92Å; R665-D703 IonicContact CZ-OD2 3.95Å; R665-D703 IonicContact NE-OD1 3Å; R665-D703 PolarHBondContact NE-OD1 3.29Å; R665-D703 IonicContact NE-OD2 3.79Å; R665-D703 IonicContact NH2-OD1 2.84Å; R665-D703 IonicContact NH2-OD2 3.59Å; R665-D703 PolarHBondContact NH2-OD2 2.89Å
666	E	88.5	Confident	83.4	Confident	39 Å²	39	57.3 Å²	57.3	18%	0.182	30%	0.297	C	S	.	.	H	α-helix	trans	-69.6	-40.7	-179.8	-68.9	-165.6	165.6	0	0	112.4	K659 T663 K664 L668 S669 A670	K659-E666 HydrophobicContact CD-CG 4.4Å; K659-E666 WeakPolarHBondContact CD-OE1 3.41Å; K659-E666 WeakPolarHBondContact CD-OE2 3.32Å; K659-E666 IonicContact NZ-OE1 2.55Å; K659-E666 PolarHBondContact NZ-OE1 3.06Å; K659-E666 VanDerWaalsContact NZ-OE1 3.09Å; T663-E666 PolarHBondContact O-N 3.32Å; T663-E666 WeakPolarHBondContact OG1-CG 3.4Å; T663-E666 PolarHBondContact OG1-N 3.36Å; K664-E666 VanDerWaalsContact C-N 3.33Å; E666-L668 VanDerWaalsContact C-N 3.35Å; E666-L668 PolarHBondContact O-N 3.2Å; E666-S669 PolarHBondContact O-N 3.29Å; E666-A670 WeakPolarHBondContact O-CB 3.43Å; E666-A670 PolarHBondContact O-N 2.81Å
667	L	89.1	Confident	83.9	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-57.2	-49.1	172.7	-173.7	155.1	0	0	0	111.1	T663 S669 A670 V671 I691 L692 L695 I706 W714	T663-L667 PolarHBondContact O-N 3.36Å; L667-S669 VanDerWaalsContact C-N 3.34Å; L667-S669 PolarHBondContact O-N 3.09Å; L667-A670 PolarHBondContact O-N 3.14Å; L667-V671 HydrophobicContact CD2-CG2 4.3Å; L667-V671 WeakPolarHBondContact O-CG2 3.33Å; L667-V671 PolarHBondContact O-N 2.96Å; L667-I691 HydrophobicContact CD1-CB 4.02Å; L667-I691 HydrophobicContact CD1-CG2 3.49Å; L667-I691 VanDerWaalsContact CD1-CG2 3.49Å; L667-L692 HydrophobicContact CD2-CB 3.71Å; L667-L692 HydrophobicContact CD2-CD1 3.92Å; L667-L692 HydrophobicContact CD2-CG 4.29Å; L667-L695 HydrophobicContact CD1-CD1 4.06Å; L667-I706 HydrophobicContact CB-CD1 4.43Å; L667-I706 HydrophobicContact CD1-CD1 4.29Å; L667-W714 HydrophobicContact CB-CD2 4.5Å; L667-W714 HydrophobicContact CB-CH2 4.34Å; L667-W714 HydrophobicContact CB-CZ2 4.2Å; L667-W714 HydrophobicContact CD1-CD2 3.77Å; L667-W714 HydrophobicContact CD1-CE3 3.6Å; L667-W714 HydrophobicContact CD1-CG 4.19Å; L667-W714 HydrophobicContact CD1-CZ3 4.08Å; L667-W714 HydrophobicContact CG-CD2 4.02Å; L667-W714 HydrophobicContact CG-CE3 3.72Å; L667-W714 HydrophobicContact CG-CH2 3.92Å; L667-W714 HydrophobicContact CG-CZ2 4.2Å; L667-W714 HydrophobicContact CG-CZ3 3.66Å
668	L	89.9	Confident	84.8	Confident	29 Å²	29	58.1 Å²	58.1	15%	0.152	30%	0.304	C	S	.	.	H	α-helix	trans	-59.7	-45.1	176.5	177.3	66.2	0	0	0	111.9	L502 L505 K664 R665 E666 A670 V671 A672 L692 W702	L502-L668 HydrophobicContact CD1-CD1 3.79Å; L502-L668 HydrophobicContact CD1-CD2 3.43Å; L502-L668 VanDerWaalsContact CD1-CD2 3.43Å; L502-L668 HydrophobicContact CD1-CG 4.27Å; L505-L668 HydrophobicContact CD2-CD1 3.69Å; K664-L668 PolarHBondContact O-N 3.43Å; K664-L668 VanDerWaalsContact O-N 3.12Å; R665-L668 PolarHBondContact O-N 3.07Å; E666-L668 VanDerWaalsContact C-N 3.35Å; E666-L668 PolarHBondContact O-N 3.2Å; L668-A670 VanDerWaalsContact C-N 3.3Å; L668-A670 PolarHBondContact O-N 3.46Å; L668-V671 PolarHBondContact O-N 3.18Å; L668-A672 WeakPolarHBondContact O-CB 3.46Å; L668-A672 PolarHBondContact O-N 3.42Å; L668-L692 HydrophobicContact CB-CD1 4.41Å; L668-L692 HydrophobicContact CD1-CD2 3.83Å; L668-W702 HydrophobicContact CD2-CH2 4.15Å; L668-W702 HydrophobicContact CD2-CZ3 3.91Å
669	S	88.3	Confident	86.2	Confident	47 Å²	47	53.4 Å²	53.4	33%	0.329	27%	0.272	S	S	.	.	H	α-helix	trans	-61.4	-39.8	178.2	-179.8	0	0	0	0	111.7	R665 E666 L667 A672 K673	R665-S669 WeakPolarHBondContact O-CB 3.24Å; R665-S669 PolarHBondContact O-N 3.15Å; E666-S669 PolarHBondContact O-N 3.29Å; L667-S669 VanDerWaalsContact C-N 3.34Å; L667-S669 PolarHBondContact O-N 3.09Å; S669-A672 PolarHBondContact O-N 3.14Å; S669-K673 VanDerWaalsContact O-CG 3.24Å; S669-K673 WeakPolarHBondContact O-CG 3.38Å; S669-K673 PolarHBondContact O-N 2.85Å
670	A	88.2	Confident	87.5	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.008	26%	0.258	C	S	.	.	H	α-helix	trans	-65.7	-44.1	178.1	0	0	0	0	0	112.3	V656 E666 L667 L668 K673 W714	V656-A670 HydrophobicContact CB-CB 4.3Å; V656-A670 HydrophobicContact CG1-CB 3.53Å; V656-A670 HydrophobicContact CG2-CB 3.73Å; E666-A670 WeakPolarHBondContact O-CB 3.43Å; E666-A670 PolarHBondContact O-N 2.81Å; L667-A670 PolarHBondContact O-N 3.14Å; L668-A670 VanDerWaalsContact C-N 3.3Å; L668-A670 PolarHBondContact O-N 3.46Å; A670-K673 PolarHBondContact O-N 3.05Å; A670-W714 HydrophobicContact CB-CH2 3.54Å; A670-W714 HydrophobicContact CB-CZ2 3.81Å
671	V	88.6	Confident	89	Confident	14 Å²	14	44.4 Å²	44.4	9%	0.085	22%	0.218	C	C	.	.	H	α-helix	trans	-62.2	-44.8	174.7	177.8	0	0	0	0	111	L667 L668 K673 I674 A688 K689 W717	L667-V671 HydrophobicContact CD2-CG2 4.3Å; L667-V671 WeakPolarHBondContact O-CG2 3.33Å; L667-V671 PolarHBondContact O-N 2.96Å; L668-V671 PolarHBondContact O-N 3.18Å; V671-K673 VanDerWaalsContact C-N 3.26Å; V671-K673 PolarHBondContact O-N 3.49Å; V671-I674 PolarHBondContact O-N 2.94Å; V671-A688 HydrophobicContact CG2-CB 3.34Å; V671-K689 HydrophobicContact CG1-CG 4.31Å; V671-W717 HydrophobicContact CG2-CH2 4.5Å
672	A	86.8	Confident	90	Very high	55 Å²	55	35.5 Å²	35.5	46%	0.455	19%	0.185	S	C	.	.	H	α-helix	trans	-69	-20.3	-179.2	0	0	0	0	0	114.2	L505 L668 S669 I674	L505-A672 HydrophobicContact CD1-CB 4.26Å; L668-A672 WeakPolarHBondContact O-CB 3.46Å; L668-A672 PolarHBondContact O-N 3.42Å; S669-A672 PolarHBondContact O-N 3.14Å; A672-I674 VanDerWaalsContact C-N 3.31Å
673	K	88.5	Confident	90.5	Very high	93 Å²	93	34.1 Å²	34.1	40%	0.404	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-14.4	174.5	-77.6	172.1	176.4	-174.7	0	113.2	P653 H654 V656 S669 A670 V671 F675	P653-K673 HydrophobicContact CB-CB 3.84Å; P653-K673 HydrophobicContact CB-CD 4.28Å; P653-K673 HydrophobicContact CG-CB 4.32Å; H654-K673 PolarHBondContact O-NZ 3.33Å; V656-K673 HydrophobicContact CG2-CD 4.03Å; S669-K673 VanDerWaalsContact O-CG 3.24Å; S669-K673 WeakPolarHBondContact O-CG 3.38Å; S669-K673 PolarHBondContact O-N 2.85Å; A670-K673 PolarHBondContact O-N 3.05Å; V671-K673 VanDerWaalsContact C-N 3.26Å; V671-K673 PolarHBondContact O-N 3.49Å; K673-F675 PolarHBondContact O-N 3.12Å
674	I	88.7	Confident	90.7	Very high	20 Å²	20	33.7 Å²	33.7	10%	0.103	18%	0.175	C	C	.	.	S	Bend	trans	-79.2	106	173.1	-61	174.6	0	0	0	107.4	P653 V671 A672 D676 L681 F684 T685 W717 L721	P653-I674 HydrophobicContact CG-CG1 3.74Å; V671-I674 PolarHBondContact O-N 2.94Å; A672-I674 VanDerWaalsContact C-N 3.31Å; I674-D676 HydrophobicContact CG2-CB 4.27Å; I674-D676 PolarHBondContact O-N 3.16Å; I674-L681 HydrophobicContact CG2-CD1 3.77Å; I674-F684 HydrophobicContact CD1-CE1 4.01Å; I674-T685 HydrophobicContact CD1-CG2 4.19Å; I674-T685 HydrophobicContact CG2-CG2 4.17Å; I674-W717 HydrophobicContact CD1-CH2 3.56Å; I674-W717 HydrophobicContact CD1-CZ2 3.63Å; I674-L721 HydrophobicContact CD1-CD2 4.08Å
675	F	87.4	Confident	90.9	Very high	112 Å²	112	33.6 Å²	33.6	49%	0.491	18%	0.176	S	C	.	.			trans	-84.2	97	176.9	-168.7	-104.9	0	0	0	109.8	L637 V639 K673 P677	L637-F675 WeakPolarHBondContact O-CE1 3.44Å; L637-F675 WeakPolarHBondContact O-CZ 3.28Å; V639-F675 HydrophobicContact CG2-CD1 3.78Å; V639-F675 HydrophobicContact CG2-CE1 3.68Å; K673-F675 PolarHBondContact O-N 3.12Å; F675-P677 HydrophobicContact CD1-CG 4.39Å; F675-P677 HydrophobicContact CE1-CG 3.88Å; F675-P677 HydrophobicContact CZ-CG 4.24Å
676	D	90.1	Very high	91.1	Very high	26 Å²	26	28.8 Å²	28.8	14%	0.139	16%	0.158	C	C	.	.			trans	-130.9	74.6	-179.3	177.8	25.1	0	0	0	110.5	I674 M678 G679 F680 L681	I674-D676 HydrophobicContact CG2-CB 4.27Å; I674-D676 PolarHBondContact O-N 3.16Å; D676-M678 VanDerWaalsContact C-N 3.33Å; D676-M678 PolarHBondContact O-N 2.84Å; D676-G679 VanDerWaalsContact CG-CA 3.5Å; D676-G679 PolarHBondContact O-N 3Å; D676-G679 WeakPolarHBondContact OD1-CA 3.26Å; D676-G679 PolarHBondContact OD1-N 3.1Å; D676-G679 WeakPolarHBondContact OD2-CA 3.33Å; D676-F680 PolarHBondContact OD1-N 2.82Å; D676-F680 PolarHBondContact OD2-N 3.32Å; D676-L681 HydrophobicContact CB-CB 4.48Å; D676-L681 HydrophobicContact CB-CD1 4.5Å; D676-L681 VanDerWaalsContact OD2-CA 3.31Å; D676-L681 WeakPolarHBondContact OD2-CA 3.39Å; D676-L681 VanDerWaalsContact OD2-CB 3.3Å; D676-L681 WeakPolarHBondContact OD2-CB 3.41Å; D676-L681 PolarHBondContact OD2-N 3.48Å
677	P	88.6	Confident	91.4	Very high	60 Å²	60	29.5 Å²	29.5	39%	0.39	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-36.5	-175.2	24.5	-32.9	0	0	0	112.9	V639 F675 G679 K780	V639-P677 HydrophobicContact CG2-CG 4.06Å; F675-P677 HydrophobicContact CD1-CG 4.39Å; F675-P677 HydrophobicContact CE1-CG 3.88Å; F675-P677 HydrophobicContact CZ-CG 4.24Å; P677-G679 VanDerWaalsContact C-N 3.35Å; P677-K780 PolarHBondContact O-NZ 3.45Å; P677-K780 VanDerWaalsContact O-NZ 3.16Å
678	M	91.3	Very high	91.6	Very high	68 Å²	68	29.5 Å²	29.5	34%	0.335	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-9.2	-179.2	-58.3	-55.2	-73.7	0	0	113.2	D676 F680 V777 I778 A779	D676-M678 VanDerWaalsContact C-N 3.33Å; D676-M678 PolarHBondContact O-N 2.84Å; M678-F680 VanDerWaalsContact C-N 3.34Å; M678-F680 HydrophobicContact CB-CD1 4.43Å; M678-F680 HydrophobicContact CB-CD2 3.88Å; M678-F680 HydrophobicContact CB-CE1 4.14Å; M678-F680 HydrophobicContact CB-CE2 3.57Å; M678-F680 HydrophobicContact CB-CG 4.31Å; M678-F680 HydrophobicContact CB-CZ 3.71Å; M678-F680 HydrophobicContact CG-CE2 3.92Å; M678-F680 HydrophobicContact CG-CZ 4.1Å; M678-V777 HydrophobicContact CE-CG1 4.41Å; M678-V777 WeakPolarHBondContact CE-O 3.11Å; M678-I778 HydrophobicContact CE-CB 4.05Å; M678-I778 HydrophobicContact CE-CD1 4.33Å; M678-I778 HydrophobicContact CE-CG1 4.31Å; M678-I778 CarbonylContact O-C 3.57Å; M678-I778 VanDerWaalsContact O-CA 3.29Å; M678-I778 WeakPolarHBondContact O-CA 3.23Å; M678-I778 VanDerWaalsContact O-CG1 3.26Å; M678-I778 WeakPolarHBondContact O-CG1 3.49Å; M678-I778 HydrophobicContact SD-CD1 4.46Å; M678-A779 PolarHBondContact O-N 3Å
679	G	93.7	Very high	91.8	Very high	6 Å²	6	28.8 Å²	28.8	6%	0.062	16%	0.155	C	C	.	.			trans	72.7	24.5	178.3	0	0	0	0	0	114	D676 P677 L681 A682 A779	D676-G679 VanDerWaalsContact CG-CA 3.5Å; D676-G679 PolarHBondContact O-N 3Å; D676-G679 WeakPolarHBondContact OD1-CA 3.26Å; D676-G679 PolarHBondContact OD1-N 3.1Å; D676-G679 WeakPolarHBondContact OD2-CA 3.33Å; P677-G679 VanDerWaalsContact C-N 3.35Å; G679-L681 PolarHBondContact O-N 2.79Å; G679-A682 WeakPolarHBondContact O-CB 3.45Å; G679-A682 PolarHBondContact O-N 3.34Å; G679-A779 WeakPolarHBondContact CA-O 2.84Å
680	F	94.7	Very high	92.1	Very high	19 Å²	19	27.6 Å²	27.6	8%	0.083	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-32.8	175.9	-66	-47.9	0	0	0	111.8	L648 F650 D676 M678 V729 M776 W888 W889	L648-F680 HydrophobicContact CD1-CE2 4.17Å; F650-F680 HydrophobicContact CZ-CB 3.8Å; F650-F680 AromaticContact CZ-CD2 3.95Å; F650-F680 HydrophobicContact CZ-CD2 3.95Å; F650-F680 HydrophobicContact CZ-CG 4.34Å; D676-F680 PolarHBondContact OD1-N 2.82Å; D676-F680 PolarHBondContact OD2-N 3.32Å; M678-F680 VanDerWaalsContact C-N 3.34Å; M678-F680 HydrophobicContact CB-CD1 4.43Å; M678-F680 HydrophobicContact CB-CD2 3.88Å; M678-F680 HydrophobicContact CB-CE1 4.14Å; M678-F680 HydrophobicContact CB-CE2 3.57Å; M678-F680 HydrophobicContact CB-CG 4.31Å; M678-F680 HydrophobicContact CB-CZ 3.71Å; M678-F680 HydrophobicContact CG-CE2 3.92Å; M678-F680 HydrophobicContact CG-CZ 4.1Å; F680-V729 HydrophobicContact CD1-CG1 4.22Å; F680-V729 HydrophobicContact CD2-CG1 4.36Å; F680-V729 HydrophobicContact CD2-CG2 4.42Å; F680-V729 HydrophobicContact CE1-CG1 3.99Å; F680-V729 HydrophobicContact CE2-CG1 4.1Å; F680-V729 HydrophobicContact CG-CG1 4.42Å; F680-V729 HydrophobicContact CG-CG2 4.35Å; F680-V729 HydrophobicContact CZ-CG1 3.92Å; F680-M776 HydrophobicContact CD1-CE 3.79Å; F680-M776 HydrophobicContact CD1-CG 4.5Å; F680-M776 HydrophobicContact CD1-SD 4.04Å; F680-M776 HydrophobicContact CE1-CE 4.45Å; F680-W888 PolarHBondContact O-NE1 3.05Å; F680-W889 HydrophobicContact CB-CH2 4.05Å; F680-W889 HydrophobicContact CB-CZ3 4.01Å; F680-W889 AromaticContact CD1-CZ3 3.94Å; F680-W889 HydrophobicContact CD1-CZ3 3.94Å; F680-W889 HydrophobicContact CG-CZ3 4.23Å
681	L	95.2	Very high	92.3	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	13.8	177	-52.6	177.2	0	0	0	112.2	F650 I674 D676 G679 P683 F684 T685 L724 L727 I879 L882	F650-L681 HydrophobicContact CB-CD1 4.42Å; F650-L681 HydrophobicContact CD1-CD1 3.45Å; F650-L681 VanDerWaalsContact CD1-CD1 3.45Å; F650-L681 HydrophobicContact CD1-CG 4.02Å; F650-L681 HydrophobicContact CD2-CD1 4.43Å; F650-L681 HydrophobicContact CD2-CD2 4.3Å; F650-L681 HydrophobicContact CE1-CD1 3.72Å; F650-L681 HydrophobicContact CE1-CD2 4.41Å; F650-L681 HydrophobicContact CE1-CG 3.77Å; F650-L681 HydrophobicContact CE2-CD2 4.17Å; F650-L681 HydrophobicContact CE2-CG 4.41Å; F650-L681 HydrophobicContact CG-CD1 3.83Å; F650-L681 HydrophobicContact CG-CG 4.41Å; F650-L681 HydrophobicContact CZ-CD1 4.34Å; F650-L681 HydrophobicContact CZ-CD2 4.21Å; F650-L681 HydrophobicContact CZ-CG 3.99Å; I674-L681 HydrophobicContact CG2-CD1 3.77Å; D676-L681 HydrophobicContact CB-CB 4.48Å; D676-L681 HydrophobicContact CB-CD1 4.5Å; D676-L681 VanDerWaalsContact OD2-CA 3.31Å; D676-L681 WeakPolarHBondContact OD2-CA 3.39Å; D676-L681 VanDerWaalsContact OD2-CB 3.3Å; D676-L681 WeakPolarHBondContact OD2-CB 3.41Å; D676-L681 PolarHBondContact OD2-N 3.48Å; G679-L681 PolarHBondContact O-N 2.79Å; L681-P683 VanDerWaalsContact C-CD 3.45Å; L681-P683 VanDerWaalsContact C-N 3.31Å; L681-F684 HydrophobicContact CB-CB 4.48Å; L681-F684 WeakPolarHBondContact O-CA 3.38Å; L681-F684 PolarHBondContact O-N 3.26Å; L681-T685 HydrophobicContact CB-CG2 4.15Å; L681-T685 PolarHBondContact O-N 3.46Å; L681-T685 PolarHBondContact O-OG1 3.23Å; L681-T685 VanDerWaalsContact O-OG1 3.1Å; L681-L724 HydrophobicContact CD1-CD2 3.65Å; L681-L724 HydrophobicContact CD2-CD2 4.06Å; L681-L727 HydrophobicContact CD2-CD1 4.16Å; L681-L727 HydrophobicContact CD2-CD2 4.31Å; L681-I879 HydrophobicContact CD2-CD1 3.95Å; L681-L882 HydrophobicContact CD2-CD2 4.22Å
682	A	95.4	Very high	92.5	Very high	3 Å²	3	27.5 Å²	27.5	3%	0.025	14%	0.143	C	C	.	.	H	α-helix	trans	-52	-40.9	179.1	0	0	0	0	0	113.6	G679 F684 T685 I686 A779 S781	G679-A682 WeakPolarHBondContact O-CB 3.45Å; G679-A682 PolarHBondContact O-N 3.34Å; A682-F684 VanDerWaalsContact C-N 3.3Å; A682-F684 PolarHBondContact O-N 3.13Å; A682-T685 PolarHBondContact O-OG1 2.98Å; A682-I686 WeakPolarHBondContact O-CB 3.38Å; A682-I686 WeakPolarHBondContact O-CG2 3.43Å; A682-I686 PolarHBondContact O-N 2.83Å; A682-I686 VanDerWaalsContact O-N 3.16Å; A682-A779 HydrophobicContact CB-CB 4.24Å; A682-S781 PolarHBondContact O-OG 3.38Å
683	P	96.1	Very high	92.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64.7	-28.5	173.3	-25.3	36.7	0	0	0	114.6	L681 I686 L872 L873 G876 T877 L882 W888	L681-P683 VanDerWaalsContact C-CD 3.45Å; L681-P683 VanDerWaalsContact C-N 3.31Å; P683-I686 WeakPolarHBondContact O-CG2 3.36Å; P683-L872 WeakPolarHBondContact CB-O 3.07Å; P683-L872 HydrophobicContact CG-CB 4.4Å; P683-L873 HydrophobicContact CG-CB 4.08Å; P683-G876 CarbonylContact O-C 3.48Å; P683-G876 WeakPolarHBondContact O-CA 3.31Å; P683-T877 HydrophobicContact CB-CG2 3.7Å; P683-T877 PolarHBondContact O-N 3.39Å; P683-L882 HydrophobicContact CB-CD1 4.16Å; P683-L882 HydrophobicContact CG-CD1 4.01Å; P683-W888 HydrophobicContact CG-CD2 3.94Å; P683-W888 HydrophobicContact CG-CE3 4.03Å; P683-W888 HydrophobicContact CG-CH2 3.51Å; P683-W888 HydrophobicContact CG-CZ2 3.38Å; P683-W888 HydrophobicContact CG-CZ3 3.83Å
684	F	95.6	Very high	92.8	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-84.7	-46.5	179.3	171.2	-112	0	0	0	111.7	I674 L681 A682 I686 R687 W717 D720 L721 L724 I879	I674-F684 HydrophobicContact CD1-CE1 4.01Å; L681-F684 HydrophobicContact CB-CB 4.48Å; L681-F684 WeakPolarHBondContact O-CA 3.38Å; L681-F684 PolarHBondContact O-N 3.26Å; A682-F684 VanDerWaalsContact C-N 3.3Å; A682-F684 PolarHBondContact O-N 3.13Å; F684-I686 VanDerWaalsContact C-N 3.34Å; F684-I686 PolarHBondContact O-N 3.15Å; F684-R687 WeakPolarHBondContact O-CB 3.02Å; F684-R687 PolarHBondContact O-N 2.73Å; F684-W717 HydrophobicContact CD1-CZ2 4.26Å; F684-W717 AromaticContact CD2-NE1 3.7Å; F684-W717 AromaticContact CE1-CE2 3.63Å; F684-W717 HydrophobicContact CE1-CH2 4.31Å; F684-W717 AromaticContact CE1-CZ2 3.49Å; F684-W717 HydrophobicContact CE1-CZ2 3.49Å; F684-W717 VanDerWaalsContact CE1-CZ2 3.49Å; F684-W717 AromaticContact CE1-NE1 3.72Å; F684-W717 AromaticContact CE2-CD1 3.51Å; F684-W717 HydrophobicContact CE2-CD2 4.27Å; F684-W717 AromaticContact CE2-CE2 3.8Å; F684-W717 HydrophobicContact CE2-CG 4.13Å; F684-W717 HydrophobicContact CE2-CZ2 4.5Å; F684-W717 AromaticContact CE2-NE1 3.27Å; F684-W717 VanDerWaalsContact CE2-NE1 3.27Å; F684-W717 AromaticContact CZ-CD1 3.87Å; F684-W717 AromaticContact CZ-CD2 3.87Å; F684-W717 HydrophobicContact CZ-CD2 3.87Å; F684-W717 AromaticContact CZ-CE2 3.31Å; F684-W717 HydrophobicContact CZ-CG 4.23Å; F684-W717 HydrophobicContact CZ-CH2 4.42Å; F684-W717 AromaticContact CZ-CZ2 3.64Å; F684-W717 HydrophobicContact CZ-CZ2 3.64Å; F684-W717 AromaticContact CZ-NE1 3.3Å; F684-W717 VanDerWaalsContact CZ-NE1 3.3Å; F684-W717 PolarHBondContact O-NE1 2.82Å; F684-D720 HydrophobicContact CD2-CB 4.5Å; F684-D720 HydrophobicContact CE2-CB 3.56Å; F684-D720 HydrophobicContact CZ-CB 4Å; F684-L721 HydrophobicContact CE1-CD2 3.88Å; F684-L721 HydrophobicContact CZ-CD2 3.89Å; F684-L724 HydrophobicContact CD1-CD2 4.5Å; F684-L724 HydrophobicContact CE1-CD2 4.42Å; F684-I879 HydrophobicContact CB-CD1 3.61Å; F684-I879 HydrophobicContact CB-CG1 4.4Å; F684-I879 HydrophobicContact CD1-CD1 3.61Å; F684-I879 HydrophobicContact CD1-CG1 4.03Å; F684-I879 HydrophobicContact CD2-CD1 3.79Å; F684-I879 HydrophobicContact CD2-CG1 3.61Å; F684-I879 HydrophobicContact CE1-CD1 4.19Å; F684-I879 HydrophobicContact CE1-CG1 4.17Å; F684-I879 HydrophobicContact CE2-CD1 4.36Å; F684-I879 HydrophobicContact CE2-CG1 3.79Å; F684-I879 HydrophobicContact CG-CD1 3.36Å; F684-I879 HydrophobicContact CG-CG1 3.74Å; F684-I879 HydrophobicContact CZ-CG1 4.04Å
685	T	94.3	Very high	93	Very high	13 Å²	13	22 Å²	22	8%	0.08	11%	0.113	C	C	.	.	H	α-helix	trans	-68	-31.7	-176.8	56.5	0	0	0	0	112.3	I674 L681 A682 R687 A688 K689	I674-T685 HydrophobicContact CD1-CG2 4.19Å; I674-T685 HydrophobicContact CG2-CG2 4.17Å; L681-T685 HydrophobicContact CB-CG2 4.15Å; L681-T685 PolarHBondContact O-N 3.46Å; L681-T685 PolarHBondContact O-OG1 3.23Å; L681-T685 VanDerWaalsContact O-OG1 3.1Å; A682-T685 PolarHBondContact O-OG1 2.98Å; T685-R687 PolarHBondContact O-N 3.23Å; T685-A688 PolarHBondContact O-N 3.41Å; T685-K689 PolarHBondContact O-N 3.48Å
686	I	94.7	Very high	93	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-60.9	-31.4	177.9	-162.4	61.3	0	0	0	112.7	A682 P683 F684 A688 K689 I690 A756 L783	A682-I686 WeakPolarHBondContact O-CB 3.38Å; A682-I686 WeakPolarHBondContact O-CG2 3.43Å; A682-I686 PolarHBondContact O-N 2.83Å; A682-I686 VanDerWaalsContact O-N 3.16Å; P683-I686 WeakPolarHBondContact O-CG2 3.36Å; F684-I686 VanDerWaalsContact C-N 3.34Å; F684-I686 PolarHBondContact O-N 3.15Å; I686-A688 VanDerWaalsContact C-N 3.33Å; I686-A688 PolarHBondContact O-N 3.28Å; I686-K689 HydrophobicContact CD1-CB 4.23Å; I686-K689 HydrophobicContact CD1-CD 4.11Å; I686-K689 WeakPolarHBondContact O-CB 3.45Å; I686-K689 PolarHBondContact O-N 3.03Å; I686-I690 HydrophobicContact CG1-CD1 4.29Å; I686-I690 HydrophobicContact CG1-CG1 4.48Å; I686-I690 VanDerWaalsContact O-CG1 3.27Å; I686-I690 WeakPolarHBondContact O-CG1 3.34Å; I686-I690 PolarHBondContact O-N 3.2Å; I686-A756 HydrophobicContact CD1-CB 3.66Å; I686-A756 HydrophobicContact CG1-CB 3.45Å; I686-A756 VanDerWaalsContact CG1-CB 3.45Å; I686-L783 HydrophobicContact CD1-CD2 4.08Å; I686-L783 HydrophobicContact CD1-CG 4.43Å
687	R	95.2	Very high	92.9	Very high	54 Å²	54	25.8 Å²	25.8	20%	0.204	13%	0.127	C	C	.	.	H	α-helix	trans	-59.3	-44.1	176.7	-69.8	170.7	61.6	-150	0.3	111.3	F684 T685 I690 I691 D720 T877	F684-R687 WeakPolarHBondContact O-CB 3.02Å; F684-R687 PolarHBondContact O-N 2.73Å; T685-R687 PolarHBondContact O-N 3.23Å; R687-I690 PolarHBondContact O-N 3.31Å; R687-I691 WeakPolarHBondContact O-CG1 3.34Å; R687-I691 PolarHBondContact O-N 3.38Å; R687-D720 IonicContact CZ-OD2 2.76Å; R687-D720 IonicContact NH1-OD2 3.9Å; R687-D720 PolarHBondContact NH1-OD2 2.91Å; R687-D720 IonicContact NH2-OD2 2.7Å; R687-T877 WeakPolarHBondContact CD-O 3.21Å; R687-T877 PolarHBondContact NH1-O 3.17Å
688	A	93.5	Very high	92.9	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-68.8	-39.5	176	0	0	0	0	0	112.1	V671 T685 I686 I690 I691 L692 W714 W717	V671-A688 HydrophobicContact CG2-CB 3.34Å; T685-A688 PolarHBondContact O-N 3.41Å; I686-A688 VanDerWaalsContact C-N 3.33Å; I686-A688 PolarHBondContact O-N 3.28Å; A688-I690 VanDerWaalsContact C-N 3.27Å; A688-I690 PolarHBondContact O-N 3.17Å; A688-I691 WeakPolarHBondContact O-CB 3.19Å; A688-I691 PolarHBondContact O-N 2.72Å; A688-I691 VanDerWaalsContact O-N 3.15Å; A688-L692 PolarHBondContact O-N 3.3Å; A688-W714 HydrophobicContact CB-CZ3 4.01Å; A688-W717 HydrophobicContact CB-CD2 3.97Å; A688-W717 HydrophobicContact CB-CG 4.37Å; A688-W717 HydrophobicContact CB-CH2 4.33Å; A688-W717 HydrophobicContact CB-CZ2 3.77Å
689	K	93.2	Very high	92.7	Very high	13 Å²	13	25.8 Å²	25.8	6%	0.057	15%	0.145	C	C	.	.	H	α-helix	trans	-59.5	-37.5	173.5	-64.5	179.7	-175.5	-172.7	0	111.9	W506 E509 V671 T685 I686 L692 Q693 L783	W506-K689 HydrophobicContact CH2-CB 4.27Å; W506-K689 HydrophobicContact CH2-CD 3.97Å; W506-K689 HydrophobicContact CH2-CG 4.08Å; W506-K689 HydrophobicContact CZ3-CD 4.04Å; E509-K689 WeakPolarHBondContact OE1-CE 3.43Å; E509-K689 IonicContact OE1-NZ 3.48Å; E509-K689 PolarHBondContact OE1-NZ 3.06Å; E509-K689 IonicContact OE2-NZ 2.75Å; E509-K689 PolarHBondContact OE2-NZ 3.37Å; V671-K689 HydrophobicContact CG1-CG 4.31Å; T685-K689 PolarHBondContact O-N 3.48Å; I686-K689 HydrophobicContact CD1-CB 4.23Å; I686-K689 HydrophobicContact CD1-CD 4.11Å; I686-K689 WeakPolarHBondContact O-CB 3.45Å; I686-K689 PolarHBondContact O-N 3.03Å; K689-L692 WeakPolarHBondContact O-CB 3.38Å; K689-L692 PolarHBondContact O-N 3.46Å; K689-Q693 PolarHBondContact O-N 3Å; K689-L783 HydrophobicContact CB-CD1 4Å; K689-L783 HydrophobicContact CB-CD2 3.86Å; K689-L783 HydrophobicContact CB-CG 3.95Å; K689-L783 WeakPolarHBondContact O-CD1 3.45Å
690	I	93.5	Very high	92.4	Very high	22 Å²	22	26 Å²	26	11%	0.113	15%	0.146	C	C	.	.	H	α-helix	trans	-65.6	-39.9	176.3	-70.8	166	0	0	0	111.1	I686 R687 A688 L692 Q693 S694 K755 L783	I686-I690 HydrophobicContact CG1-CD1 4.29Å; I686-I690 HydrophobicContact CG1-CG1 4.48Å; I686-I690 VanDerWaalsContact O-CG1 3.27Å; I686-I690 WeakPolarHBondContact O-CG1 3.34Å; I686-I690 PolarHBondContact O-N 3.2Å; R687-I690 PolarHBondContact O-N 3.31Å; A688-I690 VanDerWaalsContact C-N 3.27Å; A688-I690 PolarHBondContact O-N 3.17Å; I690-L692 VanDerWaalsContact C-N 3.34Å; I690-Q693 PolarHBondContact O-N 3.18Å; I690-S694 PolarHBondContact O-N 3.23Å; I690-S694 PolarHBondContact O-OG 2.88Å; I690-K755 HydrophobicContact CD1-CB 3.95Å; I690-K755 HydrophobicContact CD1-CD 4.43Å; I690-K755 HydrophobicContact CG1-CB 4.12Å; I690-K755 HydrophobicContact CG2-CD 3.92Å; I690-L783 HydrophobicContact CB-CD2 4.46Å; I690-L783 HydrophobicContact CG1-CD2 3.76Å
691	I	94	Very high	92.1	Very high	10 Å²	10	26 Å²	26	5%	0.051	15%	0.151	C	C	.	.	H	α-helix	trans	-62.7	-44.4	173.4	-60.3	166.2	0	0	0	109.7	L667 R687 A688 Q693 S694 L695 L710 K713 W714	L667-I691 HydrophobicContact CD1-CB 4.02Å; L667-I691 HydrophobicContact CD1-CG2 3.49Å; L667-I691 VanDerWaalsContact CD1-CG2 3.49Å; R687-I691 WeakPolarHBondContact O-CG1 3.34Å; R687-I691 PolarHBondContact O-N 3.38Å; A688-I691 WeakPolarHBondContact O-CB 3.19Å; A688-I691 PolarHBondContact O-N 2.72Å; A688-I691 VanDerWaalsContact O-N 3.15Å; I691-Q693 VanDerWaalsContact C-N 3.33Å; I691-Q693 PolarHBondContact O-N 3.01Å; I691-S694 WeakPolarHBondContact O-CB 3.23Å; I691-S694 PolarHBondContact O-N 2.95Å; I691-S694 VanDerWaalsContact O-N 3.09Å; I691-L695 HydrophobicContact CG2-CD1 4.42Å; I691-L695 PolarHBondContact O-N 2.95Å; I691-L710 HydrophobicContact CG2-CB 4.32Å; I691-K713 HydrophobicContact CD1-CB 3.89Å; I691-K713 HydrophobicContact CG1-CB 4.27Å; I691-W714 HydrophobicContact CD1-CB 4.37Å; I691-W714 HydrophobicContact CD1-CE3 4.42Å
692	L	91.6	Very high	91.9	Very high	3 Å²	3	28.4 Å²	28.4	2%	0.016	16%	0.16	C	C	.	.	H	α-helix	trans	-58.9	-42.8	176.7	-171.8	66.1	0	0	0	112.1	W506 K664 L667 L668 A688 K689 I690 S694 L695 W696	W506-L692 HydrophobicContact CZ2-CD2 4.14Å; K664-L692 HydrophobicContact CD-CD1 4.43Å; K664-L692 HydrophobicContact CG-CD1 3.71Å; L667-L692 HydrophobicContact CD2-CB 3.71Å; L667-L692 HydrophobicContact CD2-CD1 3.92Å; L667-L692 HydrophobicContact CD2-CG 4.29Å; L668-L692 HydrophobicContact CB-CD1 4.41Å; L668-L692 HydrophobicContact CD1-CD2 3.83Å; A688-L692 PolarHBondContact O-N 3.3Å; K689-L692 WeakPolarHBondContact O-CB 3.38Å; K689-L692 PolarHBondContact O-N 3.46Å; I690-L692 VanDerWaalsContact C-N 3.34Å; L692-S694 VanDerWaalsContact C-N 3.31Å; L692-S694 PolarHBondContact O-N 3.04Å; L692-L695 PolarHBondContact O-N 3.08Å; L692-W696 HydrophobicContact CD2-CZ2 4.42Å; L692-W696 HydrophobicContact CG-CZ2 4.46Å; L692-W696 PolarHBondContact O-N 3Å; L692-W696 VanDerWaalsContact O-N 3.16Å
693	Q	91	Very high	91.6	Very high	21 Å²	21	33.2 Å²	33.2	10%	0.098	19%	0.185	C	C	.	.	H	α-helix	trans	-62.1	-40.4	175.1	-170.3	176.7	58.1	0	0	111.9	K689 I690 I691 L695 W696 Q697 L783 A784 L786	K689-Q693 PolarHBondContact O-N 3Å; I690-Q693 PolarHBondContact O-N 3.18Å; I691-Q693 VanDerWaalsContact C-N 3.33Å; I691-Q693 PolarHBondContact O-N 3.01Å; Q693-L695 VanDerWaalsContact C-N 3.34Å; Q693-W696 PolarHBondContact O-N 2.79Å; Q693-Q697 WeakPolarHBondContact O-CG 3.18Å; Q693-Q697 PolarHBondContact O-N 3.28Å; Q693-Q697 VanDerWaalsContact O-N 3.07Å; Q693-L783 HydrophobicContact CB-CD1 4.02Å; Q693-L783 HydrophobicContact CB-CD2 4.46Å; Q693-A784 PolarHBondContact NE2-O 3.25Å; Q693-L786 HydrophobicContact CG-CD2 3.66Å; Q693-L786 HydrophobicContact CG-CG 4.43Å
694	S	92	Very high	91.2	Very high	33 Å²	33	38.5 Å²	38.5	23%	0.231	21%	0.21	C	C	.	.	H	α-helix	trans	-64	-39.8	177.5	-54	0	0	0	0	111.3	I690 I691 L692 W696 Q697 S698	I690-S694 PolarHBondContact O-N 3.23Å; I690-S694 PolarHBondContact O-OG 2.88Å; I691-S694 WeakPolarHBondContact O-CB 3.23Å; I691-S694 PolarHBondContact O-N 2.95Å; I691-S694 VanDerWaalsContact O-N 3.09Å; L692-S694 VanDerWaalsContact C-N 3.31Å; L692-S694 PolarHBondContact O-N 3.04Å; S694-W696 VanDerWaalsContact C-N 3.29Å; S694-W696 PolarHBondContact O-N 2.72Å; S694-Q697 PolarHBondContact O-N 3.16Å; S694-Q697 VanDerWaalsContact O-N 3.17Å; S694-S698 PolarHBondContact O-N 3.37Å; S694-S698 PolarHBondContact O-OG 2.88Å
695	L	91.4	Very high	91	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.6	-31.4	174.5	-73.5	170.1	0	0	0	113.3	K664 L667 I691 L692 Q693 S698 G699 T700 I706 L710	K664-L695 HydrophobicContact CB-CD1 4.18Å; K664-L695 HydrophobicContact CD-CB 4.12Å; K664-L695 HydrophobicContact CG-CB 4.27Å; K664-L695 HydrophobicContact CG-CD1 4.09Å; L667-L695 HydrophobicContact CD1-CD1 4.06Å; I691-L695 HydrophobicContact CG2-CD1 4.42Å; I691-L695 PolarHBondContact O-N 2.95Å; L692-L695 PolarHBondContact O-N 3.08Å; Q693-L695 VanDerWaalsContact C-N 3.34Å; L695-S698 WeakPolarHBondContact CA-OG 3.41Å; L695-S698 PolarHBondContact O-OG 3.15Å; L695-G699 PolarHBondContact O-N 3.48Å; L695-T700 HydrophobicContact CD2-CG2 4.25Å; L695-T700 PolarHBondContact O-N 3.19Å; L695-I706 HydrophobicContact CD1-CD1 4.17Å; L695-I706 HydrophobicContact CD1-CG1 4.1Å; L695-I706 HydrophobicContact CD2-CG1 4.25Å; L695-I706 HydrophobicContact CD2-CG2 4.15Å; L695-L710 HydrophobicContact CD2-CD1 3.62Å; L695-L710 HydrophobicContact CG-CD1 3.88Å
696	W	88.7	Confident	90.9	Very high	86 Å²	86	42.3 Å²	42.3	33%	0.326	24%	0.237	S	C	.	.	H	α-helix	trans	-72.9	-37.9	172.1	-74.2	-14.6	0	0	0	112.7	L502 W506 L692 Q693 S694 S698 G699	L502-W696 HydrophobicContact CD1-CZ2 4.17Å; L502-W696 HydrophobicContact CD2-CH2 3.6Å; L502-W696 HydrophobicContact CD2-CZ2 3.35Å; L502-W696 HydrophobicContact CG-CH2 4.44Å; L502-W696 HydrophobicContact CG-CZ2 4.32Å; W506-W696 HydrophobicContact CZ2-CH2 4.4Å; W506-W696 AromaticContact NE1-CH2 3.92Å; L692-W696 HydrophobicContact CD2-CZ2 4.42Å; L692-W696 HydrophobicContact CG-CZ2 4.46Å; L692-W696 PolarHBondContact O-N 3Å; L692-W696 VanDerWaalsContact O-N 3.16Å; Q693-W696 PolarHBondContact O-N 2.79Å; S694-W696 VanDerWaalsContact C-N 3.29Å; S694-W696 PolarHBondContact O-N 2.72Å; W696-S698 VanDerWaalsContact C-N 3.3Å; W696-S698 PolarHBondContact O-N 3.23Å; W696-G699 PolarHBondContact O-N 2.84Å
697	Q	88.1	Confident	90.8	Very high	130 Å²	130	45 Å²	45	61%	0.607	25%	0.254	S	S	*	.	H	α-helix	trans	-65.2	-34.4	176.1	-70.4	175.8	-12.3	0	0	112.2	Q693 S694 G699 L786	Q693-Q697 WeakPolarHBondContact O-CG 3.18Å; Q693-Q697 PolarHBondContact O-N 3.28Å; Q693-Q697 VanDerWaalsContact O-N 3.07Å; S694-Q697 PolarHBondContact O-N 3.16Å; S694-Q697 VanDerWaalsContact O-N 3.17Å; Q697-G699 PolarHBondContact O-N 3.36Å; Q697-L786 HydrophobicContact CG-CD2 3.66Å
698	S	88.6	Confident	90.6	Very high	66 Å²	66	48.9 Å²	48.9	46%	0.462	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-8.5	175	59.7	0	0	0	0	114	S694 L695 W696 T700	S694-S698 PolarHBondContact O-N 3.37Å; S694-S698 PolarHBondContact O-OG 2.88Å; L695-S698 WeakPolarHBondContact CA-OG 3.41Å; L695-S698 PolarHBondContact O-OG 3.15Å; W696-S698 VanDerWaalsContact C-N 3.3Å; W696-S698 PolarHBondContact O-N 3.23Å; S698-T700 VanDerWaalsContact C-N 3.26Å; S698-T700 PolarHBondContact O-N 3.43Å; S698-T700 PolarHBondContact OG-OG1 2.76Å
699	G	86.7	Confident	90.4	Very high	62 Å²	62	54.1 Å²	54.1	64%	0.639	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.1	15.3	-178.4	0	0	0	0	0	114.5	L695 W696 Q697 G701	L695-G699 PolarHBondContact O-N 3.48Å; W696-G699 PolarHBondContact O-N 2.84Å; Q697-G699 PolarHBondContact O-N 3.36Å; G699-G701 PolarHBondContact O-N 3.45Å
700	T	87.5	Confident	90.3	Very high	12 Å²	12	54.5 Å²	54.5	7%	0.074	31%	0.314	C	S	.	.			trans	-61	133	-179.2	-54.9	0	0	0	0	110.6	K664 L695 S698 E704	K664-T700 PolarHBondContact NZ-O 2.9Å; L695-T700 HydrophobicContact CD2-CG2 4.25Å; L695-T700 PolarHBondContact O-N 3.19Å; S698-T700 VanDerWaalsContact C-N 3.26Å; S698-T700 PolarHBondContact O-N 3.43Å; S698-T700 PolarHBondContact OG-OG1 2.76Å; T700-E704 HydrophobicContact CG2-CB 3.88Å
701	G	88.5	Confident	90.2	Very high	19 Å²	19	55.3 Å²	55.3	20%	0.196	32%	0.318	C	S	.	.			trans	-58.5	171	176.4	0	0	0	0	0	113.6	K664 G699 E704	K664-G701 WeakPolarHBondContact CE-O 3.41Å; G699-G701 PolarHBondContact O-N 3.45Å; G701-E704 VanDerWaalsContact N-CD 3.26Å; G701-E704 PolarHBondContact N-OE2 3.01Å
702	W	89.3	Confident	90.1	Very high	50 Å²	50	57.9 Å²	57.9	19%	0.189	34%	0.341	C	S	.	.	S	Bend	trans	-67.6	-40	179.3	-80.3	111.2	0	0	0	113.2	L502 K664 R665 L668	L502-W702 HydrophobicContact CD1-CH2 4.25Å; L502-W702 HydrophobicContact CD2-CH2 4.35Å; K664-W702 HydrophobicContact CD-CE3 4.34Å; K664-W702 HydrophobicContact CD-CZ3 4.41Å; K664-W702 HydrophobicContact CG-CE3 4.23Å; K664-W702 HydrophobicContact CG-CZ3 4.24Å; K664-W702 PolarHBondContact N-O 3.4Å; R665-W702 HydrophobicContact CB-CE3 4.33Å; R665-W702 WeakPolarHBondContact CB-O 3.38Å; R665-W702 PolarHBondContact N-O 3.14Å; L668-W702 HydrophobicContact CD2-CH2 4.15Å; L668-W702 HydrophobicContact CD2-CZ3 3.91Å
703	D	89.4	Confident	90.2	Very high	103 Å²	103	63.3 Å²	63.3	55%	0.551	36%	0.364	S	S	*	.	S	Bend	trans	-115.2	10.8	-172.2	-55.2	-67.2	0	0	0	111.7	T663 R665	T663-D703 WeakPolarHBondContact CG2-O 3.24Å; R665-D703 IonicContact CZ-OD1 3.92Å; R665-D703 IonicContact CZ-OD2 3.95Å; R665-D703 IonicContact NE-OD1 3Å; R665-D703 PolarHBondContact NE-OD1 3.29Å; R665-D703 IonicContact NE-OD2 3.79Å; R665-D703 IonicContact NH2-OD1 2.84Å; R665-D703 IonicContact NH2-OD2 3.59Å; R665-D703 PolarHBondContact NH2-OD2 2.89Å
704	E	89.3	Confident	90.2	Very high	112 Å²	112	62.4 Å²	62.4	52%	0.523	36%	0.36	S	S	.	.	S	Bend	trans	-77	149.1	170.6	-75.2	173.3	-162.1	0	0	110.9	T700 G701	T700-E704 HydrophobicContact CG2-CB 3.88Å; G701-E704 VanDerWaalsContact N-CD 3.26Å; G701-E704 PolarHBondContact N-OE2 3.01Å
705	S	91	Very high	90.2	Very high	91 Å²	91	62.9 Å²	62.9	64%	0.636	36%	0.364	S	S	*	.	B	Isolated β-bridge	trans	-61.9	137	176.6	-168.5	0	0	0	0	110.9	E662	E662-S705 WeakPolarHBondContact O-CA 3.26Å
706	I	92.2	Very high	90.1	Very high	2 Å²	2	71 Å²	71	1%	0.01	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-64.5	131.3	175	-67.7	175.9	0	0	0	109.3	E662 L667 L695 L710 N711 W714	E662-I706 HydrophobicContact CB-CD1 4.28Å; E662-I706 WeakPolarHBondContact O-CG1 2.89Å; E662-I706 PolarHBondContact O-N 3.12Å; L667-I706 HydrophobicContact CB-CD1 4.43Å; L667-I706 HydrophobicContact CD1-CD1 4.29Å; L695-I706 HydrophobicContact CD1-CD1 4.17Å; L695-I706 HydrophobicContact CD1-CG1 4.1Å; L695-I706 HydrophobicContact CD2-CG1 4.25Å; L695-I706 HydrophobicContact CD2-CG2 4.15Å; I706-L710 HydrophobicContact CG2-CB 3.75Å; I706-N711 HydrophobicContact CB-CB 4.34Å; I706-N711 HydrophobicContact CG2-CB 3.82Å; I706-W714 HydrophobicContact CD1-CG 4.47Å
707	P	92.2	Very high	90.4	Very high	55 Å²	55	67 Å²	67	36%	0.357	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-57.9	141.9	175.5	-24.9	33.8	0	0	0	112.6	V709 L710 N711	P707-V709 VanDerWaalsContact C-N 3.28Å; P707-V709 PolarHBondContact O-N 3.45Å; P707-L710 WeakPolarHBondContact O-CA 3.37Å; P707-L710 PolarHBondContact O-N 3.04Å; P707-N711 PolarHBondContact O-N 3.14Å
708	D	90.1	Very high	90.5	Very high	137 Å²	137	61.7 Å²	61.7	73%	0.733	35%	0.354	S	S	*	.	H	α-helix	trans	-49	-43.2	-169.6	-60.8	-29.3	0	0	0	114.5	L710 N711 A712	D708-L710 VanDerWaalsContact C-N 3.34Å; D708-L710 PolarHBondContact O-N 3.05Å; D708-N711 PolarHBondContact O-N 2.75Å; D708-A712 PolarHBondContact O-N 2.78Å
709	V	90	Very high	90.6	Very high	110 Å²	110	64.4 Å²	64.4	67%	0.667	36%	0.359	S	S	*	.	H	α-helix	trans	-62.2	-40.2	179.3	178.9	0	0	0	0	112.2	P707	P707-V709 VanDerWaalsContact C-N 3.28Å; P707-V709 PolarHBondContact O-N 3.45Å
710	L	91.9	Very high	90.7	Very high	21 Å²	21	62.2 Å²	62.2	11%	0.11	33%	0.333	C	S	.	.	H	α-helix	trans	-79.1	-32	176.5	-65.9	-179.3	0	0	0	110.8	I691 L695 I706 P707 D708 K713 W714	I691-L710 HydrophobicContact CG2-CB 4.32Å; L695-L710 HydrophobicContact CD2-CD1 3.62Å; L695-L710 HydrophobicContact CG-CD1 3.88Å; I706-L710 HydrophobicContact CG2-CB 3.75Å; P707-L710 WeakPolarHBondContact O-CA 3.37Å; P707-L710 PolarHBondContact O-N 3.04Å; D708-L710 VanDerWaalsContact C-N 3.34Å; D708-L710 PolarHBondContact O-N 3.05Å; L710-K713 PolarHBondContact O-N 3.23Å; L710-W714 WeakPolarHBondContact O-CB 2.98Å; L710-W714 PolarHBondContact O-N 3.36Å
711	N	91.3	Very high	90.9	Very high	39 Å²	39	61.6 Å²	61.6	21%	0.209	33%	0.329	C	S	.	.	H	α-helix	trans	-65.3	-39.5	177.2	-162.7	37.5	0	0	0	111.3	I706 P707 D708 K713 W714 S715	I706-N711 HydrophobicContact CB-CB 4.34Å; I706-N711 HydrophobicContact CG2-CB 3.82Å; P707-N711 PolarHBondContact O-N 3.14Å; D708-N711 PolarHBondContact O-N 2.75Å; N711-K713 PolarHBondContact O-N 3.17Å; N711-W714 WeakPolarHBondContact O-CB 3.29Å; N711-W714 PolarHBondContact O-N 2.97Å; N711-S715 WeakPolarHBondContact O-CB 3.4Å; N711-S715 PolarHBondContact O-N 3.31Å; N711-S715 PolarHBondContact O-OG 3.07Å; N711-S715 VanDerWaalsContact O-OG 3.11Å
712	A	92.1	Very high	90.9	Very high	64 Å²	64	66 Å²	66	53%	0.529	35%	0.345	S	S	.	.	H	α-helix	trans	-59.8	-43.3	174.1	0	0	0	0	0	112.4	D708 R716	D708-A712 PolarHBondContact O-N 2.78Å; A712-R716 PolarHBondContact O-N 2.98Å
713	K	92.7	Very high	90.9	Very high	116 Å²	116	64.8 Å²	64.8	50%	0.504	34%	0.341	S	S	.	.	H	α-helix	trans	-65.8	-39.7	175.4	-67.7	178.2	-178	173.4	0	111.8	I691 L710 N711 W717	I691-K713 HydrophobicContact CD1-CB 3.89Å; I691-K713 HydrophobicContact CG1-CB 4.27Å; L710-K713 PolarHBondContact O-N 3.23Å; N711-K713 PolarHBondContact O-N 3.17Å; K713-W717 PolarHBondContact O-N 3.39Å
714	W	91.8	Very high	91	Very high	3 Å²	3	59.9 Å²	59.9	1%	0.011	32%	0.315	C	S	.	.	H	α-helix	trans	-65.2	-47.8	177.6	176.2	-124.5	0	0	0	111.9	V656 E662 L667 A670 A688 I691 I706 L710 N711 R716 W717 K718	V656-W714 HydrophobicContact CG1-CZ2 4.49Å; E662-W714 PolarHBondContact OE2-NE1 2.96Å; L667-W714 HydrophobicContact CB-CD2 4.5Å; L667-W714 HydrophobicContact CB-CH2 4.34Å; L667-W714 HydrophobicContact CB-CZ2 4.2Å; L667-W714 HydrophobicContact CD1-CD2 3.77Å; L667-W714 HydrophobicContact CD1-CE3 3.6Å; L667-W714 HydrophobicContact CD1-CG 4.19Å; L667-W714 HydrophobicContact CD1-CZ3 4.08Å; L667-W714 HydrophobicContact CG-CD2 4.02Å; L667-W714 HydrophobicContact CG-CE3 3.72Å; L667-W714 HydrophobicContact CG-CH2 3.92Å; L667-W714 HydrophobicContact CG-CZ2 4.2Å; L667-W714 HydrophobicContact CG-CZ3 3.66Å; A670-W714 HydrophobicContact CB-CH2 3.54Å; A670-W714 HydrophobicContact CB-CZ2 3.81Å; A688-W714 HydrophobicContact CB-CZ3 4.01Å; I691-W714 HydrophobicContact CD1-CB 4.37Å; I691-W714 HydrophobicContact CD1-CE3 4.42Å; I706-W714 HydrophobicContact CD1-CG 4.47Å; L710-W714 WeakPolarHBondContact O-CB 2.98Å; L710-W714 PolarHBondContact O-N 3.36Å; N711-W714 WeakPolarHBondContact O-CB 3.29Å; N711-W714 PolarHBondContact O-N 2.97Å; W714-R716 VanDerWaalsContact C-N 3.32Å; W714-R716 PolarHBondContact O-N 3.48Å; W714-W717 HydrophobicContact CE3-CB 4.48Å; W714-W717 HydrophobicContact CE3-CD2 4.3Å; W714-W717 AromaticContact CE3-CE3 3.78Å; W714-W717 HydrophobicContact CE3-CE3 3.78Å; W714-W717 HydrophobicContact CE3-CZ3 4.38Å; W714-W717 AromaticContact CH2-CE3 3.51Å; W714-W717 HydrophobicContact CH2-CE3 3.51Å; W714-W717 HydrophobicContact CH2-CH2 4.16Å; W714-W717 AromaticContact CH2-CZ3 3.26Å; W714-W717 HydrophobicContact CH2-CZ3 3.26Å; W714-W717 HydrophobicContact CZ2-CZ3 4.36Å; W714-W717 AromaticContact CZ3-CD2 3.77Å; W714-W717 HydrophobicContact CZ3-CD2 3.77Å; W714-W717 AromaticContact CZ3-CE3 3.06Å; W714-W717 HydrophobicContact CZ3-CE3 3.06Å; W714-W717 HydrophobicContact CZ3-CG 4.5Å; W714-W717 HydrophobicContact CZ3-CH2 4.12Å; W714-W717 AromaticContact CZ3-CZ3 3.29Å; W714-W717 HydrophobicContact CZ3-CZ3 3.29Å; W714-W717 WeakPolarHBondContact O-CB 3.3Å; W714-W717 PolarHBondContact O-N 3.3Å; W714-W717 VanDerWaalsContact O-N 3.11Å; W714-K718 HydrophobicContact CD2-CD 4.46Å; W714-K718 HydrophobicContact CD2-CG 4.22Å; W714-K718 HydrophobicContact CH2-CG 4.18Å; W714-K718 HydrophobicContact CZ2-CD 3.79Å; W714-K718 HydrophobicContact CZ2-CG 3.81Å; W714-K718 PolarHBondContact O-N 3.03Å
715	S	90.8	Very high	91	Very high	43 Å²	43	57.3 Å²	57.3	30%	0.301	31%	0.308	S	S	.	.	H	α-helix	trans	-57.5	-43.7	174.5	-67.1	0	0	0	0	112.1	N711 W717 K718 Q719	N711-S715 WeakPolarHBondContact O-CB 3.4Å; N711-S715 PolarHBondContact O-N 3.31Å; N711-S715 PolarHBondContact O-OG 3.07Å; N711-S715 VanDerWaalsContact O-OG 3.11Å; S715-W717 PolarHBondContact O-N 3.05Å; S715-K718 PolarHBondContact O-N 3.24Å; S715-Q719 WeakPolarHBondContact O-CG 3.4Å; S715-Q719 PolarHBondContact O-N 3.25Å
716	R	91.1	Very high	90.9	Very high	170 Å²	170	57.6 Å²	57.6	64%	0.642	30%	0.299	S	S	*	.	H	α-helix	trans	-65.6	-36.2	175.8	-166.1	165.7	-172.8	153.7	1.6	112.8	A712 W714	A712-R716 PolarHBondContact O-N 2.98Å; W714-R716 VanDerWaalsContact C-N 3.32Å; W714-R716 PolarHBondContact O-N 3.48Å
717	W	93.8	Very high	90.8	Very high	1 Å²	1	57.6 Å²	57.6	0%	0.004	30%	0.299	C	S	.	.	H	α-helix	trans	-66.8	-38.8	173.1	-178.6	91.6	0	0	0	112.1	V671 I674 F684 A688 K713 W714 S715 Q719 D720 L721	V671-W717 HydrophobicContact CG2-CH2 4.5Å; I674-W717 HydrophobicContact CD1-CH2 3.56Å; I674-W717 HydrophobicContact CD1-CZ2 3.63Å; F684-W717 HydrophobicContact CD1-CZ2 4.26Å; F684-W717 AromaticContact CD2-NE1 3.7Å; F684-W717 AromaticContact CE1-CE2 3.63Å; F684-W717 HydrophobicContact CE1-CH2 4.31Å; F684-W717 AromaticContact CE1-CZ2 3.49Å; F684-W717 HydrophobicContact CE1-CZ2 3.49Å; F684-W717 VanDerWaalsContact CE1-CZ2 3.49Å; F684-W717 AromaticContact CE1-NE1 3.72Å; F684-W717 AromaticContact CE2-CD1 3.51Å; F684-W717 HydrophobicContact CE2-CD2 4.27Å; F684-W717 AromaticContact CE2-CE2 3.8Å; F684-W717 HydrophobicContact CE2-CG 4.13Å; F684-W717 HydrophobicContact CE2-CZ2 4.5Å; F684-W717 AromaticContact CE2-NE1 3.27Å; F684-W717 VanDerWaalsContact CE2-NE1 3.27Å; F684-W717 AromaticContact CZ-CD1 3.87Å; F684-W717 AromaticContact CZ-CD2 3.87Å; F684-W717 HydrophobicContact CZ-CD2 3.87Å; F684-W717 AromaticContact CZ-CE2 3.31Å; F684-W717 HydrophobicContact CZ-CG 4.23Å; F684-W717 HydrophobicContact CZ-CH2 4.42Å; F684-W717 AromaticContact CZ-CZ2 3.64Å; F684-W717 HydrophobicContact CZ-CZ2 3.64Å; F684-W717 AromaticContact CZ-NE1 3.3Å; F684-W717 VanDerWaalsContact CZ-NE1 3.3Å; F684-W717 PolarHBondContact O-NE1 2.82Å; A688-W717 HydrophobicContact CB-CD2 3.97Å; A688-W717 HydrophobicContact CB-CG 4.37Å; A688-W717 HydrophobicContact CB-CH2 4.33Å; A688-W717 HydrophobicContact CB-CZ2 3.77Å; K713-W717 PolarHBondContact O-N 3.39Å; W714-W717 HydrophobicContact CE3-CB 4.48Å; W714-W717 HydrophobicContact CE3-CD2 4.3Å; W714-W717 AromaticContact CE3-CE3 3.78Å; W714-W717 HydrophobicContact CE3-CE3 3.78Å; W714-W717 HydrophobicContact CE3-CZ3 4.38Å; W714-W717 AromaticContact CH2-CE3 3.51Å; W714-W717 HydrophobicContact CH2-CE3 3.51Å; W714-W717 HydrophobicContact CH2-CH2 4.16Å; W714-W717 AromaticContact CH2-CZ3 3.26Å; W714-W717 HydrophobicContact CH2-CZ3 3.26Å; W714-W717 HydrophobicContact CZ2-CZ3 4.36Å; W714-W717 AromaticContact CZ3-CD2 3.77Å; W714-W717 HydrophobicContact CZ3-CD2 3.77Å; W714-W717 AromaticContact CZ3-CE3 3.06Å; W714-W717 HydrophobicContact CZ3-CE3 3.06Å; W714-W717 HydrophobicContact CZ3-CG 4.5Å; W714-W717 HydrophobicContact CZ3-CH2 4.12Å; W714-W717 AromaticContact CZ3-CZ3 3.29Å; W714-W717 HydrophobicContact CZ3-CZ3 3.29Å; W714-W717 WeakPolarHBondContact O-CB 3.3Å; W714-W717 PolarHBondContact O-N 3.3Å; W714-W717 VanDerWaalsContact O-N 3.11Å; S715-W717 PolarHBondContact O-N 3.05Å; W717-Q719 VanDerWaalsContact C-N 3.33Å; W717-Q719 PolarHBondContact O-N 2.75Å; W717-D720 PolarHBondContact O-N 3.37Å; W717-L721 HydrophobicContact CE3-CD1 4.46Å; W717-L721 HydrophobicContact CE3-CG 4.49Å; W717-L721 HydrophobicContact CH2-CD2 3.81Å; W717-L721 HydrophobicContact CZ2-CD2 4.33Å; W717-L721 HydrophobicContact CZ3-CD1 3.88Å; W717-L721 HydrophobicContact CZ3-CD2 3.9Å; W717-L721 HydrophobicContact CZ3-CG 4.13Å
718	K	91.3	Very high	90.7	Very high	19 Å²	19	58.5 Å²	58.5	8%	0.083	30%	0.301	C	S	.	.	H	α-helix	trans	-65.7	-34.1	176.7	-73.5	-168.8	-64.1	176	0	112.9	V656 E662 W714 S715 D720 L721	V656-K718 HydrophobicContact CG1-CD 4.07Å; V656-K718 HydrophobicContact CG1-CG 4.31Å; E662-K718 IonicContact OE1-NZ 2.76Å; E662-K718 PolarHBondContact OE1-NZ 2.86Å; E662-K718 IonicContact OE2-NZ 3.48Å; E662-K718 PolarHBondContact OE2-NZ 2.91Å; W714-K718 HydrophobicContact CD2-CD 4.46Å; W714-K718 HydrophobicContact CD2-CG 4.22Å; W714-K718 HydrophobicContact CH2-CG 4.18Å; W714-K718 HydrophobicContact CZ2-CD 3.79Å; W714-K718 HydrophobicContact CZ2-CG 3.81Å; W714-K718 PolarHBondContact O-N 3.03Å; S715-K718 PolarHBondContact O-N 3.24Å; K718-D720 PolarHBondContact O-N 3.32Å; K718-L721 HydrophobicContact CB-CD1 4.36Å; K718-L721 HydrophobicContact CG-CD1 4.35Å; K718-L721 VanDerWaalsContact O-CB 3.3Å; K718-L721 WeakPolarHBondContact O-CB 3.06Å; K718-L721 WeakPolarHBondContact O-CG 3.46Å; K718-L721 PolarHBondContact O-N 3.38Å; K718-L721 VanDerWaalsContact O-N 3.1Å
719	Q	89.3	Confident	90.8	Very high	124 Å²	124	52.6 Å²	52.6	58%	0.579	27%	0.27	S	S	*	.	H	α-helix	trans	-56.6	-38.5	174.7	-74.8	168.7	-3.2	0	0	110.8	S715 W717 L721 H722	S715-Q719 WeakPolarHBondContact O-CG 3.4Å; S715-Q719 PolarHBondContact O-N 3.25Å; W717-Q719 VanDerWaalsContact C-N 3.33Å; W717-Q719 PolarHBondContact O-N 2.75Å; Q719-L721 PolarHBondContact O-N 2.71Å; Q719-L721 VanDerWaalsContact O-N 3.15Å; Q719-H722 PolarHBondContact O-CE1 3.35Å; Q719-H722 PolarHBondContact O-ND1 3.38Å
720	D	90.4	Very high	90.8	Very high	15 Å²	15	53.1 Å²	53.1	8%	0.08	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-66.6	-17.7	-179.9	-62.8	-4.5	0	0	0	113.9	F684 R687 W717 K718 H722 M723 T878 I879	F684-D720 HydrophobicContact CD2-CB 4.5Å; F684-D720 HydrophobicContact CE2-CB 3.56Å; F684-D720 HydrophobicContact CZ-CB 4Å; R687-D720 IonicContact CZ-OD2 2.76Å; R687-D720 IonicContact NH1-OD2 3.9Å; R687-D720 PolarHBondContact NH1-OD2 2.91Å; R687-D720 IonicContact NH2-OD2 2.7Å; W717-D720 PolarHBondContact O-N 3.37Å; K718-D720 PolarHBondContact O-N 3.32Å; D720-H722 VanDerWaalsContact C-N 3.32Å; D720-H722 PolarHBondContact O-N 3.39Å; D720-M723 HydrophobicContact CB-CE 3.91Å; D720-M723 WeakPolarHBondContact O-CB 3.42Å; D720-M723 PolarHBondContact O-N 3.04Å; D720-M723 VanDerWaalsContact O-N 3.14Å; D720-T878 WeakPolarHBondContact OD2-CB 2.95Å; D720-I879 HydrophobicContact CB-CB 4.25Å; D720-I879 HydrophobicContact CB-CG1 4.08Å
721	L	91.1	Very high	90.7	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-63.7	-32	-172	-68.1	174.4	0	0	0	113.8	T652 V656 I674 F684 W717 K718 Q719 M723 L724	T652-L721 HydrophobicContact CG2-CB 4.16Å; T652-L721 PolarHBondContact OG1-O 2.8Å; V656-L721 HydrophobicContact CB-CD1 4.39Å; V656-L721 HydrophobicContact CG1-CD1 3.75Å; I674-L721 HydrophobicContact CD1-CD2 4.08Å; F684-L721 HydrophobicContact CE1-CD2 3.88Å; F684-L721 HydrophobicContact CZ-CD2 3.89Å; W717-L721 HydrophobicContact CE3-CD1 4.46Å; W717-L721 HydrophobicContact CE3-CG 4.49Å; W717-L721 HydrophobicContact CH2-CD2 3.81Å; W717-L721 HydrophobicContact CZ2-CD2 4.33Å; W717-L721 HydrophobicContact CZ3-CD1 3.88Å; W717-L721 HydrophobicContact CZ3-CD2 3.9Å; W717-L721 HydrophobicContact CZ3-CG 4.13Å; K718-L721 HydrophobicContact CB-CD1 4.36Å; K718-L721 HydrophobicContact CG-CD1 4.35Å; K718-L721 VanDerWaalsContact O-CB 3.3Å; K718-L721 WeakPolarHBondContact O-CB 3.06Å; K718-L721 WeakPolarHBondContact O-CG 3.46Å; K718-L721 PolarHBondContact O-N 3.38Å; K718-L721 VanDerWaalsContact O-N 3.1Å; Q719-L721 PolarHBondContact O-N 2.71Å; Q719-L721 VanDerWaalsContact O-N 3.15Å; L721-M723 PolarHBondContact O-N 2.95Å; L721-L724 HydrophobicContact CD2-CD1 3.73Å; L721-L724 WeakPolarHBondContact O-CB 3.42Å; L721-L724 WeakPolarHBondContact O-CG 3.45Å; L721-L724 PolarHBondContact O-N 3.19Å
722	H	88.3	Confident	90.6	Very high	112 Å²	112	56.3 Å²	56.3	52%	0.519	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-67.9	-17.2	179.9	73.5	-85.9	0	0	0	112.9	Q719 D720 P725	Q719-H722 PolarHBondContact O-CE1 3.35Å; Q719-H722 PolarHBondContact O-ND1 3.38Å; D720-H722 VanDerWaalsContact C-N 3.32Å; D720-H722 PolarHBondContact O-N 3.39Å; H722-P725 WeakPolarHBondContact O-CD 3.39Å
723	M	89.7	Confident	90.5	Very high	23 Å²	23	55.8 Å²	55.8	11%	0.113	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-84.6	-13.7	177.5	-61.4	-172.2	-80.7	0	0	113	D720 L721 P725 Q726 I879 E880	D720-M723 HydrophobicContact CB-CE 3.91Å; D720-M723 WeakPolarHBondContact O-CB 3.42Å; D720-M723 PolarHBondContact O-N 3.04Å; D720-M723 VanDerWaalsContact O-N 3.14Å; L721-M723 PolarHBondContact O-N 2.95Å; M723-P725 VanDerWaalsContact C-CD 3.49Å; M723-Q726 WeakPolarHBondContact O-CB 3.33Å; M723-Q726 PolarHBondContact O-N 3.18Å; M723-I879 HydrophobicContact CB-CB 4.35Å; M723-I879 HydrophobicContact CB-CG2 3.62Å; M723-I879 HydrophobicContact CE-CB 4.14Å; M723-E880 HydrophobicContact CE-CB 3.95Å; M723-E880 HydrophobicContact SD-CB 3.98Å
724	L	90.8	Very high	90.3	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-52.7	-44.5	-177.7	-74.2	175.3	0	0	0	113.8	F650 L681 F684 L721 Q726 L727 I879	F650-L724 HydrophobicContact CB-CB 4Å; F650-L724 HydrophobicContact CB-CD2 4.42Å; F650-L724 CarbonylContact O-C 3.59Å; L681-L724 HydrophobicContact CD1-CD2 3.65Å; L681-L724 HydrophobicContact CD2-CD2 4.06Å; F684-L724 HydrophobicContact CD1-CD2 4.5Å; F684-L724 HydrophobicContact CE1-CD2 4.42Å; L721-L724 HydrophobicContact CD2-CD1 3.73Å; L721-L724 WeakPolarHBondContact O-CB 3.42Å; L721-L724 WeakPolarHBondContact O-CG 3.45Å; L721-L724 PolarHBondContact O-N 3.19Å; L724-Q726 PolarHBondContact O-N 3.4Å; L724-Q726 VanDerWaalsContact O-N 3.16Å; L724-L727 WeakPolarHBondContact O-CB 3.44Å; L724-L727 PolarHBondContact O-N 3.07Å; L724-L727 VanDerWaalsContact O-N 3.08Å; L724-I879 HydrophobicContact CD2-CD1 3.55Å; L724-I879 HydrophobicContact CD2-CG1 3.96Å
725	P	89	Confident	90	Very high	58 Å²	58	55 Å²	55	38%	0.377	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-65.5	-18.8	179.1	-21.3	34.6	0	0	0	114.2	S649 F650 T652 H722 M723 L727	S649-P725 PolarHBondContact OG-O 3.44Å; F650-P725 WeakPolarHBondContact O-CA 3.49Å; F650-P725 WeakPolarHBondContact O-CG 3.46Å; T652-P725 WeakPolarHBondContact OG1-CD 3.36Å; H722-P725 WeakPolarHBondContact O-CD 3.39Å; M723-P725 VanDerWaalsContact C-CD 3.49Å; P725-L727 VanDerWaalsContact C-N 3.32Å
726	Q	88.4	Confident	89.7	Confident	98 Å²	98	55 Å²	55	46%	0.458	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-84	-10.9	178	-48.8	177.9	14.4	0	0	112.8	M723 L724 K883	M723-Q726 WeakPolarHBondContact O-CB 3.33Å; M723-Q726 PolarHBondContact O-N 3.18Å; L724-Q726 PolarHBondContact O-N 3.4Å; L724-Q726 VanDerWaalsContact O-N 3.16Å; Q726-K883 VanDerWaalsContact O-CE 3.27Å; Q726-K883 WeakPolarHBondContact O-CE 3.31Å; Q726-K883 VanDerWaalsContact OE1-NZ 3.07Å
727	L	90.6	Very high	89.3	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.01	26%	0.263	C	S	.	.			trans	-86.1	113.8	178.4	-165.2	148	0	0	0	108	F650 L681 L724 P725 V729 I879 L882 K883 W889	F650-L727 HydrophobicContact CD2-CB 4.38Å; F650-L727 HydrophobicContact CD2-CD2 3.86Å; F650-L727 HydrophobicContact CE2-CD2 3.41Å; F650-L727 VanDerWaalsContact CE2-CD2 3.41Å; F650-L727 HydrophobicContact CZ-CD2 4.44Å; L681-L727 HydrophobicContact CD2-CD1 4.16Å; L681-L727 HydrophobicContact CD2-CD2 4.31Å; L724-L727 WeakPolarHBondContact O-CB 3.44Å; L724-L727 PolarHBondContact O-N 3.07Å; L724-L727 VanDerWaalsContact O-N 3.08Å; P725-L727 VanDerWaalsContact C-N 3.32Å; L727-V729 HydrophobicContact CD2-CG2 3.7Å; L727-I879 HydrophobicContact CD1-CD1 4.47Å; L727-I879 HydrophobicContact CD1-CG2 4.19Å; L727-L882 HydrophobicContact CD1-CD2 4.17Å; L727-L882 HydrophobicContact CD1-CG 4.41Å; L727-K883 HydrophobicContact CD1-CB 4.43Å; L727-W889 HydrophobicContact CD1-CZ2 4.11Å; L727-W889 HydrophobicContact CD2-CH2 3.76Å; L727-W889 HydrophobicContact CD2-CZ2 3.8Å; L727-W889 HydrophobicContact CG-CZ2 4.25Å
728	L	90.2	Very high	88.8	Confident	74 Å²	74	56.4 Å²	56.4	39%	0.387	29%	0.288	S	S	.	.			trans	-111.6	125.8	-177.3	-61.7	171.4	0	0	0	108.7	A647 L648	A647-L728 HydrophobicContact CB-CB 4.07Å; A647-L728 HydrophobicContact CB-CD2 4.32Å; L648-L728 WeakPolarHBondContact O-CA 3.45Å
729	V	92.1	Very high	88.5	Confident	13 Å²	13	62 Å²	62	8%	0.079	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	123.5	176.9	-176.9	0	0	0	0	107.5	A647 L648 F650 F680 L727 R731 W889	A647-V729 CarbonylContact C-O 3.29Å; A647-V729 WeakPolarHBondContact CA-O 3.38Å; L648-V729 HydrophobicContact CB-CB 4.49Å; L648-V729 PolarHBondContact N-O 2.95Å; L648-V729 PolarHBondContact O-N 3.47Å; F650-V729 HydrophobicContact CE2-CG2 4.02Å; F650-V729 HydrophobicContact CZ-CG2 4.39Å; F680-V729 HydrophobicContact CD1-CG1 4.22Å; F680-V729 HydrophobicContact CD2-CG1 4.36Å; F680-V729 HydrophobicContact CD2-CG2 4.42Å; F680-V729 HydrophobicContact CE1-CG1 3.99Å; F680-V729 HydrophobicContact CE2-CG1 4.1Å; F680-V729 HydrophobicContact CG-CG1 4.42Å; F680-V729 HydrophobicContact CG-CG2 4.35Å; F680-V729 HydrophobicContact CZ-CG1 3.92Å; L727-V729 HydrophobicContact CD2-CG2 3.7Å; V729-R731 PolarHBondContact O-N 2.92Å; V729-W889 HydrophobicContact CG1-CZ3 4.19Å; V729-W889 HydrophobicContact CG2-CE3 4.35Å; V729-W889 HydrophobicContact CG2-CH2 3.68Å; V729-W889 HydrophobicContact CG2-CZ3 3.57Å
730	Q	90.5	Very high	88.4	Confident	120 Å²	120	57.7 Å²	57.7	56%	0.561	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.2	129	178.3	-71.4	-60.9	-27	0	0	110.1
731	R	89.8	Confident	88.5	Confident	81 Å²	81	58.3 Å²	58.3	31%	0.306	31%	0.308	S	S	.	.	S	Bend	trans	-72.2	-38.4	-179.1	-176.3	-165.3	60.6	75.4	10.2	111	D646 L648 V729	D646-R731 WeakPolarHBondContact O-CB 3.17Å; D646-R731 PolarHBondContact O-N 3.31Å; D646-R731 VanDerWaalsContact O-N 3.13Å; D646-R731 IonicContact OD1-CZ 3.62Å; D646-R731 IonicContact OD1-NE 2.98Å; D646-R731 PolarHBondContact OD1-NE 3.06Å; D646-R731 IonicContact OD1-NH2 3.79Å; D646-R731 PolarHBondContact OD1-NH2 3.5Å; D646-R731 IonicContact OD2-CZ 3.54Å; D646-R731 IonicContact OD2-NE 2.8Å; D646-R731 PolarHBondContact OD2-NE 3.13Å; D646-R731 IonicContact OD2-NH2 3.68Å; D646-R731 PolarHBondContact OD2-NH2 2.98Å; L648-R731 HydrophobicContact CD2-CG 4.4Å; L648-R731 HydrophobicContact CG-CB 4.27Å; L648-R731 HydrophobicContact CG-CG 4.45Å; V729-R731 PolarHBondContact O-N 2.92Å
732	T	89.2	Confident	88.5	Confident	47 Å²	47	67.5 Å²	67.5	29%	0.288	34%	0.343	S	S	.	.			trans	-80.2	120	-174.6	-62.7	0	0	0	0	111	D646 I734	D646-T732 PolarHBondContact OD2-OG1 3.41Å; T732-I734 WeakPolarHBondContact CG2-O 3.4Å
733	L	89.1	Confident	88.7	Confident	52 Å²	52	63.2 Å²	63.2	27%	0.272	33%	0.326	S	S	.	.	S	Bend	trans	-83.2	-22.8	177.4	-66	176.1	0	0	0	113.4	M763 V777 I813	L733-M763 HydrophobicContact CB-SD 4.24Å; L733-M763 HydrophobicContact CD1-CE 4.48Å; L733-V777 HydrophobicContact CD1-CG1 4.32Å; L733-V777 HydrophobicContact CD1-CG2 4.26Å; L733-V777 HydrophobicContact CD2-CG2 4.26Å; L733-I813 HydrophobicContact CD1-CD1 4.38Å
734	I	88.8	Confident	89	Confident	32 Å²	32	62.5 Å²	62.5	16%	0.164	32%	0.323	C	S	.	.			trans	-121.8	89.8	179.8	-55.9	179.5	0	0	0	107.2	T732 V736 V741 I744 M763 V765 M815	T732-I734 WeakPolarHBondContact CG2-O 3.4Å; I734-V736 HydrophobicContact CG2-CG2 3.91Å; I734-V736 PolarHBondContact O-N 3.29Å; I734-V741 HydrophobicContact CG2-CG2 3.83Å; I734-I744 HydrophobicContact CD1-CD1 4Å; I734-M763 HydrophobicContact CG1-SD 4.16Å; I734-V765 HydrophobicContact CG1-CG2 4.02Å; I734-V765 HydrophobicContact CG2-CG1 4.31Å; I734-M815 HydrophobicContact CD1-CE 3.44Å; I734-M815 VanDerWaalsContact CD1-CE 3.44Å; I734-M815 HydrophobicContact CD1-SD 3.77Å
735	P	84.9	Confident	89.2	Confident	70 Å²	70	63.5 Å²	63.5	46%	0.455	33%	0.327	S	S	.	.			trans	-80	22.7	-173.4	34.1	-37.2	0	0	0	113.1	F773	P735-F773 HydrophobicContact CG-CD1 3.82Å; P735-F773 HydrophobicContact CG-CD2 4.22Å; P735-F773 HydrophobicContact CG-CE1 4.01Å; P735-F773 HydrophobicContact CG-CE2 4.36Å; P735-F773 HydrophobicContact CG-CG 3.93Å; P735-F773 HydrophobicContact CG-CZ 4.28Å
736	V	85.7	Confident	89.7	Confident	45 Å²	45	60.8 Å²	60.8	27%	0.273	31%	0.309	S	S	.	.	S	Bend	trans	-139.7	163.1	-175.8	-64.9	0	0	0	0	110.4	I734 I738 V741 I767 F773	I734-V736 HydrophobicContact CG2-CG2 3.91Å; I734-V736 PolarHBondContact O-N 3.29Å; V736-I738 PolarHBondContact O-N 2.88Å; V736-V741 HydrophobicContact CG2-CG2 4.01Å; V736-I767 HydrophobicContact CB-CD1 4.1Å; V736-I767 HydrophobicContact CG1-CD1 3.66Å; V736-I767 HydrophobicContact CG2-CD1 3.55Å; V736-I767 HydrophobicContact CG2-CG1 4.17Å; V736-F773 HydrophobicContact CG1-CD2 4.42Å; V736-F773 HydrophobicContact CG1-CE2 3.65Å; V736-F773 HydrophobicContact CG1-CZ 4.19Å
737	D	83.3	Confident	90.1	Very high	98 Å²	98	56.1 Å²	56.1	52%	0.524	29%	0.288	S	S	.	.			trans	-56.1	132.5	171.3	-171.1	-32	0	0	0	110.3	N739 A740	D737-N739 PolarHBondContact O-N 2.85Å; D737-N739 WeakPolarHBondContact OD1-CB 3.45Å; D737-N739 PolarHBondContact OD1-N 3.34Å; D737-N739 PolarHBondContact OD1-ND2 3.47Å; D737-A740 WeakPolarHBondContact O-CB 3.39Å; D737-A740 PolarHBondContact O-N 2.87Å
738	I	81.6	Confident	90.5	Very high	101 Å²	101	56 Å²	56	52%	0.518	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-59.1	-28.7	-179.8	-159.9	157.6	0	0	0	112.2	V736 A740 V741 M815	V736-I738 PolarHBondContact O-N 2.88Å; I738-A740 PolarHBondContact O-N 3.34Å; I738-V741 WeakPolarHBondContact O-CB 3.41Å; I738-V741 PolarHBondContact O-N 3.27Å; I738-V741 VanDerWaalsContact O-N 3.15Å; I738-M815 HydrophobicContact CD1-CE 3.99Å
739	N	84.8	Confident	90.8	Very high	138 Å²	138	52.5 Å²	52.5	74%	0.738	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-71.1	-19.9	176.8	-61.9	-55.4	0	0	0	113	D737 V741	D737-N739 PolarHBondContact O-N 2.85Å; D737-N739 WeakPolarHBondContact OD1-CB 3.45Å; D737-N739 PolarHBondContact OD1-N 3.34Å; D737-N739 PolarHBondContact OD1-ND2 3.47Å; N739-V741 VanDerWaalsContact C-N 3.34Å
740	A	89.1	Confident	91.1	Very high	33 Å²	33	51.9 Å²	51.9	27%	0.273	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-84.6	-11.2	174.1	0	0	0	0	0	112.5	D737 I738 R742 I767 V768	D737-A740 WeakPolarHBondContact O-CB 3.39Å; D737-A740 PolarHBondContact O-N 2.87Å; I738-A740 PolarHBondContact O-N 3.34Å; A740-R742 PolarHBondContact O-N 2.89Å; A740-I767 HydrophobicContact CB-CG2 4.12Å; A740-I767 WeakPolarHBondContact O-CA 3.37Å; A740-I767 VanDerWaalsContact O-CG2 3.3Å; A740-I767 WeakPolarHBondContact O-CG2 3.28Å; A740-V768 PolarHBondContact O-N 2.94Å; A740-V768 VanDerWaalsContact O-N 3.09Å
741	V	90.7	Very high	91.4	Very high	27 Å²	27	46.3 Å²	46.3	16%	0.164	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	119.2	179.6	-178.4	0	0	0	0	109.5	I734 V736 I738 N739 I744 V765	I734-V741 HydrophobicContact CG2-CG2 3.83Å; V736-V741 HydrophobicContact CG2-CG2 4.01Å; I738-V741 WeakPolarHBondContact O-CB 3.41Å; I738-V741 PolarHBondContact O-N 3.27Å; I738-V741 VanDerWaalsContact O-N 3.15Å; N739-V741 VanDerWaalsContact C-N 3.34Å; V741-I744 HydrophobicContact CG1-CD1 4.38Å; V741-I744 HydrophobicContact CG1-CG1 3.84Å; V741-V765 HydrophobicContact CB-CG1 4.35Å; V741-V765 HydrophobicContact CG1-CG1 3.81Å; V741-V765 HydrophobicContact CG2-CG1 3.71Å
742	R	91.8	Very high	91.7	Very high	193 Å²	193	42.8 Å²	42.8	73%	0.728	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	-43.3	175.3	178.6	-178.1	175	177.2	-0	112	A740 V766 V768	A740-R742 PolarHBondContact O-N 2.89Å; R742-V766 HydrophobicContact CB-CG1 4.33Å; R742-V766 WeakPolarHBondContact CB-O 3.36Å; R742-V766 PolarHBondContact N-O 3.39Å; R742-V768 HydrophobicContact CB-CG2 4.49Å
743	S	93.4	Very high	91.8	Very high	22 Å²	22	41.4 Å²	41.4	15%	0.154	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	154.6	179.5	60.4	0	0	0	0	112.3	V766 D818	S743-V766 PolarHBondContact N-O 3.18Å; S743-V766 PolarHBondContact O-N 3.39Å; S743-V766 WeakPolarHBondContact OG-CB 3.34Å; S743-D818 WeakPolarHBondContact CA-OD2 3.31Å; S743-D818 VanDerWaalsContact CB-OD2 3.28Å; S743-D818 WeakPolarHBondContact CB-OD2 3Å
744	I	94.7	Very high	91.9	Very high	9 Å²	9	45.9 Å²	45.9	5%	0.046	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	126	177.5	-62.3	175.3	0	0	0	109.3	I734 V741 M763 M815 D818 R819	I734-I744 HydrophobicContact CD1-CD1 4Å; V741-I744 HydrophobicContact CG1-CD1 4.38Å; V741-I744 HydrophobicContact CG1-CG1 3.84Å; I744-M763 HydrophobicContact CG2-CE 3.97Å; I744-M763 HydrophobicContact CG2-CG 3.97Å; I744-M763 HydrophobicContact CG2-SD 4.09Å; I744-M815 HydrophobicContact CD1-CE 3.5Å; I744-M815 VanDerWaalsContact CD1-CE 3.5Å; I744-M815 HydrophobicContact CD1-SD 4.19Å; I744-D818 PolarHBondContact N-OD2 3.49Å; I744-D818 PolarHBondContact O-N 3.24Å; I744-R819 PolarHBondContact O-N 2.92Å
745	E	96.3	Very high	91.9	Very high	21 Å²	21	49.5 Å²	49.5	10%	0.098	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	141.2	179.4	-43.1	-179.9	-164.5	0	0	110.7	H747 M763 K764 R819 W902	E745-H747 IonicContact OE2-CE1 3.99Å; E745-H747 IonicContact OE2-NE2 2.72Å; E745-H747 PolarHBondContact OE2-NE2 3.01Å; E745-M763 CarbonylContact O-C 3.58Å; E745-M763 WeakPolarHBondContact O-CA 3.3Å; E745-K764 HydrophobicContact CB-CB 4.2Å; E745-K764 PolarHBondContact N-O 3.12Å; E745-K764 PolarHBondContact O-N 2.83Å; E745-R819 CarbonylContact C-O 3.59Å; E745-R819 WeakPolarHBondContact CA-O 3.32Å; E745-R819 HydrophobicContact CB-CB 4.05Å; E745-R819 HydrophobicContact CG-CB 3.87Å; E745-W902 WeakPolarHBondContact OE2-CH2 3.38Å
746	L	97.8	Very high	92.3	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	126.3	173	-66.2	-179.8	0	0	0	110.9	V761 Y762 M763 V806 V809 K810 V817 R819 V820 A821	L746-V761 HydrophobicContact CB-CG1 4.48Å; L746-V761 HydrophobicContact CD2-CG1 4.33Å; L746-Y762 WeakPolarHBondContact CA-O 3.36Å; L746-M763 HydrophobicContact CD2-CB 4.22Å; L746-M763 HydrophobicContact CD2-CE 4.48Å; L746-V806 HydrophobicContact CB-CG2 3.76Å; L746-V806 HydrophobicContact CD1-CG2 4.18Å; L746-V809 HydrophobicContact CD1-CB 4.19Å; L746-V809 HydrophobicContact CD1-CG1 3.81Å; L746-V809 HydrophobicContact CD2-CG1 3.97Å; L746-K810 HydrophobicContact CD1-CB 4.02Å; L746-V817 HydrophobicContact CB-CG1 4.26Å; L746-V817 HydrophobicContact CD1-CG1 3.95Å; L746-V817 HydrophobicContact CD1-CG2 3.89Å; L746-V817 HydrophobicContact CG-CG1 3.74Å; L746-V817 HydrophobicContact CG-CG2 4.14Å; L746-R819 PolarHBondContact N-O 3.42Å; L746-V820 HydrophobicContact CB-CG2 4.47Å; L746-V820 WeakPolarHBondContact O-CA 3.45Å; L746-A821 PolarHBondContact O-N 2.86Å
747	H	97.8	Very high	92.8	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	111.1	-178.1	-73.9	-103.3	0	0	0	110.7	E745 F749 V761 Y762 A821 W823 L895 W902	E745-H747 IonicContact OE2-CE1 3.99Å; E745-H747 IonicContact OE2-NE2 2.72Å; E745-H747 PolarHBondContact OE2-NE2 3.01Å; H747-F749 HydrophobicContact CB-CE2 4.05Å; H747-V761 CarbonylContact O-C 3.52Å; H747-V761 WeakPolarHBondContact O-CA 3.46Å; H747-Y762 PolarHBondContact N-O 2.87Å; H747-Y762 PolarHBondContact O-N 3.3Å; H747-A821 CarbonylContact C-O 3.53Å; H747-A821 VanDerWaalsContact CA-O 3.31Å; H747-A821 WeakPolarHBondContact CA-O 3.46Å; H747-W823 AromaticContact CE1-NE1 3.99Å; H747-W823 AromaticContact ND1-CE2 3.87Å; H747-W823 AromaticContact ND1-NE1 3.11Å; H747-W823 PolarHBondContact ND1-NE1 3.3Å; H747-W823 VanDerWaalsContact ND1-NE1 3.11Å; H747-L895 HydrophobicContact CB-CD1 4.48Å; H747-L895 HydrophobicContact CB-CD2 3.89Å; H747-L895 VanDerWaalsContact CE1-CD1 3.42Å; H747-L895 WeakPolarHBondContact CE1-CD1 3.49Å; H747-L895 VanDerWaalsContact ND1-CD1 3.3Å; H747-L895 WeakPolarHBondContact ND1-CD1 3.26Å; H747-W902 AromaticContact CE1-CH2 3.28Å; H747-W902 WeakPolarHBondContact CE1-CH2 3.47Å; H747-W902 AromaticContact CE1-CZ2 3.88Å; H747-W902 AromaticContact CE1-CZ3 3.74Å; H747-W902 AromaticContact NE2-CH2 3.75Å
748	A	98	Very high	93.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	128.5	178.2	0	0	0	0	0	111.1	V760 V761 A802 V806 A821 C822 W823	A748-V760 CarbonylContact C-O 3.55Å; A748-V760 VanDerWaalsContact CA-O 3.31Å; A748-V760 WeakPolarHBondContact CA-O 3.27Å; A748-V761 HydrophobicContact CB-CG2 3.97Å; A748-A802 HydrophobicContact CB-CB 4.03Å; A748-V806 HydrophobicContact CB-CB 4.01Å; A748-V806 HydrophobicContact CB-CG2 4.3Å; A748-A821 PolarHBondContact N-O 3.26Å; A748-C822 CarbonylContact O-C 3.6Å; A748-C822 WeakPolarHBondContact O-CA 3.38Å; A748-W823 PolarHBondContact O-N 3.18Å
749	F	98.3	Very high	94.1	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	132.5	175.7	-67.3	-98.1	0	0	0	109.7	H747 A759 V760 Y762 W823 P869 A870 P892 W894 L895	H747-F749 HydrophobicContact CB-CE2 4.05Å; F749-A759 CarbonylContact O-C 3.53Å; F749-A759 WeakPolarHBondContact O-CA 3.43Å; F749-A759 WeakPolarHBondContact O-CB 3.26Å; F749-V760 HydrophobicContact CB-CG1 4.03Å; F749-V760 PolarHBondContact N-O 3.03Å; F749-V760 PolarHBondContact O-N 3.13Å; F749-Y762 AromaticContact CD2-CD2 3.72Å; F749-Y762 HydrophobicContact CD2-CD2 3.72Å; F749-Y762 AromaticContact CD2-CE2 3.89Å; F749-Y762 HydrophobicContact CD2-CE2 3.89Å; F749-Y762 AromaticContact CE2-CD2 3.85Å; F749-Y762 HydrophobicContact CE2-CD2 3.85Å; F749-Y762 HydrophobicContact CE2-CE2 4.25Å; F749-W823 HydrophobicContact CD1-CB 3.43Å; F749-W823 VanDerWaalsContact CD1-CB 3.43Å; F749-W823 AromaticContact CD1-CG 3.95Å; F749-W823 HydrophobicContact CD1-CG 3.95Å; F749-W823 HydrophobicContact CE1-CB 3.61Å; F749-W823 AromaticContact CE1-CD1 3.98Å; F749-W823 HydrophobicContact CE1-CD2 4.18Å; F749-W823 AromaticContact CE1-CG 3.63Å; F749-W823 HydrophobicContact CE1-CG 3.63Å; F749-W823 HydrophobicContact CG-CB 4.07Å; F749-W823 HydrophobicContact CZ-CB 4.37Å; F749-W823 AromaticContact CZ-CD1 3.87Å; F749-W823 HydrophobicContact CZ-CD2 4.44Å; F749-W823 AromaticContact CZ-CG 3.97Å; F749-W823 HydrophobicContact CZ-CG 3.97Å; F749-P869 HydrophobicContact CB-CG 3.99Å; F749-P869 HydrophobicContact CD1-CG 4.01Å; F749-P869 HydrophobicContact CD2-CG 3.9Å; F749-P869 HydrophobicContact CE1-CG 4.47Å; F749-P869 HydrophobicContact CE2-CG 4.38Å; F749-P869 HydrophobicContact CG-CG 3.7Å; F749-A870 HydrophobicContact CB-CB 4.2Å; F749-P892 HydrophobicContact CE1-CG 4.06Å; F749-P892 HydrophobicContact CZ-CG 3.88Å; F749-W894 AromaticContact CE1-CH2 3.95Å; F749-W894 HydrophobicContact CE1-CH2 3.95Å; F749-W894 HydrophobicContact CE1-CZ2 4.09Å; F749-W894 AromaticContact CZ-CH2 3.81Å; F749-W894 HydrophobicContact CZ-CH2 3.81Å; F749-W894 HydrophobicContact CZ-CZ2 4.22Å; F749-L895 HydrophobicContact CE2-CD2 4.06Å; F749-L895 HydrophobicContact CZ-CD2 4.24Å
750	A	97.5	Very high	94.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	139.3	179.6	0	0	0	0	0	111	A798 A802 W823 N868	A750-A798 HydrophobicContact CB-CB 4.04Å; A750-A802 HydrophobicContact CB-CB 3.92Å; A750-W823 PolarHBondContact N-O 2.95Å; A750-N868 PolarHBondContact O-ND2 2.86Å
751	D	97	Very high	95.1	Very high	4 Å²	4	27.9 Å²	27.9	2%	0.021	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	152.1	175	-170.5	67.4	0	0	0	112.1	Y757 G758 A798 N868 A870 D871 S874	D751-Y757 WeakPolarHBondContact O-CA 3.48Å; D751-G758 PolarHBondContact N-O 2.95Å; D751-G758 PolarHBondContact O-N 3.45Å; D751-A798 WeakPolarHBondContact O-CB 3.39Å; D751-N868 WeakPolarHBondContact CB-ND2 3.45Å; D751-N868 PolarHBondContact OD1-ND2 2.91Å; D751-A870 VanDerWaalsContact CB-C 3.48Å; D751-A870 HydrophobicContact CB-CB 3.51Å; D751-D871 WeakPolarHBondContact OD2-CA 3.31Å; D751-S874 WeakPolarHBondContact OD2-CB 3.46Å; D751-S874 PolarHBondContact OD2-OG 2.93Å
752	A	95.1	Very high	95.5	Very high	6 Å²	6	26.6 Å²	26.6	5%	0.05	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	135.9	171.2	0	0	0	0	0	114.1	R794 E795 A798	A752-R794 HydrophobicContact CB-CB 3.61Å; A752-E795 HydrophobicContact CB-CG 4.47Å; A752-E795 PolarHBondContact N-OE1 2.68Å; A752-E795 PolarHBondContact N-OE2 3.26Å; A752-A798 HydrophobicContact CB-CB 4.28Å
753	S	92.9	Very high	95.7	Very high	19 Å²	19	17.6 Å²	17.6	13%	0.133	9%	0.085	C	C	.	.			trans	-107.5	-174.1	172	83.5	0	0	0	0	112	K755 A756 S874	S753-K755 PolarHBondContact O-N 2.91Å; S753-K755 PolarHBondContact OG-N 2.82Å; S753-K755 VanDerWaalsContact OG-N 3.12Å; S753-A756 PolarHBondContact N-O 2.83Å; S753-A756 PolarHBondContact OG-N 2.82Å; S753-A756 VanDerWaalsContact OG-N 3.09Å; S753-A756 PolarHBondContact OG-O 2.83Å; S753-S874 WeakPolarHBondContact CB-O 3.5Å; S753-S874 PolarHBondContact OG-O 2.52Å
754	E	89.8	Confident	95.8	Very high	145 Å²	145	16.8 Å²	16.8	68%	0.678	8%	0.079	S	C	*	.	S	Bend	trans	-64.2	-28.3	173.5	-158.3	-173.8	169.2	0	0	112.5	A784 R794	E754-A784 WeakPolarHBondContact O-CB 3.47Å; E754-R794 VanDerWaalsContact C-NH1 3.29Å; E754-R794 PolarHBondContact O-NH1 2.6Å
755	K	90	Very high	95.8	Very high	108 Å²	108	16.4 Å²	16.4	47%	0.47	8%	0.077	S	C	.	.	S	Bend	trans	-113.7	-28.1	-165.4	-62	-177.9	-177.2	171.7	0	113.7	I690 S753 A784	I690-K755 HydrophobicContact CD1-CB 3.95Å; I690-K755 HydrophobicContact CD1-CD 4.43Å; I690-K755 HydrophobicContact CG1-CB 4.12Å; I690-K755 HydrophobicContact CG2-CD 3.92Å; S753-K755 PolarHBondContact O-N 2.91Å; S753-K755 PolarHBondContact OG-N 2.82Å; S753-K755 VanDerWaalsContact OG-N 3.12Å; K755-A784 WeakPolarHBondContact O-CB 3.43Å; K755-A784 PolarHBondContact O-N 3Å
756	A	93.2	Very high	95.6	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	163.7	179.3	0	0	0	0	0	111.6	I686 S753 H782 S874	I686-A756 HydrophobicContact CD1-CB 3.66Å; I686-A756 HydrophobicContact CG1-CB 3.45Å; I686-A756 VanDerWaalsContact CG1-CB 3.45Å; S753-A756 PolarHBondContact N-O 2.83Å; S753-A756 PolarHBondContact OG-N 2.82Å; S753-A756 VanDerWaalsContact OG-N 3.09Å; S753-A756 PolarHBondContact OG-O 2.83Å; A756-H782 CarbonylContact C-O 3.57Å; A756-H782 WeakPolarHBondContact CA-O 3.49Å; A756-H782 VanDerWaalsContact CB-O 3.26Å; A756-H782 WeakPolarHBondContact CB-O 3.28Å; A756-S874 WeakPolarHBondContact CB-O 3.27Å
757	Y	95	Very high	95.2	Very high	32 Å²	32	16.9 Å²	16.9	13%	0.125	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	162.3	175.7	63.4	-88.8	0	0	0	109.2	D751 H782 L783 A784 I797 V801	D751-Y757 WeakPolarHBondContact O-CA 3.48Å; Y757-H782 HydrophobicContact CD1-CB 4.41Å; Y757-H782 HydrophobicContact CD2-CB 4.19Å; Y757-H782 HydrophobicContact CE1-CB 3.88Å; Y757-H782 HydrophobicContact CE2-CB 3.61Å; Y757-H782 AromaticContact CE2-CD2 3.91Å; Y757-H782 VanDerWaalsContact CZ-CB 3.45Å; Y757-H782 PolarHBondContact N-O 3.03Å; Y757-H782 PolarHBondContact O-N 3.38Å; Y757-L783 VanDerWaalsContact CE1-O 3.24Å; Y757-L783 WeakPolarHBondContact CE1-O 3.42Å; Y757-A784 HydrophobicContact CD1-CB 4.48Å; Y757-I797 HydrophobicContact CD2-CB 4.42Å; Y757-I797 HydrophobicContact CD2-CG2 3.87Å; Y757-I797 HydrophobicContact CE2-CB 4.27Å; Y757-I797 HydrophobicContact CE2-CG2 3.29Å; Y757-V801 HydrophobicContact CD2-CG2 4.3Å; Y757-V801 HydrophobicContact CE2-CG2 4.01Å
758	G	95.1	Very high	94.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.8	-161.6	176.1	0	0	0	0	0	113.3	D751 K780 L873	D751-G758 PolarHBondContact N-O 2.95Å; D751-G758 PolarHBondContact O-N 3.45Å; G758-K780 CarbonylContact C-O 3.49Å; G758-K780 WeakPolarHBondContact CA-O 3.41Å; G758-L873 VanDerWaalsContact CA-CD1 3.46Å
759	A	97.5	Very high	93.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	155.8	179.5	0	0	0	0	0	112.3	F749 A779 K780 V801 A802 L805 L873	F749-A759 CarbonylContact O-C 3.53Å; F749-A759 WeakPolarHBondContact O-CA 3.43Å; F749-A759 WeakPolarHBondContact O-CB 3.26Å; A759-A779 CarbonylContact O-C 3.19Å; A759-A779 VanDerWaalsContact O-CA 3.3Å; A759-A779 WeakPolarHBondContact O-CA 3.46Å; A759-K780 PolarHBondContact N-O 2.96Å; A759-K780 PolarHBondContact O-N 3.29Å; A759-V801 HydrophobicContact CB-CB 4.42Å; A759-V801 HydrophobicContact CB-CG1 4.04Å; A759-A802 VanDerWaalsContact CB-CA 3.48Å; A759-A802 HydrophobicContact CB-CB 3.61Å; A759-L805 HydrophobicContact CB-CD2 4.35Å; A759-L873 WeakPolarHBondContact O-CD2 3.24Å
760	V	98	Very high	92.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	140.4	172.1	56.2	0	0	0	0	109.1	A748 F749 Y762 M776 A779 P869 A870 L873 W888	A748-V760 CarbonylContact C-O 3.55Å; A748-V760 VanDerWaalsContact CA-O 3.31Å; A748-V760 WeakPolarHBondContact CA-O 3.27Å; F749-V760 HydrophobicContact CB-CG1 4.03Å; F749-V760 PolarHBondContact N-O 3.03Å; F749-V760 PolarHBondContact O-N 3.13Å; V760-Y762 HydrophobicContact CB-CE2 4.28Å; V760-Y762 HydrophobicContact CG1-CD2 4.49Å; V760-Y762 HydrophobicContact CG1-CE2 3.62Å; V760-Y762 HydrophobicContact CG2-CD2 4.31Å; V760-Y762 HydrophobicContact CG2-CE1 4.47Å; V760-Y762 HydrophobicContact CG2-CE2 3.68Å; V760-M776 HydrophobicContact CG2-CE 4.13Å; V760-M776 HydrophobicContact CG2-CG 3.84Å; V760-M776 HydrophobicContact CG2-SD 4.1Å; V760-A779 HydrophobicContact CB-CB 3.98Å; V760-A779 HydrophobicContact CG2-CB 4.09Å; V760-P869 HydrophobicContact CG1-CG 4.23Å; V760-A870 HydrophobicContact CG1-CB 4.19Å; V760-L873 HydrophobicContact CB-CD2 4.13Å; V760-L873 HydrophobicContact CG1-CD2 4.47Å; V760-W888 HydrophobicContact CB-CH2 4.2Å; V760-W888 HydrophobicContact CB-CZ3 4.23Å; V760-W888 HydrophobicContact CG1-CZ3 4.33Å; V760-W888 HydrophobicContact CG2-CH2 4.25Å; V760-W888 HydrophobicContact CG2-CZ3 4.38Å
761	V	98	Very high	92.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	128.7	177.1	-178.1	0	0	0	0	109	L746 H747 A748 V777 I778 L805 V806 V809	L746-V761 HydrophobicContact CB-CG1 4.48Å; L746-V761 HydrophobicContact CD2-CG1 4.33Å; H747-V761 CarbonylContact O-C 3.52Å; H747-V761 WeakPolarHBondContact O-CA 3.46Å; A748-V761 HydrophobicContact CB-CG2 3.97Å; V761-V777 PolarHBondContact O-N 3.13Å; V761-I778 HydrophobicContact CB-CG2 4Å; V761-I778 HydrophobicContact CG2-CG2 4.18Å; V761-I778 PolarHBondContact N-O 3.2Å; V761-I778 PolarHBondContact O-N 3.36Å; V761-L805 HydrophobicContact CG2-CB 4.11Å; V761-L805 HydrophobicContact CG2-CD2 3.84Å; V761-L805 HydrophobicContact CG2-CG 3.7Å; V761-V806 HydrophobicContact CG1-CG2 4.38Å; V761-V806 HydrophobicContact CG2-CB 4.42Å; V761-V809 HydrophobicContact CB-CG2 4.49Å; V761-V809 HydrophobicContact CG1-CG2 4.31Å
762	Y	97.8	Very high	91.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	147.1	171.4	-62.9	-88.2	0	0	0	110.1	L746 H747 F749 V760 V774 D775 M776 P869 W888 G891	L746-Y762 WeakPolarHBondContact CA-O 3.36Å; H747-Y762 PolarHBondContact N-O 2.87Å; H747-Y762 PolarHBondContact O-N 3.3Å; F749-Y762 AromaticContact CD2-CD2 3.72Å; F749-Y762 HydrophobicContact CD2-CD2 3.72Å; F749-Y762 AromaticContact CD2-CE2 3.89Å; F749-Y762 HydrophobicContact CD2-CE2 3.89Å; F749-Y762 AromaticContact CE2-CD2 3.85Å; F749-Y762 HydrophobicContact CE2-CD2 3.85Å; F749-Y762 HydrophobicContact CE2-CE2 4.25Å; V760-Y762 HydrophobicContact CB-CE2 4.28Å; V760-Y762 HydrophobicContact CG1-CD2 4.49Å; V760-Y762 HydrophobicContact CG1-CE2 3.62Å; V760-Y762 HydrophobicContact CG2-CD2 4.31Å; V760-Y762 HydrophobicContact CG2-CE1 4.47Å; V760-Y762 HydrophobicContact CG2-CE2 3.68Å; Y762-V774 HydrophobicContact CD1-CG1 4.19Å; Y762-V774 HydrophobicContact CG-CG1 4.3Å; Y762-D775 CarbonylContact C-O 3.3Å; Y762-D775 VanDerWaalsContact CA-O 3.29Å; Y762-D775 WeakPolarHBondContact CA-O 3.5Å; Y762-M776 HydrophobicContact CD1-CB 4.01Å; Y762-M776 HydrophobicContact CE1-CB 3.72Å; Y762-M776 HydrophobicContact CE1-CG 4.4Å; Y762-P869 HydrophobicContact CE2-CB 4.24Å; Y762-P869 HydrophobicContact CE2-CG 3.69Å; Y762-P869 WeakPolarHBondContact OH-CB 3.26Å; Y762-W888 VanDerWaalsContact CE1-O 3.22Å; Y762-W888 WeakPolarHBondContact CE1-O 3.5Å; Y762-W888 PolarHBondContact OH-O 3.23Å; Y762-G891 VanDerWaalsContact CE1-N 3.25Å
763	M	96.4	Very high	91.6	Very high	4 Å²	4	39 Å²	39	2%	0.02	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	129.1	164.8	176.3	-177.4	-74	0	0	108.4	L733 I734 I744 E745 L746 V765 V774 D775 V777 I813	L733-M763 HydrophobicContact CB-SD 4.24Å; L733-M763 HydrophobicContact CD1-CE 4.48Å; I734-M763 HydrophobicContact CG1-SD 4.16Å; I744-M763 HydrophobicContact CG2-CE 3.97Å; I744-M763 HydrophobicContact CG2-CG 3.97Å; I744-M763 HydrophobicContact CG2-SD 4.09Å; E745-M763 CarbonylContact O-C 3.58Å; E745-M763 WeakPolarHBondContact O-CA 3.3Å; L746-M763 HydrophobicContact CD2-CB 4.22Å; L746-M763 HydrophobicContact CD2-CE 4.48Å; M763-V765 HydrophobicContact CG-CG2 4.02Å; M763-V765 HydrophobicContact SD-CG2 3.84Å; M763-V774 VanDerWaalsContact O-CA 3.27Å; M763-V774 WeakPolarHBondContact O-CA 3.12Å; M763-D775 PolarHBondContact N-O 3.45Å; M763-D775 PolarHBondContact O-N 2.99Å; M763-V777 HydrophobicContact CB-CG2 3.62Å; M763-I813 HydrophobicContact CE-CD1 3.08Å; M763-I813 HydrophobicContact CE-CG1 4.21Å
764	K	95.5	Very high	91.7	Very high	5 Å²	5	38.2 Å²	38.2	2%	0.022	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	121.5	167	-179.5	-175.9	-177.4	-179	0	108.8	E745 V766 F773 V774 L895 M897 W902	E745-K764 HydrophobicContact CB-CB 4.2Å; E745-K764 PolarHBondContact N-O 3.12Å; E745-K764 PolarHBondContact O-N 2.83Å; K764-V766 HydrophobicContact CD-CG2 4.27Å; K764-V766 HydrophobicContact CG-CG2 4.26Å; K764-F773 CarbonylContact C-O 3.53Å; K764-F773 VanDerWaalsContact CA-O 3.27Å; K764-F773 WeakPolarHBondContact CA-O 3.48Å; K764-V774 HydrophobicContact CB-CG2 3.98Å; K764-V774 HydrophobicContact CG-CG2 3.84Å; K764-L895 HydrophobicContact CD-CD1 4.41Å; K764-L895 WeakPolarHBondContact CD-O 3.45Å; K764-L895 WeakPolarHBondContact CE-O 3.38Å; K764-L895 PolarHBondContact NZ-O 3.15Å; K764-L895 VanDerWaalsContact NZ-O 3.12Å; K764-M897 PolarHBondContact NZ-O 3.3Å; K764-W902 HydrophobicContact CD-CZ2 4.3Å
765	V	94.1	Very high	92	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.006	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	112.1	174.2	-176	0	0	0	0	107.8	I734 V741 M763 I767 N772 F773	I734-V765 HydrophobicContact CG1-CG2 4.02Å; I734-V765 HydrophobicContact CG2-CG1 4.31Å; V741-V765 HydrophobicContact CB-CG1 4.35Å; V741-V765 HydrophobicContact CG1-CG1 3.81Å; V741-V765 HydrophobicContact CG2-CG1 3.71Å; M763-V765 HydrophobicContact CG-CG2 4.02Å; M763-V765 HydrophobicContact SD-CG2 3.84Å; V765-I767 HydrophobicContact CG1-CG1 4.22Å; V765-N772 VanDerWaalsContact O-CA 3.28Å; V765-N772 WeakPolarHBondContact O-CA 3.06Å; V765-N772 WeakPolarHBondContact O-CB 3.49Å; V765-F773 HydrophobicContact CB-CB 4.36Å; V765-F773 PolarHBondContact N-O 2.9Å; V765-F773 PolarHBondContact O-N 2.69Å
766	V	92.4	Very high	92.3	Very high	18 Å²	18	28 Å²	28	11%	0.109	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	126.2	177.1	-177.6	0	0	0	0	108.4	R742 S743 K764 N772	R742-V766 HydrophobicContact CB-CG1 4.33Å; R742-V766 WeakPolarHBondContact CB-O 3.36Å; R742-V766 PolarHBondContact N-O 3.39Å; S743-V766 PolarHBondContact N-O 3.18Å; S743-V766 PolarHBondContact O-N 3.39Å; S743-V766 WeakPolarHBondContact OG-CB 3.34Å; K764-V766 HydrophobicContact CD-CG2 4.27Å; K764-V766 HydrophobicContact CG-CG2 4.26Å; V766-N772 WeakPolarHBondContact CA-OD1 3.21Å; V766-N772 WeakPolarHBondContact CG1-OD1 3.19Å
767	I	90.5	Very high	92.4	Very high	12 Å²	12	28.4 Å²	28.4	6%	0.062	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	151.8	-176	-60.4	178.4	0	0	0	109.5	V736 A740 V765 S769 A770 N772 F773	V736-I767 HydrophobicContact CB-CD1 4.1Å; V736-I767 HydrophobicContact CG1-CD1 3.66Å; V736-I767 HydrophobicContact CG2-CD1 3.55Å; V736-I767 HydrophobicContact CG2-CG1 4.17Å; A740-I767 HydrophobicContact CB-CG2 4.12Å; A740-I767 WeakPolarHBondContact O-CA 3.37Å; A740-I767 VanDerWaalsContact O-CG2 3.3Å; A740-I767 WeakPolarHBondContact O-CG2 3.28Å; V765-I767 HydrophobicContact CG1-CG1 4.22Å; I767-S769 WeakPolarHBondContact CG2-OG 3Å; I767-S769 PolarHBondContact O-N 2.74Å; I767-A770 WeakPolarHBondContact O-CA 3.49Å; I767-A770 PolarHBondContact O-N 3.18Å; I767-N772 PolarHBondContact N-OD1 3.5Å; I767-F773 HydrophobicContact CD1-CD2 3.39Å; I767-F773 HydrophobicContact CD1-CE2 3.22Å; I767-F773 HydrophobicContact CG1-CD2 4.41Å
768	V	85.6	Confident	92.4	Very high	113 Å²	113	27.1 Å²	27.1	69%	0.685	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	-36.2	177.1	-179.4	0	0	0	0	112.6	A740 R742 A770	A740-V768 PolarHBondContact O-N 2.94Å; A740-V768 VanDerWaalsContact O-N 3.09Å; R742-V768 HydrophobicContact CB-CG2 4.49Å; V768-A770 PolarHBondContact O-N 3.48Å
769	S	82.6	Confident	92.5	Very high	82 Å²	82	27.1 Å²	27.1	57%	0.573	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	0.8	176.7	62.6	0	0	0	0	115	I767 N771	I767-S769 WeakPolarHBondContact CG2-OG 3Å; I767-S769 PolarHBondContact O-N 2.74Å; S769-N771 PolarHBondContact O-N 3.47Å
770	A	75.9	Confident	92.4	Very high	68 Å²	68	28.4 Å²	28.4	56%	0.562	17%	0.167	S	C	*	.	S	Bend	trans	65.2	4.6	-176.9	0	0	0	0	0	116.8	I767 V768 N772	I767-A770 WeakPolarHBondContact O-CA 3.49Å; I767-A770 PolarHBondContact O-N 3.18Å; V768-A770 PolarHBondContact O-N 3.48Å; A770-N772 PolarHBondContact O-N 2.9Å; A770-N772 VanDerWaalsContact O-N 3.09Å
771	N	82.5	Confident	92.2	Very high	121 Å²	121	28.8 Å²	28.8	65%	0.647	17%	0.17	S	C	*	.			trans	-81.4	80.1	170	-78.8	-15.9	0	0	0	110.7	S769 F773	S769-N771 PolarHBondContact O-N 3.47Å; N771-F773 WeakPolarHBondContact O-CE2 3.35Å
772	N	90.7	Very high	91.9	Very high	20 Å²	20	30.4 Å²	30.4	11%	0.107	18%	0.178	C	C	.	.			trans	-73.8	144.1	-175.1	-50.9	-35.9	0	0	0	112.4	V765 V766 I767 A770 K896	V765-N772 VanDerWaalsContact O-CA 3.28Å; V765-N772 WeakPolarHBondContact O-CA 3.06Å; V765-N772 WeakPolarHBondContact O-CB 3.49Å; V766-N772 WeakPolarHBondContact CA-OD1 3.21Å; V766-N772 WeakPolarHBondContact CG1-OD1 3.19Å; I767-N772 PolarHBondContact N-OD1 3.5Å; A770-N772 PolarHBondContact O-N 2.9Å; A770-N772 VanDerWaalsContact O-N 3.09Å; N772-K896 WeakPolarHBondContact CB-O 3.45Å; N772-K896 PolarHBondContact ND2-O 3.26Å
773	F	91.3	Very high	91.6	Very high	72 Å²	72	31.4 Å²	31.4	32%	0.316	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	145.6	173	-63.4	-87.9	0	0	0	110.3	P735 V736 K764 V765 I767 N771	P735-F773 HydrophobicContact CG-CD1 3.82Å; P735-F773 HydrophobicContact CG-CD2 4.22Å; P735-F773 HydrophobicContact CG-CE1 4.01Å; P735-F773 HydrophobicContact CG-CE2 4.36Å; P735-F773 HydrophobicContact CG-CG 3.93Å; P735-F773 HydrophobicContact CG-CZ 4.28Å; V736-F773 HydrophobicContact CG1-CD2 4.42Å; V736-F773 HydrophobicContact CG1-CE2 3.65Å; V736-F773 HydrophobicContact CG1-CZ 4.19Å; K764-F773 CarbonylContact C-O 3.53Å; K764-F773 VanDerWaalsContact CA-O 3.27Å; K764-F773 WeakPolarHBondContact CA-O 3.48Å; V765-F773 HydrophobicContact CB-CB 4.36Å; V765-F773 PolarHBondContact N-O 2.9Å; V765-F773 PolarHBondContact O-N 2.69Å; I767-F773 HydrophobicContact CD1-CD2 3.39Å; I767-F773 HydrophobicContact CD1-CE2 3.22Å; I767-F773 HydrophobicContact CG1-CD2 4.41Å; N771-F773 WeakPolarHBondContact O-CE2 3.35Å
774	V	94.7	Very high	91.2	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.006	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	121.2	175.1	178.6	0	0	0	0	107.4	Y762 M763 K764 H890 L895 K896	Y762-V774 HydrophobicContact CD1-CG1 4.19Å; Y762-V774 HydrophobicContact CG-CG1 4.3Å; M763-V774 VanDerWaalsContact O-CA 3.27Å; M763-V774 WeakPolarHBondContact O-CA 3.12Å; K764-V774 HydrophobicContact CB-CG2 3.98Å; K764-V774 HydrophobicContact CG-CG2 3.84Å; V774-H890 WeakPolarHBondContact CB-O 3.36Å; V774-H890 WeakPolarHBondContact CG1-O 3.3Å; V774-H890 VanDerWaalsContact O-CA 3.25Å; V774-H890 WeakPolarHBondContact O-CA 3.43Å; V774-H890 WeakPolarHBondContact O-CB 3.48Å; V774-H890 PolarHBondContact O-ND1 3.18Å; V774-L895 HydrophobicContact CG1-CD2 3.78Å; V774-L895 HydrophobicContact CG1-CG 4.19Å; V774-L895 HydrophobicContact CG2-CB 4.47Å; V774-L895 HydrophobicContact CG2-CG 4.03Å; V774-K896 HydrophobicContact CB-CG 3.96Å; V774-K896 HydrophobicContact CG2-CB 4.41Å; V774-K896 HydrophobicContact CG2-CG 3.62Å
775	D	95	Very high	90.6	Very high	30 Å²	30	33.4 Å²	33.4	16%	0.16	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	145.1	-177.3	-70.2	-62.2	0	0	0	111.5	Y762 M763 V777 H890	Y762-D775 CarbonylContact C-O 3.3Å; Y762-D775 VanDerWaalsContact CA-O 3.29Å; Y762-D775 WeakPolarHBondContact CA-O 3.5Å; M763-D775 PolarHBondContact N-O 3.45Å; M763-D775 PolarHBondContact O-N 2.99Å; D775-V777 PolarHBondContact O-N 3.07Å; D775-H890 IonicContact OD1-CE1 3.84Å; D775-H890 PolarHBondContact OD1-CE1 3.27Å; D775-H890 IonicContact OD1-CG 3.63Å; D775-H890 IonicContact OD1-ND1 2.64Å; D775-H890 PolarHBondContact OD1-ND1 3.28Å
776	M	95.7	Very high	89.9	Confident	8 Å²	8	38 Å²	38	4%	0.039	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	127.5	177.5	178.9	-176.7	165.3	0	0	110.2	F680 V760 Y762 A779 W888 W889	F680-M776 HydrophobicContact CD1-CE 3.79Å; F680-M776 HydrophobicContact CD1-CG 4.5Å; F680-M776 HydrophobicContact CD1-SD 4.04Å; F680-M776 HydrophobicContact CE1-CE 4.45Å; V760-M776 HydrophobicContact CG2-CE 4.13Å; V760-M776 HydrophobicContact CG2-CG 3.84Å; V760-M776 HydrophobicContact CG2-SD 4.1Å; Y762-M776 HydrophobicContact CD1-CB 4.01Å; Y762-M776 HydrophobicContact CE1-CB 3.72Å; Y762-M776 HydrophobicContact CE1-CG 4.4Å; M776-A779 HydrophobicContact CE-CB 3.37Å; M776-W888 HydrophobicContact CE-CH2 4.33Å; M776-W888 HydrophobicContact CE-CZ2 3.61Å; M776-W888 HydrophobicContact SD-CD2 4.33Å; M776-W888 VanDerWaalsContact SD-CE2 3.53Å; M776-W888 HydrophobicContact SD-CH2 4.47Å; M776-W888 HydrophobicContact SD-CZ2 3.63Å; M776-W888 PolarHBondContact SD-NE1 3.22Å; M776-W889 WeakPolarHBondContact CB-O 3.38Å; M776-W889 PolarHBondContact N-O 2.85Å; M776-W889 HydrophobicContact SD-CE3 4.38Å; M776-W889 HydrophobicContact SD-CZ3 4.32Å
777	V	95.4	Very high	89.3	Confident	9 Å²	9	45.4 Å²	45.4	6%	0.055	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-56.1	176.4	-178.1	0	0	0	0	110.5	M678 L733 V761 M763 D775 V809	M678-V777 HydrophobicContact CE-CG1 4.41Å; M678-V777 WeakPolarHBondContact CE-O 3.11Å; L733-V777 HydrophobicContact CD1-CG1 4.32Å; L733-V777 HydrophobicContact CD1-CG2 4.26Å; L733-V777 HydrophobicContact CD2-CG2 4.26Å; V761-V777 PolarHBondContact O-N 3.13Å; M763-V777 HydrophobicContact CB-CG2 3.62Å; D775-V777 PolarHBondContact O-N 3.07Å; V777-V809 HydrophobicContact CG1-CG1 4.01Å; V777-V809 HydrophobicContact CG1-CG2 4.31Å
778	I	96.3	Very high	88.6	Confident	5 Å²	5	53.9 Å²	53.9	3%	0.026	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	146.4	-173.3	-167.6	168.9	0	0	0	110.5	M678 V761 L805 Y808 V809	M678-I778 HydrophobicContact CE-CB 4.05Å; M678-I778 HydrophobicContact CE-CD1 4.33Å; M678-I778 HydrophobicContact CE-CG1 4.31Å; M678-I778 CarbonylContact O-C 3.57Å; M678-I778 VanDerWaalsContact O-CA 3.29Å; M678-I778 WeakPolarHBondContact O-CA 3.23Å; M678-I778 VanDerWaalsContact O-CG1 3.26Å; M678-I778 WeakPolarHBondContact O-CG1 3.49Å; M678-I778 HydrophobicContact SD-CD1 4.46Å; V761-I778 HydrophobicContact CB-CG2 4Å; V761-I778 HydrophobicContact CG2-CG2 4.18Å; V761-I778 PolarHBondContact N-O 3.2Å; V761-I778 PolarHBondContact O-N 3.36Å; I778-L805 HydrophobicContact CD1-CD1 3.88Å; I778-L805 HydrophobicContact CG1-CD1 4.07Å; I778-L805 HydrophobicContact CG2-CD1 3.75Å; I778-L805 HydrophobicContact CG2-CD2 4.05Å; I778-L805 HydrophobicContact CG2-CG 3.74Å; I778-Y808 HydrophobicContact CD1-CD1 4.29Å; I778-Y808 HydrophobicContact CD1-CE1 4.02Å; I778-V809 HydrophobicContact CB-CG2 4.47Å; I778-V809 HydrophobicContact CG2-CG2 3.3Å
779	A	97	Very high	88.6	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	156.1	167.3	0	0	0	0	0	111.8	M678 G679 A682 A759 V760 M776 L873 W888	M678-A779 PolarHBondContact O-N 3Å; G679-A779 WeakPolarHBondContact CA-O 2.84Å; A682-A779 HydrophobicContact CB-CB 4.24Å; A759-A779 CarbonylContact O-C 3.19Å; A759-A779 VanDerWaalsContact O-CA 3.3Å; A759-A779 WeakPolarHBondContact O-CA 3.46Å; V760-A779 HydrophobicContact CB-CB 3.98Å; V760-A779 HydrophobicContact CG2-CB 4.09Å; M776-A779 HydrophobicContact CE-CB 3.37Å; A779-L873 HydrophobicContact CB-CD2 4.29Å; A779-W888 HydrophobicContact CB-CH2 3.82Å; A779-W888 HydrophobicContact CB-CZ2 4.06Å
780	K	94.9	Very high	89	Confident	28 Å²	28	49.7 Å²	49.7	12%	0.122	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	129.1	171.7	-68.4	-65.2	-179.3	-170	0	109.6	P677 G758 A759 V801 L805	P677-K780 PolarHBondContact O-NZ 3.45Å; P677-K780 VanDerWaalsContact O-NZ 3.16Å; G758-K780 CarbonylContact C-O 3.49Å; G758-K780 WeakPolarHBondContact CA-O 3.41Å; A759-K780 PolarHBondContact N-O 2.96Å; A759-K780 PolarHBondContact O-N 3.29Å; K780-V801 HydrophobicContact CB-CG1 4.18Å; K780-L805 HydrophobicContact CB-CD2 4.31Å; K780-L805 HydrophobicContact CG-CD1 3.77Å; K780-L805 HydrophobicContact CG-CD2 4.18Å
781	S	93.5	Very high	89.7	Confident	8 Å²	8	51 Å²	51	6%	0.056	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	142.5	174.8	65	0	0	0	0	111.1	A682	A682-S781 PolarHBondContact O-OG 3.38Å
782	H	91.9	Very high	90.1	Very high	34 Å²	34	46.4 Å²	46.4	16%	0.157	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	148	179.9	-63.6	-72.3	0	0	0	110.4	A756 Y757	A756-H782 CarbonylContact C-O 3.57Å; A756-H782 WeakPolarHBondContact CA-O 3.49Å; A756-H782 VanDerWaalsContact CB-O 3.26Å; A756-H782 WeakPolarHBondContact CB-O 3.28Å; Y757-H782 HydrophobicContact CD1-CB 4.41Å; Y757-H782 HydrophobicContact CD2-CB 4.19Å; Y757-H782 HydrophobicContact CE1-CB 3.88Å; Y757-H782 HydrophobicContact CE2-CB 3.61Å; Y757-H782 AromaticContact CE2-CD2 3.91Å; Y757-H782 VanDerWaalsContact CZ-CB 3.45Å; Y757-H782 PolarHBondContact N-O 3.03Å; Y757-H782 PolarHBondContact O-N 3.38Å
783	L	91.1	Very high	90.3	Very high	21 Å²	21	48.2 Å²	48.2	11%	0.11	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	137.4	171.3	-70.5	170.9	0	0	0	111	W506 I686 K689 I690 Q693 Y757	W506-L783 HydrophobicContact CH2-CD1 3.49Å; W506-L783 VanDerWaalsContact CH2-CD1 3.49Å; W506-L783 HydrophobicContact CH2-CG 4.19Å; W506-L783 HydrophobicContact CZ2-CD1 4.19Å; W506-L783 HydrophobicContact CZ3-CD1 4.17Å; W506-L783 HydrophobicContact CZ3-CG 4.48Å; I686-L783 HydrophobicContact CD1-CD2 4.08Å; I686-L783 HydrophobicContact CD1-CG 4.43Å; K689-L783 HydrophobicContact CB-CD1 4Å; K689-L783 HydrophobicContact CB-CD2 3.86Å; K689-L783 HydrophobicContact CB-CG 3.95Å; K689-L783 WeakPolarHBondContact O-CD1 3.45Å; I690-L783 HydrophobicContact CB-CD2 4.46Å; I690-L783 HydrophobicContact CG1-CD2 3.76Å; Q693-L783 HydrophobicContact CB-CD1 4.02Å; Q693-L783 HydrophobicContact CB-CD2 4.46Å; Y757-L783 VanDerWaalsContact CE1-O 3.24Å; Y757-L783 WeakPolarHBondContact CE1-O 3.42Å
784	A	88.3	Confident	90.3	Very high	3 Å²	3	45.9 Å²	45.9	3%	0.025	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-60.6	140.2	172.9	0	0	0	0	0	109.9	Q693 E754 K755 Y757 L786	Q693-A784 PolarHBondContact NE2-O 3.25Å; E754-A784 WeakPolarHBondContact O-CB 3.47Å; K755-A784 WeakPolarHBondContact O-CB 3.43Å; K755-A784 PolarHBondContact O-N 3Å; Y757-A784 HydrophobicContact CD1-CB 4.48Å; A784-L786 PolarHBondContact O-N 3.41Å
785	P	83.9	Confident	90.4	Very high	48 Å²	48	46.3 Å²	46.3	31%	0.312	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-60.1	138.7	-179.7	-23.1	33.8	0	0	0	112	K787 I789	P785-K787 PolarHBondContact O-N 3.22Å; P785-I789 HydrophobicContact CG-CD1 4.06Å
786	L	79.1	Confident	90.4	Very high	96 Å²	96	44.9 Å²	44.9	50%	0.503	22%	0.22	S	C	.	.	S	Bend	trans	-59	-32.1	174.2	-70.6	176.4	0	0	0	112.3	Q693 Q697 A784 K788	Q693-L786 HydrophobicContact CG-CD2 3.66Å; Q693-L786 HydrophobicContact CG-CG 4.43Å; Q697-L786 HydrophobicContact CG-CD2 3.66Å; A784-L786 PolarHBondContact O-N 3.41Å; L786-K788 PolarHBondContact O-N 3.37Å; L786-K788 VanDerWaalsContact O-N 3.16Å
787	K	79.1	Confident	90.4	Very high	175 Å²	175	45.6 Å²	45.6	76%	0.761	22%	0.224	S	C	*	.	S	Bend	trans	-68	112.1	170.8	-173.7	175.2	-177.1	175	0	108.4	P785 I789	P785-K787 PolarHBondContact O-N 3.22Å; K787-I789 PolarHBondContact O-N 3.05Å
788	K	76	Confident	90.5	Very high	190 Å²	190	45.1 Å²	45.1	83%	0.826	22%	0.221	S	C	*	.			trans	-52.2	113.1	177.9	-69.4	-168.9	178.2	-171.7	0	110.3	L786	L786-K788 PolarHBondContact O-N 3.37Å; L786-K788 VanDerWaalsContact O-N 3.16Å
789	I	86.6	Confident	90.5	Very high	30 Å²	30	44.9 Å²	44.9	15%	0.154	22%	0.22	C	C	.	.			trans	-116	151.5	168.4	54.5	169	0	0	0	107.4	P785 K787 R793 R794 I797	P785-I789 HydrophobicContact CG-CD1 4.06Å; K787-I789 PolarHBondContact O-N 3.05Å; I789-R793 HydrophobicContact CB-CB 4.41Å; I789-R794 HydrophobicContact CD1-CG 3.54Å; I789-R794 HydrophobicContact CG1-CG 3.63Å; I789-R794 PolarHBondContact O-NE 3.3Å; I789-I797 HydrophobicContact CD1-CD1 3.56Å
790	T	89.7	Confident	90.5	Very high	76 Å²	76	45.4 Å²	45.4	47%	0.466	22%	0.223	S	C	.	.			trans	-65.2	151.9	-178.9	56.8	0	0	0	0	110.7	R793 R794	T790-R793 WeakPolarHBondContact O-CB 3.41Å; T790-R793 PolarHBondContact O-N 2.62Å; T790-R793 WeakPolarHBondContact OG1-CG 3.27Å; T790-R794 PolarHBondContact O-N 2.93Å; T790-R794 VanDerWaalsContact O-N 3.16Å
791	L	90.8	Very high	90.5	Very high	97 Å²	97	44.4 Å²	44.4	51%	0.508	22%	0.219	S	C	.	.	H	α-helix	trans	-53.1	-48.1	178.7	177.8	66.1	0	0	0	112.3	R793 R794 E795	L791-R793 PolarHBondContact O-N 2.74Å; L791-R793 VanDerWaalsContact O-N 3.14Å; L791-R794 WeakPolarHBondContact O-CA 3.42Å; L791-R794 VanDerWaalsContact O-CB 3.3Å; L791-R794 WeakPolarHBondContact O-CB 3.42Å; L791-R794 PolarHBondContact O-N 2.75Å; L791-E795 WeakPolarHBondContact O-CG 3.34Å; L791-E795 PolarHBondContact O-N 3.1Å
792	P	92	Very high	90.7	Very high	24 Å²	24	44 Å²	44	16%	0.156	22%	0.216	C	C	.	.	H	α-helix	trans	-58.2	-32.6	176.5	-27.3	35.9	0	0	0	114.5	R794 E795 L796 V828 W832 T918	P792-R794 VanDerWaalsContact C-N 3.31Å; P792-E795 PolarHBondContact O-N 2.78Å; P792-L796 PolarHBondContact O-N 3.39Å; P792-V828 HydrophobicContact CB-CB 4.19Å; P792-V828 HydrophobicContact CB-CG1 3.71Å; P792-V828 HydrophobicContact CG-CB 4.47Å; P792-V828 HydrophobicContact CG-CG1 4.19Å; P792-W832 HydrophobicContact CB-CH2 3.58Å; P792-W832 HydrophobicContact CB-CZ2 4.41Å; P792-W832 HydrophobicContact CB-CZ3 3.9Å; P792-W832 WeakPolarHBondContact O-CZ3 3.19Å; P792-T918 HydrophobicContact CG-CG2 3.95Å
793	R	93.4	Very high	91	Very high	57 Å²	57	42.4 Å²	42.4	22%	0.215	21%	0.209	C	C	.	.	H	α-helix	trans	-70.7	-28.3	174.1	-76.5	-178.2	176.9	-170.3	-1.8	112.2	I789 T790 L791 I797 W832 F843 E922	I789-R793 HydrophobicContact CB-CB 4.41Å; T790-R793 WeakPolarHBondContact O-CB 3.41Å; T790-R793 PolarHBondContact O-N 2.62Å; T790-R793 WeakPolarHBondContact OG1-CG 3.27Å; L791-R793 PolarHBondContact O-N 2.74Å; L791-R793 VanDerWaalsContact O-N 3.14Å; R793-I797 VanDerWaalsContact O-CG1 3.29Å; R793-I797 WeakPolarHBondContact O-CG1 3.37Å; R793-I797 PolarHBondContact O-N 2.84Å; R793-W832 HydrophobicContact CG-CH2 4.26Å; R793-W832 HydrophobicContact CG-CZ3 4.38Å; R793-F843 HydrophobicContact CB-CD1 4.37Å; R793-F843 HydrophobicContact CB-CE1 3.61Å; R793-F843 HydrophobicContact CB-CZ 4.18Å; R793-F843 HydrophobicContact CG-CD1 3.84Å; R793-F843 HydrophobicContact CG-CE1 3.58Å; R793-F843 HydrophobicContact CG-CZ 4.5Å; R793-E922 IonicContact CZ-OE1 2.81Å; R793-E922 IonicContact CZ-OE2 2.73Å; R793-E922 IonicContact NE-OE1 2.62Å; R793-E922 PolarHBondContact NE-OE1 3.08Å; R793-E922 VanDerWaalsContact NH2-CD 3.27Å; R793-E922 IonicContact NH2-OE1 3.76Å; R793-E922 PolarHBondContact NH2-OE1 3.15Å; R793-E922 IonicContact NH2-OE2 4Å; R793-E922 PolarHBondContact NH2-OE2 3.13Å
794	R	92.8	Very high	91.3	Very high	23 Å²	23	45.1 Å²	45.1	9%	0.087	22%	0.218	C	C	.	.	H	α-helix	trans	-72.6	-43.8	172.9	-63.1	176.8	174.1	179.6	-8.4	110.5	A752 E754 I789 T790 L791 P792 L796 I797 A798	A752-R794 HydrophobicContact CB-CB 3.61Å; E754-R794 VanDerWaalsContact C-NH1 3.29Å; E754-R794 PolarHBondContact O-NH1 2.6Å; I789-R794 HydrophobicContact CD1-CG 3.54Å; I789-R794 HydrophobicContact CG1-CG 3.63Å; I789-R794 PolarHBondContact O-NE 3.3Å; T790-R794 PolarHBondContact O-N 2.93Å; T790-R794 VanDerWaalsContact O-N 3.16Å; L791-R794 WeakPolarHBondContact O-CA 3.42Å; L791-R794 VanDerWaalsContact O-CB 3.3Å; L791-R794 WeakPolarHBondContact O-CB 3.42Å; L791-R794 PolarHBondContact O-N 2.75Å; P792-R794 VanDerWaalsContact C-N 3.31Å; R794-L796 VanDerWaalsContact C-N 3.28Å; R794-L796 PolarHBondContact O-N 3.36Å; R794-I797 WeakPolarHBondContact O-CA 3.35Å; R794-I797 WeakPolarHBondContact O-CB 3.36Å; R794-I797 PolarHBondContact O-N 2.86Å; R794-A798 PolarHBondContact O-N 3.35Å
795	E	95.5	Very high	91.6	Very high	10 Å²	10	45 Å²	45	5%	0.047	22%	0.217	C	C	.	.	H	α-helix	trans	-56.6	-42.9	173.1	-60.3	-57	157.5	0	0	112	A752 L791 P792 I797 A798 A799 A829	A752-E795 HydrophobicContact CB-CG 4.47Å; A752-E795 PolarHBondContact N-OE1 2.68Å; A752-E795 PolarHBondContact N-OE2 3.26Å; L791-E795 WeakPolarHBondContact O-CG 3.34Å; L791-E795 PolarHBondContact O-N 3.1Å; P792-E795 PolarHBondContact O-N 2.78Å; E795-I797 VanDerWaalsContact C-N 3.28Å; E795-I797 PolarHBondContact O-N 3.43Å; E795-A798 WeakPolarHBondContact O-CB 3.44Å; E795-A798 PolarHBondContact O-N 3.31Å; E795-A798 VanDerWaalsContact O-N 3.15Å; E795-A799 WeakPolarHBondContact O-CB 3.49Å; E795-A799 PolarHBondContact O-N 2.89Å; E795-A829 HydrophobicContact CB-CB 3.93Å
796	L	96.4	Very high	92.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.9	-33.8	174.9	-174.5	67.4	0	0	0	112.9	P792 R794 L800 A829 W832 I833 V844 R847 V848 I851	P792-L796 PolarHBondContact O-N 3.39Å; R794-L796 VanDerWaalsContact C-N 3.28Å; R794-L796 PolarHBondContact O-N 3.36Å; L796-L800 PolarHBondContact O-N 3.25Å; L796-A829 HydrophobicContact CB-CB 4.48Å; L796-W832 HydrophobicContact CB-CE3 4.21Å; L796-W832 HydrophobicContact CB-CZ3 4.26Å; L796-W832 HydrophobicContact CD1-CE3 4.43Å; L796-W832 HydrophobicContact CD2-CE3 3.9Å; L796-W832 HydrophobicContact CD2-CZ3 4.24Å; L796-W832 HydrophobicContact CG-CE3 4.41Å; L796-I833 HydrophobicContact CD1-CD1 4.2Å; L796-I833 HydrophobicContact CD1-CG1 3.88Å; L796-V844 HydrophobicContact CD2-CB 4.15Å; L796-V844 HydrophobicContact CD2-CG1 3.89Å; L796-V844 HydrophobicContact CD2-CG2 4.15Å; L796-R847 HydrophobicContact CD2-CB 3.76Å; L796-R847 HydrophobicContact CD2-CG 4.47Å; L796-R847 HydrophobicContact CG-CB 3.96Å; L796-V848 HydrophobicContact CD1-CG2 4Å; L796-V848 HydrophobicContact CD2-CG2 4.37Å; L796-I851 HydrophobicContact CD1-CD1 3.76Å
797	I	95.1	Very high	92.9	Very high	23 Å²	23	40.5 Å²	40.5	12%	0.118	19%	0.193	C	C	.	.	H	α-helix	trans	-71.8	-39.7	174.4	-60.7	162.3	0	0	0	110	Y757 I789 R793 R794 E795 A799 L800 V801 F843	Y757-I797 HydrophobicContact CD2-CB 4.42Å; Y757-I797 HydrophobicContact CD2-CG2 3.87Å; Y757-I797 HydrophobicContact CE2-CB 4.27Å; Y757-I797 HydrophobicContact CE2-CG2 3.29Å; I789-I797 HydrophobicContact CD1-CD1 3.56Å; R793-I797 VanDerWaalsContact O-CG1 3.29Å; R793-I797 WeakPolarHBondContact O-CG1 3.37Å; R793-I797 PolarHBondContact O-N 2.84Å; R794-I797 WeakPolarHBondContact O-CA 3.35Å; R794-I797 WeakPolarHBondContact O-CB 3.36Å; R794-I797 PolarHBondContact O-N 2.86Å; E795-I797 VanDerWaalsContact C-N 3.28Å; E795-I797 PolarHBondContact O-N 3.43Å; I797-A799 VanDerWaalsContact C-N 3.34Å; I797-A799 PolarHBondContact O-N 3.36Å; I797-L800 WeakPolarHBondContact O-CB 3.44Å; I797-L800 PolarHBondContact O-N 3.25Å; I797-L800 VanDerWaalsContact O-N 3.16Å; I797-V801 WeakPolarHBondContact O-CG2 3.27Å; I797-V801 PolarHBondContact O-N 3.21Å; I797-F843 HydrophobicContact CD1-CZ 3.98Å; I797-F843 HydrophobicContact CG1-CZ 4.14Å
798	A	96.4	Very high	93.7	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.2	-45.4	174	0	0	0	0	0	111.5	A750 D751 A752 R794 E795 L800 V801 A802	A750-A798 HydrophobicContact CB-CB 4.04Å; D751-A798 WeakPolarHBondContact O-CB 3.39Å; A752-A798 HydrophobicContact CB-CB 4.28Å; R794-A798 PolarHBondContact O-N 3.35Å; E795-A798 WeakPolarHBondContact O-CB 3.44Å; E795-A798 PolarHBondContact O-N 3.31Å; E795-A798 VanDerWaalsContact O-N 3.15Å; A798-L800 VanDerWaalsContact C-N 3.3Å; A798-L800 PolarHBondContact O-N 3.39Å; A798-V801 WeakPolarHBondContact O-CA 3.49Å; A798-V801 WeakPolarHBondContact O-CB 3.34Å; A798-V801 PolarHBondContact O-N 2.91Å; A798-A802 PolarHBondContact O-N 2.79Å
799	A	97.5	Very high	94.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-58.3	-41.5	173.5	0	0	0	0	0	111.8	E795 I797 V801 A802 A803 I833 I851 W860	E795-A799 WeakPolarHBondContact O-CB 3.49Å; E795-A799 PolarHBondContact O-N 2.89Å; I797-A799 VanDerWaalsContact C-N 3.34Å; I797-A799 PolarHBondContact O-N 3.36Å; A799-V801 VanDerWaalsContact C-N 3.32Å; A799-V801 PolarHBondContact O-N 3.1Å; A799-A802 PolarHBondContact O-N 2.78Å; A799-A803 PolarHBondContact O-N 2.87Å; A799-I833 HydrophobicContact CB-CD1 3.76Å; A799-I851 HydrophobicContact CB-CD1 4.08Å; A799-W860 HydrophobicContact CB-CH2 3.66Å; A799-W860 HydrophobicContact CB-CZ3 3.63Å; A799-W860 VanDerWaalsContact O-CH2 3.23Å; A799-W860 WeakPolarHBondContact O-CH2 3.32Å
800	L	96.7	Very high	94.9	Very high	10 Å²	10	30.5 Å²	30.5	5%	0.052	15%	0.148	C	C	.	.	H	α-helix	trans	-61.1	-40.6	173.5	177.4	59.2	0	0	0	112.1	L796 I797 A798 A803 R804 R847 E850 I851	L796-L800 PolarHBondContact O-N 3.25Å; I797-L800 WeakPolarHBondContact O-CB 3.44Å; I797-L800 PolarHBondContact O-N 3.25Å; I797-L800 VanDerWaalsContact O-N 3.16Å; A798-L800 VanDerWaalsContact C-N 3.3Å; A798-L800 PolarHBondContact O-N 3.39Å; L800-A803 PolarHBondContact O-N 3.43Å; L800-R804 HydrophobicContact CD1-CG 4.29Å; L800-R804 VanDerWaalsContact O-CD 3.26Å; L800-R804 WeakPolarHBondContact O-CD 3.47Å; L800-R804 WeakPolarHBondContact O-CG 3.47Å; L800-R804 PolarHBondContact O-N 2.73Å; L800-R804 VanDerWaalsContact O-N 3.08Å; L800-R847 HydrophobicContact CD2-CG 4Å; L800-E850 HydrophobicContact CD1-CB 4.08Å; L800-E850 HydrophobicContact CD1-CG 3.82Å; L800-I851 HydrophobicContact CB-CD1 4.07Å; L800-I851 HydrophobicContact CB-CG1 4Å; L800-I851 HydrophobicContact CD1-CG1 3.89Å
801	V	95.6	Very high	94.9	Very high	8 Å²	8	33.8 Å²	33.8	5%	0.048	15%	0.152	C	C	.	.	H	α-helix	trans	-62	-44.3	174.5	177.6	0	0	0	0	110.8	Y757 A759 K780 I797 A798 A799 A803 R804 L805	Y757-V801 HydrophobicContact CD2-CG2 4.3Å; Y757-V801 HydrophobicContact CE2-CG2 4.01Å; A759-V801 HydrophobicContact CB-CB 4.42Å; A759-V801 HydrophobicContact CB-CG1 4.04Å; K780-V801 HydrophobicContact CB-CG1 4.18Å; I797-V801 WeakPolarHBondContact O-CG2 3.27Å; I797-V801 PolarHBondContact O-N 3.21Å; A798-V801 WeakPolarHBondContact O-CA 3.49Å; A798-V801 WeakPolarHBondContact O-CB 3.34Å; A798-V801 PolarHBondContact O-N 2.91Å; A799-V801 VanDerWaalsContact C-N 3.32Å; A799-V801 PolarHBondContact O-N 3.1Å; V801-A803 PolarHBondContact O-N 3.15Å; V801-R804 PolarHBondContact O-N 3.25Å; V801-L805 WeakPolarHBondContact O-CB 3.2Å; V801-L805 PolarHBondContact O-N 3.4Å
802	A	97.6	Very high	94.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-59.6	-46.2	176.1	0	0	0	0	0	112.5	A748 A750 A759 A798 A799 R804 L805 V806 W860	A748-A802 HydrophobicContact CB-CB 4.03Å; A750-A802 HydrophobicContact CB-CB 3.92Å; A759-A802 VanDerWaalsContact CB-CA 3.48Å; A759-A802 HydrophobicContact CB-CB 3.61Å; A798-A802 PolarHBondContact O-N 2.79Å; A799-A802 PolarHBondContact O-N 2.78Å; A802-R804 VanDerWaalsContact C-N 3.32Å; A802-R804 PolarHBondContact O-N 2.9Å; A802-L805 PolarHBondContact O-N 2.73Å; A802-V806 WeakPolarHBondContact O-CG1 3.16Å; A802-V806 PolarHBondContact O-N 2.9Å; A802-W860 HydrophobicContact CB-CH2 4.29Å
803	A	97.7	Very high	94.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.7	-44.2	178.1	0	0	0	0	0	112	A799 L800 V801 V806 C807 I851 L854 V855 W860	A799-A803 PolarHBondContact O-N 2.87Å; L800-A803 PolarHBondContact O-N 3.43Å; V801-A803 PolarHBondContact O-N 3.15Å; A803-V806 WeakPolarHBondContact O-CG1 3.47Å; A803-C807 VanDerWaalsContact O-CB 3.32Å; A803-C807 WeakPolarHBondContact O-CB 3.47Å; A803-C807 PolarHBondContact O-N 2.88Å; A803-I851 HydrophobicContact CB-CG1 4.39Å; A803-I851 HydrophobicContact CB-CG2 4.46Å; A803-L854 HydrophobicContact CB-CB 4.18Å; A803-L854 HydrophobicContact CB-CD1 4.15Å; A803-V855 HydrophobicContact CB-CG2 4.12Å; A803-W860 HydrophobicContact CB-CZ2 4.01Å
804	R	96.7	Very high	93.9	Very high	77 Å²	77	38.3 Å²	38.3	29%	0.291	17%	0.172	S	C	.	.	H	α-helix	trans	-68.6	-42	178.1	-75.9	152.6	152.6	-148.9	9	111.7	I513 L800 V801 A802 Y808 E850 L854	I513-R804 HydrophobicContact CB-CB 4.31Å; I513-R804 HydrophobicContact CD1-CB 3.91Å; I513-R804 HydrophobicContact CG1-CB 3.9Å; I513-R804 HydrophobicContact CG2-CB 3.59Å; I513-R804 HydrophobicContact CG2-CG 3.63Å; L800-R804 HydrophobicContact CD1-CG 4.29Å; L800-R804 VanDerWaalsContact O-CD 3.26Å; L800-R804 WeakPolarHBondContact O-CD 3.47Å; L800-R804 WeakPolarHBondContact O-CG 3.47Å; L800-R804 PolarHBondContact O-N 2.73Å; L800-R804 VanDerWaalsContact O-N 3.08Å; V801-R804 PolarHBondContact O-N 3.25Å; A802-R804 VanDerWaalsContact C-N 3.32Å; A802-R804 PolarHBondContact O-N 2.9Å; R804-Y808 WeakPolarHBondContact O-CB 3.35Å; R804-Y808 PolarHBondContact O-N 3.2Å; R804-E850 IonicContact CZ-OE1 3.64Å; R804-E850 IonicContact NE-OE1 3.87Å; R804-E850 PolarHBondContact NE-OE1 2.89Å; R804-E850 IonicContact NH2-OE1 2.56Å; R804-E850 PolarHBondContact NH2-OE1 3.44Å; R804-E850 IonicContact NH2-OE2 3.14Å; R804-E850 PolarHBondContact NH2-OE2 3.25Å; R804-L854 HydrophobicContact CB-CD1 4.47Å; R804-L854 HydrophobicContact CG-CD1 3.54Å
805	L	95.6	Very high	93.4	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-69.5	-42.4	-176.8	-166.5	60.3	0	0	0	111.6	A759 V761 I778 K780 V801 A802 Y808 V809	A759-L805 HydrophobicContact CB-CD2 4.35Å; V761-L805 HydrophobicContact CG2-CB 4.11Å; V761-L805 HydrophobicContact CG2-CD2 3.84Å; V761-L805 HydrophobicContact CG2-CG 3.7Å; I778-L805 HydrophobicContact CD1-CD1 3.88Å; I778-L805 HydrophobicContact CG1-CD1 4.07Å; I778-L805 HydrophobicContact CG2-CD1 3.75Å; I778-L805 HydrophobicContact CG2-CD2 4.05Å; I778-L805 HydrophobicContact CG2-CG 3.74Å; K780-L805 HydrophobicContact CB-CD2 4.31Å; K780-L805 HydrophobicContact CG-CD1 3.77Å; K780-L805 HydrophobicContact CG-CD2 4.18Å; V801-L805 WeakPolarHBondContact O-CB 3.2Å; V801-L805 PolarHBondContact O-N 3.4Å; A802-L805 PolarHBondContact O-N 2.73Å; L805-Y808 WeakPolarHBondContact O-CB 3.29Å; L805-Y808 PolarHBondContact O-N 3.31Å; L805-V809 WeakPolarHBondContact O-CG2 3.01Å; L805-V809 PolarHBondContact O-N 3.16Å
806	V	96.4	Very high	93.1	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-68.6	-37.6	177.7	78.5	0	0	0	0	112.1	L746 A748 V761 A802 A803 Y808 V809 K810 V820 V855	L746-V806 HydrophobicContact CB-CG2 3.76Å; L746-V806 HydrophobicContact CD1-CG2 4.18Å; A748-V806 HydrophobicContact CB-CB 4.01Å; A748-V806 HydrophobicContact CB-CG2 4.3Å; V761-V806 HydrophobicContact CG1-CG2 4.38Å; V761-V806 HydrophobicContact CG2-CB 4.42Å; A802-V806 WeakPolarHBondContact O-CG1 3.16Å; A802-V806 PolarHBondContact O-N 2.9Å; A803-V806 WeakPolarHBondContact O-CG1 3.47Å; V806-Y808 VanDerWaalsContact C-N 3.33Å; V806-V809 PolarHBondContact O-N 3.01Å; V806-K810 VanDerWaalsContact O-CB 3.32Å; V806-K810 WeakPolarHBondContact O-CB 3.24Å; V806-K810 PolarHBondContact O-N 3.18Å; V806-V820 HydrophobicContact CB-CG1 4.46Å; V806-V820 HydrophobicContact CG1-CG1 3.93Å; V806-V820 HydrophobicContact CG2-CG1 3.66Å; V806-V855 HydrophobicContact CG1-CG2 3.79Å
807	C	94.3	Very high	93	Very high	46 Å²	46	46 Å²	46	31%	0.311	22%	0.218	S	C	.	.	H	α-helix	trans	-67.3	-35.6	174.5	-171.6	0	0	0	0	111.7	A803 R811 L854	A803-C807 VanDerWaalsContact O-CB 3.32Å; A803-C807 WeakPolarHBondContact O-CB 3.47Å; A803-C807 PolarHBondContact O-N 2.88Å; C807-R811 WeakPolarHBondContact O-CB 3.19Å; C807-R811 PolarHBondContact O-N 2.9Å; C807-L854 HydrophobicContact CB-CD2 4.48Å
808	Y	94.2	Very high	93	Very high	70 Å²	70	49.6 Å²	49.6	28%	0.275	24%	0.238	S	C	.	.	H	α-helix	trans	-61.6	-53.9	172.1	173.2	-95.6	0	0	0	110.6	G512 I778 R804 L805 V806 K810 R811 E812	G512-Y808 VanDerWaalsContact CA-CD2 3.46Å; G512-Y808 VanDerWaalsContact CA-CE2 3.42Å; G512-Y808 WeakPolarHBondContact O-CD2 2.88Å; I778-Y808 HydrophobicContact CD1-CD1 4.29Å; I778-Y808 HydrophobicContact CD1-CE1 4.02Å; R804-Y808 WeakPolarHBondContact O-CB 3.35Å; R804-Y808 PolarHBondContact O-N 3.2Å; L805-Y808 WeakPolarHBondContact O-CB 3.29Å; L805-Y808 PolarHBondContact O-N 3.31Å; V806-Y808 VanDerWaalsContact C-N 3.33Å; Y808-K810 PolarHBondContact O-N 3.17Å; Y808-R811 PolarHBondContact O-N 3.46Å; Y808-R811 VanDerWaalsContact O-N 3.11Å; Y808-E812 HydrophobicContact CD1-CG 4.47Å; Y808-E812 HydrophobicContact CD2-CG 3.94Å; Y808-E812 HydrophobicContact CE1-CG 4.17Å; Y808-E812 HydrophobicContact CE2-CG 3.61Å; Y808-E812 HydrophobicContact CG-CG 4.36Å; Y808-E812 WeakPolarHBondContact O-CG 3.26Å; Y808-E812 PolarHBondContact O-N 2.92Å
809	V	94.3	Very high	92.9	Very high	8 Å²	8	52 Å²	52	5%	0.048	25%	0.247	C	C	.	.	H	α-helix	trans	-58.1	-48	178.9	176.5	0	0	0	0	111.2	L746 V761 V777 I778 L805 V806 R811 E812 I813	L746-V809 HydrophobicContact CD1-CB 4.19Å; L746-V809 HydrophobicContact CD1-CG1 3.81Å; L746-V809 HydrophobicContact CD2-CG1 3.97Å; V761-V809 HydrophobicContact CB-CG2 4.49Å; V761-V809 HydrophobicContact CG1-CG2 4.31Å; V777-V809 HydrophobicContact CG1-CG1 4.01Å; V777-V809 HydrophobicContact CG1-CG2 4.31Å; I778-V809 HydrophobicContact CB-CG2 4.47Å; I778-V809 HydrophobicContact CG2-CG2 3.3Å; L805-V809 WeakPolarHBondContact O-CG2 3.01Å; L805-V809 PolarHBondContact O-N 3.16Å; V806-V809 PolarHBondContact O-N 3.01Å; V809-R811 PolarHBondContact O-N 3.34Å; V809-R811 VanDerWaalsContact O-N 3.17Å; V809-E812 PolarHBondContact O-N 3.41Å; V809-I813 HydrophobicContact CG1-CB 4.49Å; V809-I813 HydrophobicContact CG1-CD1 4.12Å; V809-I813 VanDerWaalsContact O-CB 3.26Å; V809-I813 WeakPolarHBondContact O-CB 3.49Å; V809-I813 WeakPolarHBondContact O-CG2 3.13Å; V809-I813 PolarHBondContact O-N 3.26Å
810	K	94	Very high	92.9	Very high	108 Å²	108	52.8 Å²	52.8	47%	0.47	25%	0.252	S	S	.	.	H	α-helix	trans	-56	-34.9	178.9	-178.8	172.7	178.9	173.1	0	112.8	L746 V806 Y808 V817 V820	L746-K810 HydrophobicContact CD1-CB 4.02Å; V806-K810 VanDerWaalsContact O-CB 3.32Å; V806-K810 WeakPolarHBondContact O-CB 3.24Å; V806-K810 PolarHBondContact O-N 3.18Å; Y808-K810 PolarHBondContact O-N 3.17Å; K810-V817 HydrophobicContact CG-CB 4.32Å; K810-V817 HydrophobicContact CG-CG2 4.28Å; K810-V820 HydrophobicContact CD-CG2 4.08Å
811	R	89.9	Confident	92.9	Very high	145 Å²	145	52.3 Å²	52.3	55%	0.547	25%	0.249	S	C	.	.	H	α-helix	trans	-78.1	-43.3	179.5	-174	-178.6	68.2	-139.2	-4.2	112.4	C807 Y808 V809	C807-R811 WeakPolarHBondContact O-CB 3.19Å; C807-R811 PolarHBondContact O-N 2.9Å; Y808-R811 PolarHBondContact O-N 3.46Å; Y808-R811 VanDerWaalsContact O-N 3.11Å; V809-R811 PolarHBondContact O-N 3.34Å; V809-R811 VanDerWaalsContact O-N 3.17Å
812	E	87.7	Confident	93	Very high	94 Å²	94	52 Å²	52	44%	0.439	25%	0.247	S	C	.	.	H	α-helix	trans	-89	-15.2	-171.7	-54.4	-58.8	147.5	0	0	113.8	Y808 V809 E814	Y808-E812 HydrophobicContact CD1-CG 4.47Å; Y808-E812 HydrophobicContact CD2-CG 3.94Å; Y808-E812 HydrophobicContact CE1-CG 4.17Å; Y808-E812 HydrophobicContact CE2-CG 3.61Å; Y808-E812 HydrophobicContact CG-CG 4.36Å; Y808-E812 WeakPolarHBondContact O-CG 3.26Å; Y808-E812 PolarHBondContact O-N 2.92Å; V809-E812 PolarHBondContact O-N 3.41Å; E812-E814 PolarHBondContact O-N 2.89Å
813	I	86.9	Confident	92.9	Very high	37 Å²	37	52 Å²	52	19%	0.19	25%	0.247	C	C	.	.	S	Bend	trans	-75.9	-12.2	-178.3	-157	152	0	0	0	113.6	L733 M763 V809 M815 V817	L733-I813 HydrophobicContact CD1-CD1 4.38Å; M763-I813 HydrophobicContact CE-CD1 3.08Å; M763-I813 HydrophobicContact CE-CG1 4.21Å; V809-I813 HydrophobicContact CG1-CB 4.49Å; V809-I813 HydrophobicContact CG1-CD1 4.12Å; V809-I813 VanDerWaalsContact O-CB 3.26Å; V809-I813 WeakPolarHBondContact O-CB 3.49Å; V809-I813 WeakPolarHBondContact O-CG2 3.13Å; V809-I813 PolarHBondContact O-N 3.26Å; I813-M815 HydrophobicContact CG2-CB 4.31Å; I813-M815 WeakPolarHBondContact O-CG 3.32Å; I813-M815 PolarHBondContact O-N 3.38Å; I813-V817 HydrophobicContact CG2-CG2 4.14Å
814	E	79.6	Confident	92.8	Very high	141 Å²	141	52.1 Å²	52.1	66%	0.659	25%	0.248	S	C	*	.			trans	53.6	22.1	177.1	-58.5	-170	164.6	0	0	115.1	E812	E812-E814 PolarHBondContact O-N 2.89Å
815	M	84.1	Confident	92.7	Very high	63 Å²	63	50.5 Å²	50.5	31%	0.31	25%	0.245	S	C	.	.	S	Bend	trans	-118.8	155.4	176	-61.3	-176.4	79.8	0	0	110.9	I734 I738 I744 I813 V817	I734-M815 HydrophobicContact CD1-CE 3.44Å; I734-M815 VanDerWaalsContact CD1-CE 3.44Å; I734-M815 HydrophobicContact CD1-SD 3.77Å; I738-M815 HydrophobicContact CD1-CE 3.99Å; I744-M815 HydrophobicContact CD1-CE 3.5Å; I744-M815 VanDerWaalsContact CD1-CE 3.5Å; I744-M815 HydrophobicContact CD1-SD 4.19Å; I813-M815 HydrophobicContact CG2-CB 4.31Å; I813-M815 WeakPolarHBondContact O-CG 3.32Å; I813-M815 PolarHBondContact O-N 3.38Å; M815-V817 PolarHBondContact O-N 3.26Å
816	T	89	Confident	92.5	Very high	116 Å²	116	51 Å²	51	71%	0.712	25%	0.249	S	C	*	.			trans	-68.5	117.2	171.5	-51.6	0	0	0	0	109.5
817	V	94.1	Very high	92.3	Very high	15 Å²	15	53.9 Å²	53.9	9%	0.091	26%	0.261	C	S	.	.			trans	-100.1	109.8	173.3	177	0	0	0	0	108.3	L746 K810 I813 M815 R819 V820	L746-V817 HydrophobicContact CB-CG1 4.26Å; L746-V817 HydrophobicContact CD1-CG1 3.95Å; L746-V817 HydrophobicContact CD1-CG2 3.89Å; L746-V817 HydrophobicContact CG-CG1 3.74Å; L746-V817 HydrophobicContact CG-CG2 4.14Å; K810-V817 HydrophobicContact CG-CB 4.32Å; K810-V817 HydrophobicContact CG-CG2 4.28Å; I813-V817 HydrophobicContact CG2-CG2 4.14Å; M815-V817 PolarHBondContact O-N 3.26Å; V817-R819 VanDerWaalsContact CG1-O 3.24Å; V817-R819 WeakPolarHBondContact CG1-O 3.14Å; V817-V820 HydrophobicContact CG1-CG2 4Å
818	D	95.3	Very high	92.2	Very high	99 Å²	99	52 Å²	52	53%	0.529	25%	0.248	S	C	.	.			trans	-71	-34.6	-176.1	-57.9	-71.9	0	0	0	112.3	S743 I744	S743-D818 WeakPolarHBondContact CA-OD2 3.31Å; S743-D818 VanDerWaalsContact CB-OD2 3.28Å; S743-D818 WeakPolarHBondContact CB-OD2 3Å; I744-D818 PolarHBondContact N-OD2 3.49Å; I744-D818 PolarHBondContact O-N 3.24Å
819	R	94.7	Very high	92.2	Very high	52 Å²	52	48.6 Å²	48.6	20%	0.196	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	144.2	-178	-167.5	179.6	-177.5	169.7	4.5	112.9	I744 E745 L746 V817 Y861 E899	I744-R819 PolarHBondContact O-N 2.92Å; E745-R819 CarbonylContact C-O 3.59Å; E745-R819 WeakPolarHBondContact CA-O 3.32Å; E745-R819 HydrophobicContact CB-CB 4.05Å; E745-R819 HydrophobicContact CG-CB 3.87Å; L746-R819 PolarHBondContact N-O 3.42Å; V817-R819 VanDerWaalsContact CG1-O 3.24Å; V817-R819 WeakPolarHBondContact CG1-O 3.14Å; R819-Y861 PolarHBondContact NH2-OH 2.9Å; R819-E899 IonicContact CZ-OE1 3.1Å; R819-E899 IonicContact CZ-OE2 3.97Å; R819-E899 IonicContact NH1-OE1 2.9Å; R819-E899 PolarHBondContact NH1-OE1 3.35Å; R819-E899 IonicContact NH1-OE2 3.61Å; R819-E899 PolarHBondContact NH1-OE2 2.79Å; R819-E899 IonicContact NH2-OE1 3.63Å; R819-E899 PolarHBondContact NH2-OE1 3.39Å; R819-E899 IonicContact NH2-OE2 3.2Å
820	V	96.5	Very high	92.2	Very high	16 Å²	16	48.4 Å²	48.4	10%	0.097	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	129.6	169.1	174.6	0	0	0	0	108.7	L746 V806 K810 V817 N859	L746-V820 HydrophobicContact CB-CG2 4.47Å; L746-V820 WeakPolarHBondContact O-CA 3.45Å; V806-V820 HydrophobicContact CB-CG1 4.46Å; V806-V820 HydrophobicContact CG1-CG1 3.93Å; V806-V820 HydrophobicContact CG2-CG1 3.66Å; K810-V820 HydrophobicContact CD-CG2 4.08Å; V817-V820 HydrophobicContact CG1-CG2 4Å; V820-N859 WeakPolarHBondContact O-CB 3.49Å
821	A	96.2	Very high	92.1	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	132.2	175	0	0	0	0	0	110.6	L746 H747 A748 Y861	L746-A821 PolarHBondContact O-N 2.86Å; H747-A821 CarbonylContact C-O 3.53Å; H747-A821 VanDerWaalsContact CA-O 3.31Å; H747-A821 WeakPolarHBondContact CA-O 3.46Å; A748-A821 PolarHBondContact N-O 3.26Å; A821-Y861 HydrophobicContact CB-CD2 3.99Å; A821-Y861 HydrophobicContact CB-CE2 3.7Å
822	C	97.6	Very high	92.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	137.9	176	-65	0	0	0	0	110.4	A748 N859 W860 Y861	A748-C822 CarbonylContact O-C 3.6Å; A748-C822 WeakPolarHBondContact O-CA 3.38Å; C822-N859 PolarHBondContact N-O 3.25Å; C822-W860 HydrophobicContact CB-CD2 3.69Å; C822-W860 HydrophobicContact CB-CE3 3.64Å; C822-W860 HydrophobicContact CB-CG 4.36Å; C822-W860 HydrophobicContact CB-CH2 3.69Å; C822-W860 HydrophobicContact CB-CZ2 3.78Å; C822-W860 HydrophobicContact CB-CZ3 3.65Å; C822-W860 CarbonylContact O-C 3.58Å; C822-W860 WeakPolarHBondContact O-CA 3.43Å; C822-Y861 PolarHBondContact O-N 3.02Å
823	W	97.1	Very high	92.7	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.008	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	138.4	-171.9	-57.9	82.4	0	0	0	110.4	H747 A748 F749 A750 Y861 C863 W894 W902	H747-W823 AromaticContact CE1-NE1 3.99Å; H747-W823 AromaticContact ND1-CE2 3.87Å; H747-W823 AromaticContact ND1-NE1 3.11Å; H747-W823 PolarHBondContact ND1-NE1 3.3Å; H747-W823 VanDerWaalsContact ND1-NE1 3.11Å; A748-W823 PolarHBondContact O-N 3.18Å; F749-W823 HydrophobicContact CD1-CB 3.43Å; F749-W823 VanDerWaalsContact CD1-CB 3.43Å; F749-W823 AromaticContact CD1-CG 3.95Å; F749-W823 HydrophobicContact CD1-CG 3.95Å; F749-W823 HydrophobicContact CE1-CB 3.61Å; F749-W823 AromaticContact CE1-CD1 3.98Å; F749-W823 HydrophobicContact CE1-CD2 4.18Å; F749-W823 AromaticContact CE1-CG 3.63Å; F749-W823 HydrophobicContact CE1-CG 3.63Å; F749-W823 HydrophobicContact CG-CB 4.07Å; F749-W823 HydrophobicContact CZ-CB 4.37Å; F749-W823 AromaticContact CZ-CD1 3.87Å; F749-W823 HydrophobicContact CZ-CD2 4.44Å; F749-W823 AromaticContact CZ-CG 3.97Å; F749-W823 HydrophobicContact CZ-CG 3.97Å; A750-W823 PolarHBondContact N-O 2.95Å; W823-Y861 WeakPolarHBondContact CA-O 3.46Å; W823-Y861 VanDerWaalsContact CE3-CB 3.47Å; W823-Y861 HydrophobicContact CE3-CG 4.45Å; W823-Y861 HydrophobicContact CH2-CG 4.13Å; W823-Y861 HydrophobicContact CZ2-CD2 4.24Å; W823-Y861 HydrophobicContact CZ2-CG 4.27Å; W823-Y861 VanDerWaalsContact CZ3-CB 3.48Å; W823-Y861 HydrophobicContact CZ3-CG 4.22Å; W823-C863 HydrophobicContact CE3-CB 4.1Å; W823-W894 HydrophobicContact CD2-CH2 4.15Å; W823-W894 HydrophobicContact CE3-CH2 4.05Å; W823-W894 HydrophobicContact CH2-CH2 4.01Å; W823-W894 AromaticContact CH2-CZ3 3.97Å; W823-W894 HydrophobicContact CH2-CZ3 3.97Å; W823-W894 HydrophobicContact CZ2-CH2 4.12Å; W823-W894 HydrophobicContact CZ2-CZ3 4.04Å; W823-W894 AromaticContact CZ3-CH2 3.98Å; W823-W894 HydrophobicContact CZ3-CH2 3.98Å; W823-W894 HydrophobicContact CZ3-CZ3 4.36Å; W823-W902 HydrophobicContact CH2-CB 4.42Å; W823-W902 HydrophobicContact CH2-CD2 4.43Å; W823-W902 AromaticContact CH2-CE3 3.87Å; W823-W902 HydrophobicContact CH2-CE3 3.87Å; W823-W902 HydrophobicContact CZ2-CD2 4.46Å; W823-W902 AromaticContact CZ2-CE3 3.79Å; W823-W902 HydrophobicContact CZ2-CE3 3.79Å; W823-W902 HydrophobicContact CZ2-CZ3 4.09Å
824	S	95.3	Very high	93.1	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.007	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	147.8	171.6	178	0	0	0	0	109.4	S826 Y861 H862 C863	S824-S826 VanDerWaalsContact C-N 3.32Å; S824-S826 PolarHBondContact OG-N 2.91Å; S824-Y861 PolarHBondContact N-O 3.48Å; S824-Y861 VanDerWaalsContact N-O 3.14Å; S824-H862 WeakPolarHBondContact O-CA 3.31Å; S824-C863 PolarHBondContact O-N 3.16Å
825	D	93.1	Very high	93.6	Very high	43 Å²	43	28.5 Å²	28.5	23%	0.23	15%	0.148	C	C	.	.	S	Bend	trans	-86.2	-5.2	173.1	67.8	-15.1	0	0	0	113.4	K827 C863 G865	D825-K827 PolarHBondContact O-N 2.93Å; D825-C863 WeakPolarHBondContact CA-O 3.45Å; D825-C863 VanDerWaalsContact CB-O 3.29Å; D825-C863 WeakPolarHBondContact CB-O 3.47Å; D825-G865 VanDerWaalsContact OD2-CA 3.31Å; D825-G865 WeakPolarHBondContact OD2-CA 3.06Å
826	S	92.9	Very high	94	Very high	14 Å²	14	30.2 Å²	30.2	10%	0.098	16%	0.164	C	C	.	.			trans	-86.7	93.6	179.2	-169.2	0	0	0	0	112.2	S824 V828 A829 L830	S824-S826 VanDerWaalsContact C-N 3.32Å; S824-S826 PolarHBondContact OG-N 2.91Å; S826-V828 PolarHBondContact O-N 2.93Å; S826-V828 VanDerWaalsContact O-N 3.1Å; S826-A829 PolarHBondContact O-N 2.8Å; S826-A829 VanDerWaalsContact O-N 3.1Å; S826-A829 PolarHBondContact OG-N 2.95Å; S826-L830 WeakPolarHBondContact O-CG 3.43Å; S826-L830 PolarHBondContact O-N 3.44Å
827	K	91.3	Very high	94.1	Very high	62 Å²	62	25.5 Å²	25.5	27%	0.27	14%	0.136	S	C	.	.	H	α-helix	trans	-52.1	-33	171.2	-68.2	-171.5	174.4	-172.5	0	112.6	D825 S831 E910 L911	D825-K827 PolarHBondContact O-N 2.93Å; K827-S831 WeakPolarHBondContact O-CB 3.3Å; K827-S831 PolarHBondContact O-N 3.15Å; K827-E910 IonicContact NZ-OE2 2.68Å; K827-E910 PolarHBondContact NZ-OE2 3Å; K827-E910 VanDerWaalsContact NZ-OE2 3.14Å; K827-L911 HydrophobicContact CB-CD2 3.89Å
828	V	92.6	Very high	93.8	Very high	5 Å²	5	32.9 Å²	32.9	3%	0.03	17%	0.167	C	C	.	.	H	α-helix	trans	-70.2	-47.2	177.4	177.8	0	0	0	0	111.8	P792 S826 S831 W832 H915 T918 V919	P792-V828 HydrophobicContact CB-CB 4.19Å; P792-V828 HydrophobicContact CB-CG1 3.71Å; P792-V828 HydrophobicContact CG-CB 4.47Å; P792-V828 HydrophobicContact CG-CG1 4.19Å; S826-V828 PolarHBondContact O-N 2.93Å; S826-V828 VanDerWaalsContact O-N 3.1Å; V828-S831 WeakPolarHBondContact O-CB 3.47Å; V828-S831 PolarHBondContact O-N 3.45Å; V828-W832 HydrophobicContact CG1-CD2 4.29Å; V828-W832 HydrophobicContact CG1-CH2 4.03Å; V828-W832 HydrophobicContact CG1-CZ2 3.67Å; V828-W832 HydrophobicContact CG1-CZ3 4.45Å; V828-W832 PolarHBondContact O-N 2.82Å; V828-W832 VanDerWaalsContact O-N 3.11Å; V828-H915 HydrophobicContact CG2-CB 3.84Å; V828-T918 HydrophobicContact CG1-CG2 4.11Å; V828-V919 HydrophobicContact CB-CG2 4.43Å; V828-V919 HydrophobicContact CG1-CG2 3.89Å; V828-V919 HydrophobicContact CG2-CG2 4.48Å
829	A	94.5	Very high	93.5	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-64.9	-41.9	178.5	0	0	0	0	0	111.2	E795 L796 S826 S831 W832 I833	E795-A829 HydrophobicContact CB-CB 3.93Å; L796-A829 HydrophobicContact CB-CB 4.48Å; S826-A829 PolarHBondContact O-N 2.8Å; S826-A829 VanDerWaalsContact O-N 3.1Å; S826-A829 PolarHBondContact OG-N 2.95Å; A829-S831 VanDerWaalsContact C-N 3.33Å; A829-S831 PolarHBondContact O-N 3.49Å; A829-W832 WeakPolarHBondContact O-CB 3.45Å; A829-W832 PolarHBondContact O-N 2.92Å; A829-I833 VanDerWaalsContact O-CG1 3.3Å; A829-I833 WeakPolarHBondContact O-CG1 3.45Å; A829-I833 PolarHBondContact O-N 2.91Å
830	L	94.3	Very high	93.3	Very high	4 Å²	4	28.8 Å²	28.8	2%	0.021	15%	0.152	C	C	.	.	H	α-helix	trans	-59.6	-41.8	173.6	-70.4	172.1	0	0	0	112	S826 W832 I833 R834 W860 H862	S826-L830 WeakPolarHBondContact O-CG 3.43Å; S826-L830 PolarHBondContact O-N 3.44Å; L830-W832 VanDerWaalsContact C-N 3.31Å; L830-W832 PolarHBondContact O-N 3.17Å; L830-I833 PolarHBondContact O-N 3.11Å; L830-R834 WeakPolarHBondContact O-CB 3.49Å; L830-R834 WeakPolarHBondContact O-CG 3.47Å; L830-R834 PolarHBondContact O-N 3.16Å; L830-W860 HydrophobicContact CD2-CB 3.9Å; L830-W860 HydrophobicContact CD2-CE3 4Å; L830-H862 HydrophobicContact CD1-CB 3.66Å
831	S	92	Very high	93.1	Very high	8 Å²	8	32.2 Å²	32.2	6%	0.056	17%	0.165	C	C	.	.	H	α-helix	trans	-59.8	-40.1	175.2	-171.6	0	0	0	0	112.7	K827 V828 A829 S835	K827-S831 WeakPolarHBondContact O-CB 3.3Å; K827-S831 PolarHBondContact O-N 3.15Å; V828-S831 WeakPolarHBondContact O-CB 3.47Å; V828-S831 PolarHBondContact O-N 3.45Å; A829-S831 VanDerWaalsContact C-N 3.33Å; A829-S831 PolarHBondContact O-N 3.49Å; S831-S835 WeakPolarHBondContact O-CB 3.49Å; S831-S835 PolarHBondContact O-N 3.08Å; S831-S835 PolarHBondContact O-OG 2.95Å
832	W	95.1	Very high	92.8	Very high	1 Å²	1	36.3 Å²	36.3	0%	0.004	19%	0.192	C	C	.	.	H	α-helix	trans	-66.8	-44	174.2	-65.6	-25.9	0	0	0	112.8	P792 R793 L796 V828 A829 L830 R834 S835 W840 V844 V848 E922	P792-W832 HydrophobicContact CB-CH2 3.58Å; P792-W832 HydrophobicContact CB-CZ2 4.41Å; P792-W832 HydrophobicContact CB-CZ3 3.9Å; P792-W832 WeakPolarHBondContact O-CZ3 3.19Å; R793-W832 HydrophobicContact CG-CH2 4.26Å; R793-W832 HydrophobicContact CG-CZ3 4.38Å; L796-W832 HydrophobicContact CB-CE3 4.21Å; L796-W832 HydrophobicContact CB-CZ3 4.26Å; L796-W832 HydrophobicContact CD1-CE3 4.43Å; L796-W832 HydrophobicContact CD2-CE3 3.9Å; L796-W832 HydrophobicContact CD2-CZ3 4.24Å; L796-W832 HydrophobicContact CG-CE3 4.41Å; V828-W832 HydrophobicContact CG1-CD2 4.29Å; V828-W832 HydrophobicContact CG1-CH2 4.03Å; V828-W832 HydrophobicContact CG1-CZ2 3.67Å; V828-W832 HydrophobicContact CG1-CZ3 4.45Å; V828-W832 PolarHBondContact O-N 2.82Å; V828-W832 VanDerWaalsContact O-N 3.11Å; A829-W832 WeakPolarHBondContact O-CB 3.45Å; A829-W832 PolarHBondContact O-N 2.92Å; L830-W832 VanDerWaalsContact C-N 3.31Å; L830-W832 PolarHBondContact O-N 3.17Å; W832-R834 VanDerWaalsContact C-N 3.35Å; W832-S835 PolarHBondContact O-N 3.42Å; W832-W840 HydrophobicContact CB-CZ2 4.5Å; W832-W840 AromaticContact CD1-CE2 3.81Å; W832-W840 AromaticContact CD1-CH2 3.85Å; W832-W840 AromaticContact CD1-CZ2 3.62Å; W832-W840 HydrophobicContact CG-CZ2 4.43Å; W832-W840 PolarHBondContact O-NE1 3.1Å; W832-W840 VanDerWaalsContact O-NE1 3.15Å; W832-V844 HydrophobicContact CB-CG1 3.9Å; W832-V844 HydrophobicContact CD2-CG1 3.74Å; W832-V844 HydrophobicContact CD2-CG2 4.32Å; W832-V844 HydrophobicContact CE3-CG1 3.94Å; W832-V844 HydrophobicContact CE3-CG2 4.12Å; W832-V844 HydrophobicContact CG-CG1 3.75Å; W832-V844 HydrophobicContact CH2-CG2 4.15Å; W832-V844 HydrophobicContact CZ2-CG2 4.39Å; W832-V844 HydrophobicContact CZ3-CG2 4.01Å; W832-V848 HydrophobicContact CB-CG2 3.95Å; W832-V848 WeakPolarHBondContact O-CG1 3.3Å; W832-E922 HydrophobicContact CH2-CG 4.05Å; W832-E922 HydrophobicContact CZ2-CB 4.03Å; W832-E922 HydrophobicContact CZ2-CG 3.51Å
833	I	95.3	Very high	92.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.1	-36.7	-179.6	-67.8	164.3	0	0	0	111.6	L796 A799 A829 L830 S835 I851 Q852 W860	L796-I833 HydrophobicContact CD1-CD1 4.2Å; L796-I833 HydrophobicContact CD1-CG1 3.88Å; A799-I833 HydrophobicContact CB-CD1 3.76Å; A829-I833 VanDerWaalsContact O-CG1 3.3Å; A829-I833 WeakPolarHBondContact O-CG1 3.45Å; A829-I833 PolarHBondContact O-N 2.91Å; L830-I833 PolarHBondContact O-N 3.11Å; I833-S835 VanDerWaalsContact C-N 3.27Å; I833-S835 PolarHBondContact O-N 2.99Å; I833-I851 HydrophobicContact CD1-CD1 3.99Å; I833-I851 HydrophobicContact CD1-CG2 4.33Å; I833-I851 HydrophobicContact CG1-CD1 3.99Å; I833-I851 HydrophobicContact CG1-CG2 4.21Å; I833-I851 HydrophobicContact CG2-CG2 3.83Å; I833-Q852 PolarHBondContact O-NE2 3.41Å; I833-W860 HydrophobicContact CD1-CD2 4.15Å; I833-W860 HydrophobicContact CD1-CE3 3.98Å; I833-W860 HydrophobicContact CD1-CZ3 4.16Å; I833-W860 HydrophobicContact CG2-CD2 4.08Å; I833-W860 HydrophobicContact CG2-CG 3.84Å
834	R	93.4	Very high	92.4	Very high	68 Å²	68	38.6 Å²	38.6	26%	0.257	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-10	178.2	-68.8	173.7	179.3	174.6	-0.6	113.7	L830 W832 W860 D905 M908	L830-R834 WeakPolarHBondContact O-CB 3.49Å; L830-R834 WeakPolarHBondContact O-CG 3.47Å; L830-R834 PolarHBondContact O-N 3.16Å; W832-R834 VanDerWaalsContact C-N 3.35Å; R834-W860 PolarHBondContact NH2-O 2.66Å; R834-D905 IonicContact CZ-OD1 2.67Å; R834-D905 IonicContact CZ-OD2 2.85Å; R834-D905 IonicContact NH1-OD1 2.89Å; R834-D905 PolarHBondContact NH1-OD1 3.47Å; R834-D905 VanDerWaalsContact NH1-OD1 3.13Å; R834-D905 IonicContact NH1-OD2 2.7Å; R834-D905 PolarHBondContact NH1-OD2 3.42Å; R834-D905 IonicContact NH2-OD1 3.55Å; R834-D905 PolarHBondContact NH2-OD1 3.06Å; R834-D905 IonicContact NH2-OD2 2.7Å; R834-D905 PolarHBondContact NH2-OD2 2.82Å; R834-M908 HydrophobicContact CB-CE 4.39Å
835	S	91.5	Very high	92.2	Very high	29 Å²	29	40.5 Å²	40.5	20%	0.203	21%	0.21	C	C	.	.	S	Bend	trans	-100.6	155.8	-178.6	-62.2	0	0	0	0	112.5	S831 W832 I833 S837 W840 Q852	S831-S835 WeakPolarHBondContact O-CB 3.49Å; S831-S835 PolarHBondContact O-N 3.08Å; S831-S835 PolarHBondContact O-OG 2.95Å; W832-S835 PolarHBondContact O-N 3.42Å; I833-S835 VanDerWaalsContact C-N 3.27Å; I833-S835 PolarHBondContact O-N 2.99Å; S835-S837 PolarHBondContact O-N 3.2Å; S835-W840 WeakPolarHBondContact OG-CZ2 3.48Å; S835-Q852 PolarHBondContact O-NE2 2.71Å
836	P	91.9	Very high	92.2	Very high	99 Å²	99	44.6 Å²	44.6	64%	0.643	23%	0.226	S	C	*	.			trans	-59.4	125.5	177.6	-23.5	33.2	0	0	0	112.3	K838 S839	P836-K838 PolarHBondContact O-N 3.34Å; P836-S839 WeakPolarHBondContact O-CB 3.01Å; P836-S839 PolarHBondContact O-N 2.71Å; P836-S839 PolarHBondContact O-OG 3.26Å
837	S	90.6	Very high	92.4	Very high	18 Å²	18	47.8 Å²	47.8	13%	0.126	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-52.5	-32.9	-174.2	60.6	0	0	0	0	115.1	S835 S839 W840 Q845	S835-S837 PolarHBondContact O-N 3.2Å; S837-S839 VanDerWaalsContact C-N 3.25Å; S837-S839 PolarHBondContact O-N 2.91Å; S837-W840 PolarHBondContact O-N 3.05Å; S837-Q845 WeakPolarHBondContact O-CB 3.4Å; S837-Q845 VanDerWaalsContact O-CG 3.24Å; S837-Q845 WeakPolarHBondContact O-CG 3.43Å
838	K	89.4	Confident	92.6	Very high	169 Å²	169	44.9 Å²	44.9	74%	0.735	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-67.8	-15.9	-178.3	-66.9	-179.2	-178	173.3	0	114.7	P836 W840	P836-K838 PolarHBondContact O-N 3.34Å; K838-W840 PolarHBondContact O-N 2.84Å
839	S	87.6	Confident	92.8	Very high	47 Å²	47	49.8 Å²	49.8	33%	0.329	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-72.9	-19.1	179	66	0	0	0	0	112.9	P836 S837 R924	P836-S839 WeakPolarHBondContact O-CB 3.01Å; P836-S839 PolarHBondContact O-N 2.71Å; P836-S839 PolarHBondContact O-OG 3.26Å; S837-S839 VanDerWaalsContact C-N 3.25Å; S837-S839 PolarHBondContact O-N 2.91Å; S839-R924 WeakPolarHBondContact O-CB 3.28Å; S839-R924 PolarHBondContact O-N 3.47Å
840	W	90.9	Very high	92.9	Very high	19 Å²	19	52.9 Å²	52.9	7%	0.072	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-97.5	160.7	-170	-51.3	130.1	0	0	0	114.3	W832 S835 S837 K838 V844 Q845 V919 E922	W832-W840 HydrophobicContact CB-CZ2 4.5Å; W832-W840 AromaticContact CD1-CE2 3.81Å; W832-W840 AromaticContact CD1-CH2 3.85Å; W832-W840 AromaticContact CD1-CZ2 3.62Å; W832-W840 HydrophobicContact CG-CZ2 4.43Å; W832-W840 PolarHBondContact O-NE1 3.1Å; W832-W840 VanDerWaalsContact O-NE1 3.15Å; S835-W840 WeakPolarHBondContact OG-CZ2 3.48Å; S837-W840 PolarHBondContact O-N 3.05Å; K838-W840 PolarHBondContact O-N 2.84Å; W840-V844 HydrophobicContact CB-CB 3.9Å; W840-V844 HydrophobicContact CB-CG1 3.79Å; W840-V844 HydrophobicContact CD2-CG1 4.35Å; W840-V844 HydrophobicContact CG-CB 4.34Å; W840-V844 HydrophobicContact CG-CG1 3.67Å; W840-Q845 HydrophobicContact CB-CB 4.24Å; W840-V919 HydrophobicContact CH2-CG1 3.59Å; W840-V919 HydrophobicContact CZ2-CG1 4.48Å; W840-V919 HydrophobicContact CZ3-CG1 4.07Å; W840-E922 CarbonylContact C-O 3.59Å
841	K	91.5	Very high	93	Very high	88 Å²	88	52.7 Å²	52.7	38%	0.383	26%	0.26	S	S	.	.			trans	-62	158	167.6	-76	172.8	-176.4	166.6	0	111.2	F843 V844 Q845 Q921 E922	K841-F843 VanDerWaalsContact C-N 3.27Å; K841-F843 PolarHBondContact O-N 3Å; K841-V844 PolarHBondContact O-N 3.37Å; K841-V844 VanDerWaalsContact O-N 3.16Å; K841-Q845 WeakPolarHBondContact O-CB 3.34Å; K841-Q845 PolarHBondContact O-N 3.07Å; K841-Q921 WeakPolarHBondContact CE-O 3.42Å; K841-Q921 PolarHBondContact NZ-O 3.02Å; K841-E922 WeakPolarHBondContact CD-OE2 3.3Å; K841-E922 WeakPolarHBondContact CG-O 3.38Å; K841-E922 PolarHBondContact N-O 2.83Å
842	P	90	Very high	93.3	Very high	86 Å²	86	55.1 Å²	55.1	56%	0.558	27%	0.27	S	S	*	.	H	α-helix	trans	-55.2	-31.6	-168	-29.5	35.7	0	0	0	116.6	K846	P842-K846 WeakPolarHBondContact O-CG 3.33Å; P842-K846 PolarHBondContact O-N 2.82Å
843	F	92.1	Very high	93.3	Very high	49 Å²	49	59.2 Å²	59.2	22%	0.215	30%	0.304	C	S	.	.	H	α-helix	trans	-67.4	-55.5	178.3	178.7	-86.5	0	0	0	111.3	R793 I797 K841 R847	R793-F843 HydrophobicContact CB-CD1 4.37Å; R793-F843 HydrophobicContact CB-CE1 3.61Å; R793-F843 HydrophobicContact CB-CZ 4.18Å; R793-F843 HydrophobicContact CG-CD1 3.84Å; R793-F843 HydrophobicContact CG-CE1 3.58Å; R793-F843 HydrophobicContact CG-CZ 4.5Å; I797-F843 HydrophobicContact CD1-CZ 3.98Å; I797-F843 HydrophobicContact CG1-CZ 4.14Å; K841-F843 VanDerWaalsContact C-N 3.27Å; K841-F843 PolarHBondContact O-N 3Å; F843-R847 WeakPolarHBondContact O-CD 3.46Å
844	V	94.2	Very high	93.3	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-66.9	-44.1	-179.8	175.1	0	0	0	0	110	L796 W832 W840 K841 K846 R847 V848 E922	L796-V844 HydrophobicContact CD2-CB 4.15Å; L796-V844 HydrophobicContact CD2-CG1 3.89Å; L796-V844 HydrophobicContact CD2-CG2 4.15Å; W832-V844 HydrophobicContact CB-CG1 3.9Å; W832-V844 HydrophobicContact CD2-CG1 3.74Å; W832-V844 HydrophobicContact CD2-CG2 4.32Å; W832-V844 HydrophobicContact CE3-CG1 3.94Å; W832-V844 HydrophobicContact CE3-CG2 4.12Å; W832-V844 HydrophobicContact CG-CG1 3.75Å; W832-V844 HydrophobicContact CH2-CG2 4.15Å; W832-V844 HydrophobicContact CZ2-CG2 4.39Å; W832-V844 HydrophobicContact CZ3-CG2 4.01Å; W840-V844 HydrophobicContact CB-CB 3.9Å; W840-V844 HydrophobicContact CB-CG1 3.79Å; W840-V844 HydrophobicContact CD2-CG1 4.35Å; W840-V844 HydrophobicContact CG-CB 4.34Å; W840-V844 HydrophobicContact CG-CG1 3.67Å; K841-V844 PolarHBondContact O-N 3.37Å; K841-V844 VanDerWaalsContact O-N 3.16Å; V844-K846 PolarHBondContact O-N 3.36Å; V844-R847 PolarHBondContact O-N 3.41Å; V844-V848 HydrophobicContact CG1-CG2 3.81Å; V844-V848 WeakPolarHBondContact O-CB 3.48Å; V844-V848 WeakPolarHBondContact O-CG2 3.34Å; V844-V848 PolarHBondContact O-N 3.01Å; V844-E922 HydrophobicContact CG2-CB 4.17Å; V844-E922 HydrophobicContact CG2-CG 3.95Å
845	Q	93	Very high	93.4	Very high	41 Å²	41	59.4 Å²	59.4	19%	0.192	31%	0.31	C	S	.	.	H	α-helix	trans	-50.9	-52.1	178.3	171.9	174.5	27.2	0	0	112.6	S837 W840 K841 R847 Q849	S837-Q845 WeakPolarHBondContact O-CB 3.4Å; S837-Q845 VanDerWaalsContact O-CG 3.24Å; S837-Q845 WeakPolarHBondContact O-CG 3.43Å; W840-Q845 HydrophobicContact CB-CB 4.24Å; K841-Q845 WeakPolarHBondContact O-CB 3.34Å; K841-Q845 PolarHBondContact O-N 3.07Å; Q845-R847 VanDerWaalsContact C-N 3.34Å; Q845-R847 PolarHBondContact O-N 3.17Å; Q845-Q849 VanDerWaalsContact O-CB 3.27Å; Q845-Q849 WeakPolarHBondContact O-CB 3.49Å; Q845-Q849 PolarHBondContact O-N 3.33Å
846	K	92.9	Very high	93.6	Very high	129 Å²	129	62.5 Å²	62.5	56%	0.561	33%	0.325	S	S	*	.	H	α-helix	trans	-63.6	-39.1	-176.5	-76.7	-174.1	177.3	-167.7	0	112.7	P842 V844 E850	P842-K846 WeakPolarHBondContact O-CG 3.33Å; P842-K846 PolarHBondContact O-N 2.82Å; V844-K846 PolarHBondContact O-N 3.36Å; K846-E850 PolarHBondContact O-N 3.33Å
847	R	95.6	Very high	93.6	Very high	82 Å²	82	59.7 Å²	59.7	31%	0.309	31%	0.307	S	S	.	.	H	α-helix	trans	-73.8	-44.7	-178.2	-80.4	44.2	169	168.4	5.4	110.5	L796 L800 F843 V844 Q845 Q849 E850 I851	L796-R847 HydrophobicContact CD2-CB 3.76Å; L796-R847 HydrophobicContact CD2-CG 4.47Å; L796-R847 HydrophobicContact CG-CB 3.96Å; L800-R847 HydrophobicContact CD2-CG 4Å; F843-R847 WeakPolarHBondContact O-CD 3.46Å; V844-R847 PolarHBondContact O-N 3.41Å; Q845-R847 VanDerWaalsContact C-N 3.34Å; Q845-R847 PolarHBondContact O-N 3.17Å; R847-Q849 VanDerWaalsContact C-N 3.35Å; R847-Q849 PolarHBondContact O-N 3.17Å; R847-E850 PolarHBondContact O-N 3.29Å; R847-I851 VanDerWaalsContact O-CG1 3.29Å; R847-I851 WeakPolarHBondContact O-CG1 3.29Å; R847-I851 PolarHBondContact O-N 3.25Å
848	V	96.7	Very high	93.6	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-60.9	-44	175.7	170.4	0	0	0	0	111.1	L796 W832 V844 E850 I851 Q852	L796-V848 HydrophobicContact CD1-CG2 4Å; L796-V848 HydrophobicContact CD2-CG2 4.37Å; W832-V848 HydrophobicContact CB-CG2 3.95Å; W832-V848 WeakPolarHBondContact O-CG1 3.3Å; V844-V848 HydrophobicContact CG1-CG2 3.81Å; V844-V848 WeakPolarHBondContact O-CB 3.48Å; V844-V848 WeakPolarHBondContact O-CG2 3.34Å; V844-V848 PolarHBondContact O-N 3.01Å; V848-E850 VanDerWaalsContact C-N 3.3Å; V848-E850 PolarHBondContact O-N 3.43Å; V848-I851 PolarHBondContact O-N 3.41Å; V848-Q852 HydrophobicContact CG1-CG 4.19Å; V848-Q852 WeakPolarHBondContact O-CB 3.35Å; V848-Q852 VanDerWaalsContact O-CG 3.27Å; V848-Q852 WeakPolarHBondContact O-CG 3.32Å; V848-Q852 PolarHBondContact O-N 3.49Å
849	Q	96.4	Very high	93.9	Very high	109 Å²	109	56.3 Å²	56.3	51%	0.509	31%	0.305	S	S	.	.	H	α-helix	trans	-59.2	-42	177.3	-176.7	177.9	11.7	0	0	112	Q845 R847 A853	Q845-Q849 VanDerWaalsContact O-CB 3.27Å; Q845-Q849 WeakPolarHBondContact O-CB 3.49Å; Q845-Q849 PolarHBondContact O-N 3.33Å; R847-Q849 VanDerWaalsContact C-N 3.35Å; R847-Q849 PolarHBondContact O-N 3.17Å; Q849-A853 WeakPolarHBondContact O-CB 3.44Å; Q849-A853 PolarHBondContact O-N 2.97Å; Q849-A853 VanDerWaalsContact O-N 3.17Å
850	E	96.5	Very high	94.3	Very high	65 Å²	65	54.1 Å²	54.1	30%	0.304	29%	0.289	S	S	.	.	H	α-helix	trans	-70.4	-43.6	178.2	-169.9	178.7	168.4	0	0	112.1	L800 R804 K846 R847 V848 Q852 A853 L854	L800-E850 HydrophobicContact CD1-CB 4.08Å; L800-E850 HydrophobicContact CD1-CG 3.82Å; R804-E850 IonicContact CZ-OE1 3.64Å; R804-E850 IonicContact NE-OE1 3.87Å; R804-E850 PolarHBondContact NE-OE1 2.89Å; R804-E850 IonicContact NH2-OE1 2.56Å; R804-E850 PolarHBondContact NH2-OE1 3.44Å; R804-E850 IonicContact NH2-OE2 3.14Å; R804-E850 PolarHBondContact NH2-OE2 3.25Å; K846-E850 PolarHBondContact O-N 3.33Å; R847-E850 PolarHBondContact O-N 3.29Å; V848-E850 VanDerWaalsContact C-N 3.3Å; V848-E850 PolarHBondContact O-N 3.43Å; E850-Q852 PolarHBondContact O-N 3.49Å; E850-A853 PolarHBondContact O-N 3.5Å; E850-L854 HydrophobicContact CG-CD1 4.24Å; E850-L854 WeakPolarHBondContact O-CG 3.3Å; E850-L854 PolarHBondContact O-N 3.15Å
851	I	97.3	Very high	94.5	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-56.4	-50.9	175	-71.1	166	0	0	0	110.4	L796 A799 L800 A803 I833 R847 V848 A853 L854 V855 W860	L796-I851 HydrophobicContact CD1-CD1 3.76Å; A799-I851 HydrophobicContact CB-CD1 4.08Å; L800-I851 HydrophobicContact CB-CD1 4.07Å; L800-I851 HydrophobicContact CB-CG1 4Å; L800-I851 HydrophobicContact CD1-CG1 3.89Å; A803-I851 HydrophobicContact CB-CG1 4.39Å; A803-I851 HydrophobicContact CB-CG2 4.46Å; I833-I851 HydrophobicContact CD1-CD1 3.99Å; I833-I851 HydrophobicContact CD1-CG2 4.33Å; I833-I851 HydrophobicContact CG1-CD1 3.99Å; I833-I851 HydrophobicContact CG1-CG2 4.21Å; I833-I851 HydrophobicContact CG2-CG2 3.83Å; R847-I851 VanDerWaalsContact O-CG1 3.29Å; R847-I851 WeakPolarHBondContact O-CG1 3.29Å; R847-I851 PolarHBondContact O-N 3.25Å; V848-I851 PolarHBondContact O-N 3.41Å; I851-A853 PolarHBondContact O-N 2.94Å; I851-L854 PolarHBondContact O-N 3.21Å; I851-V855 PolarHBondContact O-N 3.03Å; I851-V855 VanDerWaalsContact O-O 3.07Å; I851-W860 HydrophobicContact CG2-CH2 4.45Å; I851-W860 HydrophobicContact CG2-CZ2 3.49Å; I851-W860 VanDerWaalsContact CG2-CZ2 3.49Å
852	Q	97.2	Very high	94.5	Very high	58 Å²	58	53 Å²	53	27%	0.271	29%	0.285	S	S	.	.	H	α-helix	trans	-63.1	-26.7	-179.6	-73	172.3	-18.9	0	0	113.1	I833 S835 V848 E850	I833-Q852 PolarHBondContact O-NE2 3.41Å; S835-Q852 PolarHBondContact O-NE2 2.71Å; V848-Q852 HydrophobicContact CG1-CG 4.19Å; V848-Q852 WeakPolarHBondContact O-CB 3.35Å; V848-Q852 VanDerWaalsContact O-CG 3.27Å; V848-Q852 WeakPolarHBondContact O-CG 3.32Å; V848-Q852 PolarHBondContact O-N 3.49Å; E850-Q852 PolarHBondContact O-N 3.49Å
853	A	96	Very high	94.6	Very high	87 Å²	87	49 Å²	49	72%	0.719	26%	0.258	S	S	*	.	H	α-helix	trans	-77.9	-24.5	175.5	0	0	0	0	0	113	Q849 E850 I851	Q849-A853 WeakPolarHBondContact O-CB 3.44Å; Q849-A853 PolarHBondContact O-N 2.97Å; Q849-A853 VanDerWaalsContact O-N 3.17Å; E850-A853 PolarHBondContact O-N 3.5Å; I851-A853 PolarHBondContact O-N 2.94Å
854	L	95.1	Very high	94.5	Very high	64 Å²	64	48.1 Å²	48.1	34%	0.335	26%	0.261	S	S	.	.	H	α-helix	trans	-94.7	-40	-179.2	-66.9	171.6	0	0	0	112.6	A803 R804 C807 E850 I851	A803-L854 HydrophobicContact CB-CB 4.18Å; A803-L854 HydrophobicContact CB-CD1 4.15Å; R804-L854 HydrophobicContact CB-CD1 4.47Å; R804-L854 HydrophobicContact CG-CD1 3.54Å; C807-L854 HydrophobicContact CB-CD2 4.48Å; E850-L854 HydrophobicContact CG-CD1 4.24Å; E850-L854 WeakPolarHBondContact O-CG 3.3Å; E850-L854 PolarHBondContact O-N 3.15Å; I851-L854 PolarHBondContact O-N 3.21Å
855	V	95.7	Very high	94.2	Very high	8 Å²	8	49.6 Å²	49.6	5%	0.048	28%	0.276	C	S	.	.	S	Bend	trans	-139.5	126.1	-178.1	-178	0	0	0	0	108.6	A803 V806 I851 S857 N859	A803-V855 HydrophobicContact CB-CG2 4.12Å; V806-V855 HydrophobicContact CG1-CG2 3.79Å; I851-V855 PolarHBondContact O-N 3.03Å; I851-V855 VanDerWaalsContact O-O 3.07Å; V855-S857 PolarHBondContact O-N 3.34Å; V855-N859 HydrophobicContact CG1-CB 3.86Å
856	D	94.9	Very high	93.9	Very high	95 Å²	95	56 Å²	56	51%	0.508	30%	0.303	S	S	.	.			trans	-54.8	135.3	175.6	-166.8	-37.3	0	0	0	110.5	A858 N859	D856-A858 PolarHBondContact O-N 2.89Å; D856-A858 PolarHBondContact OD1-N 3Å; D856-N859 WeakPolarHBondContact O-CB 3.26Å; D856-N859 PolarHBondContact O-N 3.43Å
857	S	92.1	Very high	93.8	Very high	39 Å²	39	52.2 Å²	52.2	27%	0.273	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-48.3	-28.6	171.5	56	0	0	0	0	114.8	V855 N859 W860	V855-S857 PolarHBondContact O-N 3.34Å; S857-N859 VanDerWaalsContact C-N 3.26Å; S857-N859 PolarHBondContact O-N 3.02Å; S857-W860 PolarHBondContact O-N 3.38Å
858	A	91.6	Very high	93.7	Very high	65 Å²	65	48.4 Å²	48.4	54%	0.537	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-69.1	-21	176.1	0	0	0	0	0	113.7	D856 W860	D856-A858 PolarHBondContact O-N 2.89Å; D856-A858 PolarHBondContact OD1-N 3Å; A858-W860 VanDerWaalsContact C-N 3.34Å
859	N	95.1	Very high	93.7	Very high	51 Å²	51	48.4 Å²	48.4	27%	0.273	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-94.2	12.9	-179.9	-67.6	-24.6	0	0	0	113.2	V820 C822 V855 D856 S857 Y861	V820-N859 WeakPolarHBondContact O-CB 3.49Å; C822-N859 PolarHBondContact N-O 3.25Å; V855-N859 HydrophobicContact CG1-CB 3.86Å; D856-N859 WeakPolarHBondContact O-CB 3.26Å; D856-N859 PolarHBondContact O-N 3.43Å; S857-N859 VanDerWaalsContact C-N 3.26Å; S857-N859 PolarHBondContact O-N 3.02Å; N859-Y861 VanDerWaalsContact C-CE2 3.48Å; N859-Y861 WeakPolarHBondContact O-CD2 3.48Å; N859-Y861 VanDerWaalsContact O-CE2 3.32Å; N859-Y861 WeakPolarHBondContact O-CE2 3.22Å
860	W	95.6	Very high	93.7	Very high	1 Å²	1	43.2 Å²	43.2	0%	0.004	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	125.7	175.8	-75.4	83.7	0	0	0	110.7	A799 A802 A803 C822 L830 I833 R834 I851 S857 A858	A799-W860 HydrophobicContact CB-CH2 3.66Å; A799-W860 HydrophobicContact CB-CZ3 3.63Å; A799-W860 VanDerWaalsContact O-CH2 3.23Å; A799-W860 WeakPolarHBondContact O-CH2 3.32Å; A802-W860 HydrophobicContact CB-CH2 4.29Å; A803-W860 HydrophobicContact CB-CZ2 4.01Å; C822-W860 HydrophobicContact CB-CD2 3.69Å; C822-W860 HydrophobicContact CB-CE3 3.64Å; C822-W860 HydrophobicContact CB-CG 4.36Å; C822-W860 HydrophobicContact CB-CH2 3.69Å; C822-W860 HydrophobicContact CB-CZ2 3.78Å; C822-W860 HydrophobicContact CB-CZ3 3.65Å; C822-W860 CarbonylContact O-C 3.58Å; C822-W860 WeakPolarHBondContact O-CA 3.43Å; L830-W860 HydrophobicContact CD2-CB 3.9Å; L830-W860 HydrophobicContact CD2-CE3 4Å; I833-W860 HydrophobicContact CD1-CD2 4.15Å; I833-W860 HydrophobicContact CD1-CE3 3.98Å; I833-W860 HydrophobicContact CD1-CZ3 4.16Å; I833-W860 HydrophobicContact CG2-CD2 4.08Å; I833-W860 HydrophobicContact CG2-CG 3.84Å; R834-W860 PolarHBondContact NH2-O 2.66Å; I851-W860 HydrophobicContact CG2-CH2 4.45Å; I851-W860 HydrophobicContact CG2-CZ2 3.49Å; I851-W860 VanDerWaalsContact CG2-CZ2 3.49Å; S857-W860 PolarHBondContact O-N 3.38Å; A858-W860 VanDerWaalsContact C-N 3.34Å
861	Y	94.2	Very high	93.6	Very high	40 Å²	40	41.9 Å²	41.9	16%	0.157	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	155.7	-174.3	-55.1	-89.1	0	0	0	111.4	R819 A821 C822 W823 S824 N859	R819-Y861 PolarHBondContact NH2-OH 2.9Å; A821-Y861 HydrophobicContact CB-CD2 3.99Å; A821-Y861 HydrophobicContact CB-CE2 3.7Å; C822-Y861 PolarHBondContact O-N 3.02Å; W823-Y861 WeakPolarHBondContact CA-O 3.46Å; W823-Y861 VanDerWaalsContact CE3-CB 3.47Å; W823-Y861 HydrophobicContact CE3-CG 4.45Å; W823-Y861 HydrophobicContact CH2-CG 4.13Å; W823-Y861 HydrophobicContact CZ2-CD2 4.24Å; W823-Y861 HydrophobicContact CZ2-CG 4.27Å; W823-Y861 VanDerWaalsContact CZ3-CB 3.48Å; W823-Y861 HydrophobicContact CZ3-CG 4.22Å; S824-Y861 PolarHBondContact N-O 3.48Å; S824-Y861 VanDerWaalsContact N-O 3.14Å; N859-Y861 VanDerWaalsContact C-CE2 3.48Å; N859-Y861 WeakPolarHBondContact O-CD2 3.48Å; N859-Y861 VanDerWaalsContact O-CE2 3.32Å; N859-Y861 WeakPolarHBondContact O-CE2 3.22Å
862	H	93.5	Very high	93.5	Very high	45 Å²	45	43.3 Å²	43.3	21%	0.208	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	133	173.8	174	-92.1	0	0	0	111	S824 L830	S824-H862 WeakPolarHBondContact O-CA 3.31Å; L830-H862 HydrophobicContact CD1-CB 3.66Å
863	C	91.6	Very high	93.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.24	C	C	.	.			trans	-118.2	155.1	162.9	60.7	0	0	0	0	109.7	W823 S824 D825	W823-C863 HydrophobicContact CE3-CB 4.1Å; S824-C863 PolarHBondContact O-N 3.16Å; D825-C863 WeakPolarHBondContact CA-O 3.45Å; D825-C863 VanDerWaalsContact CB-O 3.29Å; D825-C863 WeakPolarHBondContact CB-O 3.47Å
864	A	90.1	Very high	93.1	Very high	32 Å²	32	36.4 Å²	36.4	26%	0.264	21%	0.206	S	C	.	.			trans	-70.3	148	171.6	0	0	0	0	0	109.6	K866 D867 N868	A864-K866 HydrophobicContact CB-CG 3.91Å; A864-K866 PolarHBondContact O-N 3.26Å; A864-K866 VanDerWaalsContact O-N 3.14Å; A864-D867 CarbonylContact O-C 3.58Å; A864-D867 VanDerWaalsContact O-C 3.3Å; A864-D867 VanDerWaalsContact O-CA 3.3Å; A864-D867 WeakPolarHBondContact O-CA 3.35Å; A864-D867 WeakPolarHBondContact O-CB 3.16Å; A864-D867 PolarHBondContact O-N 3.43Å; A864-N868 PolarHBondContact O-N 2.96Å; A864-N868 VanDerWaalsContact O-N 3.16Å
865	G	87.4	Confident	92.9	Very high	31 Å²	31	41.4 Å²	41.4	32%	0.32	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-57.9	-31.4	-179.5	0	0	0	0	0	113.9	D825 D867 N868	D825-G865 VanDerWaalsContact OD2-CA 3.31Å; D825-G865 WeakPolarHBondContact OD2-CA 3.06Å; G865-D867 PolarHBondContact O-N 2.67Å; G865-N868 WeakPolarHBondContact O-CB 3.32Å; G865-N868 PolarHBondContact O-N 3.14Å
866	K	87	Confident	92.8	Very high	175 Å²	175	42 Å²	42	76%	0.761	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-64.9	-22.8	172	58.8	175.5	-177.7	173.9	0	113.9	A864 Y887	A864-K866 HydrophobicContact CB-CG 3.91Å; A864-K866 PolarHBondContact O-N 3.26Å; A864-K866 VanDerWaalsContact O-N 3.14Å; K866-Y887 PolarHBondContact O-OH 3.32Å
867	D	89.7	Confident	92.7	Very high	50 Å²	50	38.3 Å²	38.3	27%	0.267	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-107.2	15.6	178.5	-55.7	-52.3	0	0	0	111.6	A864 G865 P869 Y887	A864-D867 CarbonylContact O-C 3.58Å; A864-D867 VanDerWaalsContact O-C 3.3Å; A864-D867 VanDerWaalsContact O-CA 3.3Å; A864-D867 WeakPolarHBondContact O-CA 3.35Å; A864-D867 WeakPolarHBondContact O-CB 3.16Å; A864-D867 PolarHBondContact O-N 3.43Å; G865-D867 PolarHBondContact O-N 2.67Å; D867-P869 WeakPolarHBondContact O-CD 3.33Å; D867-Y887 VanDerWaalsContact CA-OH 3.24Å; D867-Y887 WeakPolarHBondContact CA-OH 3.46Å; D867-Y887 PolarHBondContact O-OH 3.19Å
868	N	95	Very high	92.9	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	21%	0.205	C	C	.	.			trans	-100.3	104.7	173	-169	-2.2	0	0	0	112.1	A750 D751 A864 G865 A870 D871 Y887	A750-N868 PolarHBondContact O-ND2 2.86Å; D751-N868 WeakPolarHBondContact CB-ND2 3.45Å; D751-N868 PolarHBondContact OD1-ND2 2.91Å; A864-N868 PolarHBondContact O-N 2.96Å; A864-N868 VanDerWaalsContact O-N 3.16Å; G865-N868 WeakPolarHBondContact O-CB 3.32Å; G865-N868 PolarHBondContact O-N 3.14Å; N868-A870 PolarHBondContact O-N 3.42Å; N868-A870 WeakPolarHBondContact OD1-CB 2.76Å; N868-A870 PolarHBondContact OD1-N 2.83Å; N868-D871 WeakPolarHBondContact O-CB 3.45Å; N868-D871 PolarHBondContact O-N 3.49Å; N868-Y887 WeakPolarHBondContact CA-OH 2.97Å; N868-Y887 PolarHBondContact N-OH 3.5Å; N868-Y887 PolarHBondContact O-OH 3.18Å
869	P	96.1	Very high	92.9	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-19.5	-179.5	27.4	-35.7	0	0	0	113.2	F749 V760 Y762 D867 D871 L872 Y887 P892	F749-P869 HydrophobicContact CB-CG 3.99Å; F749-P869 HydrophobicContact CD1-CG 4.01Å; F749-P869 HydrophobicContact CD2-CG 3.9Å; F749-P869 HydrophobicContact CE1-CG 4.47Å; F749-P869 HydrophobicContact CE2-CG 4.38Å; F749-P869 HydrophobicContact CG-CG 3.7Å; V760-P869 HydrophobicContact CG1-CG 4.23Å; Y762-P869 HydrophobicContact CE2-CB 4.24Å; Y762-P869 HydrophobicContact CE2-CG 3.69Å; Y762-P869 WeakPolarHBondContact OH-CB 3.26Å; D867-P869 WeakPolarHBondContact O-CD 3.33Å; P869-D871 PolarHBondContact O-N 3.29Å; P869-L872 PolarHBondContact O-N 2.99Å; P869-Y887 HydrophobicContact CB-CD1 4.4Å; P869-Y887 HydrophobicContact CB-CE1 3.93Å; P869-Y887 HydrophobicContact CB-CE2 4.31Å; P869-P892 HydrophobicContact CG-CG 4.39Å
870	A	96.3	Very high	92.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-11.6	174.5	0	0	0	0	0	113.2	F749 D751 V760 N868 L872 L873 S874	F749-A870 HydrophobicContact CB-CB 4.2Å; D751-A870 VanDerWaalsContact CB-C 3.48Å; D751-A870 HydrophobicContact CB-CB 3.51Å; V760-A870 HydrophobicContact CG1-CB 4.19Å; N868-A870 PolarHBondContact O-N 3.42Å; N868-A870 WeakPolarHBondContact OD1-CB 2.76Å; N868-A870 PolarHBondContact OD1-N 2.83Å; A870-L872 PolarHBondContact O-N 2.76Å; A870-L873 HydrophobicContact CB-CD2 4.18Å; A870-L873 HydrophobicContact CB-CG 4.39Å; A870-L873 VanDerWaalsContact O-CG 3.31Å; A870-L873 WeakPolarHBondContact O-CG 2.93Å; A870-L873 PolarHBondContact O-N 3.32Å; A870-S874 PolarHBondContact O-N 2.61Å; A870-S874 VanDerWaalsContact O-N 3.13Å
871	D	94.3	Very high	92.6	Very high	38 Å²	38	42.5 Å²	42.5	20%	0.203	22%	0.216	C	C	.	.	H	α-helix	trans	-60.1	-34.2	171.6	-171.6	77.7	0	0	0	111.7	D751 N868 P869 L873 S874 R875	D751-D871 WeakPolarHBondContact OD2-CA 3.31Å; N868-D871 WeakPolarHBondContact O-CB 3.45Å; N868-D871 PolarHBondContact O-N 3.49Å; P869-D871 PolarHBondContact O-N 3.29Å; D871-L873 VanDerWaalsContact C-N 3.34Å; D871-L873 PolarHBondContact O-N 3.39Å; D871-S874 PolarHBondContact O-N 2.9Å; D871-S874 PolarHBondContact O-OG 2.91Å; D871-R875 VanDerWaalsContact CG-NE 3.3Å; D871-R875 WeakPolarHBondContact O-CB 3.32Å; D871-R875 WeakPolarHBondContact O-CG 3.25Å; D871-R875 PolarHBondContact O-N 3.16Å; D871-R875 IonicContact OD1-CZ 2.9Å; D871-R875 IonicContact OD1-NE 3.09Å; D871-R875 PolarHBondContact OD1-NE 3.05Å; D871-R875 IonicContact OD1-NH2 3.67Å; D871-R875 PolarHBondContact OD1-NH2 3.24Å; D871-R875 VanDerWaalsContact OD2-CD 3.32Å; D871-R875 WeakPolarHBondContact OD2-CD 3.25Å; D871-R875 IonicContact OD2-CZ 3.51Å; D871-R875 IonicContact OD2-NE 3.74Å; D871-R875 PolarHBondContact OD2-NE 3.44Å; D871-R875 IonicContact OD2-NH2 2.76Å
872	L	94.1	Very high	92.6	Very high	29 Å²	29	40.6 Å²	40.6	15%	0.152	21%	0.209	C	C	.	.	H	α-helix	trans	-62.8	-38.9	177.5	-70.2	168.7	0	0	0	112.3	P683 P869 A870 G876 N885 Y887 W888	P683-L872 WeakPolarHBondContact CB-O 3.07Å; P683-L872 HydrophobicContact CG-CB 4.4Å; P869-L872 PolarHBondContact O-N 2.99Å; A870-L872 PolarHBondContact O-N 2.76Å; L872-G876 WeakPolarHBondContact O-CA 3.42Å; L872-G876 PolarHBondContact O-N 3.5Å; L872-N885 WeakPolarHBondContact CD1-ND2 3.19Å; L872-Y887 HydrophobicContact CD1-CD1 4.12Å; L872-W888 HydrophobicContact CB-CE3 3.98Å; L872-W888 HydrophobicContact CB-CZ3 4.34Å; L872-W888 HydrophobicContact CD1-CB 3.77Å; L872-W888 HydrophobicContact CD1-CD2 4.46Å; L872-W888 HydrophobicContact CD1-CE3 4.02Å; L872-W888 HydrophobicContact CD1-CG 4.41Å
873	L	93.1	Very high	92.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-80.8	-26.3	179.1	73.7	82.3	0	0	0	112.7	P683 G758 A759 V760 A779 A870 D871 W888	P683-L873 HydrophobicContact CG-CB 4.08Å; G758-L873 VanDerWaalsContact CA-CD1 3.46Å; A759-L873 WeakPolarHBondContact O-CD2 3.24Å; V760-L873 HydrophobicContact CB-CD2 4.13Å; V760-L873 HydrophobicContact CG1-CD2 4.47Å; A779-L873 HydrophobicContact CB-CD2 4.29Å; A870-L873 HydrophobicContact CB-CD2 4.18Å; A870-L873 HydrophobicContact CB-CG 4.39Å; A870-L873 VanDerWaalsContact O-CG 3.31Å; A870-L873 WeakPolarHBondContact O-CG 2.93Å; A870-L873 PolarHBondContact O-N 3.32Å; D871-L873 VanDerWaalsContact C-N 3.34Å; D871-L873 PolarHBondContact O-N 3.39Å; L873-W888 HydrophobicContact CB-CH2 3.88Å; L873-W888 HydrophobicContact CB-CZ3 4.07Å; L873-W888 HydrophobicContact CD2-CH2 3.82Å; L873-W888 HydrophobicContact CD2-CZ3 4.02Å; L873-W888 HydrophobicContact CG-CH2 4.41Å; L873-W888 HydrophobicContact CG-CZ3 4.45Å
874	S	91.8	Very high	92.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-81	-27	179.1	83.3	0	0	0	0	112.3	D751 S753 A756 A870 D871	D751-S874 WeakPolarHBondContact OD2-CB 3.46Å; D751-S874 PolarHBondContact OD2-OG 2.93Å; S753-S874 WeakPolarHBondContact CB-O 3.5Å; S753-S874 PolarHBondContact OG-O 2.52Å; A756-S874 WeakPolarHBondContact CB-O 3.27Å; A870-S874 PolarHBondContact O-N 2.61Å; A870-S874 VanDerWaalsContact O-N 3.13Å; D871-S874 PolarHBondContact O-N 2.9Å; D871-S874 PolarHBondContact O-OG 2.91Å
875	R	91.2	Very high	92.4	Very high	170 Å²	170	47.9 Å²	47.9	64%	0.642	25%	0.247	S	C	*	.	H	α-helix	trans	-101.2	-32.1	178.1	-59.8	-169.5	-171.5	-165.5	10.7	113.5	D871	D871-R875 VanDerWaalsContact CG-NE 3.3Å; D871-R875 WeakPolarHBondContact O-CB 3.32Å; D871-R875 WeakPolarHBondContact O-CG 3.25Å; D871-R875 PolarHBondContact O-N 3.16Å; D871-R875 IonicContact OD1-CZ 2.9Å; D871-R875 IonicContact OD1-NE 3.09Å; D871-R875 PolarHBondContact OD1-NE 3.05Å; D871-R875 IonicContact OD1-NH2 3.67Å; D871-R875 PolarHBondContact OD1-NH2 3.24Å; D871-R875 VanDerWaalsContact OD2-CD 3.32Å; D871-R875 WeakPolarHBondContact OD2-CD 3.25Å; D871-R875 IonicContact OD2-CZ 3.51Å; D871-R875 IonicContact OD2-NE 3.74Å; D871-R875 PolarHBondContact OD2-NE 3.44Å; D871-R875 IonicContact OD2-NH2 2.76Å
876	G	93.4	Very high	92.7	Very high	21 Å²	21	50.2 Å²	50.2	22%	0.216	26%	0.259	C	S	.	.			trans	83.6	151	-177.8	0	0	0	0	0	114.1	P683 L872	P683-G876 CarbonylContact O-C 3.48Å; P683-G876 WeakPolarHBondContact O-CA 3.31Å; L872-G876 WeakPolarHBondContact O-CA 3.42Å; L872-G876 PolarHBondContact O-N 3.5Å
877	T	94.5	Very high	92.9	Very high	16 Å²	16	44.7 Å²	44.7	10%	0.098	23%	0.234	C	C	.	.			trans	-139.1	170.8	-180	-166.3	0	0	0	0	112.8	P683 R687 N881 L882	P683-T877 HydrophobicContact CB-CG2 3.7Å; P683-T877 PolarHBondContact O-N 3.39Å; R687-T877 WeakPolarHBondContact CD-O 3.21Å; R687-T877 PolarHBondContact NH1-O 3.17Å; T877-N881 WeakPolarHBondContact OG1-CB 3.45Å; T877-L882 HydrophobicContact CG2-CB 3.97Å; T877-L882 HydrophobicContact CG2-CD1 3.78Å; T877-L882 HydrophobicContact CG2-CG 4.41Å
878	T	94.4	Very high	93.2	Very high	31 Å²	31	42.3 Å²	42.3	19%	0.19	22%	0.221	C	C	.	.			trans	-81.6	157.9	173.9	59.7	0	0	0	0	111	D720 E880 N881 L882	D720-T878 WeakPolarHBondContact OD2-CB 2.95Å; T878-E880 VanDerWaalsContact C-N 3.29Å; T878-E880 PolarHBondContact O-N 3.11Å; T878-N881 PolarHBondContact O-N 2.99Å; T878-N881 WeakPolarHBondContact OG1-CB 3.25Å; T878-N881 VanDerWaalsContact OG1-CG 3.28Å; T878-N881 PolarHBondContact OG1-N 3.44Å; T878-N881 PolarHBondContact OG1-ND2 3.23Å; T878-L882 VanDerWaalsContact O-CB 3.27Å; T878-L882 WeakPolarHBondContact O-CB 3.1Å; T878-L882 PolarHBondContact O-N 2.67Å
879	I	93.2	Very high	93.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.9	-39	175.2	-67.1	-61.3	0	0	0	111.4	L681 F684 D720 M723 L724 L727 N881 L882 K883	L681-I879 HydrophobicContact CD2-CD1 3.95Å; F684-I879 HydrophobicContact CB-CD1 3.61Å; F684-I879 HydrophobicContact CB-CG1 4.4Å; F684-I879 HydrophobicContact CD1-CD1 3.61Å; F684-I879 HydrophobicContact CD1-CG1 4.03Å; F684-I879 HydrophobicContact CD2-CD1 3.79Å; F684-I879 HydrophobicContact CD2-CG1 3.61Å; F684-I879 HydrophobicContact CE1-CD1 4.19Å; F684-I879 HydrophobicContact CE1-CG1 4.17Å; F684-I879 HydrophobicContact CE2-CD1 4.36Å; F684-I879 HydrophobicContact CE2-CG1 3.79Å; F684-I879 HydrophobicContact CG-CD1 3.36Å; F684-I879 HydrophobicContact CG-CG1 3.74Å; F684-I879 HydrophobicContact CZ-CG1 4.04Å; D720-I879 HydrophobicContact CB-CB 4.25Å; D720-I879 HydrophobicContact CB-CG1 4.08Å; M723-I879 HydrophobicContact CB-CB 4.35Å; M723-I879 HydrophobicContact CB-CG2 3.62Å; M723-I879 HydrophobicContact CE-CB 4.14Å; L724-I879 HydrophobicContact CD2-CD1 3.55Å; L724-I879 HydrophobicContact CD2-CG1 3.96Å; L727-I879 HydrophobicContact CD1-CD1 4.47Å; L727-I879 HydrophobicContact CD1-CG2 4.19Å; I879-N881 PolarHBondContact O-N 3.28Å; I879-L882 HydrophobicContact CD1-CD2 4.37Å; I879-L882 PolarHBondContact O-N 2.83Å; I879-K883 WeakPolarHBondContact O-CB 3.37Å; I879-K883 PolarHBondContact O-N 3.43Å
880	E	91.1	Very high	93.1	Very high	127 Å²	127	47.1 Å²	47.1	59%	0.593	24%	0.242	S	C	*	.	H	α-helix	trans	-56.4	-50.4	176.4	-176.5	176.1	-158.8	0	0	111.6	M723 T878 S884	M723-E880 HydrophobicContact CE-CB 3.95Å; M723-E880 HydrophobicContact SD-CB 3.98Å; T878-E880 VanDerWaalsContact C-N 3.29Å; T878-E880 PolarHBondContact O-N 3.11Å; E880-S884 PolarHBondContact O-OG 3.07Å
881	N	93	Very high	93.1	Very high	86 Å²	86	47.4 Å²	47.4	46%	0.46	25%	0.245	S	C	.	.	H	α-helix	trans	-67.7	-38.2	176.8	-72	-7.6	0	0	0	111.6	T877 T878 I879 K883 S884 N885	T877-N881 WeakPolarHBondContact OG1-CB 3.45Å; T878-N881 PolarHBondContact O-N 2.99Å; T878-N881 WeakPolarHBondContact OG1-CB 3.25Å; T878-N881 VanDerWaalsContact OG1-CG 3.28Å; T878-N881 PolarHBondContact OG1-N 3.44Å; T878-N881 PolarHBondContact OG1-ND2 3.23Å; I879-N881 PolarHBondContact O-N 3.28Å; N881-K883 VanDerWaalsContact C-N 3.35Å; N881-S884 PolarHBondContact O-OG 2.96Å; N881-N885 WeakPolarHBondContact O-CB 3.47Å; N881-N885 PolarHBondContact O-N 3.04Å
882	L	93.8	Very high	93	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.5	-40.4	-179.9	-167.6	67.1	0	0	0	111.5	L681 P683 L727 T877 T878 I879 S884 N885 W888 W889	L681-L882 HydrophobicContact CD2-CD2 4.22Å; P683-L882 HydrophobicContact CB-CD1 4.16Å; P683-L882 HydrophobicContact CG-CD1 4.01Å; L727-L882 HydrophobicContact CD1-CD2 4.17Å; L727-L882 HydrophobicContact CD1-CG 4.41Å; T877-L882 HydrophobicContact CG2-CB 3.97Å; T877-L882 HydrophobicContact CG2-CD1 3.78Å; T877-L882 HydrophobicContact CG2-CG 4.41Å; T878-L882 VanDerWaalsContact O-CB 3.27Å; T878-L882 WeakPolarHBondContact O-CB 3.1Å; T878-L882 PolarHBondContact O-N 2.67Å; I879-L882 HydrophobicContact CD1-CD2 4.37Å; I879-L882 PolarHBondContact O-N 2.83Å; L882-S884 VanDerWaalsContact C-N 3.33Å; L882-S884 PolarHBondContact O-N 3.45Å; L882-N885 PolarHBondContact O-N 2.9Å; L882-W888 HydrophobicContact CD1-CB 4.27Å; L882-W888 HydrophobicContact CD1-CD2 4.21Å; L882-W888 HydrophobicContact CD1-CG 3.69Å; L882-W889 HydrophobicContact CD2-CZ2 4.34Å; L882-W889 HydrophobicContact CG-CZ2 3.97Å; L882-W889 PolarHBondContact O-NE1 2.78Å
883	K	89.5	Confident	93	Very high	99 Å²	99	48.2 Å²	48.2	43%	0.43	26%	0.261	S	S	.	.	H	α-helix	trans	-60.9	-38.7	-178.6	-175.2	-176.7	177.8	-172.5	0	112.5	Q726 L727 I879 N881	Q726-K883 VanDerWaalsContact O-CE 3.27Å; Q726-K883 WeakPolarHBondContact O-CE 3.31Å; Q726-K883 VanDerWaalsContact OE1-NZ 3.07Å; L727-K883 HydrophobicContact CD1-CB 4.43Å; I879-K883 WeakPolarHBondContact O-CB 3.37Å; I879-K883 PolarHBondContact O-N 3.43Å; N881-K883 VanDerWaalsContact C-N 3.35Å
884	S	89.6	Confident	93	Very high	96 Å²	96	49.9 Å²	49.9	67%	0.671	27%	0.267	S	S	*	.	H	α-helix	trans	-92.7	-0.7	-179.4	56.3	0	0	0	0	114.1	E880 N881 L882 S886	E880-S884 PolarHBondContact O-OG 3.07Å; N881-S884 PolarHBondContact O-OG 2.96Å; L882-S884 VanDerWaalsContact C-N 3.33Å; L882-S884 PolarHBondContact O-N 3.45Å; S884-S886 PolarHBondContact O-N 2.86Å
885	N	93	Very high	93.1	Very high	35 Å²	35	49.9 Å²	49.9	19%	0.187	27%	0.267	C	S	.	.			trans	-89.2	87.9	-172.9	-169.5	-37.7	0	0	0	112.4	L872 N881 L882 Y887 W888 W889	L872-N885 WeakPolarHBondContact CD1-ND2 3.19Å; N881-N885 WeakPolarHBondContact O-CB 3.47Å; N881-N885 PolarHBondContact O-N 3.04Å; L882-N885 PolarHBondContact O-N 2.9Å; N885-Y887 PolarHBondContact O-N 2.75Å; N885-Y887 VanDerWaalsContact O-N 3.17Å; N885-Y887 WeakPolarHBondContact OD1-CA 3.26Å; N885-Y887 VanDerWaalsContact OD1-CB 3.24Å; N885-Y887 WeakPolarHBondContact OD1-CB 3.34Å; N885-Y887 PolarHBondContact OD1-N 2.65Å; N885-Y887 VanDerWaalsContact OD1-N 3.1Å; N885-W888 HydrophobicContact CB-CB 4.35Å; N885-W888 PolarHBondContact O-N 3.17Å; N885-W888 PolarHBondContact OD1-N 3.11Å; N885-W889 PolarHBondContact O-N 2.92Å
886	S	92	Very high	93.1	Very high	81 Å²	81	45.5 Å²	45.5	57%	0.566	25%	0.253	S	S	*	.	H	α-helix	trans	-57.3	-28.3	175.6	61	0	0	0	0	113.5	S884 W889 H890	S884-S886 PolarHBondContact O-N 2.86Å; S886-W889 PolarHBondContact O-N 3.05Å; S886-H890 WeakPolarHBondContact O-CB 3.31Å; S886-H890 PolarHBondContact O-N 3.23Å
887	Y	92.1	Very high	93	Very high	59 Å²	59	49.2 Å²	49.2	23%	0.231	27%	0.266	C	S	.	.	H	α-helix	trans	-69	-33.9	179.6	172.7	-112.1	0	0	0	113.1	K866 D867 N868 P869 L872 N885 G891 P892	K866-Y887 PolarHBondContact O-OH 3.32Å; D867-Y887 VanDerWaalsContact CA-OH 3.24Å; D867-Y887 WeakPolarHBondContact CA-OH 3.46Å; D867-Y887 PolarHBondContact O-OH 3.19Å; N868-Y887 WeakPolarHBondContact CA-OH 2.97Å; N868-Y887 PolarHBondContact N-OH 3.5Å; N868-Y887 PolarHBondContact O-OH 3.18Å; P869-Y887 HydrophobicContact CB-CD1 4.4Å; P869-Y887 HydrophobicContact CB-CE1 3.93Å; P869-Y887 HydrophobicContact CB-CE2 4.31Å; L872-Y887 HydrophobicContact CD1-CD1 4.12Å; N885-Y887 PolarHBondContact O-N 2.75Å; N885-Y887 VanDerWaalsContact O-N 3.17Å; N885-Y887 WeakPolarHBondContact OD1-CA 3.26Å; N885-Y887 VanDerWaalsContact OD1-CB 3.24Å; N885-Y887 WeakPolarHBondContact OD1-CB 3.34Å; N885-Y887 PolarHBondContact OD1-N 2.65Å; N885-Y887 VanDerWaalsContact OD1-N 3.1Å; Y887-G891 CarbonylContact O-C 3.45Å; Y887-G891 WeakPolarHBondContact O-CA 3.22Å; Y887-G891 PolarHBondContact O-N 3.45Å; Y887-G891 VanDerWaalsContact O-N 3.13Å; Y887-P892 HydrophobicContact CE2-CB 4.07Å; Y887-P892 HydrophobicContact CE2-CG 3.92Å
888	W	95.8	Very high	92.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-69.9	-42.4	171.3	178.1	-109.1	0	0	0	112.1	F680 P683 V760 Y762 M776 A779 L872 L873 L882 N885	F680-W888 PolarHBondContact O-NE1 3.05Å; P683-W888 HydrophobicContact CG-CD2 3.94Å; P683-W888 HydrophobicContact CG-CE3 4.03Å; P683-W888 HydrophobicContact CG-CH2 3.51Å; P683-W888 HydrophobicContact CG-CZ2 3.38Å; P683-W888 HydrophobicContact CG-CZ3 3.83Å; V760-W888 HydrophobicContact CB-CH2 4.2Å; V760-W888 HydrophobicContact CB-CZ3 4.23Å; V760-W888 HydrophobicContact CG1-CZ3 4.33Å; V760-W888 HydrophobicContact CG2-CH2 4.25Å; V760-W888 HydrophobicContact CG2-CZ3 4.38Å; Y762-W888 VanDerWaalsContact CE1-O 3.22Å; Y762-W888 WeakPolarHBondContact CE1-O 3.5Å; Y762-W888 PolarHBondContact OH-O 3.23Å; M776-W888 HydrophobicContact CE-CH2 4.33Å; M776-W888 HydrophobicContact CE-CZ2 3.61Å; M776-W888 HydrophobicContact SD-CD2 4.33Å; M776-W888 VanDerWaalsContact SD-CE2 3.53Å; M776-W888 HydrophobicContact SD-CH2 4.47Å; M776-W888 HydrophobicContact SD-CZ2 3.63Å; M776-W888 PolarHBondContact SD-NE1 3.22Å; A779-W888 HydrophobicContact CB-CH2 3.82Å; A779-W888 HydrophobicContact CB-CZ2 4.06Å; L872-W888 HydrophobicContact CB-CE3 3.98Å; L872-W888 HydrophobicContact CB-CZ3 4.34Å; L872-W888 HydrophobicContact CD1-CB 3.77Å; L872-W888 HydrophobicContact CD1-CD2 4.46Å; L872-W888 HydrophobicContact CD1-CE3 4.02Å; L872-W888 HydrophobicContact CD1-CG 4.41Å; L873-W888 HydrophobicContact CB-CH2 3.88Å; L873-W888 HydrophobicContact CB-CZ3 4.07Å; L873-W888 HydrophobicContact CD2-CH2 3.82Å; L873-W888 HydrophobicContact CD2-CZ3 4.02Å; L873-W888 HydrophobicContact CG-CH2 4.41Å; L873-W888 HydrophobicContact CG-CZ3 4.45Å; L882-W888 HydrophobicContact CD1-CB 4.27Å; L882-W888 HydrophobicContact CD1-CD2 4.21Å; L882-W888 HydrophobicContact CD1-CG 3.69Å; N885-W888 HydrophobicContact CB-CB 4.35Å; N885-W888 PolarHBondContact O-N 3.17Å; N885-W888 PolarHBondContact OD1-N 3.11Å
889	W	95.4	Very high	92.1	Very high	32 Å²	32	55.8 Å²	55.8	12%	0.121	30%	0.3	C	S	.	.	H	α-helix	trans	-80.8	-35.6	-173.5	-60.4	112.9	0	0	0	113.6	F680 L727 V729 M776 L882 N885 S886	F680-W889 HydrophobicContact CB-CH2 4.05Å; F680-W889 HydrophobicContact CB-CZ3 4.01Å; F680-W889 AromaticContact CD1-CZ3 3.94Å; F680-W889 HydrophobicContact CD1-CZ3 3.94Å; F680-W889 HydrophobicContact CG-CZ3 4.23Å; L727-W889 HydrophobicContact CD1-CZ2 4.11Å; L727-W889 HydrophobicContact CD2-CH2 3.76Å; L727-W889 HydrophobicContact CD2-CZ2 3.8Å; L727-W889 HydrophobicContact CG-CZ2 4.25Å; V729-W889 HydrophobicContact CG1-CZ3 4.19Å; V729-W889 HydrophobicContact CG2-CE3 4.35Å; V729-W889 HydrophobicContact CG2-CH2 3.68Å; V729-W889 HydrophobicContact CG2-CZ3 3.57Å; M776-W889 WeakPolarHBondContact CB-O 3.38Å; M776-W889 PolarHBondContact N-O 2.85Å; M776-W889 HydrophobicContact SD-CE3 4.38Å; M776-W889 HydrophobicContact SD-CZ3 4.32Å; L882-W889 HydrophobicContact CD2-CZ2 4.34Å; L882-W889 HydrophobicContact CG-CZ2 3.97Å; L882-W889 PolarHBondContact O-NE1 2.78Å; N885-W889 PolarHBondContact O-N 2.92Å; S886-W889 PolarHBondContact O-N 3.05Å
890	H	94.8	Very high	91.7	Very high	70 Å²	70	59.3 Å²	59.3	32%	0.324	34%	0.337	S	S	.	.	H	α-helix	trans	-117.6	7.4	-173.2	-53.8	-63.9	0	0	0	114.1	V774 D775 S886	V774-H890 WeakPolarHBondContact CB-O 3.36Å; V774-H890 WeakPolarHBondContact CG1-O 3.3Å; V774-H890 VanDerWaalsContact O-CA 3.25Å; V774-H890 WeakPolarHBondContact O-CA 3.43Å; V774-H890 WeakPolarHBondContact O-CB 3.48Å; V774-H890 PolarHBondContact O-ND1 3.18Å; D775-H890 IonicContact OD1-CE1 3.84Å; D775-H890 PolarHBondContact OD1-CE1 3.27Å; D775-H890 IonicContact OD1-CG 3.63Å; D775-H890 IonicContact OD1-ND1 2.64Å; D775-H890 PolarHBondContact OD1-ND1 3.28Å; S886-H890 WeakPolarHBondContact O-CB 3.31Å; S886-H890 PolarHBondContact O-N 3.23Å
891	G	94.5	Very high	91.5	Very high	6 Å²	6	56.5 Å²	56.5	6%	0.062	33%	0.331	C	S	.	.			trans	67.1	-170.2	-179.2	0	0	0	0	0	113.7	Y762 Y887	Y762-G891 VanDerWaalsContact CE1-N 3.25Å; Y887-G891 CarbonylContact O-C 3.45Å; Y887-G891 WeakPolarHBondContact O-CA 3.22Å; Y887-G891 PolarHBondContact O-N 3.45Å; Y887-G891 VanDerWaalsContact O-N 3.13Å
892	P	94	Very high	91.4	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.006	31%	0.313	C	S	.	.			trans	-64.6	139.7	177.6	-18.6	31.6	0	0	0	111.9	F749 P869 Y887 W894 L895	F749-P892 HydrophobicContact CE1-CG 4.06Å; F749-P892 HydrophobicContact CZ-CG 3.88Å; P869-P892 HydrophobicContact CG-CG 4.39Å; Y887-P892 HydrophobicContact CE2-CB 4.07Å; Y887-P892 HydrophobicContact CE2-CG 3.92Å; P892-W894 HydrophobicContact CB-CD2 3.92Å; P892-W894 HydrophobicContact CB-CG 4.16Å; P892-W894 HydrophobicContact CB-CZ2 3.69Å; P892-W894 HydrophobicContact CG-CH2 4.36Å; P892-W894 HydrophobicContact CG-CZ2 3.65Å; P892-W894 PolarHBondContact O-N 2.86Å; P892-W894 VanDerWaalsContact O-N 3.16Å; P892-L895 VanDerWaalsContact O-CB 3.22Å; P892-L895 WeakPolarHBondContact O-CB 3.39Å; P892-L895 PolarHBondContact O-N 3.15Å
893	A	92.2	Very high	91	Very high	82 Å²	82	55.2 Å²	55.2	68%	0.678	33%	0.325	S	S	*	.	H	α-helix	trans	-57.7	-35.4	-176.4	0	0	0	0	0	113.5	L895 K896	A893-L895 PolarHBondContact O-N 2.9Å; A893-K896 PolarHBondContact O-N 3.03Å
894	W	93.1	Very high	90.2	Very high	36 Å²	36	59 Å²	59	14%	0.136	34%	0.341	C	S	.	.	H	α-helix	trans	-63.4	-22.1	177	54.5	-105.4	0	0	0	113.1	F749 W823 P892 K896 M897 W902 P903	F749-W894 AromaticContact CE1-CH2 3.95Å; F749-W894 HydrophobicContact CE1-CH2 3.95Å; F749-W894 HydrophobicContact CE1-CZ2 4.09Å; F749-W894 AromaticContact CZ-CH2 3.81Å; F749-W894 HydrophobicContact CZ-CH2 3.81Å; F749-W894 HydrophobicContact CZ-CZ2 4.22Å; W823-W894 HydrophobicContact CD2-CH2 4.15Å; W823-W894 HydrophobicContact CE3-CH2 4.05Å; W823-W894 HydrophobicContact CH2-CH2 4.01Å; W823-W894 AromaticContact CH2-CZ3 3.97Å; W823-W894 HydrophobicContact CH2-CZ3 3.97Å; W823-W894 HydrophobicContact CZ2-CH2 4.12Å; W823-W894 HydrophobicContact CZ2-CZ3 4.04Å; W823-W894 AromaticContact CZ3-CH2 3.98Å; W823-W894 HydrophobicContact CZ3-CH2 3.98Å; W823-W894 HydrophobicContact CZ3-CZ3 4.36Å; P892-W894 HydrophobicContact CB-CD2 3.92Å; P892-W894 HydrophobicContact CB-CG 4.16Å; P892-W894 HydrophobicContact CB-CZ2 3.69Å; P892-W894 HydrophobicContact CG-CH2 4.36Å; P892-W894 HydrophobicContact CG-CZ2 3.65Å; P892-W894 PolarHBondContact O-N 2.86Å; P892-W894 VanDerWaalsContact O-N 3.16Å; W894-K896 VanDerWaalsContact C-N 3.3Å; W894-K896 PolarHBondContact O-N 3.29Å; W894-M897 VanDerWaalsContact O-CB 3.3Å; W894-M897 WeakPolarHBondContact O-CB 3.49Å; W894-M897 PolarHBondContact O-N 3.14Å; W894-W902 HydrophobicContact CE3-CB 4.1Å; W894-W902 AromaticContact CE3-CD1 3.58Å; W894-W902 HydrophobicContact CE3-CD2 4.4Å; W894-W902 AromaticContact CE3-CG 3.76Å; W894-W902 HydrophobicContact CE3-CG 3.76Å; W894-W902 HydrophobicContact CZ3-CB 4.32Å; W894-W902 HydrophobicContact CZ3-CD2 4.26Å; W894-W902 AromaticContact CZ3-CG 3.99Å; W894-W902 HydrophobicContact CZ3-CG 3.99Å; W894-W902 PolarHBondContact O-NE1 2.93Å; W894-W902 VanDerWaalsContact O-NE1 3.12Å; W894-P903 HydrophobicContact CD2-CG 4.26Å; W894-P903 HydrophobicContact CH2-CG 4.39Å; W894-P903 HydrophobicContact CZ2-CG 3.98Å
895	L	93.7	Very high	89.1	Confident	0 Å²	0	57 Å²	57	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-69.3	-30.7	-179.5	-175	54.7	0	0	0	112	H747 F749 K764 V774 P892 A893 M897 W902	H747-L895 HydrophobicContact CB-CD1 4.48Å; H747-L895 HydrophobicContact CB-CD2 3.89Å; H747-L895 VanDerWaalsContact CE1-CD1 3.42Å; H747-L895 WeakPolarHBondContact CE1-CD1 3.49Å; H747-L895 VanDerWaalsContact ND1-CD1 3.3Å; H747-L895 WeakPolarHBondContact ND1-CD1 3.26Å; F749-L895 HydrophobicContact CE2-CD2 4.06Å; F749-L895 HydrophobicContact CZ-CD2 4.24Å; K764-L895 HydrophobicContact CD-CD1 4.41Å; K764-L895 WeakPolarHBondContact CD-O 3.45Å; K764-L895 WeakPolarHBondContact CE-O 3.38Å; K764-L895 PolarHBondContact NZ-O 3.15Å; K764-L895 VanDerWaalsContact NZ-O 3.12Å; V774-L895 HydrophobicContact CG1-CD2 3.78Å; V774-L895 HydrophobicContact CG1-CG 4.19Å; V774-L895 HydrophobicContact CG2-CB 4.47Å; V774-L895 HydrophobicContact CG2-CG 4.03Å; P892-L895 VanDerWaalsContact O-CB 3.22Å; P892-L895 WeakPolarHBondContact O-CB 3.39Å; P892-L895 PolarHBondContact O-N 3.15Å; A893-L895 PolarHBondContact O-N 2.9Å; L895-M897 PolarHBondContact O-N 3.17Å; L895-W902 HydrophobicContact CD1-CH2 4.36Å; L895-W902 HydrophobicContact CD1-CZ2 3.73Å
896	K	91.4	Very high	87.3	Confident	78 Å²	78	60.2 Å²	60.2	34%	0.339	34%	0.34	S	S	.	.	H	α-helix	trans	-67.2	-26.9	171.8	-65.8	-174.5	178.4	-171.3	0	112	N772 V774 A893 W894	N772-K896 WeakPolarHBondContact CB-O 3.45Å; N772-K896 PolarHBondContact ND2-O 3.26Å; V774-K896 HydrophobicContact CB-CG 3.96Å; V774-K896 HydrophobicContact CG2-CB 4.41Å; V774-K896 HydrophobicContact CG2-CG 3.62Å; A893-K896 PolarHBondContact O-N 3.03Å; W894-K896 VanDerWaalsContact C-N 3.3Å; W894-K896 PolarHBondContact O-N 3.29Å
897	M	91.2	Very high	85.4	Confident	99 Å²	99	64.9 Å²	64.9	49%	0.488	35%	0.351	S	S	.	.	S	Bend	trans	-75.4	163.3	179.3	-53.6	-62.8	-85.9	0	0	111.4	K764 W894 L895 W902	K764-M897 PolarHBondContact NZ-O 3.3Å; W894-M897 VanDerWaalsContact O-CB 3.3Å; W894-M897 WeakPolarHBondContact O-CB 3.49Å; W894-M897 PolarHBondContact O-N 3.14Å; L895-M897 PolarHBondContact O-N 3.17Å; M897-W902 PolarHBondContact O-NE1 2.86Å
898	P	85.5	Confident	83.5	Confident	81 Å²	81	65.5 Å²	65.5	53%	0.526	36%	0.357	S	S	.	.			trans	-56.8	154.9	169.3	-23.7	34.6	0	0	0	112	G900 S901	P898-G900 PolarHBondContact O-N 3.26Å; P898-S901 WeakPolarHBondContact O-CB 3.25Å; P898-S901 PolarHBondContact O-N 3.34Å
899	E	85.3	Confident	81.4	Confident	103 Å²	103	70.5 Å²	70.5	48%	0.481	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-53.5	-31.4	-175.4	176.5	170.9	-165.1	0	0	114.2	R819 S901 W902	R819-E899 IonicContact CZ-OE1 3.1Å; R819-E899 IonicContact CZ-OE2 3.97Å; R819-E899 IonicContact NH1-OE1 2.9Å; R819-E899 PolarHBondContact NH1-OE1 3.35Å; R819-E899 IonicContact NH1-OE2 3.61Å; R819-E899 PolarHBondContact NH1-OE2 2.79Å; R819-E899 IonicContact NH2-OE1 3.63Å; R819-E899 PolarHBondContact NH2-OE1 3.39Å; R819-E899 IonicContact NH2-OE2 3.2Å; E899-S901 PolarHBondContact O-N 3.09Å; E899-S901 VanDerWaalsContact O-N 3.09Å; E899-W902 HydrophobicContact CB-CD2 4.27Å; E899-W902 HydrophobicContact CB-CE3 4.26Å; E899-W902 HydrophobicContact CB-CZ3 4.37Å; E899-W902 HydrophobicContact CG-CD2 4.24Å; E899-W902 HydrophobicContact CG-CE3 3.84Å; E899-W902 HydrophobicContact CG-CZ3 4.06Å; E899-W902 VanDerWaalsContact O-CB 3.31Å; E899-W902 WeakPolarHBondContact O-CB 3.46Å; E899-W902 PolarHBondContact O-N 3.48Å
900	G	85.9	Confident	79.8	Confident	75 Å²	75	73.8 Å²	73.8	77%	0.773	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-59.9	-20.4	177	0	0	0	0	0	114.8	P898	P898-G900 PolarHBondContact O-N 3.26Å
901	S	86.9	Confident	78.8	Confident	68 Å²	68	72.1 Å²	72.1	48%	0.476	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-93.2	-1.7	178.3	-57.2	0	0	0	0	113.6	P898 E899	P898-S901 WeakPolarHBondContact O-CB 3.25Å; P898-S901 PolarHBondContact O-N 3.34Å; E899-S901 PolarHBondContact O-N 3.09Å; E899-S901 VanDerWaalsContact O-N 3.09Å
902	W	90.4	Very high	78	Confident	18 Å²	18	75.4 Å²	75.4	7%	0.068	42%	0.42	C	S	.	.	S	Bend	trans	-76.9	161.2	-179	-63.9	1.3	0	0	0	111.5	E745 H747 K764 W823 W894 L895 M897 E899 K904	E745-W902 WeakPolarHBondContact OE2-CH2 3.38Å; H747-W902 AromaticContact CE1-CH2 3.28Å; H747-W902 WeakPolarHBondContact CE1-CH2 3.47Å; H747-W902 AromaticContact CE1-CZ2 3.88Å; H747-W902 AromaticContact CE1-CZ3 3.74Å; H747-W902 AromaticContact NE2-CH2 3.75Å; K764-W902 HydrophobicContact CD-CZ2 4.3Å; W823-W902 HydrophobicContact CH2-CB 4.42Å; W823-W902 HydrophobicContact CH2-CD2 4.43Å; W823-W902 AromaticContact CH2-CE3 3.87Å; W823-W902 HydrophobicContact CH2-CE3 3.87Å; W823-W902 HydrophobicContact CZ2-CD2 4.46Å; W823-W902 AromaticContact CZ2-CE3 3.79Å; W823-W902 HydrophobicContact CZ2-CE3 3.79Å; W823-W902 HydrophobicContact CZ2-CZ3 4.09Å; W894-W902 HydrophobicContact CE3-CB 4.1Å; W894-W902 AromaticContact CE3-CD1 3.58Å; W894-W902 HydrophobicContact CE3-CD2 4.4Å; W894-W902 AromaticContact CE3-CG 3.76Å; W894-W902 HydrophobicContact CE3-CG 3.76Å; W894-W902 HydrophobicContact CZ3-CB 4.32Å; W894-W902 HydrophobicContact CZ3-CD2 4.26Å; W894-W902 AromaticContact CZ3-CG 3.99Å; W894-W902 HydrophobicContact CZ3-CG 3.99Å; W894-W902 PolarHBondContact O-NE1 2.93Å; W894-W902 VanDerWaalsContact O-NE1 3.12Å; L895-W902 HydrophobicContact CD1-CH2 4.36Å; L895-W902 HydrophobicContact CD1-CZ2 3.73Å; M897-W902 PolarHBondContact O-NE1 2.86Å; E899-W902 HydrophobicContact CB-CD2 4.27Å; E899-W902 HydrophobicContact CB-CE3 4.26Å; E899-W902 HydrophobicContact CB-CZ3 4.37Å; E899-W902 HydrophobicContact CG-CD2 4.24Å; E899-W902 HydrophobicContact CG-CE3 3.84Å; E899-W902 HydrophobicContact CG-CZ3 4.06Å; E899-W902 VanDerWaalsContact O-CB 3.31Å; E899-W902 WeakPolarHBondContact O-CB 3.46Å; E899-W902 PolarHBondContact O-N 3.48Å; W902-K904 PolarHBondContact O-N 3.34Å; W902-K904 VanDerWaalsContact O-N 3.15Å
903	P	85.1	Confident	77.2	Confident	40 Å²	40	81.6 Å²	81.6	26%	0.26	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-54	122.6	172.4	-23.6	33.3	0	0	0	110.5	W894 D905	W894-P903 HydrophobicContact CD2-CG 4.26Å; W894-P903 HydrophobicContact CH2-CG 4.39Å; W894-P903 HydrophobicContact CZ2-CG 3.98Å; P903-D905 PolarHBondContact O-N 3.34Å
904	K	73.2	Confident	76.6	Confident	178 Å²	178	82.4 Å²	82.4	77%	0.774	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-67.2	129.6	177	-67.6	-173.9	-179.7	-179.6	0	109.4	W902 D906	W902-K904 PolarHBondContact O-N 3.34Å; W902-K904 VanDerWaalsContact O-N 3.15Å; K904-D906 VanDerWaalsContact C-N 3.3Å; K904-D906 PolarHBondContact O-N 2.78Å
905	D	66.1	Low	76.1	Confident	56 Å²	56	84 Å²	84	30%	0.299	46%	0.458	S	S	.	.			trans	-76	85.2	172.3	-170.6	27.3	0	0	0	108.6	R834 P903 K907	R834-D905 IonicContact CZ-OD1 2.67Å; R834-D905 IonicContact CZ-OD2 2.85Å; R834-D905 IonicContact NH1-OD1 2.89Å; R834-D905 PolarHBondContact NH1-OD1 3.47Å; R834-D905 VanDerWaalsContact NH1-OD1 3.13Å; R834-D905 IonicContact NH1-OD2 2.7Å; R834-D905 PolarHBondContact NH1-OD2 3.42Å; R834-D905 IonicContact NH2-OD1 3.55Å; R834-D905 PolarHBondContact NH2-OD1 3.06Å; R834-D905 IonicContact NH2-OD2 2.7Å; R834-D905 PolarHBondContact NH2-OD2 2.82Å; P903-D905 PolarHBondContact O-N 3.34Å; D905-K907 PolarHBondContact O-N 3.27Å
906	D	55.5	Low	75.6	Confident	101 Å²	101	85.1 Å²	85.1	54%	0.54	47%	0.468	S	S	.	.			trans	-62.9	105.5	171.4	-100.9	-35.1	0	0	0	108.5	K904 M908	K904-D906 VanDerWaalsContact C-N 3.3Å; K904-D906 PolarHBondContact O-N 2.78Å; D906-M908 PolarHBondContact O-N 3.44Å
907	K	51.4	Low	75.2	Confident	179 Å²	179	87.1 Å²	87.1	78%	0.778	48%	0.479	S	S	*	.			trans	-54.7	89.3	-172.8	-69.8	-179.7	176.2	177.1	0	112.4	D905 S909	D905-K907 PolarHBondContact O-N 3.27Å; K907-S909 PolarHBondContact O-N 3.45Å; K907-S909 PolarHBondContact O-OG 3.43Å
908	M	51.3	Low	74.8	Confident	73 Å²	73	84 Å²	84	36%	0.36	47%	0.465	S	S	.	.	S	Bend	trans	52.2	-17.6	164.6	-154.9	75.9	79.8	0	0	118.6	R834 D906 E910 L911	R834-M908 HydrophobicContact CB-CE 4.39Å; D906-M908 PolarHBondContact O-N 3.44Å; M908-E910 PolarHBondContact O-N 2.93Å; M908-L911 HydrophobicContact CG-CD1 3.87Å; M908-L911 HydrophobicContact CG-CG 4.42Å; M908-L911 PolarHBondContact O-N 2.89Å; M908-L911 HydrophobicContact SD-CD1 3.58Å; M908-L911 VanDerWaalsContact SD-CD1 3.58Å; M908-L911 HydrophobicContact SD-CG 4.11Å
909	S	51.6	Low	74.8	Confident	104 Å²	104	80.9 Å²	80.9	73%	0.727	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-10	-172.7	44.1	0	0	0	0	112.9	K907	K907-S909 PolarHBondContact O-N 3.45Å; K907-S909 PolarHBondContact O-OG 3.43Å
910	E	62.6	Low	74.8	Confident	102 Å²	102	83.2 Å²	83.2	48%	0.477	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113	26.9	179.6	-55.3	-169.6	148.5	0	0	114.5	K827 M908 T912	K827-E910 IonicContact NZ-OE2 2.68Å; K827-E910 PolarHBondContact NZ-OE2 3Å; K827-E910 VanDerWaalsContact NZ-OE2 3.14Å; M908-E910 PolarHBondContact O-N 2.93Å; E910-T912 PolarHBondContact O-N 2.99Å; E910-T912 VanDerWaalsContact O-N 3.11Å
911	L	73.8	Confident	74.8	Confident	35 Å²	35	85.5 Å²	85.5	18%	0.183	44%	0.443	C	S	.	.			trans	-65	114.2	163.6	-76.2	169.1	0	0	0	107.8	K827 M908 H915 A916	K827-L911 HydrophobicContact CB-CD2 3.89Å; M908-L911 HydrophobicContact CG-CD1 3.87Å; M908-L911 HydrophobicContact CG-CG 4.42Å; M908-L911 PolarHBondContact O-N 2.89Å; M908-L911 HydrophobicContact SD-CD1 3.58Å; M908-L911 VanDerWaalsContact SD-CD1 3.58Å; M908-L911 HydrophobicContact SD-CG 4.11Å; L911-H915 HydrophobicContact CB-CB 4.3Å; L911-H915 HydrophobicContact CD2-CB 3.65Å; L911-A916 HydrophobicContact CB-CB 4.39Å
912	T	77.4	Confident	74.8	Confident	74 Å²	74	83 Å²	83	45%	0.454	43%	0.425	S	S	.	.			trans	-53.4	152.9	169.2	64.6	0	0	0	0	109.9	E910 V914 H915 A916	E910-T912 PolarHBondContact O-N 2.99Å; E910-T912 VanDerWaalsContact O-N 3.11Å; T912-V914 PolarHBondContact O-N 3.35Å; T912-H915 WeakPolarHBondContact O-CA 3.45Å; T912-H915 WeakPolarHBondContact O-CB 3.45Å; T912-H915 PolarHBondContact O-N 3.21Å; T912-H915 PolarHBondContact OG1-N 3.4Å; T912-H915 PolarHBondContact OG1-ND1 3.45Å; T912-A916 PolarHBondContact O-N 2.76Å
913	D	78.2	Confident	74.5	Confident	132 Å²	132	83 Å²	83	71%	0.706	43%	0.429	S	S	*	.	H	α-helix	trans	-52	-36.2	-179.8	-76	-31	0	0	0	112.4	A916 Q917	D913-A916 PolarHBondContact O-N 2.81Å; D913-Q917 WeakPolarHBondContact O-CB 3.41Å; D913-Q917 VanDerWaalsContact O-CG 3.25Å; D913-Q917 WeakPolarHBondContact O-CG 3.34Å; D913-Q917 PolarHBondContact O-N 2.91Å
914	V	79.8	Confident	74.1	Confident	98 Å²	98	89.2 Å²	89.2	59%	0.594	45%	0.448	S	S	*	.	H	α-helix	trans	-64.3	-46	175.7	-177.9	0	0	0	0	111.7	T912 Q917 T918	T912-V914 PolarHBondContact O-N 3.35Å; V914-Q917 PolarHBondContact O-N 2.97Å; V914-T918 WeakPolarHBondContact O-CB 3.4Å; V914-T918 PolarHBondContact O-N 3.47Å; V914-T918 PolarHBondContact O-OG1 2.78Å
915	H	82.3	Confident	73.9	Confident	69 Å²	69	89.1 Å²	89.1	32%	0.319	45%	0.447	S	S	.	.	H	α-helix	trans	-64.7	-44.7	176	-64.4	154.2	0	0	0	111.4	V828 L911 T912 Q917 T918 V919	V828-H915 HydrophobicContact CG2-CB 3.84Å; L911-H915 HydrophobicContact CB-CB 4.3Å; L911-H915 HydrophobicContact CD2-CB 3.65Å; T912-H915 WeakPolarHBondContact O-CA 3.45Å; T912-H915 WeakPolarHBondContact O-CB 3.45Å; T912-H915 PolarHBondContact O-N 3.21Å; T912-H915 PolarHBondContact OG1-N 3.4Å; T912-H915 PolarHBondContact OG1-ND1 3.45Å; H915-Q917 VanDerWaalsContact C-N 3.33Å; H915-Q917 PolarHBondContact O-N 2.7Å; H915-T918 WeakPolarHBondContact O-CB 3.32Å; H915-T918 PolarHBondContact O-N 3.06Å; H915-T918 VanDerWaalsContact O-N 3.12Å; H915-V919 WeakPolarHBondContact O-CG2 3.36Å; H915-V919 PolarHBondContact O-N 2.88Å
916	A	83.1	Confident	73.4	Confident	25 Å²	25	96.3 Å²	96.3	21%	0.207	48%	0.476	C	S	.	.	H	α-helix	trans	-61.1	-40.7	177.9	0	0	0	0	0	112	L911 T912 D913 V919 K920	L911-A916 HydrophobicContact CB-CB 4.39Å; T912-A916 PolarHBondContact O-N 2.76Å; D913-A916 PolarHBondContact O-N 2.81Å; A916-V919 PolarHBondContact O-N 3.46Å; A916-K920 VanDerWaalsContact O-CG 3.3Å; A916-K920 WeakPolarHBondContact O-CG 3.41Å; A916-K920 PolarHBondContact O-N 2.73Å
917	Q	83.2	Confident	73.5	Confident	120 Å²	120	98.8 Å²	98.8	56%	0.561	49%	0.487	S	S	*	.	H	α-helix	trans	-63.3	-43.4	173.1	-76.5	179.7	13.5	0	0	111.7	D913 V914 H915 V919 K920 Q921	D913-Q917 WeakPolarHBondContact O-CB 3.41Å; D913-Q917 VanDerWaalsContact O-CG 3.25Å; D913-Q917 WeakPolarHBondContact O-CG 3.34Å; D913-Q917 PolarHBondContact O-N 2.91Å; V914-Q917 PolarHBondContact O-N 2.97Å; H915-Q917 VanDerWaalsContact C-N 3.33Å; H915-Q917 PolarHBondContact O-N 2.7Å; Q917-V919 VanDerWaalsContact C-N 3.33Å; Q917-V919 PolarHBondContact O-N 3.31Å; Q917-K920 PolarHBondContact O-N 3.12Å; Q917-K920 VanDerWaalsContact O-N 3.16Å; Q917-Q921 WeakPolarHBondContact O-CG 3.39Å; Q917-Q921 PolarHBondContact O-N 2.86Å
918	T	83.3	Confident	73.5	Confident	34 Å²	34	97.1 Å²	97.1	21%	0.209	49%	0.492	C	S	.	.	H	α-helix	trans	-62.5	-40.7	179.7	-55.8	0	0	0	0	111.5	P792 V828 V914 H915 Q921	P792-T918 HydrophobicContact CG-CG2 3.95Å; V828-T918 HydrophobicContact CG1-CG2 4.11Å; V914-T918 WeakPolarHBondContact O-CB 3.4Å; V914-T918 PolarHBondContact O-N 3.47Å; V914-T918 PolarHBondContact O-OG1 2.78Å; H915-T918 WeakPolarHBondContact O-CB 3.32Å; H915-T918 PolarHBondContact O-N 3.06Å; H915-T918 VanDerWaalsContact O-N 3.12Å; T918-Q921 PolarHBondContact O-N 2.83Å
919	V	85.2	Confident	73.1	Confident	14 Å²	14	97 Å²	97	9%	0.085	51%	0.51	C	S	.	.	H	α-helix	trans	-60.8	-49.1	172.2	173.3	0	0	0	0	110.6	V828 W840 H915 A916 Q917 Q921 E922	V828-V919 HydrophobicContact CB-CG2 4.43Å; V828-V919 HydrophobicContact CG1-CG2 3.89Å; V828-V919 HydrophobicContact CG2-CG2 4.48Å; W840-V919 HydrophobicContact CH2-CG1 3.59Å; W840-V919 HydrophobicContact CZ2-CG1 4.48Å; W840-V919 HydrophobicContact CZ3-CG1 4.07Å; H915-V919 WeakPolarHBondContact O-CG2 3.36Å; H915-V919 PolarHBondContact O-N 2.88Å; A916-V919 PolarHBondContact O-N 3.46Å; Q917-V919 VanDerWaalsContact C-N 3.33Å; Q917-V919 PolarHBondContact O-N 3.31Å; V919-Q921 VanDerWaalsContact C-N 3.28Å; V919-Q921 PolarHBondContact O-N 2.83Å; V919-E922 PolarHBondContact O-N 3.29Å
920	K	84.1	Confident	72.9	Confident	153 Å²	153	100.2 Å²	100.2	67%	0.665	52%	0.518	S	S	*	.	H	α-helix	trans	-61.9	-30.8	179.8	-73.6	173.7	-177.8	175.8	0	113.3	A916 Q917 E922 G923	A916-K920 VanDerWaalsContact O-CG 3.3Å; A916-K920 WeakPolarHBondContact O-CG 3.41Å; A916-K920 PolarHBondContact O-N 2.73Å; Q917-K920 PolarHBondContact O-N 3.12Å; Q917-K920 VanDerWaalsContact O-N 3.16Å; K920-E922 VanDerWaalsContact C-N 3.27Å; K920-E922 PolarHBondContact O-N 3.11Å; K920-G923 PolarHBondContact O-N 2.78Å; K920-G923 VanDerWaalsContact O-N 3.1Å
921	Q	85.7	Confident	72.1	Confident	122 Å²	122	103.4 Å²	103.4	57%	0.57	54%	0.537	S	S	*	.	H	α-helix	trans	-63.8	-30.1	178.8	-76.8	177.4	18.1	0	0	113.2	K841 Q917 T918 V919 G923	K841-Q921 WeakPolarHBondContact CE-O 3.42Å; K841-Q921 PolarHBondContact NZ-O 3.02Å; Q917-Q921 WeakPolarHBondContact O-CG 3.39Å; Q917-Q921 PolarHBondContact O-N 2.86Å; T918-Q921 PolarHBondContact O-N 2.83Å; V919-Q921 VanDerWaalsContact C-N 3.28Å; V919-Q921 PolarHBondContact O-N 2.83Å; Q921-G923 VanDerWaalsContact C-N 3.35Å
922	E	87.9	Confident	71.1	Confident	17 Å²	17	106.4 Å²	106.4	8%	0.079	57%	0.567	C	S	.	*	T	Hydrogen-bonded Turn	trans	-88	-4.2	175.5	-67.7	-66.3	171.1	0	0	113.3	R793 W832 W840 K841 V844 V919 K920	R793-E922 IonicContact CZ-OE1 2.81Å; R793-E922 IonicContact CZ-OE2 2.73Å; R793-E922 IonicContact NE-OE1 2.62Å; R793-E922 PolarHBondContact NE-OE1 3.08Å; R793-E922 VanDerWaalsContact NH2-CD 3.27Å; R793-E922 IonicContact NH2-OE1 3.76Å; R793-E922 PolarHBondContact NH2-OE1 3.15Å; R793-E922 IonicContact NH2-OE2 4Å; R793-E922 PolarHBondContact NH2-OE2 3.13Å; W832-E922 HydrophobicContact CH2-CG 4.05Å; W832-E922 HydrophobicContact CZ2-CB 4.03Å; W832-E922 HydrophobicContact CZ2-CG 3.51Å; W840-E922 CarbonylContact C-O 3.59Å; K841-E922 WeakPolarHBondContact CD-OE2 3.3Å; K841-E922 WeakPolarHBondContact CG-O 3.38Å; K841-E922 PolarHBondContact N-O 2.83Å; V844-E922 HydrophobicContact CG2-CB 4.17Å; V844-E922 HydrophobicContact CG2-CG 3.95Å; V919-E922 PolarHBondContact O-N 3.29Å; K920-E922 VanDerWaalsContact C-N 3.27Å; K920-E922 PolarHBondContact O-N 3.11Å
923	G	83.8	Confident	70.2	Confident	16 Å²	16	111.3 Å²	111.3	17%	0.165	59%	0.585	C	S	.	*	B	Isolated β-bridge	trans	-64.2	139.3	172.8	0	0	0	0	0	112.4	K920 Q921 K925	K920-G923 PolarHBondContact O-N 2.78Å; K920-G923 VanDerWaalsContact O-N 3.1Å; Q921-G923 VanDerWaalsContact C-N 3.35Å; G923-K925 PolarHBondContact O-N 3.23Å
924	R	77	Confident	68.9	Low	172 Å²	172	114.7 Å²	114.7	65%	0.649	60%	0.596	S	S	*	*			trans	-78.1	105.6	178	-164.2	173.7	-175.8	172.3	0.1	110.4	S839	S839-R924 WeakPolarHBondContact O-CB 3.28Å; S839-R924 PolarHBondContact O-N 3.47Å
925	K	68.2	Low	67.6	Low	176 Å²	176	112.7 Å²	112.7	77%	0.765	59%	0.587	S	S	*	*			trans	-79.4	127.5	175.1	-61.2	-175.3	-178.9	-175.6	0	110.9	G923	G923-K925 PolarHBondContact O-N 3.23Å
926	K	57	Low	66.2	Low	206 Å²	206	116 Å²	116	90%	0.896	62%	0.618	S	S	*	*			trans	-94.1	116.6	163.1	-85.5	-177.6	176.3	177.5	0	107.9
927	I	56.5	Low	64.9	Low	153 Å²	153	119.3 Å²	119.3	79%	0.785	63%	0.632	S	S	*	*			trans	-109.9	125.8	172.3	-59.6	175	0	0	0	107
928	V	50.8	Low	63.4	Low	145 Å²	145	117.9 Å²	117.9	88%	0.879	63%	0.631	S	S	*	*			trans	-112.8	114.2	172.7	-176.8	0	0	0	0	106.7
929	G	44.3	Very low	62.1	Low	71 Å²	71	121.3 Å²	121.3	73%	0.732	65%	0.645	S	S	*	*			trans	-110.8	137.1	176.3	0	0	0	0	0	110.6
930	L	47	Very low	60.6	Low	171 Å²	171	126 Å²	126	90%	0.895	66%	0.662	S	S	*	*			trans	-111.8	122.9	173.6	-174.3	77.5	0	0	0	108.6
931	L	46.4	Very low	59.5	Low	169 Å²	169	120.6 Å²	120.6	89%	0.885	65%	0.646	S	S	*	*			trans	-112.9	125.3	173	-161.1	88	0	0	0	107.9
932	A	52.7	Low	58.5	Low	98 Å²	98	116.2 Å²	116.2	81%	0.81	63%	0.626	S	S	*	*			trans	-115.5	125.4	177.7	0	0	0	0	0	109.9
933	E	57.5	Low	57.3	Low	177 Å²	177	116.4 Å²	116.4	83%	0.827	63%	0.629	S	S	*	*			trans	-118.9	126.1	177.5	-176.3	175.7	-167	0	0	108.6	S935	E933-S935 PolarHBondContact O-N 3.29Å
934	Q	51.8	Low	56.4	Low	202 Å²	202	121 Å²	121	94%	0.944	65%	0.649	S	S	*	*			trans	-83.9	104.6	172.3	-72.9	-162.8	-4.6	0	0	109.1
935	S	52.6	Low	56	Low	57 Å²	57	121.8 Å²	121.8	40%	0.399	65%	0.652	S	S	.	*			trans	-102.4	141.1	167.8	60.2	0	0	0	0	109.5	E933 D937 V938	E933-S935 PolarHBondContact O-N 3.29Å; S935-D937 PolarHBondContact O-N 2.78Å; S935-D937 VanDerWaalsContact O-N 3.17Å; S935-V938 WeakPolarHBondContact O-CG2 3.42Å
936	S	52.4	Low	56.3	Low	138 Å²	138	115.8 Å²	115.8	97%	0.965	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-1.9	172	47.5	0	0	0	0	113.1
937	D	55.2	Low	57.1	Low	95 Å²	95	111 Å²	111	51%	0.508	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.1	19.7	-169.8	-146.6	11.3	0	0	0	112.5	S935 Q939 Y940 A941	S935-D937 PolarHBondContact O-N 2.78Å; S935-D937 VanDerWaalsContact O-N 3.17Å; D937-Q939 VanDerWaalsContact C-N 3.26Å; D937-Q939 PolarHBondContact O-N 2.98Å; D937-Y940 PolarHBondContact O-N 2.93Å; D937-Y940 WeakPolarHBondContact OD1-CB 3.34Å; D937-A941 WeakPolarHBondContact O-CB 3.31Å; D937-A941 PolarHBondContact O-N 2.99Å
938	V	53.1	Low	58.1	Low	89 Å²	89	105.6 Å²	105.6	54%	0.539	59%	0.593	S	S	.	*	H	α-helix	trans	-56.9	-38.6	-173.6	-173.2	0	0	0	0	112.3	S935 L942	S935-V938 WeakPolarHBondContact O-CG2 3.42Å; V938-L942 WeakPolarHBondContact O-CB 3.23Å; V938-L942 PolarHBondContact O-N 3.23Å
939	Q	54	Low	59.4	Low	107 Å²	107	99.3 Å²	99.3	50%	0.5	55%	0.554	S	S	.	*	H	α-helix	trans	-68.4	-46.4	-178.6	-67.5	-177.8	-1.1	0	0	111	D937 A941 L942 V943	D937-Q939 VanDerWaalsContact C-N 3.26Å; D937-Q939 PolarHBondContact O-N 2.98Å; Q939-A941 VanDerWaalsContact C-N 3.34Å; Q939-A941 PolarHBondContact O-N 2.79Å; Q939-L942 WeakPolarHBondContact O-CB 3.24Å; Q939-L942 PolarHBondContact O-N 3.4Å; Q939-L942 VanDerWaalsContact O-N 3.14Å; Q939-V943 WeakPolarHBondContact O-CG2 3.48Å; Q939-V943 PolarHBondContact O-N 2.86Å; Q939-V943 VanDerWaalsContact O-N 3.11Å
940	Y	55.5	Low	61.1	Low	111 Å²	111	98 Å²	98	44%	0.435	53%	0.528	S	S	.	.	H	α-helix	trans	-62.8	-40.6	176.9	-135.8	-93.6	0	0	0	111.8	D937 L942 V943 L944	D937-Y940 PolarHBondContact O-N 2.93Å; D937-Y940 WeakPolarHBondContact OD1-CB 3.34Å; Y940-L942 VanDerWaalsContact C-N 3.32Å; Y940-L942 PolarHBondContact O-N 3.11Å; Y940-V943 PolarHBondContact O-N 2.88Å; Y940-L944 HydrophobicContact CD1-CD1 3.83Å; Y940-L944 HydrophobicContact CD1-CG 4.43Å; Y940-L944 HydrophobicContact CE1-CD1 4.23Å; Y940-L944 WeakPolarHBondContact O-CG 3.32Å; Y940-L944 PolarHBondContact O-N 3.04Å; Y940-L944 VanDerWaalsContact O-N 3.14Å
941	A	60.2	Low	62.6	Low	41 Å²	41	96.6 Å²	96.6	34%	0.339	51%	0.511	S	S	.	.	H	α-helix	trans	-65.5	-32.6	175.8	0	0	0	0	0	113	D937 Q939 R945	D937-A941 WeakPolarHBondContact O-CB 3.31Å; D937-A941 PolarHBondContact O-N 2.99Å; Q939-A941 VanDerWaalsContact C-N 3.34Å; Q939-A941 PolarHBondContact O-N 2.79Å; A941-R945 VanDerWaalsContact O-CG 3.27Å; A941-R945 WeakPolarHBondContact O-CG 3.39Å; A941-R945 PolarHBondContact O-N 2.9Å
942	L	64.8	Low	64.3	Low	30 Å²	30	88.9 Å²	88.9	16%	0.157	47%	0.471	C	S	.	.	H	α-helix	trans	-69.4	-47	176.5	-164.8	85.8	0	0	0	111.1	V938 Q939 Y940 L944 R945 Y946 L952 I955 L959	V938-L942 WeakPolarHBondContact O-CB 3.23Å; V938-L942 PolarHBondContact O-N 3.23Å; Q939-L942 WeakPolarHBondContact O-CB 3.24Å; Q939-L942 PolarHBondContact O-N 3.4Å; Q939-L942 VanDerWaalsContact O-N 3.14Å; Y940-L942 VanDerWaalsContact C-N 3.32Å; Y940-L942 PolarHBondContact O-N 3.11Å; L942-L944 VanDerWaalsContact C-N 3.34Å; L942-L944 PolarHBondContact O-N 2.89Å; L942-R945 PolarHBondContact O-N 3.46Å; L942-Y946 HydrophobicContact CD1-CE2 4.04Å; L942-Y946 HydrophobicContact CG-CE2 4.05Å; L942-Y946 WeakPolarHBondContact O-CD2 3.46Å; L942-L952 HydrophobicContact CD2-CD1 4.47Å; L942-I955 HydrophobicContact CD1-CG2 4.42Å; L942-L959 HydrophobicContact CD1-CD1 3.48Å; L942-L959 VanDerWaalsContact CD1-CD1 3.48Å; L942-L959 HydrophobicContact CD2-CD1 3.4Å; L942-L959 HydrophobicContact CG-CD1 4.08Å
943	V	63.1	Low	65.5	Low	21 Å²	21	85.5 Å²	85.5	13%	0.127	44%	0.439	C	S	.	.	H	α-helix	trans	-66	-37.4	-176.5	-179.6	0	0	0	0	111.3	Q939 Y940 R945 L952 V1053 V1054	Q939-V943 WeakPolarHBondContact O-CG2 3.48Å; Q939-V943 PolarHBondContact O-N 2.86Å; Q939-V943 VanDerWaalsContact O-N 3.11Å; Y940-V943 PolarHBondContact O-N 2.88Å; V943-R945 VanDerWaalsContact C-N 3.29Å; V943-R945 PolarHBondContact O-N 3.35Å; V943-L952 HydrophobicContact CB-CD2 4.47Å; V943-L952 HydrophobicContact CG1-CD2 3.88Å; V943-L952 HydrophobicContact CG2-CD1 4.36Å; V943-L952 HydrophobicContact CG2-CD2 4.41Å; V943-V1053 HydrophobicContact CG1-CB 3.49Å; V943-V1053 VanDerWaalsContact CG1-CB 3.49Å; V943-V1053 HydrophobicContact CG1-CG1 3.57Å; V943-V1053 HydrophobicContact CG1-CG2 4.46Å; V943-V1054 HydrophobicContact CG1-CG2 3.94Å
944	L	64	Low	66.7	Low	113 Å²	113	82.1 Å²	82.1	59%	0.592	42%	0.418	S	S	*	.	H	α-helix	trans	-71.9	-16.4	176.6	-71.5	171.5	0	0	0	114.5	Y940 L942 V1053	Y940-L944 HydrophobicContact CD1-CD1 3.83Å; Y940-L944 HydrophobicContact CD1-CG 4.43Å; Y940-L944 HydrophobicContact CE1-CD1 4.23Å; Y940-L944 WeakPolarHBondContact O-CG 3.32Å; Y940-L944 PolarHBondContact O-N 3.04Å; Y940-L944 VanDerWaalsContact O-N 3.14Å; L942-L944 VanDerWaalsContact C-N 3.34Å; L942-L944 PolarHBondContact O-N 2.89Å; L944-V1053 HydrophobicContact CD2-CG2 3.92Å
945	R	70	Confident	68.1	Low	188 Å²	188	74.1 Å²	74.1	71%	0.709	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-18.8	-178.5	-86.8	176	-178.6	-177.4	3.4	114	A941 L942 V943	A941-R945 VanDerWaalsContact O-CG 3.27Å; A941-R945 WeakPolarHBondContact O-CG 3.39Å; A941-R945 PolarHBondContact O-N 2.9Å; L942-R945 PolarHBondContact O-N 3.46Å; V943-R945 VanDerWaalsContact C-N 3.29Å; V943-R945 PolarHBondContact O-N 3.35Å
946	Y	73.2	Confident	69.3	Low	50 Å²	50	72.6 Å²	72.6	20%	0.196	37%	0.37	C	S	.	.			trans	-119.6	128.2	-171.6	-58.5	-66.2	0	0	0	111.5	L942 R951 L952 I955 L1057	L942-Y946 HydrophobicContact CD1-CE2 4.04Å; L942-Y946 HydrophobicContact CG-CE2 4.05Å; L942-Y946 WeakPolarHBondContact O-CD2 3.46Å; Y946-R951 HydrophobicContact CD1-CG 4.07Å; Y946-L952 HydrophobicContact CD2-CD1 3.89Å; Y946-I955 HydrophobicContact CD1-CD1 3.68Å; Y946-I955 HydrophobicContact CD2-CD1 4.19Å; Y946-I955 HydrophobicContact CE1-CD1 3.18Å; Y946-I955 HydrophobicContact CE2-CB 4.34Å; Y946-I955 HydrophobicContact CE2-CD1 3.74Å; Y946-I955 HydrophobicContact CE2-CG2 3.84Å; Y946-I955 HydrophobicContact CG-CD1 4.16Å; Y946-L1057 WeakPolarHBondContact O-CD1 3.43Å
947	S	74.1	Confident	70.7	Confident	104 Å²	104	66 Å²	66	73%	0.727	32%	0.324	S	S	*	.	S	Bend	trans	-92.1	-4.3	-177.9	52.2	0	0	0	0	114.4	L1057	S947-L1057 VanDerWaalsContact C-CD2 3.42Å; S947-L1057 WeakPolarHBondContact O-CD2 3.45Å
948	S	77.2	Confident	72.2	Confident	40 Å²	40	66.9 Å²	66.9	28%	0.28	32%	0.321	S	S	.	.			trans	-119.8	131.9	177.7	152.3	0	0	0	0	109.9	E950 R951 L952	S948-E950 PolarHBondContact O-N 3.47Å; S948-E950 PolarHBondContact OG-N 3.4Å; S948-E950 PolarHBondContact OG-OE2 2.96Å; S948-R951 PolarHBondContact O-N 2.98Å; S948-R951 PolarHBondContact OG-N 2.97Å; S948-L952 WeakPolarHBondContact O-CB 3.41Å; S948-L952 PolarHBondContact O-N 3.4Å
949	F	78.9	Confident	73.6	Confident	14 Å²	14	66.1 Å²	66.1	6%	0.061	31%	0.313	C	S	.	.	H	α-helix	trans	-58.6	-45.4	175.8	178.8	-96.5	0	0	0	111.6	R951 L952 L953 V1054 L1057 L1058	F949-R951 VanDerWaalsContact C-N 3.33Å; F949-R951 PolarHBondContact O-N 3.13Å; F949-L952 PolarHBondContact O-N 2.8Å; F949-L953 WeakPolarHBondContact O-CB 3.46Å; F949-L953 PolarHBondContact O-N 2.72Å; F949-V1054 HydrophobicContact CD2-CG1 3.87Å; F949-V1054 HydrophobicContact CE2-CG1 3.49Å; F949-V1054 VanDerWaalsContact CE2-CG1 3.49Å; F949-L1057 HydrophobicContact CB-CB 4.05Å; F949-L1057 HydrophobicContact CD2-CB 4.46Å; F949-L1058 HydrophobicContact CD1-CD1 4.37Å; F949-L1058 HydrophobicContact CD2-CB 4.13Å; F949-L1058 HydrophobicContact CD2-CD1 4.38Å; F949-L1058 HydrophobicContact CE1-CD1 4.19Å; F949-L1058 HydrophobicContact CE2-CB 4.28Å; F949-L1058 HydrophobicContact CE2-CD1 4.19Å; F949-L1058 HydrophobicContact CG-CD1 4.47Å; F949-L1058 HydrophobicContact CZ-CD1 4.11Å
950	E	78.9	Confident	74.9	Confident	42 Å²	42	63.7 Å²	63.7	20%	0.196	30%	0.301	C	S	.	.	H	α-helix	trans	-65.7	-36.5	-179.6	-58.5	91.6	154.5	0	0	112.2	S948 R954 R1061 R1065	S948-E950 PolarHBondContact O-N 3.47Å; S948-E950 PolarHBondContact OG-N 3.4Å; S948-E950 PolarHBondContact OG-OE2 2.96Å; E950-R954 WeakPolarHBondContact O-CB 3.45Å; E950-R954 WeakPolarHBondContact O-CG 3.41Å; E950-R954 PolarHBondContact O-N 3.44Å; E950-R954 VanDerWaalsContact O-N 3.13Å; E950-R954 PolarHBondContact O-NE 3.1Å; E950-R954 VanDerWaalsContact O-NE 3.14Å; E950-R1061 VanDerWaalsContact CD-NE 3.3Å; E950-R1061 WeakPolarHBondContact OE1-CD 3.45Å; E950-R1061 IonicContact OE1-CZ 2.87Å; E950-R1061 IonicContact OE1-NE 2.83Å; E950-R1061 PolarHBondContact OE1-NE 3.11Å; E950-R1061 IonicContact OE1-NH2 3.67Å; E950-R1061 PolarHBondContact OE1-NH2 3.42Å; E950-R1061 IonicContact OE2-NE 3.43Å; E950-R1065 IonicContact OE1-CZ 2.83Å; E950-R1065 IonicContact OE1-NE 3.96Å; E950-R1065 IonicContact OE1-NH2 2.79Å; E950-R1065 PolarHBondContact OE1-NH2 2.81Å
951	R	79.4	Confident	76.4	Confident	143 Å²	143	58.7 Å²	58.7	54%	0.54	28%	0.281	S	S	.	.	H	α-helix	trans	-67.8	-43.7	175.4	-174.6	171.6	-178.3	167.9	2	110.9	Y946 S948 F949 R954 I955	Y946-R951 HydrophobicContact CD1-CG 4.07Å; S948-R951 PolarHBondContact O-N 2.98Å; S948-R951 PolarHBondContact OG-N 2.97Å; F949-R951 VanDerWaalsContact C-N 3.33Å; F949-R951 PolarHBondContact O-N 3.13Å; R951-R954 PolarHBondContact O-N 2.71Å; R951-I955 HydrophobicContact CG-CD1 3.66Å; R951-I955 HydrophobicContact CG-CG1 4.44Å; R951-I955 WeakPolarHBondContact O-CB 3.29Å; R951-I955 VanDerWaalsContact O-CG1 3.23Å; R951-I955 WeakPolarHBondContact O-CG1 3.15Å; R951-I955 PolarHBondContact O-N 3.1Å
952	L	80.9	Confident	77.6	Confident	6 Å²	6	63.1 Å²	63.1	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-61.8	-46.7	177.6	178.8	62.3	0	0	0	111.7	L942 V943 Y946 S948 F949 R954 I955 T956 V1054 L1057	L942-L952 HydrophobicContact CD2-CD1 4.47Å; V943-L952 HydrophobicContact CB-CD2 4.47Å; V943-L952 HydrophobicContact CG1-CD2 3.88Å; V943-L952 HydrophobicContact CG2-CD1 4.36Å; V943-L952 HydrophobicContact CG2-CD2 4.41Å; Y946-L952 HydrophobicContact CD2-CD1 3.89Å; S948-L952 WeakPolarHBondContact O-CB 3.41Å; S948-L952 PolarHBondContact O-N 3.4Å; F949-L952 PolarHBondContact O-N 2.8Å; L952-R954 PolarHBondContact O-N 2.98Å; L952-I955 PolarHBondContact O-N 3.12Å; L952-T956 WeakPolarHBondContact O-CB 3.46Å; L952-T956 PolarHBondContact O-N 2.75Å; L952-T956 PolarHBondContact O-OG1 2.98Å; L952-V1054 HydrophobicContact CD2-CG2 3.69Å; L952-L1057 HydrophobicContact CB-CD1 4.47Å; L952-L1057 HydrophobicContact CD2-CD1 3.68Å
953	L	79.5	Confident	78.6	Confident	27 Å²	27	64.7 Å²	64.7	14%	0.141	30%	0.304	C	S	.	.	H	α-helix	trans	-59.3	-48.2	178.9	-163.2	79.5	0	0	0	111.2	F949 I955 T956 A957 L983 A986 E987	F949-L953 WeakPolarHBondContact O-CB 3.46Å; F949-L953 PolarHBondContact O-N 2.72Å; L953-I955 PolarHBondContact O-N 3.24Å; L953-T956 PolarHBondContact O-N 2.7Å; L953-A957 PolarHBondContact O-N 3.28Å; L953-L983 HydrophobicContact CD2-CB 4.01Å; L953-L983 HydrophobicContact CD2-CD2 3.84Å; L953-L983 HydrophobicContact CD2-CG 4.37Å; L953-L983 HydrophobicContact CG-CD2 3.94Å; L953-A986 HydrophobicContact CD1-CB 3.84Å; L953-A986 HydrophobicContact CG-CB 4.28Å; L953-E987 HydrophobicContact CD1-CG 3.56Å
954	R	81.4	Confident	79.7	Confident	106 Å²	106	69.4 Å²	69.4	40%	0.4	32%	0.323	S	S	.	.	H	α-helix	trans	-63.3	-41.1	178.3	-75.8	-177.2	-78	-133.7	7.2	112.9	E950 R951 L952 A957 W958 I978 L983	E950-R954 WeakPolarHBondContact O-CB 3.45Å; E950-R954 WeakPolarHBondContact O-CG 3.41Å; E950-R954 PolarHBondContact O-N 3.44Å; E950-R954 VanDerWaalsContact O-N 3.13Å; E950-R954 PolarHBondContact O-NE 3.1Å; E950-R954 VanDerWaalsContact O-NE 3.14Å; R951-R954 PolarHBondContact O-N 2.71Å; L952-R954 PolarHBondContact O-N 2.98Å; R954-A957 PolarHBondContact O-N 2.74Å; R954-W958 PolarHBondContact O-N 3.14Å; R954-I978 HydrophobicContact CB-CD1 4.06Å; R954-I978 HydrophobicContact CG-CD1 4.28Å; R954-I978 VanDerWaalsContact O-CD1 3.29Å; R954-I978 WeakPolarHBondContact O-CD1 3.4Å; R954-L983 HydrophobicContact CG-CD2 4.18Å
955	I	81.3	Confident	80.9	Confident	35 Å²	35	65.1 Å²	65.1	18%	0.179	30%	0.3	C	S	.	.	H	α-helix	trans	-69.7	-38.7	179.7	-69.4	172.5	0	0	0	110.6	L942 Y946 R951 L952 L953 A957 W958 L959	L942-I955 HydrophobicContact CD1-CG2 4.42Å; Y946-I955 HydrophobicContact CD1-CD1 3.68Å; Y946-I955 HydrophobicContact CD2-CD1 4.19Å; Y946-I955 HydrophobicContact CE1-CD1 3.18Å; Y946-I955 HydrophobicContact CE2-CB 4.34Å; Y946-I955 HydrophobicContact CE2-CD1 3.74Å; Y946-I955 HydrophobicContact CE2-CG2 3.84Å; Y946-I955 HydrophobicContact CG-CD1 4.16Å; R951-I955 HydrophobicContact CG-CD1 3.66Å; R951-I955 HydrophobicContact CG-CG1 4.44Å; R951-I955 WeakPolarHBondContact O-CB 3.29Å; R951-I955 VanDerWaalsContact O-CG1 3.23Å; R951-I955 WeakPolarHBondContact O-CG1 3.15Å; R951-I955 PolarHBondContact O-N 3.1Å; L952-I955 PolarHBondContact O-N 3.12Å; L953-I955 PolarHBondContact O-N 3.24Å; I955-A957 VanDerWaalsContact C-N 3.35Å; I955-W958 PolarHBondContact O-N 2.79Å; I955-L959 HydrophobicContact CG2-CD1 4.07Å; I955-L959 HydrophobicContact CG2-CG 4.38Å; I955-L959 WeakPolarHBondContact O-CB 3.2Å; I955-L959 VanDerWaalsContact O-CG 3.28Å; I955-L959 WeakPolarHBondContact O-CG 3.32Å; I955-L959 PolarHBondContact O-N 3.35Å
956	T	79.2	Confident	81.7	Confident	24 Å²	24	60 Å²	60	15%	0.147	29%	0.292	C	S	.	.	H	α-helix	trans	-61.7	-44.8	175.1	-53.1	0	0	0	0	110.7	L952 L953 W958 L959 F960 A986	L952-T956 WeakPolarHBondContact O-CB 3.46Å; L952-T956 PolarHBondContact O-N 2.75Å; L952-T956 PolarHBondContact O-OG1 2.98Å; L953-T956 PolarHBondContact O-N 2.7Å; T956-W958 PolarHBondContact O-N 2.99Å; T956-L959 PolarHBondContact O-N 3.48Å; T956-F960 HydrophobicContact CG2-CD2 4.25Å; T956-F960 HydrophobicContact CG2-CE2 3.76Å; T956-F960 HydrophobicContact CG2-CZ 3.94Å; T956-F960 WeakPolarHBondContact O-CG 3.26Å; T956-F960 PolarHBondContact O-N 2.83Å; T956-A986 HydrophobicContact CG2-CB 3.84Å
957	A	80.8	Confident	82.4	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60.1	-45	173.2	0	0	0	0	0	112.5	L953 R954 I955 L959 F960 R961 I978 E982 L983	L953-A957 PolarHBondContact O-N 3.28Å; R954-A957 PolarHBondContact O-N 2.74Å; I955-A957 VanDerWaalsContact C-N 3.35Å; A957-L959 VanDerWaalsContact C-N 3.32Å; A957-L959 PolarHBondContact O-N 3.24Å; A957-F960 PolarHBondContact O-N 2.82Å; A957-R961 PolarHBondContact O-N 3.16Å; A957-I978 HydrophobicContact CB-CD1 4.03Å; A957-I978 HydrophobicContact CB-CG1 4.44Å; A957-I978 HydrophobicContact CB-CG2 3.74Å; A957-E982 HydrophobicContact CB-CB 4.13Å; A957-L983 HydrophobicContact CB-CD2 4.09Å
958	W	86.1	Confident	83.1	Confident	114 Å²	114	64.9 Å²	64.9	43%	0.432	30%	0.298	S	S	.	.	H	α-helix	trans	-61.4	-38.3	174.7	-84.5	122.5	0	0	0	113.1	R954 I955 T956 R961 F962 G976 I978	R954-W958 PolarHBondContact O-N 3.14Å; I955-W958 PolarHBondContact O-N 2.79Å; T956-W958 PolarHBondContact O-N 2.99Å; W958-R961 PolarHBondContact O-N 3.14Å; W958-F962 VanDerWaalsContact O-CB 3.31Å; W958-F962 WeakPolarHBondContact O-CB 3.37Å; W958-F962 PolarHBondContact O-N 3.46Å; W958-G976 VanDerWaalsContact CH2-O 3.29Å; W958-G976 WeakPolarHBondContact CH2-O 3.24Å; W958-I978 HydrophobicContact CD2-CD1 3.98Å; W958-I978 HydrophobicContact CD2-CG1 4.02Å; W958-I978 HydrophobicContact CG-CD1 3.79Å; W958-I978 HydrophobicContact CG-CG1 4.31Å; W958-I978 HydrophobicContact CZ2-CD1 4.36Å; W958-I978 HydrophobicContact CZ2-CG1 3.99Å
959	L	82.6	Confident	83.3	Confident	72 Å²	72	66 Å²	66	38%	0.377	30%	0.304	S	S	.	.	H	α-helix	trans	-67.2	-43.6	176.8	-73	169.6	0	0	0	111.2	L942 I955 T956 A957 R961 F962 V963	L942-L959 HydrophobicContact CD1-CD1 3.48Å; L942-L959 VanDerWaalsContact CD1-CD1 3.48Å; L942-L959 HydrophobicContact CD2-CD1 3.4Å; L942-L959 HydrophobicContact CG-CD1 4.08Å; I955-L959 HydrophobicContact CG2-CD1 4.07Å; I955-L959 HydrophobicContact CG2-CG 4.38Å; I955-L959 WeakPolarHBondContact O-CB 3.2Å; I955-L959 VanDerWaalsContact O-CG 3.28Å; I955-L959 WeakPolarHBondContact O-CG 3.32Å; I955-L959 PolarHBondContact O-N 3.35Å; T956-L959 PolarHBondContact O-N 3.48Å; A957-L959 VanDerWaalsContact C-N 3.32Å; A957-L959 PolarHBondContact O-N 3.24Å; L959-R961 VanDerWaalsContact C-N 3.34Å; L959-R961 PolarHBondContact O-N 3.04Å; L959-F962 PolarHBondContact O-N 2.86Å; L959-V963 WeakPolarHBondContact O-CB 3.42Å; L959-V963 VanDerWaalsContact O-CG2 3.28Å; L959-V963 WeakPolarHBondContact O-CG2 3.35Å; L959-V963 PolarHBondContact O-N 2.88Å
960	F	82.6	Confident	83.4	Confident	56 Å²	56	72.1 Å²	72.1	25%	0.246	33%	0.331	C	S	.	.	H	α-helix	trans	-61.8	-42.3	174	-69.2	-24.5	0	0	0	111.9	T956 A957 V963 K964 Q985 Q989	T956-F960 HydrophobicContact CG2-CD2 4.25Å; T956-F960 HydrophobicContact CG2-CE2 3.76Å; T956-F960 HydrophobicContact CG2-CZ 3.94Å; T956-F960 WeakPolarHBondContact O-CG 3.26Å; T956-F960 PolarHBondContact O-N 2.83Å; A957-F960 PolarHBondContact O-N 2.82Å; F960-V963 PolarHBondContact O-N 3.38Å; F960-K964 VanDerWaalsContact O-CB 3.28Å; F960-K964 WeakPolarHBondContact O-CB 3.37Å; F960-K964 PolarHBondContact O-N 3.05Å; F960-Q985 HydrophobicContact CD2-CG 4.19Å; F960-Q985 HydrophobicContact CE2-CG 4.33Å; F960-Q989 HydrophobicContact CZ-CB 4.3Å; F960-Q989 HydrophobicContact CZ-CG 4.18Å
961	R	86	Confident	83.6	Confident	7 Å²	7	77.8 Å²	77.8	3%	0.026	36%	0.357	C	S	.	.	H	α-helix	trans	-61.8	-44.8	172.7	-176.8	-178.4	-70.2	-169.1	-13.7	112.1	A957 W958 L959 K964 N965 G976 L977 E982	A957-R961 PolarHBondContact O-N 3.16Å; W958-R961 PolarHBondContact O-N 3.14Å; L959-R961 VanDerWaalsContact C-N 3.34Å; L959-R961 PolarHBondContact O-N 3.04Å; R961-K964 PolarHBondContact O-N 3.22Å; R961-N965 VanDerWaalsContact O-CB 3.3Å; R961-N965 WeakPolarHBondContact O-CB 3.39Å; R961-N965 VanDerWaalsContact O-CG 3.32Å; R961-N965 PolarHBondContact O-N 3.5Å; R961-G976 PolarHBondContact NH1-O 3.34Å; R961-L977 PolarHBondContact NH1-O 3.08Å; R961-L977 PolarHBondContact NH2-O 3.49Å; R961-E982 IonicContact CZ-OE1 3.04Å; R961-E982 IonicContact CZ-OE2 2.65Å; R961-E982 IonicContact NE-OE1 3.1Å; R961-E982 PolarHBondContact NE-OE1 3.4Å; R961-E982 IonicContact NE-OE2 2.78Å; R961-E982 VanDerWaalsContact NH2-CD 3.31Å; R961-E982 IonicContact NH2-OE1 2.75Å; R961-E982 PolarHBondContact NH2-OE1 3.25Å; R961-E982 IonicContact NH2-OE2 3.32Å; R961-E982 PolarHBondContact NH2-OE2 2.84Å
962	F	86.7	Confident	83.9	Confident	134 Å²	134	77 Å²	77	59%	0.588	36%	0.361	S	S	*	.	H	α-helix	trans	-59.9	-48.9	177.8	176.9	-100.9	0	0	0	110.8	W958 L959 K964 N965 C966	W958-F962 VanDerWaalsContact O-CB 3.31Å; W958-F962 WeakPolarHBondContact O-CB 3.37Å; W958-F962 PolarHBondContact O-N 3.46Å; L959-F962 PolarHBondContact O-N 2.86Å; F962-K964 VanDerWaalsContact C-N 3.34Å; F962-K964 PolarHBondContact O-N 3.42Å; F962-N965 PolarHBondContact O-N 2.85Å; F962-C966 VanDerWaalsContact CZ-SG 3.57Å; F962-C966 WeakPolarHBondContact O-CB 3.33Å; F962-C966 PolarHBondContact O-N 3.15Å; F962-C966 PolarHBondContact O-SG 2.87Å
963	V	84.3	Confident	84.2	Confident	63 Å²	63	81.2 Å²	81.2	38%	0.382	38%	0.376	S	S	.	.	H	α-helix	trans	-60.9	-42.2	176.7	172.5	0	0	0	0	111.3	L959 F960 C966 R967	L959-V963 WeakPolarHBondContact O-CB 3.42Å; L959-V963 VanDerWaalsContact O-CG2 3.28Å; L959-V963 WeakPolarHBondContact O-CG2 3.35Å; L959-V963 PolarHBondContact O-N 2.88Å; F960-V963 PolarHBondContact O-N 3.38Å; V963-C966 PolarHBondContact O-N 3.16Å; V963-R967 WeakPolarHBondContact O-CG 3.46Å; V963-R967 PolarHBondContact O-N 2.9Å
964	K	86.3	Confident	84.4	Confident	120 Å²	120	83.2 Å²	83.2	52%	0.522	39%	0.387	S	S	.	.	H	α-helix	trans	-62	-48	175	-172.9	178.6	179.5	179.7	0	111.1	F960 R961 F962 C966 R967 L968	F960-K964 VanDerWaalsContact O-CB 3.28Å; F960-K964 WeakPolarHBondContact O-CB 3.37Å; F960-K964 PolarHBondContact O-N 3.05Å; R961-K964 PolarHBondContact O-N 3.22Å; F962-K964 VanDerWaalsContact C-N 3.34Å; F962-K964 PolarHBondContact O-N 3.42Å; K964-C966 VanDerWaalsContact C-N 3.34Å; K964-C966 PolarHBondContact O-N 2.93Å; K964-R967 PolarHBondContact O-N 2.97Å; K964-L968 HydrophobicContact CD-CD1 4.47Å; K964-L968 HydrophobicContact CG-CD1 3.83Å; K964-L968 WeakPolarHBondContact O-CG 3.46Å; K964-L968 PolarHBondContact O-N 3.34Å
965	N	90.1	Very high	84.5	Confident	22 Å²	22	85.3 Å²	85.3	12%	0.118	40%	0.396	C	S	.	.	H	α-helix	trans	-65.9	-33.2	179.6	-77	-4.5	0	0	0	113	R961 F962 R967 L968 R973 N974	R961-N965 VanDerWaalsContact O-CB 3.3Å; R961-N965 WeakPolarHBondContact O-CB 3.39Å; R961-N965 VanDerWaalsContact O-CG 3.32Å; R961-N965 PolarHBondContact O-N 3.5Å; F962-N965 PolarHBondContact O-N 2.85Å; N965-R967 PolarHBondContact O-N 2.92Å; N965-L968 PolarHBondContact O-N 2.96Å; N965-L968 VanDerWaalsContact O-O 3.09Å; N965-R973 HydrophobicContact CB-CB 4.3Å; N965-R973 HydrophobicContact CB-CG 3.91Å; N965-R973 PolarHBondContact O-NE 3.03Å; N965-R973 WeakPolarHBondContact OD1-CA 3.44Å; N965-N974 PolarHBondContact ND2-O 3.4Å; N965-N974 PolarHBondContact OD1-N 2.85Å
966	C	85.6	Confident	84.7	Confident	80 Å²	80	86.1 Å²	86.1	54%	0.541	41%	0.413	S	S	.	.	H	α-helix	trans	-64	-23.8	172.5	-73	0	0	0	0	112.9	F962 V963 K964	F962-C966 VanDerWaalsContact CZ-SG 3.57Å; F962-C966 WeakPolarHBondContact O-CB 3.33Å; F962-C966 PolarHBondContact O-N 3.15Å; F962-C966 PolarHBondContact O-SG 2.87Å; V963-C966 PolarHBondContact O-N 3.16Å; K964-C966 VanDerWaalsContact C-N 3.34Å; K964-C966 PolarHBondContact O-N 2.93Å
967	R	89.1	Confident	84.9	Confident	208 Å²	208	91 Å²	91	79%	0.785	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-6.2	178.5	-63.8	173	-177.8	178.5	0.1	113.2	V963 K964 N965	V963-R967 WeakPolarHBondContact O-CG 3.46Å; V963-R967 PolarHBondContact O-N 2.9Å; K964-R967 PolarHBondContact O-N 2.97Å; N965-R967 PolarHBondContact O-N 2.92Å
968	L	87.7	Confident	84.9	Confident	50 Å²	50	92.2 Å²	92.2	26%	0.262	44%	0.444	S	S	.	.	S	Bend	trans	-108.9	144.2	-178.6	-68.4	173.5	0	0	0	111.9	K964 N965 M972 R973	K964-L968 HydrophobicContact CD-CD1 4.47Å; K964-L968 HydrophobicContact CG-CD1 3.83Å; K964-L968 WeakPolarHBondContact O-CG 3.46Å; K964-L968 PolarHBondContact O-N 3.34Å; N965-L968 PolarHBondContact O-N 2.96Å; N965-L968 VanDerWaalsContact O-O 3.09Å; L968-M972 HydrophobicContact CB-CB 4.39Å; L968-R973 HydrophobicContact CB-CG 4.31Å; L968-R973 PolarHBondContact O-NE 3.3Å; L968-R973 PolarHBondContact O-NH2 2.76Å
969	P	82.8	Confident	84.7	Confident	63 Å²	63	89.1 Å²	89.1	41%	0.409	44%	0.44	S	S	.	.			trans	-56.1	153.7	167	-24.3	35.9	0	0	0	112	E971 M972 R973	P969-E971 VanDerWaalsContact CB-OE2 3.25Å; P969-E971 WeakPolarHBondContact CB-OE2 3.43Å; P969-E971 PolarHBondContact O-N 2.89Å; P969-E971 VanDerWaalsContact O-N 3.09Å; P969-M972 HydrophobicContact CB-CE 4.29Å; P969-M972 HydrophobicContact CG-CE 3.78Å; P969-M972 PolarHBondContact O-N 3.26Å; P969-R973 WeakPolarHBondContact O-CG 3.08Å; P969-R973 PolarHBondContact O-N 2.9Å
970	K	80.4	Confident	84.4	Confident	143 Å²	143	91 Å²	91	62%	0.622	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-57	-33.4	-168.5	-171.3	-177.8	175	-171.2	0	112.5
971	E	83.4	Confident	84.1	Confident	160 Å²	160	93 Å²	93	75%	0.748	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-73	-28.7	-176.9	-48.4	73	-150.5	0	0	112.4	P969	P969-E971 VanDerWaalsContact CB-OE2 3.25Å; P969-E971 WeakPolarHBondContact CB-OE2 3.43Å; P969-E971 PolarHBondContact O-N 2.89Å; P969-E971 VanDerWaalsContact O-N 3.09Å
972	M	84.4	Confident	83.9	Confident	127 Å²	127	93.3 Å²	93.3	63%	0.626	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-96.7	1.4	-179.5	-71.2	-172.2	-106.1	0	0	113.6	L968 P969	L968-M972 HydrophobicContact CB-CB 4.39Å; P969-M972 HydrophobicContact CB-CE 4.29Å; P969-M972 HydrophobicContact CG-CE 3.78Å; P969-M972 PolarHBondContact O-N 3.26Å
973	R	88.6	Confident	83.4	Confident	94 Å²	94	89.2 Å²	89.2	36%	0.355	45%	0.45	S	S	.	.			trans	-70.6	138.6	-179.5	-73.1	175.7	-170.8	173.9	1.7	110.1	N965 L968 P969 Y975	N965-R973 HydrophobicContact CB-CB 4.3Å; N965-R973 HydrophobicContact CB-CG 3.91Å; N965-R973 PolarHBondContact O-NE 3.03Å; N965-R973 WeakPolarHBondContact OD1-CA 3.44Å; L968-R973 HydrophobicContact CB-CG 4.31Å; L968-R973 PolarHBondContact O-NE 3.3Å; L968-R973 PolarHBondContact O-NH2 2.76Å; P969-R973 WeakPolarHBondContact O-CG 3.08Å; P969-R973 PolarHBondContact O-N 2.9Å; R973-Y975 HydrophobicContact CB-CD2 4.39Å; R973-Y975 HydrophobicContact CB-CE2 3.59Å; R973-Y975 WeakPolarHBondContact O-CD2 3.41Å; R973-Y975 VanDerWaalsContact O-CE2 3.27Å; R973-Y975 WeakPolarHBondContact O-CE2 3.46Å
974	N	82.7	Confident	82.9	Confident	69 Å²	69	88 Å²	88	37%	0.369	44%	0.441	S	S	.	.			trans	-84	124.8	179.3	-152.2	-4	0	0	0	109.9	N965	N965-N974 PolarHBondContact ND2-O 3.4Å; N965-N974 PolarHBondContact OD1-N 2.85Å
975	Y	83.2	Confident	82.4	Confident	150 Å²	150	86.4 Å²	86.4	59%	0.588	44%	0.435	S	S	*	.			trans	-121.7	155.8	180	-60.1	-80.4	0	0	0	109.7	R973	R973-Y975 HydrophobicContact CB-CD2 4.39Å; R973-Y975 HydrophobicContact CB-CE2 3.59Å; R973-Y975 WeakPolarHBondContact O-CD2 3.41Å; R973-Y975 VanDerWaalsContact O-CE2 3.27Å; R973-Y975 WeakPolarHBondContact O-CE2 3.46Å
976	G	85.3	Confident	81.5	Confident	52 Å²	52	85.6 Å²	85.6	54%	0.536	43%	0.432	S	S	.	.	S	Bend	trans	105	-157.3	178.8	0	0	0	0	0	114.6	W958 R961	W958-G976 VanDerWaalsContact CH2-O 3.29Å; W958-G976 WeakPolarHBondContact CH2-O 3.24Å; R961-G976 PolarHBondContact NH1-O 3.34Å
977	L	83.7	Confident	80.8	Confident	126 Å²	126	83.3 Å²	83.3	66%	0.66	41%	0.413	S	S	*	.	S	Bend	trans	-69.8	156.9	-177.3	-65.6	173.5	0	0	0	112	R961 S979	R961-L977 PolarHBondContact NH1-O 3.08Å; R961-L977 PolarHBondContact NH2-O 3.49Å; L977-S979 PolarHBondContact O-N 3.41Å
978	I	81.8	Confident	80.1	Confident	27 Å²	27	75.5 Å²	75.5	14%	0.138	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-68.9	129.5	173.3	-68.4	167.2	0	0	0	108.6	R954 A957 W958 E982 L983	R954-I978 HydrophobicContact CB-CD1 4.06Å; R954-I978 HydrophobicContact CG-CD1 4.28Å; R954-I978 VanDerWaalsContact O-CD1 3.29Å; R954-I978 WeakPolarHBondContact O-CD1 3.4Å; A957-I978 HydrophobicContact CB-CD1 4.03Å; A957-I978 HydrophobicContact CB-CG1 4.44Å; A957-I978 HydrophobicContact CB-CG2 3.74Å; W958-I978 HydrophobicContact CD2-CD1 3.98Å; W958-I978 HydrophobicContact CD2-CG1 4.02Å; W958-I978 HydrophobicContact CG-CD1 3.79Å; W958-I978 HydrophobicContact CG-CG1 4.31Å; W958-I978 HydrophobicContact CZ2-CD1 4.36Å; W958-I978 HydrophobicContact CZ2-CG1 3.99Å; I978-E982 HydrophobicContact CG2-CB 3.94Å; I978-L983 HydrophobicContact CG2-CD2 3.84Å; I978-L983 HydrophobicContact CG2-CG 3.79Å
979	S	81.2	Confident	79.5	Confident	48 Å²	48	76 Å²	76	34%	0.336	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-76.7	156.2	175.6	63.5	0	0	0	0	111.8	L977 E981 E982 L983	L977-S979 PolarHBondContact O-N 3.41Å; S979-E981 PolarHBondContact O-N 3.29Å; S979-E982 PolarHBondContact N-OE2 3.22Å; S979-E982 PolarHBondContact O-N 3.39Å; S979-E982 VanDerWaalsContact OG-CD 3.29Å; S979-E982 VanDerWaalsContact OG-CG 3.28Å; S979-E982 WeakPolarHBondContact OG-CG 3.22Å; S979-E982 PolarHBondContact OG-N 3.22Å; S979-E982 PolarHBondContact OG-OE2 2.91Å; S979-L983 PolarHBondContact O-N 2.9Å
980	V	76.4	Confident	79.1	Confident	111 Å²	111	73.8 Å²	73.8	67%	0.673	37%	0.37	S	S	*	.	H	α-helix	trans	-58	-39.2	174.3	179.2	0	0	0	0	110.8	E982 L983 L984	V980-E982 VanDerWaalsContact C-N 3.34Å; V980-E982 PolarHBondContact O-N 3.42Å; V980-L983 WeakPolarHBondContact O-CB 3.4Å; V980-L983 PolarHBondContact O-N 2.95Å; V980-L984 HydrophobicContact CG1-CD1 4.18Å; V980-L984 HydrophobicContact CG1-CG 4.4Å; V980-L984 WeakPolarHBondContact O-CG 3.25Å; V980-L984 PolarHBondContact O-N 3Å
981	E	76.9	Confident	79.1	Confident	98 Å²	98	67 Å²	67	46%	0.458	34%	0.341	S	S	.	.	H	α-helix	trans	-61.6	-38.8	178.6	-171.5	52.4	-138.8	0	0	113	S979 L983 L984 Q985 R988	S979-E981 PolarHBondContact O-N 3.29Å; E981-L983 VanDerWaalsContact C-N 3.3Å; E981-L983 PolarHBondContact O-N 2.88Å; E981-L984 PolarHBondContact O-N 2.81Å; E981-Q985 WeakPolarHBondContact O-CB 3.33Å; E981-Q985 PolarHBondContact O-N 2.94Å; E981-R988 IonicContact OE1-CZ 2.89Å; E981-R988 IonicContact OE1-NH1 3.82Å; E981-R988 PolarHBondContact OE1-NH1 2.98Å; E981-R988 IonicContact OE1-NH2 3.29Å; E981-R988 PolarHBondContact OE1-NH2 3.39Å
982	E	81.9	Confident	78.8	Confident	15 Å²	15	65 Å²	65	7%	0.07	33%	0.329	C	S	.	.	H	α-helix	trans	-68.7	-29.5	175.4	-73.6	163.2	134.4	0	0	112.5	A957 R961 I978 S979 V980 A986	A957-E982 HydrophobicContact CB-CB 4.13Å; R961-E982 IonicContact CZ-OE1 3.04Å; R961-E982 IonicContact CZ-OE2 2.65Å; R961-E982 IonicContact NE-OE1 3.1Å; R961-E982 PolarHBondContact NE-OE1 3.4Å; R961-E982 IonicContact NE-OE2 2.78Å; R961-E982 VanDerWaalsContact NH2-CD 3.31Å; R961-E982 IonicContact NH2-OE1 2.75Å; R961-E982 PolarHBondContact NH2-OE1 3.25Å; R961-E982 IonicContact NH2-OE2 3.32Å; R961-E982 PolarHBondContact NH2-OE2 2.84Å; I978-E982 HydrophobicContact CG2-CB 3.94Å; S979-E982 PolarHBondContact N-OE2 3.22Å; S979-E982 PolarHBondContact O-N 3.39Å; S979-E982 VanDerWaalsContact OG-CD 3.29Å; S979-E982 VanDerWaalsContact OG-CG 3.28Å; S979-E982 WeakPolarHBondContact OG-CG 3.22Å; S979-E982 PolarHBondContact OG-N 3.22Å; S979-E982 PolarHBondContact OG-OE2 2.91Å; V980-E982 VanDerWaalsContact C-N 3.34Å; V980-E982 PolarHBondContact O-N 3.42Å; E982-A986 PolarHBondContact O-N 3.27Å
983	L	75.9	Confident	78.3	Confident	47 Å²	47	62.6 Å²	62.6	25%	0.246	32%	0.317	C	S	.	.	H	α-helix	trans	-71.7	-42.4	172.7	-65.6	174.3	0	0	0	111.1	L953 R954 A957 I978 S979 V980 E981 Q985 A986 E987	L953-L983 HydrophobicContact CD2-CB 4.01Å; L953-L983 HydrophobicContact CD2-CD2 3.84Å; L953-L983 HydrophobicContact CD2-CG 4.37Å; L953-L983 HydrophobicContact CG-CD2 3.94Å; R954-L983 HydrophobicContact CG-CD2 4.18Å; A957-L983 HydrophobicContact CB-CD2 4.09Å; I978-L983 HydrophobicContact CG2-CD2 3.84Å; I978-L983 HydrophobicContact CG2-CG 3.79Å; S979-L983 PolarHBondContact O-N 2.9Å; V980-L983 WeakPolarHBondContact O-CB 3.4Å; V980-L983 PolarHBondContact O-N 2.95Å; E981-L983 VanDerWaalsContact C-N 3.3Å; E981-L983 PolarHBondContact O-N 2.88Å; L983-Q985 VanDerWaalsContact C-N 3.33Å; L983-Q985 PolarHBondContact O-N 2.62Å; L983-A986 WeakPolarHBondContact O-CB 3.44Å; L983-A986 PolarHBondContact O-N 3.39Å; L983-A986 VanDerWaalsContact O-N 3.12Å; L983-E987 PolarHBondContact O-N 2.97Å; L983-E987 VanDerWaalsContact O-N 3.09Å
984	L	73.6	Confident	77.7	Confident	39 Å²	39	62.6 Å²	62.6	20%	0.204	32%	0.317	C	S	.	.	H	α-helix	trans	-62.3	-40.7	174.5	-69	172.3	0	0	0	111.3	V980 E981 A986 E987 R988	V980-L984 HydrophobicContact CG1-CD1 4.18Å; V980-L984 HydrophobicContact CG1-CG 4.4Å; V980-L984 WeakPolarHBondContact O-CG 3.25Å; V980-L984 PolarHBondContact O-N 3Å; E981-L984 PolarHBondContact O-N 2.81Å; L984-A986 VanDerWaalsContact C-N 3.26Å; L984-A986 PolarHBondContact O-N 3.35Å; L984-E987 PolarHBondContact O-N 3.32Å; L984-E987 VanDerWaalsContact O-N 3.08Å; L984-R988 PolarHBondContact O-N 3.46Å
985	Q	76	Confident	77.7	Confident	86 Å²	86	59.8 Å²	59.8	40%	0.402	30%	0.301	S	S	.	.	H	α-helix	trans	-58.1	-38.5	172.6	-171.4	-178.4	9.7	0	0	112.4	F960 E981 L983	F960-Q985 HydrophobicContact CD2-CG 4.19Å; F960-Q985 HydrophobicContact CE2-CG 4.33Å; E981-Q985 WeakPolarHBondContact O-CB 3.33Å; E981-Q985 PolarHBondContact O-N 2.94Å; L983-Q985 VanDerWaalsContact C-N 3.33Å; L983-Q985 PolarHBondContact O-N 2.62Å
986	A	70.2	Confident	77.7	Confident	5 Å²	5	58.4 Å²	58.4	4%	0.041	30%	0.3	C	S	.	.	H	α-helix	trans	-67.8	-35.3	175.5	0	0	0	0	0	112.7	L953 T956 E982 L983 L984	L953-A986 HydrophobicContact CD1-CB 3.84Å; L953-A986 HydrophobicContact CG-CB 4.28Å; T956-A986 HydrophobicContact CG2-CB 3.84Å; E982-A986 PolarHBondContact O-N 3.27Å; L983-A986 WeakPolarHBondContact O-CB 3.44Å; L983-A986 PolarHBondContact O-N 3.39Å; L983-A986 VanDerWaalsContact O-N 3.12Å; L984-A986 VanDerWaalsContact C-N 3.26Å; L984-A986 PolarHBondContact O-N 3.35Å
987	E	71.4	Confident	77.5	Confident	32 Å²	32	60.7 Å²	60.7	15%	0.15	30%	0.3	C	S	.	.	H	α-helix	trans	-66.1	-42.8	174.9	-65.9	-168.6	160.5	0	0	111.9	L953 L983 L984 Q989 V990 R1081	L953-E987 HydrophobicContact CD1-CG 3.56Å; L983-E987 PolarHBondContact O-N 2.97Å; L983-E987 VanDerWaalsContact O-N 3.09Å; L984-E987 PolarHBondContact O-N 3.32Å; L984-E987 VanDerWaalsContact O-N 3.08Å; E987-Q989 PolarHBondContact O-N 3.32Å; E987-V990 PolarHBondContact O-N 2.73Å; E987-R1081 VanDerWaalsContact CD-NH2 3.26Å; E987-R1081 IonicContact OE1-CZ 2.96Å; E987-R1081 IonicContact OE1-NH1 3.86Å; E987-R1081 IonicContact OE1-NH2 2.66Å; E987-R1081 PolarHBondContact OE1-NH2 2.86Å; E987-R1081 IonicContact OE2-NH2 2.95Å; E987-R1081 PolarHBondContact OE2-NH2 2.72Å
988	R	75	Confident	77.6	Confident	44 Å²	44	56.5 Å²	56.5	17%	0.166	28%	0.278	C	S	.	.	H	α-helix	trans	-57.3	-33.1	179	-73	-172.3	-74.7	-103.6	1.7	114	E981 L984 V990 Q991 K992 D1024 L1026	E981-R988 IonicContact OE1-CZ 2.89Å; E981-R988 IonicContact OE1-NH1 3.82Å; E981-R988 PolarHBondContact OE1-NH1 2.98Å; E981-R988 IonicContact OE1-NH2 3.29Å; E981-R988 PolarHBondContact OE1-NH2 3.39Å; L984-R988 PolarHBondContact O-N 3.46Å; R988-V990 PolarHBondContact O-N 3.27Å; R988-Q991 PolarHBondContact O-N 3.31Å; R988-K992 PolarHBondContact O-N 2.77Å; R988-D1024 WeakPolarHBondContact CD-O 3.3Å; R988-D1024 PolarHBondContact NH1-O 3.49Å; R988-L1026 HydrophobicContact CG-CD2 3.77Å; R988-L1026 HydrophobicContact CG-CG 4.28Å
989	Q	75.6	Confident	77.7	Confident	60 Å²	60	56.1 Å²	56.1	28%	0.28	28%	0.276	S	S	.	.	H	α-helix	trans	-60.9	-32.8	-175.2	-173.8	60.9	27.5	0	0	112.6	F960 E987 K992 E993	F960-Q989 HydrophobicContact CZ-CB 4.3Å; F960-Q989 HydrophobicContact CZ-CG 4.18Å; E987-Q989 PolarHBondContact O-N 3.32Å; Q989-K992 PolarHBondContact O-N 2.82Å; Q989-E993 PolarHBondContact O-N 3.43Å; Q989-E993 VanDerWaalsContact O-N 3.13Å
990	V	73.3	Confident	77.9	Confident	16 Å²	16	56.9 Å²	56.9	10%	0.097	28%	0.276	C	S	.	.	H	α-helix	trans	-68.6	-38.1	-179.1	-179.4	0	0	0	0	111.8	E987 R988 V1054	E987-V990 PolarHBondContact O-N 2.73Å; R988-V990 PolarHBondContact O-N 3.27Å; V990-V1054 HydrophobicContact CG2-CB 4.19Å; V990-V1054 HydrophobicContact CG2-CG1 4.08Å; V990-V1054 HydrophobicContact CG2-CG2 3.89Å
991	Q	80.5	Confident	78.3	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.009	25%	0.252	C	S	.	.	H	α-helix	trans	-71.1	-40.4	177.1	-68.8	-173.7	-34.8	0	0	111.2	R988 E993 Y994 F995 I999 L1027 L1047 L1048	R988-Q991 PolarHBondContact O-N 3.31Å; Q991-E993 VanDerWaalsContact C-N 3.29Å; Q991-E993 PolarHBondContact O-N 2.88Å; Q991-Y994 PolarHBondContact O-N 3.03Å; Q991-F995 HydrophobicContact CB-CD2 4.35Å; Q991-F995 HydrophobicContact CG-CD2 4.47Å; Q991-F995 WeakPolarHBondContact O-CA 3.47Å; Q991-F995 WeakPolarHBondContact O-CB 3.26Å; Q991-F995 PolarHBondContact O-N 3Å; Q991-I999 HydrophobicContact CB-CD1 4.1Å; Q991-L1027 PolarHBondContact NE2-O 2.81Å; Q991-L1047 PolarHBondContact NE2-O 3.39Å; Q991-L1048 HydrophobicContact CG-CD2 4.3Å
992	K	77.5	Confident	78.7	Confident	117 Å²	117	49.8 Å²	49.8	51%	0.509	24%	0.239	S	C	.	.	H	α-helix	trans	-60.3	-36.8	175.8	-74.5	-173.3	177.3	-175.8	0	112.8	R988 Q989 Y994 E996 I999	R988-K992 PolarHBondContact O-N 2.77Å; Q989-K992 PolarHBondContact O-N 2.82Å; K992-Y994 VanDerWaalsContact C-N 3.33Å; K992-Y994 PolarHBondContact O-N 3.46Å; K992-E996 VanDerWaalsContact O-CB 3.27Å; K992-E996 WeakPolarHBondContact O-CB 3.17Å; K992-E996 PolarHBondContact O-N 3.04Å; K992-I999 HydrophobicContact CG-CD1 4.41Å
993	E	74.1	Confident	78.8	Confident	77 Å²	77	53.3 Å²	53.3	36%	0.36	26%	0.261	S	S	.	.	H	α-helix	trans	-66.2	-33.7	179.4	-173.4	177.7	168.2	0	0	113.1	Q989 Q991 H1052	Q989-E993 PolarHBondContact O-N 3.43Å; Q989-E993 VanDerWaalsContact O-N 3.13Å; Q991-E993 VanDerWaalsContact C-N 3.29Å; Q991-E993 PolarHBondContact O-N 2.88Å; E993-H1052 IonicContact OE2-NE2 3.62Å
994	Y	76	Confident	79.3	Confident	94 Å²	94	57.5 Å²	57.5	37%	0.369	28%	0.277	S	S	.	.	H	α-helix	trans	-106.6	-29.2	-171.2	-115.5	-91.5	0	0	0	115	Q991 K992 P1049 N1051	Q991-Y994 PolarHBondContact O-N 3.03Å; K992-Y994 VanDerWaalsContact C-N 3.33Å; K992-Y994 PolarHBondContact O-N 3.46Å; Y994-P1049 HydrophobicContact CD1-CB 3.62Å; Y994-P1049 HydrophobicContact CD1-CG 4.17Å; Y994-P1049 HydrophobicContact CD2-CB 4.36Å; Y994-P1049 HydrophobicContact CD2-CG 4.08Å; Y994-P1049 HydrophobicContact CE1-CB 4.01Å; Y994-P1049 HydrophobicContact CG-CB 3.81Å; Y994-P1049 HydrophobicContact CG-CG 3.81Å; Y994-N1051 PolarHBondContact OH-ND2 3.21Å; Y994-N1051 PolarHBondContact OH-OD1 3.17Å
995	F	82.9	Confident	79.7	Confident	9 Å²	9	64.4 Å²	64.4	4%	0.039	31%	0.308	C	S	.	.	S	Bend	trans	-120.2	26.6	-173.6	-52.7	-46.9	0	0	0	111.3	Q991 D997 E998 I999 L1014 L1027 P1049 L1085	Q991-F995 HydrophobicContact CB-CD2 4.35Å; Q991-F995 HydrophobicContact CG-CD2 4.47Å; Q991-F995 WeakPolarHBondContact O-CA 3.47Å; Q991-F995 WeakPolarHBondContact O-CB 3.26Å; Q991-F995 PolarHBondContact O-N 3Å; F995-D997 VanDerWaalsContact C-N 3.31Å; F995-D997 PolarHBondContact O-N 3.27Å; F995-E998 WeakPolarHBondContact CA-OE2 3.23Å; F995-E998 HydrophobicContact CB-CB 4.46Å; F995-E998 PolarHBondContact O-N 3.49Å; F995-I999 HydrophobicContact CB-CD1 4.11Å; F995-I999 HydrophobicContact CB-CG1 4.26Å; F995-I999 WeakPolarHBondContact O-CB 3.24Å; F995-I999 VanDerWaalsContact O-CG1 3.22Å; F995-I999 WeakPolarHBondContact O-CG1 3.05Å; F995-I999 PolarHBondContact O-N 3.01Å; F995-L1014 HydrophobicContact CB-CD1 4.31Å; F995-L1014 HydrophobicContact CD1-CD1 3.64Å; F995-L1014 HydrophobicContact CD1-CG 4.41Å; F995-L1014 HydrophobicContact CD2-CD1 4.39Å; F995-L1014 HydrophobicContact CE1-CD1 3.96Å; F995-L1014 HydrophobicContact CE1-CD2 4.21Å; F995-L1014 HydrophobicContact CE1-CG 4.35Å; F995-L1014 HydrophobicContact CG-CD1 3.88Å; F995-L1014 HydrophobicContact CZ-CD1 4.46Å; F995-L1014 HydrophobicContact CZ-CD2 4.36Å; F995-L1027 HydrophobicContact CB-CD2 3.97Å; F995-L1027 HydrophobicContact CD2-CD2 3.8Å; F995-L1027 HydrophobicContact CG-CD2 4.07Å; F995-P1049 HydrophobicContact CZ-CB 4.08Å; F995-P1049 HydrophobicContact CZ-CG 4.47Å; F995-L1085 HydrophobicContact CE1-CD1 4.12Å; F995-L1085 HydrophobicContact CZ-CD1 4.06Å
996	E	81.6	Confident	80	Confident	121 Å²	121	66.8 Å²	66.8	57%	0.565	32%	0.317	S	S	*	.	H	α-helix	trans	-53.9	-47.4	-176.7	-165.4	171.2	-172	0	0	112	K992 N1000	K992-E996 VanDerWaalsContact O-CB 3.27Å; K992-E996 WeakPolarHBondContact O-CB 3.17Å; K992-E996 PolarHBondContact O-N 3.04Å; E996-N1000 WeakPolarHBondContact O-CB 3.34Å; E996-N1000 PolarHBondContact O-N 3.26Å; E996-N1000 PolarHBondContact O-ND2 3.41Å; E996-N1000 VanDerWaalsContact O-ND2 3.1Å
997	D	82.9	Confident	80.6	Confident	100 Å²	100	71.1 Å²	71.1	54%	0.535	35%	0.353	S	S	.	.	H	α-helix	trans	-62.8	-45.6	179.5	-78.5	-20.3	0	0	0	111.4	F995 N1000 C1001	F995-D997 VanDerWaalsContact C-N 3.31Å; F995-D997 PolarHBondContact O-N 3.27Å; D997-N1000 PolarHBondContact O-N 3.35Å; D997-C1001 PolarHBondContact O-N 3.44Å; D997-C1001 PolarHBondContact O-SG 2.95Å; D997-C1001 VanDerWaalsContact O-SG 3.35Å
998	E	84.3	Confident	81.2	Confident	39 Å²	39	70.8 Å²	70.8	18%	0.182	35%	0.352	C	S	.	.	H	α-helix	trans	-66.8	-44.2	178.6	-69.4	93.6	165.6	0	0	112.7	F995 N1000 C1001 I1002 L1008 S1012 L1014	F995-E998 WeakPolarHBondContact CA-OE2 3.23Å; F995-E998 HydrophobicContact CB-CB 4.46Å; F995-E998 PolarHBondContact O-N 3.49Å; E998-N1000 VanDerWaalsContact C-N 3.32Å; E998-N1000 PolarHBondContact O-N 3.25Å; E998-C1001 PolarHBondContact O-N 2.93Å; E998-I1002 WeakPolarHBondContact O-CG1 3.35Å; E998-I1002 PolarHBondContact O-N 2.94Å; E998-L1008 HydrophobicContact CB-CD2 3.64Å; E998-L1008 HydrophobicContact CG-CD2 3.64Å; E998-S1012 WeakPolarHBondContact CG-OG 3.5Å; E998-S1012 PolarHBondContact OE1-OG 3.07Å; E998-L1014 HydrophobicContact CB-CD1 4.09Å; E998-L1014 HydrophobicContact CG-CD1 3.99Å
999	I	84.7	Confident	81.5	Confident	19 Å²	19	76.8 Å²	76.8	10%	0.097	37%	0.374	C	S	.	.	H	α-helix	trans	-60.2	-45.4	175.2	-68.1	164.5	0	0	0	109.7	Q991 K992 F995 C1001 I1002 V1003 L1021 L1027	Q991-I999 HydrophobicContact CB-CD1 4.1Å; K992-I999 HydrophobicContact CG-CD1 4.41Å; F995-I999 HydrophobicContact CB-CD1 4.11Å; F995-I999 HydrophobicContact CB-CG1 4.26Å; F995-I999 WeakPolarHBondContact O-CB 3.24Å; F995-I999 VanDerWaalsContact O-CG1 3.22Å; F995-I999 WeakPolarHBondContact O-CG1 3.05Å; F995-I999 PolarHBondContact O-N 3.01Å; I999-C1001 VanDerWaalsContact C-N 3.33Å; I999-C1001 PolarHBondContact O-N 3.37Å; I999-I1002 PolarHBondContact O-N 3.39Å; I999-V1003 HydrophobicContact CG2-CG2 4.22Å; I999-V1003 WeakPolarHBondContact O-CB 3.33Å; I999-V1003 VanDerWaalsContact O-CG2 3.27Å; I999-V1003 WeakPolarHBondContact O-CG2 3.46Å; I999-V1003 PolarHBondContact O-N 2.88Å; I999-L1021 HydrophobicContact CG2-CD1 4.22Å; I999-L1027 HydrophobicContact CG1-CD1 4.49Å; I999-L1027 HydrophobicContact CG1-CD2 4.28Å
1000	N	85	Confident	81.7	Confident	64 Å²	64	79.4 Å²	79.4	34%	0.342	40%	0.4	S	S	.	.	H	α-helix	trans	-63.4	-35.9	177.5	-77.7	-32.1	0	0	0	113	E996 D997 E998 K1004	E996-N1000 WeakPolarHBondContact O-CB 3.34Å; E996-N1000 PolarHBondContact O-N 3.26Å; E996-N1000 PolarHBondContact O-ND2 3.41Å; E996-N1000 VanDerWaalsContact O-ND2 3.1Å; D997-N1000 PolarHBondContact O-N 3.35Å; E998-N1000 VanDerWaalsContact C-N 3.32Å; E998-N1000 PolarHBondContact O-N 3.25Å; N1000-K1004 VanDerWaalsContact O-CB 3.28Å; N1000-K1004 WeakPolarHBondContact O-CB 3.44Å; N1000-K1004 WeakPolarHBondContact O-CG 3.5Å; N1000-K1004 PolarHBondContact O-N 2.93Å; N1000-K1004 VanDerWaalsContact O-N 3.11Å
1001	C	85.4	Confident	82.1	Confident	26 Å²	26	83.3 Å²	83.3	18%	0.176	43%	0.428	C	S	.	.	H	α-helix	trans	-65.2	-46.6	173.6	-76.7	0	0	0	0	111.4	D997 E998 I999 K1004 H1005 K1006 L1008	D997-C1001 PolarHBondContact O-N 3.44Å; D997-C1001 PolarHBondContact O-SG 2.95Å; D997-C1001 VanDerWaalsContact O-SG 3.35Å; E998-C1001 PolarHBondContact O-N 2.93Å; I999-C1001 VanDerWaalsContact C-N 3.33Å; I999-C1001 PolarHBondContact O-N 3.37Å; C1001-K1004 CarbonylContact O-C 3.6Å; C1001-K1004 PolarHBondContact O-N 3.03Å; C1001-H1005 PolarHBondContact O-N 3.14Å; C1001-H1005 VanDerWaalsContact O-N 3.16Å; C1001-K1006 HydrophobicContact CB-CB 4.45Å; C1001-K1006 PolarHBondContact O-N 3.27Å; C1001-L1008 HydrophobicContact CB-CD2 3.92Å
1002	I	84.8	Confident	82.2	Confident	33 Å²	33	84 Å²	84	17%	0.169	43%	0.433	C	S	.	.	H	α-helix	trans	-63.5	-47.1	179.6	-66.1	164.3	0	0	0	110.9	E998 I999 K1004 H1005 L1008 P1019 L1021 L1027	E998-I1002 WeakPolarHBondContact O-CG1 3.35Å; E998-I1002 PolarHBondContact O-N 2.94Å; I999-I1002 PolarHBondContact O-N 3.39Å; I1002-K1004 PolarHBondContact O-N 2.75Å; I1002-H1005 PolarHBondContact O-N 3.28Å; I1002-L1008 HydrophobicContact CG1-CD2 4.42Å; I1002-P1019 HydrophobicContact CD1-CB 4.31Å; I1002-P1019 HydrophobicContact CD1-CG 4.2Å; I1002-P1019 WeakPolarHBondContact CD1-O 3.37Å; I1002-L1021 HydrophobicContact CG2-CD1 4.05Å; I1002-L1021 HydrophobicContact CG2-CG 4.07Å; I1002-L1027 HydrophobicContact CD1-CD1 3.42Å; I1002-L1027 VanDerWaalsContact CD1-CD1 3.42Å
1003	V	84.8	Confident	82.3	Confident	89 Å²	89	84.1 Å²	84.1	54%	0.539	43%	0.433	S	S	.	.	H	α-helix	trans	-60	-34.4	176.5	172.1	0	0	0	0	111.7	I999 H1005 L1021	I999-V1003 HydrophobicContact CG2-CG2 4.22Å; I999-V1003 WeakPolarHBondContact O-CB 3.33Å; I999-V1003 VanDerWaalsContact O-CG2 3.27Å; I999-V1003 WeakPolarHBondContact O-CG2 3.46Å; I999-V1003 PolarHBondContact O-N 2.88Å; V1003-H1005 VanDerWaalsContact C-N 3.28Å; V1003-H1005 PolarHBondContact O-N 3.16Å; V1003-L1021 HydrophobicContact CG2-CD1 3.47Å; V1003-L1021 VanDerWaalsContact CG2-CD1 3.47Å
1004	K	85.8	Confident	82.8	Confident	136 Å²	136	80.5 Å²	80.5	59%	0.591	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	9.5	177.5	-67.7	175.5	-177.3	176.1	0	113.3	N1000 C1001 I1002 K1006	N1000-K1004 VanDerWaalsContact O-CB 3.28Å; N1000-K1004 WeakPolarHBondContact O-CB 3.44Å; N1000-K1004 WeakPolarHBondContact O-CG 3.5Å; N1000-K1004 PolarHBondContact O-N 2.93Å; N1000-K1004 VanDerWaalsContact O-N 3.11Å; C1001-K1004 CarbonylContact O-C 3.6Å; C1001-K1004 PolarHBondContact O-N 3.03Å; I1002-K1004 PolarHBondContact O-N 2.75Å; K1004-K1006 HydrophobicContact CB-CD 4.43Å; K1004-K1006 HydrophobicContact CB-CG 4.18Å; K1004-K1006 PolarHBondContact O-N 2.56Å; K1004-K1006 VanDerWaalsContact O-N 3.15Å
1005	H	81.7	Confident	83.1	Confident	183 Å²	183	80.2 Å²	80.2	85%	0.847	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	36	-174.6	-59.5	-75.2	0	0	0	113.6	C1001 I1002 V1003	C1001-H1005 PolarHBondContact O-N 3.14Å; C1001-H1005 VanDerWaalsContact O-N 3.16Å; I1002-H1005 PolarHBondContact O-N 3.28Å; V1003-H1005 VanDerWaalsContact C-N 3.28Å; V1003-H1005 PolarHBondContact O-N 3.16Å
1006	K	83.5	Confident	83	Confident	137 Å²	137	86.9 Å²	86.9	60%	0.596	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-100.1	140.9	175.9	-66.8	-171.9	178.6	-171.2	0	110.1	C1001 K1004 L1008	C1001-K1006 HydrophobicContact CB-CB 4.45Å; C1001-K1006 PolarHBondContact O-N 3.27Å; K1004-K1006 HydrophobicContact CB-CD 4.43Å; K1004-K1006 HydrophobicContact CB-CG 4.18Å; K1004-K1006 PolarHBondContact O-N 2.56Å; K1004-K1006 VanDerWaalsContact O-N 3.15Å; K1006-L1008 PolarHBondContact O-N 3.11Å
1007	A	82.2	Confident	83.2	Confident	95 Å²	95	82.7 Å²	82.7	79%	0.785	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-57.3	137.7	172.7	0	0	0	0	0	111
1008	L	83.1	Confident	83.3	Confident	26 Å²	26	83.6 Å²	83.6	14%	0.136	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-62.9	147	173.2	-71.2	174	0	0	0	110.4	E998 C1001 I1002 K1006 S1010 L1015 P1019	E998-L1008 HydrophobicContact CB-CD2 3.64Å; E998-L1008 HydrophobicContact CG-CD2 3.64Å; C1001-L1008 HydrophobicContact CB-CD2 3.92Å; I1002-L1008 HydrophobicContact CG1-CD2 4.42Å; K1006-L1008 PolarHBondContact O-N 3.11Å; L1008-S1010 PolarHBondContact O-N 3.4Å; L1008-L1015 HydrophobicContact CB-CD1 3.91Å; L1008-P1019 HydrophobicContact CD1-CG 3.31Å
1009	R	81.8	Confident	83.4	Confident	169 Å²	169	82.4 Å²	82.4	64%	0.638	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-60.4	140.2	176.6	-63.9	-178.5	-178.1	164.5	3.7	109.5	S1011 S1012	R1009-S1011 PolarHBondContact O-N 3.14Å; R1009-S1012 WeakPolarHBondContact O-CB 3.48Å; R1009-S1012 PolarHBondContact O-N 3.21Å
1010	S	79.7	Confident	83.6	Confident	116 Å²	116	84.5 Å²	84.5	81%	0.811	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-23.3	177.2	56.2	0	0	0	0	113.8	L1008	L1008-S1010 PolarHBondContact O-N 3.4Å
1011	S	82.8	Confident	83.6	Confident	98 Å²	98	83.6 Å²	83.6	69%	0.685	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-11	175.7	57.8	0	0	0	0	114.7	R1009 K1013	R1009-S1011 PolarHBondContact O-N 3.14Å; S1011-K1013 PolarHBondContact O-N 3.05Å
1012	S	82.4	Confident	83.6	Confident	16 Å²	16	83.7 Å²	83.7	11%	0.112	44%	0.435	C	S	.	.			trans	-70.4	128.2	-179.9	-177.7	0	0	0	0	110.2	E998 R1009 L1014 L1015	E998-S1012 WeakPolarHBondContact CG-OG 3.5Å; E998-S1012 PolarHBondContact OE1-OG 3.07Å; R1009-S1012 WeakPolarHBondContact O-CB 3.48Å; R1009-S1012 PolarHBondContact O-N 3.21Å; S1012-L1014 PolarHBondContact O-N 3.09Å; S1012-L1014 PolarHBondContact OG-N 3.15Å; S1012-L1015 WeakPolarHBondContact O-CB 3.26Å; S1012-L1015 PolarHBondContact O-N 3.03Å
1013	K	79.4	Confident	83.3	Confident	119 Å²	119	91.8 Å²	91.8	52%	0.517	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-15.8	174.7	-63	177.1	-175.3	167	0	112.1	S1011	S1011-K1013 PolarHBondContact O-N 3.05Å
1014	L	84.2	Confident	83	Confident	2 Å²	2	91.1 Å²	91.1	1%	0.01	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-20.3	178.3	-64.4	-172.5	0	0	0	113	F995 E998 S1012 M1016 F1017 P1019 L1027 L1047 L1085	F995-L1014 HydrophobicContact CB-CD1 4.31Å; F995-L1014 HydrophobicContact CD1-CD1 3.64Å; F995-L1014 HydrophobicContact CD1-CG 4.41Å; F995-L1014 HydrophobicContact CD2-CD1 4.39Å; F995-L1014 HydrophobicContact CE1-CD1 3.96Å; F995-L1014 HydrophobicContact CE1-CD2 4.21Å; F995-L1014 HydrophobicContact CE1-CG 4.35Å; F995-L1014 HydrophobicContact CG-CD1 3.88Å; F995-L1014 HydrophobicContact CZ-CD1 4.46Å; F995-L1014 HydrophobicContact CZ-CD2 4.36Å; E998-L1014 HydrophobicContact CB-CD1 4.09Å; E998-L1014 HydrophobicContact CG-CD1 3.99Å; S1012-L1014 PolarHBondContact O-N 3.09Å; S1012-L1014 PolarHBondContact OG-N 3.15Å; L1014-M1016 PolarHBondContact O-N 3.23Å; L1014-M1016 VanDerWaalsContact O-N 3.08Å; L1014-F1017 HydrophobicContact CD2-CD2 4.35Å; L1014-F1017 PolarHBondContact O-N 3.2Å; L1014-P1019 HydrophobicContact CB-CG 4.18Å; L1014-P1019 WeakPolarHBondContact O-CD 3.16Å; L1014-L1027 HydrophobicContact CD1-CD2 3.76Å; L1014-L1047 HydrophobicContact CD2-CD1 4.37Å; L1014-L1047 HydrophobicContact CD2-CD2 4.29Å; L1014-L1085 HydrophobicContact CD2-CD1 3.96Å; L1014-L1085 HydrophobicContact CD2-CD2 3.98Å; L1014-L1085 HydrophobicContact CD2-CG 4.43Å
1015	L	82.2	Confident	82.7	Confident	87 Å²	87	86.3 Å²	86.3	46%	0.455	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-54.2	-34.8	-175.4	-173.6	70	0	0	0	113.1	L1008 S1012 F1017 D1018	L1008-L1015 HydrophobicContact CB-CD1 3.91Å; S1012-L1015 WeakPolarHBondContact O-CB 3.26Å; S1012-L1015 PolarHBondContact O-N 3.03Å; L1015-F1017 PolarHBondContact O-N 3.23Å; L1015-D1018 PolarHBondContact O-N 2.98Å
1016	M	81.7	Confident	82.9	Confident	149 Å²	149	77.9 Å²	77.9	73%	0.734	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-70.8	-14.2	179.6	71.9	-179	66.7	0	0	114.8	L1014	L1014-M1016 PolarHBondContact O-N 3.23Å; L1014-M1016 VanDerWaalsContact O-N 3.08Å
1017	F	84.4	Confident	83.1	Confident	34 Å²	34	71.3 Å²	71.3	15%	0.149	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-100.2	7.3	-176.9	-61	-70.8	0	0	0	113.1	L1014 L1015 V1029 G1030 L1047 W1083 L1085	L1014-F1017 HydrophobicContact CD2-CD2 4.35Å; L1014-F1017 PolarHBondContact O-N 3.2Å; L1015-F1017 PolarHBondContact O-N 3.23Å; F1017-V1029 HydrophobicContact CB-CG1 4.31Å; F1017-V1029 HydrophobicContact CB-CG2 4.49Å; F1017-G1030 PolarHBondContact O-N 3.02Å; F1017-L1047 HydrophobicContact CB-CD1 4.42Å; F1017-L1047 HydrophobicContact CB-CD2 4.4Å; F1017-L1047 HydrophobicContact CD2-CD2 4.35Å; F1017-L1047 HydrophobicContact CG-CD2 4.26Å; F1017-W1083 HydrophobicContact CD1-CZ2 4.38Å; F1017-W1083 AromaticContact CD1-NE1 3.66Å; F1017-W1083 AromaticContact CE1-CD1 3.97Å; F1017-W1083 AromaticContact CE1-CE2 3.54Å; F1017-W1083 AromaticContact CE1-CZ2 3.73Å; F1017-W1083 HydrophobicContact CE1-CZ2 3.73Å; F1017-W1083 AromaticContact CE1-NE1 3.04Å; F1017-W1083 AromaticContact CZ-NE1 3.48Å; F1017-L1085 HydrophobicContact CD2-CD2 4.14Å; F1017-L1085 HydrophobicContact CE2-CD2 3.44Å; F1017-L1085 VanDerWaalsContact CE2-CD2 3.44Å; F1017-L1085 HydrophobicContact CZ-CD2 3.97Å
1018	D	84.9	Confident	83.4	Confident	119 Å²	119	68.3 Å²	68.3	64%	0.636	36%	0.355	S	S	*	.			trans	42.6	57.1	-176.7	-169.4	31.6	0	0	0	112.9	L1015 G1030	L1015-D1018 PolarHBondContact O-N 2.98Å; D1018-G1030 WeakPolarHBondContact O-CA 3.47Å; D1018-G1030 PolarHBondContact O-N 2.83Å
1019	P	87.9	Confident	83.6	Confident	13 Å²	13	67.6 Å²	67.6	8%	0.084	35%	0.352	C	S	.	.			trans	-74.2	138.7	-163.8	32.7	-38.2	0	0	0	111.6	I1002 L1008 L1014 L1027 R1028 L1047	I1002-P1019 HydrophobicContact CD1-CB 4.31Å; I1002-P1019 HydrophobicContact CD1-CG 4.2Å; I1002-P1019 WeakPolarHBondContact CD1-O 3.37Å; L1008-P1019 HydrophobicContact CD1-CG 3.31Å; L1014-P1019 HydrophobicContact CB-CG 4.18Å; L1014-P1019 WeakPolarHBondContact O-CD 3.16Å; P1019-L1027 HydrophobicContact CB-CD1 4.06Å; P1019-L1027 HydrophobicContact CB-CG 4.4Å; P1019-R1028 VanDerWaalsContact CA-O 3.29Å; P1019-R1028 WeakPolarHBondContact CA-O 3.31Å; P1019-L1047 HydrophobicContact CB-CD1 3.68Å
1020	Y	86.9	Confident	83.4	Confident	64 Å²	64	60.4 Å²	60.4	25%	0.251	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	162.2	176.2	82.5	-79.3	0	0	0	111	D1022 R1028 R1044	Y1020-D1022 HydrophobicContact CE2-CB 4.3Å; Y1020-R1028 HydrophobicContact CD1-CB 4.4Å; Y1020-R1028 HydrophobicContact CE1-CB 3.83Å; Y1020-R1028 PolarHBondContact N-O 3.12Å; Y1020-R1028 VanDerWaalsContact N-O 3.11Å; Y1020-R1028 PolarHBondContact O-N 3.12Å; Y1020-R1044 HydrophobicContact CE1-CB 4.43Å; Y1020-R1044 WeakPolarHBondContact OH-CD 3.28Å; Y1020-R1044 PolarHBondContact OH-NH1 3.37Å
1021	L	86.7	Confident	82.9	Confident	45 Å²	45	56.7 Å²	56.7	24%	0.236	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	129.6	173.9	-70.1	168.9	0	0	0	109.6	I999 I1002 V1003 L1026 L1027	I999-L1021 HydrophobicContact CG2-CD1 4.22Å; I1002-L1021 HydrophobicContact CG2-CD1 4.05Å; I1002-L1021 HydrophobicContact CG2-CG 4.07Å; V1003-L1021 HydrophobicContact CG2-CD1 3.47Å; V1003-L1021 VanDerWaalsContact CG2-CD1 3.47Å; L1021-L1026 WeakPolarHBondContact CA-O 3.37Å; L1021-L1027 HydrophobicContact CD2-CB 4.18Å; L1021-L1027 HydrophobicContact CD2-CD1 4.11Å; L1021-L1027 HydrophobicContact CG-CD1 4.44Å
1022	D	83.8	Confident	82.4	Confident	27 Å²	27	64.1 Å²	64.1	14%	0.144	32%	0.323	C	S	.	.			trans	-77.3	179.8	171.8	71.1	0.8	0	0	0	112.5	Y1020 D1024 G1025 L1026 R1028	Y1020-D1022 HydrophobicContact CE2-CB 4.3Å; D1022-D1024 PolarHBondContact O-N 3.18Å; D1022-D1024 WeakPolarHBondContact OD1-CA 3.49Å; D1022-D1024 PolarHBondContact OD1-N 3.06Å; D1022-D1024 VanDerWaalsContact OD1-N 3.11Å; D1022-G1025 PolarHBondContact O-N 2.96Å; D1022-G1025 PolarHBondContact OD1-N 3.44Å; D1022-L1026 PolarHBondContact N-O 3.09Å; D1022-L1026 VanDerWaalsContact N-O 3.07Å; D1022-L1026 WeakPolarHBondContact OD1-CB 3.49Å; D1022-L1026 PolarHBondContact OD1-N 3.11Å; D1022-R1028 IonicContact OD2-CZ 3.29Å; D1022-R1028 VanDerWaalsContact OD2-CZ 3.26Å; D1022-R1028 IonicContact OD2-NE 3.96Å; D1022-R1028 PolarHBondContact OD2-NE 2.92Å; D1022-R1028 IonicContact OD2-NH2 3.12Å; D1022-R1028 PolarHBondContact OD2-NH2 2.75Å
1023	E	79.1	Confident	82.2	Confident	204 Å²	204	67.2 Å²	67.2	95%	0.953	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-29.9	178.1	-61.3	-179.5	179.7	0	0	112.8	G1025	E1023-G1025 VanDerWaalsContact C-N 3.27Å; E1023-G1025 PolarHBondContact O-N 2.9Å
1024	D	77.7	Confident	81.9	Confident	75 Å²	75	67.2 Å²	67.2	40%	0.401	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-5.4	177.6	-65.4	-40.5	0	0	0	113.1	R988 D1022 L1026	R988-D1024 WeakPolarHBondContact CD-O 3.3Å; R988-D1024 PolarHBondContact NH1-O 3.49Å; D1022-D1024 PolarHBondContact O-N 3.18Å; D1022-D1024 WeakPolarHBondContact OD1-CA 3.49Å; D1022-D1024 PolarHBondContact OD1-N 3.06Å; D1022-D1024 VanDerWaalsContact OD1-N 3.11Å; D1024-L1026 HydrophobicContact CB-CD1 4.47Å
1025	G	81	Confident	81.5	Confident	35 Å²	35	73 Å²	73	36%	0.361	38%	0.381	S	S	.	.	S	Bend	trans	77.3	22.9	-177.4	0	0	0	0	0	114.5	D1022 E1023	D1022-G1025 PolarHBondContact O-N 2.96Å; D1022-G1025 PolarHBondContact OD1-N 3.44Å; E1023-G1025 VanDerWaalsContact C-N 3.27Å; E1023-G1025 PolarHBondContact O-N 2.9Å
1026	L	85.2	Confident	81.4	Confident	5 Å²	5	70.3 Å²	70.3	3%	0.026	37%	0.371	C	S	.	.			trans	-92.9	135.9	173.8	-69.5	167.4	0	0	0	111.1	R988 L1021 D1022 D1024 R1028 I1046	R988-L1026 HydrophobicContact CG-CD2 3.77Å; R988-L1026 HydrophobicContact CG-CG 4.28Å; L1021-L1026 WeakPolarHBondContact CA-O 3.37Å; D1022-L1026 PolarHBondContact N-O 3.09Å; D1022-L1026 VanDerWaalsContact N-O 3.07Å; D1022-L1026 WeakPolarHBondContact OD1-CB 3.49Å; D1022-L1026 PolarHBondContact OD1-N 3.11Å; D1024-L1026 HydrophobicContact CB-CD1 4.47Å; L1026-R1028 PolarHBondContact O-N 3.2Å; L1026-I1046 HydrophobicContact CD1-CD1 4.03Å
1027	L	87.5	Confident	81.4	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	119.3	176.6	-167.8	68.9	0	0	0	110.1	Q991 F995 I999 I1002 L1014 P1019 L1021 L1047	Q991-L1027 PolarHBondContact NE2-O 2.81Å; F995-L1027 HydrophobicContact CB-CD2 3.97Å; F995-L1027 HydrophobicContact CD2-CD2 3.8Å; F995-L1027 HydrophobicContact CG-CD2 4.07Å; I999-L1027 HydrophobicContact CG1-CD1 4.49Å; I999-L1027 HydrophobicContact CG1-CD2 4.28Å; I1002-L1027 HydrophobicContact CD1-CD1 3.42Å; I1002-L1027 VanDerWaalsContact CD1-CD1 3.42Å; L1014-L1027 HydrophobicContact CD1-CD2 3.76Å; P1019-L1027 HydrophobicContact CB-CD1 4.06Å; P1019-L1027 HydrophobicContact CB-CG 4.4Å; L1021-L1027 HydrophobicContact CD2-CB 4.18Å; L1021-L1027 HydrophobicContact CD2-CD1 4.11Å; L1021-L1027 HydrophobicContact CG-CD1 4.44Å; L1027-L1047 HydrophobicContact CD2-CB 4.48Å; L1027-L1047 HydrophobicContact CD2-CD1 4.42Å; L1027-L1047 HydrophobicContact CG-CB 4.44Å; L1027-L1047 HydrophobicContact CG-CD1 4.16Å; L1027-L1047 PolarHBondContact O-N 2.85Å
1028	R	89.1	Confident	81.3	Confident	31 Å²	31	71.4 Å²	71.4	12%	0.117	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	160.6	-177.3	-69.3	-177.6	-176.7	-94.6	0.6	112.4	P1019 Y1020 D1022 L1026 R1044 Q1045 I1046	P1019-R1028 VanDerWaalsContact CA-O 3.29Å; P1019-R1028 WeakPolarHBondContact CA-O 3.31Å; Y1020-R1028 HydrophobicContact CD1-CB 4.4Å; Y1020-R1028 HydrophobicContact CE1-CB 3.83Å; Y1020-R1028 PolarHBondContact N-O 3.12Å; Y1020-R1028 VanDerWaalsContact N-O 3.11Å; Y1020-R1028 PolarHBondContact O-N 3.12Å; D1022-R1028 IonicContact OD2-CZ 3.29Å; D1022-R1028 VanDerWaalsContact OD2-CZ 3.26Å; D1022-R1028 IonicContact OD2-NE 3.96Å; D1022-R1028 PolarHBondContact OD2-NE 2.92Å; D1022-R1028 IonicContact OD2-NH2 3.12Å; D1022-R1028 PolarHBondContact OD2-NH2 2.75Å; L1026-R1028 PolarHBondContact O-N 3.2Å; R1028-R1044 VanDerWaalsContact CD-O 3.29Å; R1028-R1044 WeakPolarHBondContact CD-O 3.27Å; R1028-R1044 PolarHBondContact NH1-O 2.81Å; R1028-Q1045 CarbonylContact C-O 3.56Å; R1028-Q1045 VanDerWaalsContact CA-O 3.23Å; R1028-Q1045 WeakPolarHBondContact CA-O 3.45Å; R1028-Q1045 WeakPolarHBondContact CB-O 3.48Å; R1028-I1046 HydrophobicContact CG-CG1 4.39Å
1029	V	86.7	Confident	81.1	Confident	12 Å²	12	73 Å²	73	7%	0.073	39%	0.394	C	S	.	.			trans	-71	127.5	171.4	-179.4	0	0	0	0	109.6	F1017 Q1045 L1047 W1083	F1017-V1029 HydrophobicContact CB-CG1 4.31Å; F1017-V1029 HydrophobicContact CB-CG2 4.49Å; V1029-Q1045 PolarHBondContact N-O 2.95Å; V1029-L1047 HydrophobicContact CG2-CD1 4.29Å; V1029-L1047 HydrophobicContact CG2-CD2 3.66Å; V1029-L1047 HydrophobicContact CG2-CG 3.73Å; V1029-W1083 HydrophobicContact CG2-CB 3.64Å; V1029-W1083 HydrophobicContact CG2-CD2 4.22Å; V1029-W1083 HydrophobicContact CG2-CG 3.78Å
1030	G	79	Confident	80.6	Confident	18 Å²	18	77.3 Å²	77.3	19%	0.186	41%	0.413	C	S	.	.			trans	-78.1	119.4	161.8	0	0	0	0	0	108.7	F1017 D1018	F1017-G1030 PolarHBondContact O-N 3.02Å; D1018-G1030 WeakPolarHBondContact O-CA 3.47Å; D1018-G1030 PolarHBondContact O-N 2.83Å
1031	G	67.2	Low	80.2	Confident	37 Å²	37	76 Å²	76	38%	0.381	42%	0.416	S	S	.	.			trans	-136.6	156.7	-166.5	0	0	0	0	0	113.3	L1033	G1031-L1033 PolarHBondContact O-N 3.19Å
1032	R	74.3	Confident	80	Confident	254 Å²	254	74.5 Å²	74.5	96%	0.958	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	7.5	178.4	-58	-179.7	-176.9	-178.6	-1	114	E1034	R1032-E1034 VanDerWaalsContact C-N 3.34Å
1033	L	76.9	Confident	79.9	Confident	82 Å²	82	74.9 Å²	74.9	43%	0.429	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	11.7	-176	-66.2	176.4	0	0	0	113	G1031 S1035 A1036 I1038 K1043	G1031-L1033 PolarHBondContact O-N 3.19Å; L1033-S1035 VanDerWaalsContact C-N 3.27Å; L1033-S1035 PolarHBondContact O-N 3.16Å; L1033-A1036 HydrophobicContact CB-CB 4.23Å; L1033-A1036 HydrophobicContact CD2-CB 4.29Å; L1033-A1036 VanDerWaalsContact O-CB 3.24Å; L1033-A1036 WeakPolarHBondContact O-CB 3.48Å; L1033-A1036 PolarHBondContact O-N 3.15Å; L1033-I1038 HydrophobicContact CD1-CD1 4.26Å; L1033-K1043 HydrophobicContact CB-CB 4.45Å; L1033-K1043 WeakPolarHBondContact O-CD 3.36Å
1034	E	73	Confident	80.2	Confident	118 Å²	118	68.2 Å²	68.2	55%	0.551	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-42.8	-177.6	-174.8	161.2	-138.2	0	0	112.5	R1032 A1036 K1043 R1044	R1032-E1034 VanDerWaalsContact C-N 3.34Å; E1034-A1036 VanDerWaalsContact C-N 3.31Å; E1034-A1036 PolarHBondContact O-N 3.01Å; E1034-K1043 PolarHBondContact O-NZ 3.01Å; E1034-R1044 IonicContact OE1-CZ 3.55Å; E1034-R1044 IonicContact OE1-NH2 3.45Å; E1034-R1044 PolarHBondContact OE1-NH2 3.25Å
1035	S	76.8	Confident	80.7	Confident	125 Å²	125	65.5 Å²	65.5	87%	0.874	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	0.6	177.4	-45.6	0	0	0	0	114.6	L1033	L1033-S1035 VanDerWaalsContact C-N 3.27Å; L1033-S1035 PolarHBondContact O-N 3.16Å
1036	A	79.3	Confident	81.1	Confident	29 Å²	29	64.2 Å²	64.2	24%	0.24	35%	0.346	C	S	.	.	S	Bend	trans	-75.2	142.7	179.8	0	0	0	0	0	111.4	L1033 E1034 I1038 K1043	L1033-A1036 HydrophobicContact CB-CB 4.23Å; L1033-A1036 HydrophobicContact CD2-CB 4.29Å; L1033-A1036 VanDerWaalsContact O-CB 3.24Å; L1033-A1036 WeakPolarHBondContact O-CB 3.48Å; L1033-A1036 PolarHBondContact O-N 3.15Å; E1034-A1036 VanDerWaalsContact C-N 3.31Å; E1034-A1036 PolarHBondContact O-N 3.01Å; A1036-I1038 HydrophobicContact CB-CD1 4.22Å; A1036-I1038 HydrophobicContact CB-CG1 4.01Å; A1036-I1038 PolarHBondContact O-N 3.45Å; A1036-K1043 WeakPolarHBondContact O-CE 3.37Å; A1036-K1043 PolarHBondContact O-NZ 2.8Å
1037	S	82.8	Confident	81.2	Confident	130 Å²	130	64 Å²	64	91%	0.909	35%	0.345	S	S	*	.	S	Bend	trans	-81.3	51.6	176.6	61.9	0	0	0	0	112.4
1038	I	80.9	Confident	81.3	Confident	77 Å²	77	64.9 Å²	64.9	40%	0.395	35%	0.35	S	S	.	.	S	Bend	trans	-121.5	165.2	178	64.1	179.8	0	0	0	110.3	L1033 A1036 A1042 K1043	L1033-I1038 HydrophobicContact CD1-CD1 4.26Å; A1036-I1038 HydrophobicContact CB-CD1 4.22Å; A1036-I1038 HydrophobicContact CB-CG1 4.01Å; A1036-I1038 PolarHBondContact O-N 3.45Å; I1038-A1042 HydrophobicContact CD1-CB 4.04Å; I1038-A1042 HydrophobicContact CG1-CB 4.39Å; I1038-K1043 HydrophobicContact CD1-CG 4.06Å; I1038-K1043 HydrophobicContact CG1-CG 3.56Å; I1038-K1043 WeakPolarHBondContact O-CE 3.31Å
1039	Q	80.3	Confident	81.1	Confident	152 Å²	152	63.5 Å²	63.5	71%	0.71	34%	0.344	S	S	*	.			trans	-59.6	143.1	177.9	-68.6	-175.2	-19.9	0	0	111.8	A1041 A1042 K1043	Q1039-A1041 VanDerWaalsContact C-N 3.27Å; Q1039-A1041 PolarHBondContact O-N 3.32Å; Q1039-A1042 WeakPolarHBondContact O-CA 3.39Å; Q1039-A1042 WeakPolarHBondContact O-CB 3.32Å; Q1039-A1042 PolarHBondContact O-N 2.76Å; Q1039-K1043 PolarHBondContact O-N 2.88Å; Q1039-K1043 VanDerWaalsContact O-N 3.13Å
1040	E	77.5	Confident	80.9	Confident	104 Å²	104	64.8 Å²	64.8	49%	0.486	35%	0.349	S	S	.	.	H	α-helix	trans	-56.9	-38.5	-173.4	-162.3	55.9	-140.5	0	0	113	A1042 K1043 R1044	E1040-A1042 PolarHBondContact O-N 2.81Å; E1040-K1043 WeakPolarHBondContact O-CB 3.3Å; E1040-K1043 PolarHBondContact O-N 2.89Å; E1040-K1043 WeakPolarHBondContact OE2-CD 3.1Å; E1040-K1043 WeakPolarHBondContact OE2-CE 3.22Å; E1040-K1043 IonicContact OE2-NZ 3.59Å; E1040-K1043 PolarHBondContact OE2-NZ 2.9Å; E1040-R1044 PolarHBondContact O-N 3.45Å; E1040-R1044 VanDerWaalsContact O-N 3.08Å; E1040-R1044 IonicContact OE1-NE 3.96Å
1041	A	80.3	Confident	80.9	Confident	36 Å²	36	66.9 Å²	66.9	30%	0.298	36%	0.357	S	S	.	.	H	α-helix	trans	-61.3	-27.2	175	0	0	0	0	0	113.8	Q1039 R1044 Q1080	Q1039-A1041 VanDerWaalsContact C-N 3.27Å; Q1039-A1041 PolarHBondContact O-N 3.32Å; A1041-R1044 CarbonylContact O-C 3.37Å; A1041-Q1080 CarbonylContact C-O 3.43Å; A1041-Q1080 VanDerWaalsContact C-O 3.26Å
1042	A	81.1	Confident	81.4	Confident	14 Å²	14	65.5 Å²	65.5	12%	0.116	34%	0.34	C	S	.	.	H	α-helix	trans	-88.8	-20.1	176.7	0	0	0	0	0	112.6	I1038 Q1039 E1040 Q1045 Q1080	I1038-A1042 HydrophobicContact CD1-CB 4.04Å; I1038-A1042 HydrophobicContact CG1-CB 4.39Å; Q1039-A1042 WeakPolarHBondContact O-CA 3.39Å; Q1039-A1042 WeakPolarHBondContact O-CB 3.32Å; Q1039-A1042 PolarHBondContact O-N 2.76Å; E1040-A1042 PolarHBondContact O-N 2.81Å; A1042-Q1045 PolarHBondContact O-NE2 2.97Å; A1042-Q1080 WeakPolarHBondContact CA-O 3.33Å; A1042-Q1080 WeakPolarHBondContact CB-O 3.3Å; A1042-Q1080 PolarHBondContact N-O 2.83Å; A1042-Q1080 VanDerWaalsContact N-O 3.17Å
1043	K	81.6	Confident	81.6	Confident	34 Å²	34	55.1 Å²	55.1	15%	0.148	31%	0.305	C	S	.	.	H	α-helix	trans	-73	-40.6	169.8	-59.1	-173.5	-167.3	-174.7	0	111.2	L1033 E1034 A1036 I1038 Q1039 E1040	L1033-K1043 HydrophobicContact CB-CB 4.45Å; L1033-K1043 WeakPolarHBondContact O-CD 3.36Å; E1034-K1043 PolarHBondContact O-NZ 3.01Å; A1036-K1043 WeakPolarHBondContact O-CE 3.37Å; A1036-K1043 PolarHBondContact O-NZ 2.8Å; I1038-K1043 HydrophobicContact CD1-CG 4.06Å; I1038-K1043 HydrophobicContact CG1-CG 3.56Å; I1038-K1043 WeakPolarHBondContact O-CE 3.31Å; Q1039-K1043 PolarHBondContact O-N 2.88Å; Q1039-K1043 VanDerWaalsContact O-N 3.13Å; E1040-K1043 WeakPolarHBondContact O-CB 3.3Å; E1040-K1043 PolarHBondContact O-N 2.89Å; E1040-K1043 WeakPolarHBondContact OE2-CD 3.1Å; E1040-K1043 WeakPolarHBondContact OE2-CE 3.22Å; E1040-K1043 IonicContact OE2-NZ 3.59Å; E1040-K1043 PolarHBondContact OE2-NZ 2.9Å
1044	R	85	Confident	81.7	Confident	65 Å²	65	52 Å²	52	25%	0.245	29%	0.289	C	S	.	.	S	Bend	trans	-130.5	80.7	-172	-52.9	-170.3	-175.9	-163.6	-1.2	110.2	Y1020 R1028 E1034 E1040 A1041	Y1020-R1044 HydrophobicContact CE1-CB 4.43Å; Y1020-R1044 WeakPolarHBondContact OH-CD 3.28Å; Y1020-R1044 PolarHBondContact OH-NH1 3.37Å; R1028-R1044 VanDerWaalsContact CD-O 3.29Å; R1028-R1044 WeakPolarHBondContact CD-O 3.27Å; R1028-R1044 PolarHBondContact NH1-O 2.81Å; E1034-R1044 IonicContact OE1-CZ 3.55Å; E1034-R1044 IonicContact OE1-NH2 3.45Å; E1034-R1044 PolarHBondContact OE1-NH2 3.25Å; E1040-R1044 PolarHBondContact O-N 3.45Å; E1040-R1044 VanDerWaalsContact O-N 3.08Å; E1040-R1044 IonicContact OE1-NE 3.96Å; A1041-R1044 CarbonylContact O-C 3.37Å
1045	Q	89.2	Confident	82.2	Confident	17 Å²	17	46.5 Å²	46.5	8%	0.079	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-71.2	149.5	-175.1	-61.9	87.2	-2.5	0	0	113	R1028 V1029 A1042 L1047 R1079 R1081 W1083	R1028-Q1045 CarbonylContact C-O 3.56Å; R1028-Q1045 VanDerWaalsContact CA-O 3.23Å; R1028-Q1045 WeakPolarHBondContact CA-O 3.45Å; R1028-Q1045 WeakPolarHBondContact CB-O 3.48Å; V1029-Q1045 PolarHBondContact N-O 2.95Å; A1042-Q1045 PolarHBondContact O-NE2 2.97Å; Q1045-L1047 PolarHBondContact O-N 2.87Å; Q1045-R1079 WeakPolarHBondContact CG-O 3.17Å; Q1045-R1079 PolarHBondContact NE2-O 3.19Å; Q1045-R1081 WeakPolarHBondContact CA-O 3.41Å; Q1045-W1083 HydrophobicContact CB-CB 3.86Å
1046	I	88.7	Confident	82.7	Confident	8 Å²	8	42.3 Å²	42.3	4%	0.041	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	124.4	176.1	-57.1	168.7	0	0	0	110.3	L1026 R1028 L1048 R1081 V1082 W1083	L1026-I1046 HydrophobicContact CD1-CD1 4.03Å; R1028-I1046 HydrophobicContact CG-CG1 4.39Å; I1046-L1048 HydrophobicContact CG2-CD2 4.43Å; I1046-L1048 HydrophobicContact CG2-CG 4.44Å; I1046-R1081 HydrophobicContact CD1-CG 4.42Å; I1046-R1081 PolarHBondContact N-O 3.16Å; I1046-V1082 HydrophobicContact CB-CG1 4.3Å; I1046-V1082 CarbonylContact O-C 3.59Å; I1046-V1082 WeakPolarHBondContact O-CA 3.11Å; I1046-W1083 PolarHBondContact O-N 3.44Å
1047	L	88.6	Confident	83	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	127.6	179.1	-81.5	165.2	0	0	0	111.6	Q991 L1014 F1017 P1019 L1027 V1029 Q1045 W1083 L1085	Q991-L1047 PolarHBondContact NE2-O 3.39Å; L1014-L1047 HydrophobicContact CD2-CD1 4.37Å; L1014-L1047 HydrophobicContact CD2-CD2 4.29Å; F1017-L1047 HydrophobicContact CB-CD1 4.42Å; F1017-L1047 HydrophobicContact CB-CD2 4.4Å; F1017-L1047 HydrophobicContact CD2-CD2 4.35Å; F1017-L1047 HydrophobicContact CG-CD2 4.26Å; P1019-L1047 HydrophobicContact CB-CD1 3.68Å; L1027-L1047 HydrophobicContact CD2-CB 4.48Å; L1027-L1047 HydrophobicContact CD2-CD1 4.42Å; L1027-L1047 HydrophobicContact CG-CB 4.44Å; L1027-L1047 HydrophobicContact CG-CD1 4.16Å; L1027-L1047 PolarHBondContact O-N 2.85Å; V1029-L1047 HydrophobicContact CG2-CD1 4.29Å; V1029-L1047 HydrophobicContact CG2-CD2 3.66Å; V1029-L1047 HydrophobicContact CG2-CG 3.73Å; Q1045-L1047 PolarHBondContact O-N 2.87Å; L1047-W1083 HydrophobicContact CD2-CB 4.21Å; L1047-W1083 HydrophobicContact CD2-CG 4.27Å; L1047-L1085 HydrophobicContact CD2-CD2 4.46Å
1048	L	88.6	Confident	83.2	Confident	20 Å²	20	36.4 Å²	36.4	11%	0.105	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	145.6	179.5	-67.3	176.8	0	0	0	112.5	Q991 I1046 V1055 L1058 V1082 W1083 I1084 L1085	Q991-L1048 HydrophobicContact CG-CD2 4.3Å; I1046-L1048 HydrophobicContact CG2-CD2 4.43Å; I1046-L1048 HydrophobicContact CG2-CG 4.44Å; L1048-V1055 HydrophobicContact CB-CG2 3.95Å; L1048-V1055 HydrophobicContact CD1-CG2 4.26Å; L1048-L1058 HydrophobicContact CD1-CD2 3.86Å; L1048-V1082 HydrophobicContact CD1-CB 3.99Å; L1048-V1082 HydrophobicContact CD1-CG1 3.86Å; L1048-W1083 PolarHBondContact N-O 3.07Å; L1048-I1084 HydrophobicContact CB-CG1 4.26Å; L1048-I1084 WeakPolarHBondContact O-CA 3.5Å; L1048-L1085 PolarHBondContact O-N 3.43Å
1049	P	85.7	Confident	83.6	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.006	17%	0.167	C	C	.	.			trans	-71.6	150	176.9	31	-36.3	0	0	0	112	Y994 F995 N1051 H1052 V1055	Y994-P1049 HydrophobicContact CD1-CB 3.62Å; Y994-P1049 HydrophobicContact CD1-CG 4.17Å; Y994-P1049 HydrophobicContact CD2-CB 4.36Å; Y994-P1049 HydrophobicContact CD2-CG 4.08Å; Y994-P1049 HydrophobicContact CE1-CB 4.01Å; Y994-P1049 HydrophobicContact CG-CB 3.81Å; Y994-P1049 HydrophobicContact CG-CG 3.81Å; F995-P1049 HydrophobicContact CZ-CB 4.08Å; F995-P1049 HydrophobicContact CZ-CG 4.47Å; P1049-N1051 VanDerWaalsContact C-N 3.34Å; P1049-N1051 PolarHBondContact O-N 3.02Å; P1049-H1052 HydrophobicContact CG-CB 3.83Å; P1049-V1055 VanDerWaalsContact O-CG2 3.27Å; P1049-V1055 WeakPolarHBondContact O-CG2 3.44Å
1050	H	81.2	Confident	83.9	Confident	39 Å²	39	29.1 Å²	29.1	18%	0.181	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-17.8	-178.2	78.7	-61.9	0	0	0	115.3	I1084 L1085 R1086 C1090 R1093	H1050-I1084 HydrophobicContact CB-CG2 4.41Å; H1050-L1085 HydrophobicContact CB-CB 4.43Å; H1050-L1085 WeakPolarHBondContact CB-O 3.37Å; H1050-R1086 HydrophobicContact CB-CB 4.23Å; H1050-R1086 PolarHBondContact NE2-NH1 2.89Å; H1050-C1090 PolarHBondContact O-SG 3.13Å; H1050-C1090 VanDerWaalsContact O-SG 3.41Å; H1050-R1093 PolarHBondContact O-NH2 3.16Å
1051	N	78.9	Confident	84.4	Confident	63 Å²	63	27 Å²	27	34%	0.337	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.4	48	-165.4	61.7	-41.7	0	0	0	110.8	Y994 P1049	Y994-N1051 PolarHBondContact OH-ND2 3.21Å; Y994-N1051 PolarHBondContact OH-OD1 3.17Å; P1049-N1051 VanDerWaalsContact C-N 3.34Å; P1049-N1051 PolarHBondContact O-N 3.02Å
1052	H	78.8	Confident	84.8	Confident	8 Å²	8	26 Å²	26	4%	0.037	13%	0.125	C	C	.	.			trans	-129.5	139.1	176.2	-166.9	-95.8	0	0	0	110.2	E993 P1049 V1054 V1055 D1056	E993-H1052 IonicContact OE2-NE2 3.62Å; P1049-H1052 HydrophobicContact CG-CB 3.83Å; H1052-V1054 WeakPolarHBondContact CE1-CG2 3.41Å; H1052-V1054 WeakPolarHBondContact ND1-CB 3.3Å; H1052-V1054 WeakPolarHBondContact ND1-CG2 3.24Å; H1052-V1054 PolarHBondContact ND1-N 2.79Å; H1052-V1054 PolarHBondContact O-N 3.41Å; H1052-V1055 HydrophobicContact CB-CG2 4.28Å; H1052-V1055 WeakPolarHBondContact O-CA 3.26Å; H1052-V1055 WeakPolarHBondContact O-CB 3.11Å; H1052-V1055 PolarHBondContact O-N 3.42Å; H1052-D1056 PolarHBondContact O-N 2.95Å; H1052-D1056 VanDerWaalsContact O-N 3.09Å
1053	V	77.7	Confident	85.3	Confident	36 Å²	36	25.5 Å²	25.5	22%	0.218	12%	0.12	C	C	.	.	H	α-helix	trans	-62.4	-34	-174.3	175.1	0	0	0	0	111.5	V943 L944 V1055 D1056 L1057	V943-V1053 HydrophobicContact CG1-CB 3.49Å; V943-V1053 VanDerWaalsContact CG1-CB 3.49Å; V943-V1053 HydrophobicContact CG1-CG1 3.57Å; V943-V1053 HydrophobicContact CG1-CG2 4.46Å; L944-V1053 HydrophobicContact CD2-CG2 3.92Å; V1053-V1055 PolarHBondContact O-N 2.79Å; V1053-D1056 PolarHBondContact O-N 3.17Å; V1053-L1057 HydrophobicContact CG1-CD1 4.39Å; V1053-L1057 HydrophobicContact CG1-CG 4.41Å; V1053-L1057 WeakPolarHBondContact O-CG 3.27Å; V1053-L1057 PolarHBondContact O-N 3.21Å
1054	V	79.4	Confident	85.6	Confident	17 Å²	17	28.1 Å²	28.1	10%	0.103	13%	0.133	C	C	.	.	H	α-helix	trans	-59.4	-37.7	173.8	177.9	0	0	0	0	111.7	V943 F949 L952 V990 H1052 L1057 L1058	V943-V1054 HydrophobicContact CG1-CG2 3.94Å; F949-V1054 HydrophobicContact CD2-CG1 3.87Å; F949-V1054 HydrophobicContact CE2-CG1 3.49Å; F949-V1054 VanDerWaalsContact CE2-CG1 3.49Å; L952-V1054 HydrophobicContact CD2-CG2 3.69Å; V990-V1054 HydrophobicContact CG2-CB 4.19Å; V990-V1054 HydrophobicContact CG2-CG1 4.08Å; V990-V1054 HydrophobicContact CG2-CG2 3.89Å; H1052-V1054 WeakPolarHBondContact CE1-CG2 3.41Å; H1052-V1054 WeakPolarHBondContact ND1-CB 3.3Å; H1052-V1054 WeakPolarHBondContact ND1-CG2 3.24Å; H1052-V1054 PolarHBondContact ND1-N 2.79Å; H1052-V1054 PolarHBondContact O-N 3.41Å; V1054-L1057 PolarHBondContact O-N 2.78Å; V1054-L1058 WeakPolarHBondContact O-CB 3.15Å; V1054-L1058 PolarHBondContact O-N 2.77Å
1055	V	84.5	Confident	85.6	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-73.2	-39.2	179.3	177.1	0	0	0	0	110.6	L1048 P1049 H1052 V1053 L1057 L1058 V1059 I1084	L1048-V1055 HydrophobicContact CB-CG2 3.95Å; L1048-V1055 HydrophobicContact CD1-CG2 4.26Å; P1049-V1055 VanDerWaalsContact O-CG2 3.27Å; P1049-V1055 WeakPolarHBondContact O-CG2 3.44Å; H1052-V1055 HydrophobicContact CB-CG2 4.28Å; H1052-V1055 WeakPolarHBondContact O-CA 3.26Å; H1052-V1055 WeakPolarHBondContact O-CB 3.11Å; H1052-V1055 PolarHBondContact O-N 3.42Å; V1053-V1055 PolarHBondContact O-N 2.79Å; V1055-L1057 VanDerWaalsContact C-N 3.31Å; V1055-L1057 PolarHBondContact O-N 3.48Å; V1055-L1058 PolarHBondContact O-N 3.35Å; V1055-V1059 HydrophobicContact CG1-CG2 4.39Å; V1055-V1059 WeakPolarHBondContact O-CB 3.16Å; V1055-V1059 VanDerWaalsContact O-CG2 3.26Å; V1055-V1059 WeakPolarHBondContact O-CG2 2.93Å; V1055-V1059 PolarHBondContact O-N 3.29Å; V1055-I1084 HydrophobicContact CG1-CB 4.4Å; V1055-I1084 HydrophobicContact CG1-CD1 3.63Å; V1055-I1084 HydrophobicContact CG1-CG1 3.8Å; V1055-I1084 HydrophobicContact CG1-CG2 3.67Å
1056	D	86	Confident	85.4	Confident	37 Å²	37	35.1 Å²	35.1	20%	0.198	16%	0.162	C	C	.	.	H	α-helix	trans	-59.4	-42.9	171.3	-69.6	-29.5	0	0	0	111.2	H1052 V1053 V1059 R1060 R1093 N1094	H1052-D1056 PolarHBondContact O-N 2.95Å; H1052-D1056 VanDerWaalsContact O-N 3.09Å; V1053-D1056 PolarHBondContact O-N 3.17Å; D1056-V1059 PolarHBondContact O-N 2.85Å; D1056-R1060 VanDerWaalsContact O-CB 3.24Å; D1056-R1060 WeakPolarHBondContact O-CB 3.5Å; D1056-R1060 PolarHBondContact O-N 3.43Å; D1056-R1093 IonicContact OD1-CZ 3.14Å; D1056-R1093 IonicContact OD1-NE 2.82Å; D1056-R1093 IonicContact OD1-NH2 2.78Å; D1056-R1093 PolarHBondContact OD1-NH2 2.82Å; D1056-R1093 IonicContact OD2-NH2 3.82Å; D1056-N1094 WeakPolarHBondContact CB-OD1 3.15Å; D1056-N1094 PolarHBondContact O-OD1 3.35Å; D1056-N1094 PolarHBondContact OD1-ND2 2.89Å
1057	L	86	Confident	85	Confident	17 Å²	17	42.3 Å²	42.3	9%	0.089	20%	0.199	C	C	.	.	H	α-helix	trans	-64.3	-39.1	174.6	-69.3	176.2	0	0	0	112.7	Y946 S947 F949 L952 V1053 V1054 V1055 R1061	Y946-L1057 WeakPolarHBondContact O-CD1 3.43Å; S947-L1057 VanDerWaalsContact C-CD2 3.42Å; S947-L1057 WeakPolarHBondContact O-CD2 3.45Å; F949-L1057 HydrophobicContact CB-CB 4.05Å; F949-L1057 HydrophobicContact CD2-CB 4.46Å; L952-L1057 HydrophobicContact CB-CD1 4.47Å; L952-L1057 HydrophobicContact CD2-CD1 3.68Å; V1053-L1057 HydrophobicContact CG1-CD1 4.39Å; V1053-L1057 HydrophobicContact CG1-CG 4.41Å; V1053-L1057 WeakPolarHBondContact O-CG 3.27Å; V1053-L1057 PolarHBondContact O-N 3.21Å; V1054-L1057 PolarHBondContact O-N 2.78Å; V1055-L1057 VanDerWaalsContact C-N 3.31Å; V1055-L1057 PolarHBondContact O-N 3.48Å; L1057-R1061 VanDerWaalsContact O-CB 3.28Å; L1057-R1061 WeakPolarHBondContact O-CB 3.23Å; L1057-R1061 PolarHBondContact O-N 3.01Å
1058	L	87	Confident	84.9	Confident	18 Å²	18	45.1 Å²	45.1	9%	0.094	21%	0.212	C	C	.	.	H	α-helix	trans	-66.4	-45.9	177.5	-177.8	67.2	0	0	0	111.6	F949 L1048 V1054 V1055 R1060 R1061 C1062 L1078 V1082	F949-L1058 HydrophobicContact CD1-CD1 4.37Å; F949-L1058 HydrophobicContact CD2-CB 4.13Å; F949-L1058 HydrophobicContact CD2-CD1 4.38Å; F949-L1058 HydrophobicContact CE1-CD1 4.19Å; F949-L1058 HydrophobicContact CE2-CB 4.28Å; F949-L1058 HydrophobicContact CE2-CD1 4.19Å; F949-L1058 HydrophobicContact CG-CD1 4.47Å; F949-L1058 HydrophobicContact CZ-CD1 4.11Å; L1048-L1058 HydrophobicContact CD1-CD2 3.86Å; V1054-L1058 WeakPolarHBondContact O-CB 3.15Å; V1054-L1058 PolarHBondContact O-N 2.77Å; V1055-L1058 PolarHBondContact O-N 3.35Å; L1058-R1060 VanDerWaalsContact C-N 3.34Å; L1058-R1061 PolarHBondContact O-N 3.32Å; L1058-C1062 PolarHBondContact O-N 2.87Å; L1058-L1078 HydrophobicContact CD2-CD2 4.48Å; L1058-L1078 HydrophobicContact CG-CD2 4.18Å; L1058-V1082 HydrophobicContact CD2-CG1 4.1Å; L1058-V1082 HydrophobicContact CD2-CG2 3.94Å
1059	V	89.4	Confident	84.3	Confident	0 Å²	0	45 Å²	45	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.9	-46.2	175.8	169.6	0	0	0	0	110.2	V1055 D1056 C1062 H1063 L1078 I1084 V1091 N1094	V1055-V1059 HydrophobicContact CG1-CG2 4.39Å; V1055-V1059 WeakPolarHBondContact O-CB 3.16Å; V1055-V1059 VanDerWaalsContact O-CG2 3.26Å; V1055-V1059 WeakPolarHBondContact O-CG2 2.93Å; V1055-V1059 PolarHBondContact O-N 3.29Å; D1056-V1059 PolarHBondContact O-N 2.85Å; V1059-C1062 PolarHBondContact O-N 2.94Å; V1059-H1063 WeakPolarHBondContact O-CB 3.43Å; V1059-H1063 PolarHBondContact O-N 2.88Å; V1059-L1078 HydrophobicContact CB-CD1 4.41Å; V1059-L1078 HydrophobicContact CG1-CD1 4.49Å; V1059-L1078 HydrophobicContact CG2-CD1 3.83Å; V1059-I1084 HydrophobicContact CG2-CD1 3.75Å; V1059-V1091 HydrophobicContact CG1-CB 4.33Å; V1059-V1091 HydrophobicContact CG1-CG1 4.46Å; V1059-V1091 HydrophobicContact CG1-CG2 4Å; V1059-V1091 HydrophobicContact CG2-CG2 4.32Å; V1059-N1094 HydrophobicContact CB-CB 4.35Å; V1059-N1094 HydrophobicContact CG1-CB 3.59Å
1060	R	87.3	Confident	84.2	Confident	76 Å²	76	49.3 Å²	49.3	29%	0.287	24%	0.238	S	C	.	.	H	α-helix	trans	-61.3	-45.7	178.6	-170.6	177.5	-157.5	122.4	3.3	112	D1056 L1058 C1062 H1063 E1064	D1056-R1060 VanDerWaalsContact O-CB 3.24Å; D1056-R1060 WeakPolarHBondContact O-CB 3.5Å; D1056-R1060 PolarHBondContact O-N 3.43Å; L1058-R1060 VanDerWaalsContact C-N 3.34Å; R1060-C1062 VanDerWaalsContact C-N 3.33Å; R1060-C1062 PolarHBondContact O-N 2.58Å; R1060-H1063 PolarHBondContact O-N 2.87Å; R1060-E1064 WeakPolarHBondContact CD-OE1 3.46Å; R1060-E1064 HydrophobicContact CG-CG 4.33Å; R1060-E1064 WeakPolarHBondContact CG-OE1 3.25Å; R1060-E1064 IonicContact NE-OE1 2.86Å; R1060-E1064 PolarHBondContact NE-OE1 3.49Å; R1060-E1064 WeakPolarHBondContact O-CB 3.41Å; R1060-E1064 WeakPolarHBondContact O-CG 3.22Å; R1060-E1064 PolarHBondContact O-N 2.93Å
1061	R	88.1	Confident	84.5	Confident	59 Å²	59	48.8 Å²	48.8	22%	0.223	24%	0.237	C	C	.	.	H	α-helix	trans	-56.2	-46.3	174.1	177.8	-167.9	-178.5	-157.3	-1.2	111.7	E950 L1057 L1058 R1065	E950-R1061 VanDerWaalsContact CD-NE 3.3Å; E950-R1061 WeakPolarHBondContact OE1-CD 3.45Å; E950-R1061 IonicContact OE1-CZ 2.87Å; E950-R1061 IonicContact OE1-NE 2.83Å; E950-R1061 PolarHBondContact OE1-NE 3.11Å; E950-R1061 IonicContact OE1-NH2 3.67Å; E950-R1061 PolarHBondContact OE1-NH2 3.42Å; E950-R1061 IonicContact OE2-NE 3.43Å; L1057-R1061 VanDerWaalsContact O-CB 3.28Å; L1057-R1061 WeakPolarHBondContact O-CB 3.23Å; L1057-R1061 PolarHBondContact O-N 3.01Å; L1058-R1061 PolarHBondContact O-N 3.32Å; R1061-R1065 VanDerWaalsContact NH2-NH2 3.15Å; R1061-R1065 WeakPolarHBondContact O-CB 3.15Å; R1061-R1065 WeakPolarHBondContact O-CG 3.3Å; R1061-R1065 PolarHBondContact O-N 2.94Å
1062	C	88.3	Confident	84.8	Confident	16 Å²	16	52.2 Å²	52.2	11%	0.108	25%	0.251	C	S	.	.	H	α-helix	trans	-61.7	-50.2	177.5	-174.1	0	0	0	0	111	L1058 V1059 R1060 E1064 R1065 Q1066 T1074 I1077 L1078	L1058-C1062 PolarHBondContact O-N 2.87Å; V1059-C1062 PolarHBondContact O-N 2.94Å; R1060-C1062 VanDerWaalsContact C-N 3.33Å; R1060-C1062 PolarHBondContact O-N 2.58Å; C1062-E1064 PolarHBondContact O-N 3.23Å; C1062-R1065 PolarHBondContact O-N 3.03Å; C1062-Q1066 WeakPolarHBondContact O-CB 3.49Å; C1062-Q1066 VanDerWaalsContact O-CG 3.29Å; C1062-Q1066 WeakPolarHBondContact O-CG 3.25Å; C1062-Q1066 PolarHBondContact O-N 3.41Å; C1062-T1074 HydrophobicContact CB-CG2 4.3Å; C1062-I1077 VanDerWaalsContact SG-CG2 3.59Å; C1062-L1078 HydrophobicContact CB-CD2 3.8Å; C1062-L1078 HydrophobicContact CB-CG 4.05Å
1063	H	90.8	Very high	85	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.019	27%	0.268	C	S	.	.	H	α-helix	trans	-58.9	-44.3	179.4	171.8	67.3	0	0	0	112.8	V1059 R1060 Q1066 H1068 A1069 T1074 C1101	V1059-H1063 WeakPolarHBondContact O-CB 3.43Å; V1059-H1063 PolarHBondContact O-N 2.88Å; R1060-H1063 PolarHBondContact O-N 2.87Å; H1063-Q1066 PolarHBondContact O-N 2.97Å; H1063-H1068 AromaticContact CD2-ND1 3.54Å; H1063-H1068 VanDerWaalsContact CE1-C 3.41Å; H1063-H1068 WeakPolarHBondContact CE1-CA 3.41Å; H1063-H1068 AromaticContact CE1-ND1 3.7Å; H1063-H1068 PolarHBondContact CE1-O 3.03Å; H1063-H1068 AromaticContact NE2-CE1 3.98Å; H1063-H1068 AromaticContact NE2-CG 3.82Å; H1063-H1068 AromaticContact NE2-ND1 2.97Å; H1063-H1068 PolarHBondContact NE2-ND1 3.33Å; H1063-H1068 VanDerWaalsContact O-CA 3.31Å; H1063-H1068 WeakPolarHBondContact O-CA 3.36Å; H1063-H1068 PolarHBondContact O-N 3.5Å; H1063-A1069 PolarHBondContact CE1-O 3.44Å; H1063-A1069 PolarHBondContact ND1-O 3.34Å; H1063-T1074 HydrophobicContact CB-CG2 4.06Å; H1063-C1101 PolarHBondContact CE1-SG 2.95Å; H1063-C1101 PolarHBondContact NE2-SG 2.84Å
1064	E	87.7	Confident	85.4	Confident	88 Å²	88	54.1 Å²	54.1	41%	0.411	26%	0.257	S	S	.	.	H	α-helix	trans	-69.7	-40.1	179.8	-71.8	169.8	-179.3	0	0	112	R1060 C1062 Q1066 L1067	R1060-E1064 WeakPolarHBondContact CD-OE1 3.46Å; R1060-E1064 HydrophobicContact CG-CG 4.33Å; R1060-E1064 WeakPolarHBondContact CG-OE1 3.25Å; R1060-E1064 IonicContact NE-OE1 2.86Å; R1060-E1064 PolarHBondContact NE-OE1 3.49Å; R1060-E1064 WeakPolarHBondContact O-CB 3.41Å; R1060-E1064 WeakPolarHBondContact O-CG 3.22Å; R1060-E1064 PolarHBondContact O-N 2.93Å; C1062-E1064 PolarHBondContact O-N 3.23Å; E1064-Q1066 VanDerWaalsContact C-N 3.33Å; E1064-Q1066 PolarHBondContact O-N 2.99Å; E1064-L1067 PolarHBondContact O-N 2.67Å
1065	R	85.3	Confident	85.9	Confident	154 Å²	154	54 Å²	54	58%	0.581	26%	0.256	S	S	*	.	H	α-helix	trans	-69	-29.6	176.4	-75.5	-175.3	179.5	-148.4	-2	113.5	E950 R1061 C1062 L1067	E950-R1065 IonicContact OE1-CZ 2.83Å; E950-R1065 IonicContact OE1-NE 3.96Å; E950-R1065 IonicContact OE1-NH2 2.79Å; E950-R1065 PolarHBondContact OE1-NH2 2.81Å; R1061-R1065 VanDerWaalsContact NH2-NH2 3.15Å; R1061-R1065 WeakPolarHBondContact O-CB 3.15Å; R1061-R1065 WeakPolarHBondContact O-CG 3.3Å; R1061-R1065 PolarHBondContact O-N 2.94Å; C1062-R1065 PolarHBondContact O-N 3.03Å; R1065-L1067 PolarHBondContact O-N 3.35Å
1066	Q	85.5	Confident	86	Confident	75 Å²	75	56.5 Å²	56.5	35%	0.35	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	30.3	173.9	-58.8	-57.9	-31.7	0	0	111.7	C1062 H1063 E1064 H1068 A1069 I1077	C1062-Q1066 WeakPolarHBondContact O-CB 3.49Å; C1062-Q1066 VanDerWaalsContact O-CG 3.29Å; C1062-Q1066 WeakPolarHBondContact O-CG 3.25Å; C1062-Q1066 PolarHBondContact O-N 3.41Å; H1063-Q1066 PolarHBondContact O-N 2.97Å; E1064-Q1066 VanDerWaalsContact C-N 3.33Å; E1064-Q1066 PolarHBondContact O-N 2.99Å; Q1066-H1068 VanDerWaalsContact C-N 3.32Å; Q1066-H1068 PolarHBondContact O-N 3.2Å; Q1066-A1069 HydrophobicContact CB-CB 3.82Å; Q1066-A1069 VanDerWaalsContact O-CB 3.29Å; Q1066-A1069 WeakPolarHBondContact O-CB 3.41Å; Q1066-A1069 PolarHBondContact O-N 2.78Å; Q1066-I1077 HydrophobicContact CG-CG1 4.25Å
1067	L	80.5	Confident	86	Confident	159 Å²	159	57 Å²	57	83%	0.832	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	45.7	175.2	-58.2	175.3	0	0	0	113.8	E1064 R1065 A1069	E1064-L1067 PolarHBondContact O-N 2.67Å; R1065-L1067 PolarHBondContact O-N 3.35Å; L1067-A1069 VanDerWaalsContact C-N 3.3Å; L1067-A1069 PolarHBondContact O-N 3.1Å
1068	H	85.6	Confident	86.2	Confident	59 Å²	59	56.8 Å²	56.8	27%	0.273	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	33.6	-178.5	-64.5	-77	0	0	0	114.8	H1063 Q1066 C1098	H1063-H1068 AromaticContact CD2-ND1 3.54Å; H1063-H1068 VanDerWaalsContact CE1-C 3.41Å; H1063-H1068 WeakPolarHBondContact CE1-CA 3.41Å; H1063-H1068 AromaticContact CE1-ND1 3.7Å; H1063-H1068 PolarHBondContact CE1-O 3.03Å; H1063-H1068 AromaticContact NE2-CE1 3.98Å; H1063-H1068 AromaticContact NE2-CG 3.82Å; H1063-H1068 AromaticContact NE2-ND1 2.97Å; H1063-H1068 PolarHBondContact NE2-ND1 3.33Å; H1063-H1068 VanDerWaalsContact O-CA 3.31Å; H1063-H1068 WeakPolarHBondContact O-CA 3.36Å; H1063-H1068 PolarHBondContact O-N 3.5Å; Q1066-H1068 VanDerWaalsContact C-N 3.32Å; Q1066-H1068 PolarHBondContact O-N 3.2Å; H1068-C1098 PolarHBondContact CE1-SG 3.45Å; H1068-C1098 PolarHBondContact ND1-SG 2.86Å
1069	A	77.1	Confident	86.3	Confident	18 Å²	18	61.2 Å²	61.2	15%	0.149	29%	0.293	C	S	.	.			trans	-50.7	155.6	174.4	0	0	0	0	0	113.5	H1063 Q1066 L1067 H1073 T1074	H1063-A1069 PolarHBondContact CE1-O 3.44Å; H1063-A1069 PolarHBondContact ND1-O 3.34Å; Q1066-A1069 HydrophobicContact CB-CB 3.82Å; Q1066-A1069 VanDerWaalsContact O-CB 3.29Å; Q1066-A1069 WeakPolarHBondContact O-CB 3.41Å; Q1066-A1069 PolarHBondContact O-N 2.78Å; L1067-A1069 VanDerWaalsContact C-N 3.3Å; L1067-A1069 PolarHBondContact O-N 3.1Å; A1069-H1073 HydrophobicContact CB-CB 3.99Å; A1069-H1073 WeakPolarHBondContact CB-CD2 3.14Å; A1069-T1074 PolarHBondContact O-OG1 3.35Å
1070	D	82.7	Confident	86	Confident	92 Å²	92	66.2 Å²	66.2	49%	0.492	32%	0.317	S	S	.	.			trans	-67.2	179.6	-177.5	78.8	-0.9	0	0	0	113.2	Q1072 H1073 T1074	D1070-Q1072 VanDerWaalsContact C-N 3.32Å; D1070-Q1072 PolarHBondContact O-N 3.42Å; D1070-Q1072 PolarHBondContact OD1-N 2.93Å; D1070-Q1072 VanDerWaalsContact OD1-N 3.12Å; D1070-H1073 WeakPolarHBondContact OD1-CB 3.4Å; D1070-H1073 PolarHBondContact OD1-N 2.87Å; D1070-T1074 VanDerWaalsContact O-CB 3.24Å; D1070-T1074 WeakPolarHBondContact O-CB 3.47Å; D1070-T1074 PolarHBondContact O-N 3.48Å; D1070-T1074 PolarHBondContact O-OG1 3.11Å
1071	V	87.7	Confident	85.9	Confident	28 Å²	28	67.4 Å²	67.4	17%	0.17	32%	0.321	C	S	.	.	H	α-helix	trans	-61.8	-40.9	-178.3	175.6	0	0	0	0	111.5	L1075 R1088 V1091 E1092 I1095	V1071-L1075 WeakPolarHBondContact O-CB 3.41Å; V1071-L1075 PolarHBondContact O-N 3.48Å; V1071-L1075 VanDerWaalsContact O-N 3.08Å; V1071-R1088 HydrophobicContact CG1-CG 4.12Å; V1071-V1091 HydrophobicContact CB-CG1 4.4Å; V1071-V1091 HydrophobicContact CG1-CB 4.43Å; V1071-V1091 HydrophobicContact CG1-CG1 4.05Å; V1071-E1092 HydrophobicContact CB-CG 4.4Å; V1071-E1092 HydrophobicContact CG1-CG 3.72Å; V1071-E1092 HydrophobicContact CG2-CG 3.73Å; V1071-I1095 HydrophobicContact CB-CD1 4.48Å; V1071-I1095 HydrophobicContact CG2-CD1 3.93Å
1072	Q	85.7	Confident	86	Confident	134 Å²	134	65.1 Å²	65.1	63%	0.626	31%	0.314	S	S	*	.	H	α-helix	trans	-71.9	-46.7	-174	-64.7	-170.5	3.1	0	0	110.9	D1070 L1075 A1076	D1070-Q1072 VanDerWaalsContact C-N 3.32Å; D1070-Q1072 PolarHBondContact O-N 3.42Å; D1070-Q1072 PolarHBondContact OD1-N 2.93Å; D1070-Q1072 VanDerWaalsContact OD1-N 3.12Å; Q1072-L1075 PolarHBondContact O-N 2.9Å; Q1072-A1076 PolarHBondContact O-N 2.74Å
1073	H	82.5	Confident	86.1	Confident	84 Å²	84	68 Å²	68	39%	0.389	32%	0.322	S	S	.	.	H	α-helix	trans	-65.9	-46.5	179.3	-171	85.2	0	0	0	111.4	A1069 D1070 L1075 A1076 I1077	A1069-H1073 HydrophobicContact CB-CB 3.99Å; A1069-H1073 WeakPolarHBondContact CB-CD2 3.14Å; D1070-H1073 WeakPolarHBondContact OD1-CB 3.4Å; D1070-H1073 PolarHBondContact OD1-N 2.87Å; H1073-L1075 VanDerWaalsContact C-N 3.25Å; H1073-L1075 PolarHBondContact O-N 3.2Å; H1073-A1076 PolarHBondContact O-N 3.1Å; H1073-A1076 VanDerWaalsContact O-N 3.14Å; H1073-I1077 WeakPolarHBondContact O-CG1 3.5Å; H1073-I1077 PolarHBondContact O-N 2.89Å; H1073-I1077 VanDerWaalsContact O-N 3.1Å
1074	T	87	Confident	86	Confident	0 Å²	0	68 Å²	68	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-57.9	-41.3	175.7	-57.6	0	0	0	0	111.2	C1062 H1063 A1069 D1070 L1078 V1091	C1062-T1074 HydrophobicContact CB-CG2 4.3Å; H1063-T1074 HydrophobicContact CB-CG2 4.06Å; A1069-T1074 PolarHBondContact O-OG1 3.35Å; D1070-T1074 VanDerWaalsContact O-CB 3.24Å; D1070-T1074 WeakPolarHBondContact O-CB 3.47Å; D1070-T1074 PolarHBondContact O-N 3.48Å; D1070-T1074 PolarHBondContact O-OG1 3.11Å; T1074-L1078 HydrophobicContact CG2-CD1 4.11Å; T1074-L1078 WeakPolarHBondContact O-CG 3.3Å; T1074-L1078 PolarHBondContact O-N 3.25Å; T1074-L1078 VanDerWaalsContact O-N 3.12Å; T1074-V1091 HydrophobicContact CG2-CG1 3.96Å
1075	L	89.1	Confident	86	Confident	16 Å²	16	65 Å²	65	8%	0.084	31%	0.309	C	S	.	.	H	α-helix	trans	-67	-39.6	178.3	-178	65.3	0	0	0	112.5	V1071 Q1072 H1073 L1078 R1079 A1087 R1088 V1091	V1071-L1075 WeakPolarHBondContact O-CB 3.41Å; V1071-L1075 PolarHBondContact O-N 3.48Å; V1071-L1075 VanDerWaalsContact O-N 3.08Å; Q1072-L1075 PolarHBondContact O-N 2.9Å; H1073-L1075 VanDerWaalsContact C-N 3.25Å; H1073-L1075 PolarHBondContact O-N 3.2Å; L1075-L1078 PolarHBondContact O-N 3.19Å; L1075-R1079 WeakPolarHBondContact O-CG 3.29Å; L1075-R1079 PolarHBondContact O-N 3.37Å; L1075-R1079 VanDerWaalsContact O-N 3.11Å; L1075-A1087 HydrophobicContact CD1-CB 3.32Å; L1075-R1088 HydrophobicContact CD2-CB 4.37Å; L1075-V1091 HydrophobicContact CD1-CG2 4.31Å
1076	A	86.7	Confident	86	Confident	53 Å²	53	64 Å²	64	44%	0.438	31%	0.305	S	S	.	.	H	α-helix	trans	-61.8	-45.2	178.2	0	0	0	0	0	111.5	Q1072 H1073 R1079	Q1072-A1076 PolarHBondContact O-N 2.74Å; H1073-A1076 PolarHBondContact O-N 3.1Å; H1073-A1076 VanDerWaalsContact O-N 3.14Å; A1076-R1079 PolarHBondContact O-N 3.3Å
1077	I	86.7	Confident	85.9	Confident	47 Å²	47	60.9 Å²	60.9	24%	0.241	29%	0.293	C	S	.	.	H	α-helix	trans	-65.6	-43.3	177.8	-60	-60.8	0	0	0	111.4	C1062 Q1066 H1073 R1079 Q1080	C1062-I1077 VanDerWaalsContact SG-CG2 3.59Å; Q1066-I1077 HydrophobicContact CG-CG1 4.25Å; H1073-I1077 WeakPolarHBondContact O-CG1 3.5Å; H1073-I1077 PolarHBondContact O-N 2.89Å; H1073-I1077 VanDerWaalsContact O-N 3.1Å; I1077-R1079 VanDerWaalsContact C-N 3.27Å; I1077-R1079 PolarHBondContact O-N 3.23Å; I1077-Q1080 WeakPolarHBondContact O-CB 3.31Å; I1077-Q1080 PolarHBondContact O-N 3.04Å; I1077-Q1080 VanDerWaalsContact O-N 3.16Å
1078	L	89.8	Confident	86.3	Confident	12 Å²	12	60 Å²	60	6%	0.063	28%	0.278	C	S	.	.	H	α-helix	trans	-58.2	-39.8	176.6	-74.8	166.9	0	0	0	112.2	L1058 V1059 C1062 T1074 L1075 Q1080 R1081 V1082 I1084 V1091	L1058-L1078 HydrophobicContact CD2-CD2 4.48Å; L1058-L1078 HydrophobicContact CG-CD2 4.18Å; V1059-L1078 HydrophobicContact CB-CD1 4.41Å; V1059-L1078 HydrophobicContact CG1-CD1 4.49Å; V1059-L1078 HydrophobicContact CG2-CD1 3.83Å; C1062-L1078 HydrophobicContact CB-CD2 3.8Å; C1062-L1078 HydrophobicContact CB-CG 4.05Å; T1074-L1078 HydrophobicContact CG2-CD1 4.11Å; T1074-L1078 WeakPolarHBondContact O-CG 3.3Å; T1074-L1078 PolarHBondContact O-N 3.25Å; T1074-L1078 VanDerWaalsContact O-N 3.12Å; L1075-L1078 PolarHBondContact O-N 3.19Å; L1078-Q1080 PolarHBondContact O-N 2.96Å; L1078-Q1080 VanDerWaalsContact O-N 3.16Å; L1078-R1081 PolarHBondContact O-N 2.78Å; L1078-R1081 VanDerWaalsContact O-N 3.14Å; L1078-V1082 HydrophobicContact CB-CG2 4.18Å; L1078-V1082 HydrophobicContact CD2-CG2 4.11Å; L1078-V1082 VanDerWaalsContact O-CG2 3.31Å; L1078-V1082 WeakPolarHBondContact O-CG2 3.49Å; L1078-V1082 PolarHBondContact O-N 3.09Å; L1078-V1082 VanDerWaalsContact O-O 3.12Å; L1078-I1084 HydrophobicContact CD1-CD1 4.21Å; L1078-V1091 HydrophobicContact CD1-CG2 3.87Å
1079	R	88.1	Confident	86.4	Confident	111 Å²	111	59.9 Å²	59.9	42%	0.419	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-9.8	-179.6	-78.1	175	170.6	167.2	-4.4	114.8	Q1045 L1075 A1076 I1077 R1081	Q1045-R1079 WeakPolarHBondContact CG-O 3.17Å; Q1045-R1079 PolarHBondContact NE2-O 3.19Å; L1075-R1079 WeakPolarHBondContact O-CG 3.29Å; L1075-R1079 PolarHBondContact O-N 3.37Å; L1075-R1079 VanDerWaalsContact O-N 3.11Å; A1076-R1079 PolarHBondContact O-N 3.3Å; I1077-R1079 VanDerWaalsContact C-N 3.27Å; I1077-R1079 PolarHBondContact O-N 3.23Å; R1079-R1081 PolarHBondContact O-N 3.14Å
1080	Q	85	Confident	86.9	Confident	106 Å²	106	59 Å²	59	50%	0.495	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-16.7	172.1	-63.3	179.7	-5.8	0	0	112.7	A1041 A1042 I1077 L1078	A1041-Q1080 CarbonylContact C-O 3.43Å; A1041-Q1080 VanDerWaalsContact C-O 3.26Å; A1042-Q1080 WeakPolarHBondContact CA-O 3.33Å; A1042-Q1080 WeakPolarHBondContact CB-O 3.3Å; A1042-Q1080 PolarHBondContact N-O 2.83Å; A1042-Q1080 VanDerWaalsContact N-O 3.17Å; I1077-Q1080 WeakPolarHBondContact O-CB 3.31Å; I1077-Q1080 PolarHBondContact O-N 3.04Å; I1077-Q1080 VanDerWaalsContact O-N 3.16Å; L1078-Q1080 PolarHBondContact O-N 2.96Å; L1078-Q1080 VanDerWaalsContact O-N 3.16Å
1081	R	85.3	Confident	87.3	Confident	100 Å²	100	54.7 Å²	54.7	38%	0.377	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.4	-34	-179.7	-173.7	177.3	171.6	-147.2	-8.7	114	E987 Q1045 I1046 L1078 R1079	E987-R1081 VanDerWaalsContact CD-NH2 3.26Å; E987-R1081 IonicContact OE1-CZ 2.96Å; E987-R1081 IonicContact OE1-NH1 3.86Å; E987-R1081 IonicContact OE1-NH2 2.66Å; E987-R1081 PolarHBondContact OE1-NH2 2.86Å; E987-R1081 IonicContact OE2-NH2 2.95Å; E987-R1081 PolarHBondContact OE2-NH2 2.72Å; Q1045-R1081 WeakPolarHBondContact CA-O 3.41Å; I1046-R1081 HydrophobicContact CD1-CG 4.42Å; I1046-R1081 PolarHBondContact N-O 3.16Å; L1078-R1081 PolarHBondContact O-N 2.78Å; L1078-R1081 VanDerWaalsContact O-N 3.14Å; R1079-R1081 PolarHBondContact O-N 3.14Å
1082	V	88.7	Confident	87.3	Confident	12 Å²	12	57.2 Å²	57.2	7%	0.073	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	142.5	-171.7	-57.8	0	0	0	0	112.7	I1046 L1048 L1058 L1078 I1084	I1046-V1082 HydrophobicContact CB-CG1 4.3Å; I1046-V1082 CarbonylContact O-C 3.59Å; I1046-V1082 WeakPolarHBondContact O-CA 3.11Å; L1048-V1082 HydrophobicContact CD1-CB 3.99Å; L1048-V1082 HydrophobicContact CD1-CG1 3.86Å; L1058-V1082 HydrophobicContact CD2-CG1 4.1Å; L1058-V1082 HydrophobicContact CD2-CG2 3.94Å; L1078-V1082 HydrophobicContact CB-CG2 4.18Å; L1078-V1082 HydrophobicContact CD2-CG2 4.11Å; L1078-V1082 VanDerWaalsContact O-CG2 3.31Å; L1078-V1082 WeakPolarHBondContact O-CG2 3.49Å; L1078-V1082 PolarHBondContact O-N 3.09Å; L1078-V1082 VanDerWaalsContact O-O 3.12Å; V1082-I1084 HydrophobicContact CG2-CD1 4.23Å; V1082-I1084 HydrophobicContact CG2-CG1 4.18Å
1083	W	89.9	Confident	87.6	Confident	75 Å²	75	54.6 Å²	54.6	28%	0.284	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	96.5	171.3	-168.1	-81.2	0	0	0	109.6	F1017 V1029 Q1045 I1046 L1047 L1048	F1017-W1083 HydrophobicContact CD1-CZ2 4.38Å; F1017-W1083 AromaticContact CD1-NE1 3.66Å; F1017-W1083 AromaticContact CE1-CD1 3.97Å; F1017-W1083 AromaticContact CE1-CE2 3.54Å; F1017-W1083 AromaticContact CE1-CZ2 3.73Å; F1017-W1083 HydrophobicContact CE1-CZ2 3.73Å; F1017-W1083 AromaticContact CE1-NE1 3.04Å; F1017-W1083 AromaticContact CZ-NE1 3.48Å; V1029-W1083 HydrophobicContact CG2-CB 3.64Å; V1029-W1083 HydrophobicContact CG2-CD2 4.22Å; V1029-W1083 HydrophobicContact CG2-CG 3.78Å; Q1045-W1083 HydrophobicContact CB-CB 3.86Å; I1046-W1083 PolarHBondContact O-N 3.44Å; L1047-W1083 HydrophobicContact CD2-CB 4.21Å; L1047-W1083 HydrophobicContact CD2-CG 4.27Å; L1048-W1083 PolarHBondContact N-O 3.07Å
1084	I	90	Very high	87.9	Confident	6 Å²	6	51.3 Å²	51.3	3%	0.031	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	125.8	176.7	-59.6	162.4	0	0	0	108.3	L1048 H1050 V1055 V1059 L1078 V1082 R1086 A1087 C1090	L1048-I1084 HydrophobicContact CB-CG1 4.26Å; L1048-I1084 WeakPolarHBondContact O-CA 3.5Å; H1050-I1084 HydrophobicContact CB-CG2 4.41Å; V1055-I1084 HydrophobicContact CG1-CB 4.4Å; V1055-I1084 HydrophobicContact CG1-CD1 3.63Å; V1055-I1084 HydrophobicContact CG1-CG1 3.8Å; V1055-I1084 HydrophobicContact CG1-CG2 3.67Å; V1059-I1084 HydrophobicContact CG2-CD1 3.75Å; L1078-I1084 HydrophobicContact CD1-CD1 4.21Å; V1082-I1084 HydrophobicContact CG2-CD1 4.23Å; V1082-I1084 HydrophobicContact CG2-CG1 4.18Å; I1084-R1086 PolarHBondContact O-N 3.28Å; I1084-A1087 HydrophobicContact CB-CB 3.92Å; I1084-A1087 HydrophobicContact CG2-CB 4.44Å; I1084-A1087 VanDerWaalsContact O-CB 3.24Å; I1084-A1087 WeakPolarHBondContact O-CB 3.42Å; I1084-A1087 PolarHBondContact O-N 3.18Å; I1084-A1087 VanDerWaalsContact O-N 3.08Å; I1084-C1090 HydrophobicContact CG2-CB 4.33Å
1085	L	87.1	Confident	87.9	Confident	25 Å²	25	51.5 Å²	51.5	13%	0.131	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	137.9	172.9	-63	179.6	0	0	0	109.2	F995 L1014 F1017 L1047 L1048 H1050 A1087	F995-L1085 HydrophobicContact CE1-CD1 4.12Å; F995-L1085 HydrophobicContact CZ-CD1 4.06Å; L1014-L1085 HydrophobicContact CD2-CD1 3.96Å; L1014-L1085 HydrophobicContact CD2-CD2 3.98Å; L1014-L1085 HydrophobicContact CD2-CG 4.43Å; F1017-L1085 HydrophobicContact CD2-CD2 4.14Å; F1017-L1085 HydrophobicContact CE2-CD2 3.44Å; F1017-L1085 VanDerWaalsContact CE2-CD2 3.44Å; F1017-L1085 HydrophobicContact CZ-CD2 3.97Å; L1047-L1085 HydrophobicContact CD2-CD2 4.46Å; L1048-L1085 PolarHBondContact O-N 3.43Å; H1050-L1085 HydrophobicContact CB-CB 4.43Å; H1050-L1085 WeakPolarHBondContact CB-O 3.37Å; L1085-A1087 PolarHBondContact O-N 3.32Å
1086	R	85.2	Confident	87.6	Confident	131 Å²	131	57.2 Å²	57.2	49%	0.494	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	34.1	-178.2	-56.1	176.5	173.9	175.1	-7.5	113.8	H1050 I1084 R1088 S1089 C1090	H1050-R1086 HydrophobicContact CB-CB 4.23Å; H1050-R1086 PolarHBondContact NE2-NH1 2.89Å; I1084-R1086 PolarHBondContact O-N 3.28Å; R1086-R1088 VanDerWaalsContact C-N 3.32Å; R1086-R1088 PolarHBondContact O-N 3.21Å; R1086-R1088 VanDerWaalsContact O-N 3.11Å; R1086-S1089 PolarHBondContact O-N 3.22Å; R1086-S1089 VanDerWaalsContact O-N 3.08Å; R1086-S1089 PolarHBondContact O-OG 2.91Å; R1086-C1090 PolarHBondContact O-N 3.21Å
1087	A	84.5	Confident	87.5	Confident	11 Å²	11	58.9 Å²	58.9	9%	0.091	26%	0.257	C	S	.	.	H	α-helix	trans	-46.6	-46.8	-169.1	0	0	0	0	0	114.6	L1075 I1084 L1085 S1089 C1090 V1091	L1075-A1087 HydrophobicContact CD1-CB 3.32Å; I1084-A1087 HydrophobicContact CB-CB 3.92Å; I1084-A1087 HydrophobicContact CG2-CB 4.44Å; I1084-A1087 VanDerWaalsContact O-CB 3.24Å; I1084-A1087 WeakPolarHBondContact O-CB 3.42Å; I1084-A1087 PolarHBondContact O-N 3.18Å; I1084-A1087 VanDerWaalsContact O-N 3.08Å; L1085-A1087 PolarHBondContact O-N 3.32Å; A1087-S1089 VanDerWaalsContact C-N 3.34Å; A1087-S1089 PolarHBondContact O-N 3.37Å; A1087-C1090 CarbonylContact O-C 3.47Å; A1087-C1090 WeakPolarHBondContact O-CA 3.3Å; A1087-C1090 VanDerWaalsContact O-CB 3.3Å; A1087-C1090 WeakPolarHBondContact O-CB 3.22Å; A1087-C1090 PolarHBondContact O-N 3.28Å; A1087-V1091 WeakPolarHBondContact O-CG2 3.47Å; A1087-V1091 PolarHBondContact O-N 2.9Å
1088	R	88.2	Confident	87.5	Confident	140 Å²	140	56.8 Å²	56.8	53%	0.528	25%	0.246	S	C	.	.	H	α-helix	trans	-54.5	-47.8	-178.5	-176	173.6	-176.9	150.2	1.3	112.5	V1071 L1075 R1086 C1090 V1091 E1092	V1071-R1088 HydrophobicContact CG1-CG 4.12Å; L1075-R1088 HydrophobicContact CD2-CB 4.37Å; R1086-R1088 VanDerWaalsContact C-N 3.32Å; R1086-R1088 PolarHBondContact O-N 3.21Å; R1086-R1088 VanDerWaalsContact O-N 3.11Å; R1088-C1090 VanDerWaalsContact C-N 3.29Å; R1088-C1090 PolarHBondContact O-N 3Å; R1088-V1091 PolarHBondContact O-N 2.48Å; R1088-E1092 HydrophobicContact CG-CG 4.42Å; R1088-E1092 WeakPolarHBondContact CG-OE1 3.47Å; R1088-E1092 IonicContact CZ-OE1 3.64Å; R1088-E1092 IonicContact NE-OE1 2.76Å; R1088-E1092 PolarHBondContact NE-OE1 3.09Å; R1088-E1092 WeakPolarHBondContact O-CB 3.42Å; R1088-E1092 WeakPolarHBondContact O-CG 3.47Å; R1088-E1092 PolarHBondContact O-N 3.19Å
1089	S	87.1	Confident	87.2	Confident	56 Å²	56	61.2 Å²	61.2	39%	0.392	27%	0.274	S	S	.	.	H	α-helix	trans	-63.6	-35.1	177.7	69	0	0	0	0	112.6	R1086 A1087 R1093	R1086-S1089 PolarHBondContact O-N 3.22Å; R1086-S1089 VanDerWaalsContact O-N 3.08Å; R1086-S1089 PolarHBondContact O-OG 2.91Å; A1087-S1089 VanDerWaalsContact C-N 3.34Å; A1087-S1089 PolarHBondContact O-N 3.37Å; S1089-R1093 VanDerWaalsContact O-CB 3.27Å; S1089-R1093 WeakPolarHBondContact O-CB 3.42Å; S1089-R1093 PolarHBondContact O-N 3.49Å
1090	C	88.2	Confident	86.7	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.007	27%	0.273	C	S	.	.	H	α-helix	trans	-67.5	-44.9	175.4	-173.9	0	0	0	0	111	H1050 I1084 R1086 A1087 R1088 R1093 N1094	H1050-C1090 PolarHBondContact O-SG 3.13Å; H1050-C1090 VanDerWaalsContact O-SG 3.41Å; I1084-C1090 HydrophobicContact CG2-CB 4.33Å; R1086-C1090 PolarHBondContact O-N 3.21Å; A1087-C1090 CarbonylContact O-C 3.47Å; A1087-C1090 WeakPolarHBondContact O-CA 3.3Å; A1087-C1090 VanDerWaalsContact O-CB 3.3Å; A1087-C1090 WeakPolarHBondContact O-CB 3.22Å; A1087-C1090 PolarHBondContact O-N 3.28Å; R1088-C1090 VanDerWaalsContact C-N 3.29Å; R1088-C1090 PolarHBondContact O-N 3Å; C1090-R1093 PolarHBondContact O-N 3.24Å; C1090-N1094 PolarHBondContact O-N 3.29Å; C1090-N1094 PolarHBondContact O-ND2 3.21Å
1091	V	90.8	Very high	86.6	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.2	-49.3	177.2	177	0	0	0	0	111.3	V1059 V1071 T1074 L1075 L1078 A1087 R1088 R1093 N1094 I1095	V1059-V1091 HydrophobicContact CG1-CB 4.33Å; V1059-V1091 HydrophobicContact CG1-CG1 4.46Å; V1059-V1091 HydrophobicContact CG1-CG2 4Å; V1059-V1091 HydrophobicContact CG2-CG2 4.32Å; V1071-V1091 HydrophobicContact CB-CG1 4.4Å; V1071-V1091 HydrophobicContact CG1-CB 4.43Å; V1071-V1091 HydrophobicContact CG1-CG1 4.05Å; T1074-V1091 HydrophobicContact CG2-CG1 3.96Å; L1075-V1091 HydrophobicContact CD1-CG2 4.31Å; L1078-V1091 HydrophobicContact CD1-CG2 3.87Å; A1087-V1091 WeakPolarHBondContact O-CG2 3.47Å; A1087-V1091 PolarHBondContact O-N 2.9Å; R1088-V1091 PolarHBondContact O-N 2.48Å; V1091-R1093 VanDerWaalsContact C-N 3.29Å; V1091-R1093 PolarHBondContact O-N 3.19Å; V1091-N1094 PolarHBondContact O-N 3.31Å; V1091-N1094 VanDerWaalsContact O-N 3.12Å; V1091-I1095 HydrophobicContact CG1-CD1 3.69Å; V1091-I1095 HydrophobicContact CG1-CG1 4.22Å; V1091-I1095 WeakPolarHBondContact O-CG1 3.28Å; V1091-I1095 PolarHBondContact O-N 2.76Å
1092	E	89	Confident	86.2	Confident	81 Å²	81	56.3 Å²	56.3	38%	0.379	26%	0.263	S	S	.	.	H	α-helix	trans	-56.6	-43.3	176.2	-76	171.4	-176.3	0	0	111.8	V1071 R1088 R1096	V1071-E1092 HydrophobicContact CB-CG 4.4Å; V1071-E1092 HydrophobicContact CG1-CG 3.72Å; V1071-E1092 HydrophobicContact CG2-CG 3.73Å; R1088-E1092 HydrophobicContact CG-CG 4.42Å; R1088-E1092 WeakPolarHBondContact CG-OE1 3.47Å; R1088-E1092 IonicContact CZ-OE1 3.64Å; R1088-E1092 IonicContact NE-OE1 2.76Å; R1088-E1092 PolarHBondContact NE-OE1 3.09Å; R1088-E1092 WeakPolarHBondContact O-CB 3.42Å; R1088-E1092 WeakPolarHBondContact O-CG 3.47Å; R1088-E1092 PolarHBondContact O-N 3.19Å; E1092-R1096 WeakPolarHBondContact O-CB 3.5Å; E1092-R1096 PolarHBondContact O-N 3.17Å
1093	R	90	Very high	85.5	Confident	79 Å²	79	58.8 Å²	58.8	30%	0.298	29%	0.285	S	S	.	.	H	α-helix	trans	-60.6	-45.9	176.3	-178.6	179	68.1	-165.1	-3.9	111.5	H1050 D1056 S1089 C1090 V1091 N1097	H1050-R1093 PolarHBondContact O-NH2 3.16Å; D1056-R1093 IonicContact OD1-CZ 3.14Å; D1056-R1093 IonicContact OD1-NE 2.82Å; D1056-R1093 IonicContact OD1-NH2 2.78Å; D1056-R1093 PolarHBondContact OD1-NH2 2.82Å; D1056-R1093 IonicContact OD2-NH2 3.82Å; S1089-R1093 VanDerWaalsContact O-CB 3.27Å; S1089-R1093 WeakPolarHBondContact O-CB 3.42Å; S1089-R1093 PolarHBondContact O-N 3.49Å; C1090-R1093 PolarHBondContact O-N 3.24Å; V1091-R1093 VanDerWaalsContact C-N 3.29Å; V1091-R1093 PolarHBondContact O-N 3.19Å; R1093-N1097 WeakPolarHBondContact O-CB 3.42Å; R1093-N1097 PolarHBondContact O-N 2.66Å; R1093-N1097 PolarHBondContact O-ND2 3.12Å
1094	N	89	Confident	84.4	Confident	15 Å²	15	62.6 Å²	62.6	8%	0.08	31%	0.305	C	S	.	.	H	α-helix	trans	-68.9	-44	-178.9	-81.5	-73.7	0	0	0	112.3	D1056 V1059 C1090 V1091 N1097 C1098	D1056-N1094 WeakPolarHBondContact CB-OD1 3.15Å; D1056-N1094 PolarHBondContact O-OD1 3.35Å; D1056-N1094 PolarHBondContact OD1-ND2 2.89Å; V1059-N1094 HydrophobicContact CB-CB 4.35Å; V1059-N1094 HydrophobicContact CG1-CB 3.59Å; C1090-N1094 PolarHBondContact O-N 3.29Å; C1090-N1094 PolarHBondContact O-ND2 3.21Å; V1091-N1094 PolarHBondContact O-N 3.31Å; V1091-N1094 VanDerWaalsContact O-N 3.12Å; N1094-N1097 CarbonylContact O-C 3.53Å; N1094-N1097 PolarHBondContact O-N 2.79Å; N1094-C1098 PolarHBondContact O-N 3.47Å
1095	I	87.8	Confident	83.3	Confident	5 Å²	5	69.6 Å²	69.6	3%	0.026	33%	0.332	C	S	.	.	H	α-helix	trans	-65.9	-41	177.1	-65.1	-179.5	0	0	0	111.1	V1071 V1091 N1097 C1098 C1101	V1071-I1095 HydrophobicContact CB-CD1 4.48Å; V1071-I1095 HydrophobicContact CG2-CD1 3.93Å; V1091-I1095 HydrophobicContact CG1-CD1 3.69Å; V1091-I1095 HydrophobicContact CG1-CG1 4.22Å; V1091-I1095 WeakPolarHBondContact O-CG1 3.28Å; V1091-I1095 PolarHBondContact O-N 2.76Å; I1095-N1097 PolarHBondContact O-N 2.84Å; I1095-C1098 WeakPolarHBondContact O-CB 3.38Å; I1095-C1098 PolarHBondContact O-N 3.07Å; I1095-C1101 HydrophobicContact CG2-CB 4.48Å
1096	R	83.6	Confident	81.7	Confident	136 Å²	136	73 Å²	73	51%	0.513	35%	0.354	S	S	.	.	H	α-helix	trans	-61.2	-32.4	175.1	-172.8	-176.6	70.8	-171.8	-1.4	112.4	E1092 C1098	E1092-R1096 WeakPolarHBondContact O-CB 3.5Å; E1092-R1096 PolarHBondContact O-N 3.17Å; R1096-C1098 VanDerWaalsContact C-N 3.34Å
1097	N	84.5	Confident	80	Confident	88 Å²	88	71.9 Å²	71.9	47%	0.471	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-2.8	177.7	-66.7	-17.8	0	0	0	112.9	R1093 N1094 I1095 V1099	R1093-N1097 WeakPolarHBondContact O-CB 3.42Å; R1093-N1097 PolarHBondContact O-N 2.66Å; R1093-N1097 PolarHBondContact O-ND2 3.12Å; N1094-N1097 CarbonylContact O-C 3.53Å; N1094-N1097 PolarHBondContact O-N 2.79Å; I1095-N1097 PolarHBondContact O-N 2.84Å; N1097-V1099 PolarHBondContact O-N 2.9Å
1098	C	85.7	Confident	78.3	Confident	2 Å²	2	75.9 Å²	75.9	1%	0.014	39%	0.386	C	S	.	.			trans	-70.3	121.5	174.9	-179.8	0	0	0	0	109.4	H1068 N1094 I1095 R1096 V1100 C1101 K1102	H1068-C1098 PolarHBondContact CE1-SG 3.45Å; H1068-C1098 PolarHBondContact ND1-SG 2.86Å; N1094-C1098 PolarHBondContact O-N 3.47Å; I1095-C1098 WeakPolarHBondContact O-CB 3.38Å; I1095-C1098 PolarHBondContact O-N 3.07Å; R1096-C1098 VanDerWaalsContact C-N 3.34Å; C1098-V1100 VanDerWaalsContact C-N 3.33Å; C1098-V1100 PolarHBondContact O-N 2.89Å; C1098-C1101 HydrophobicContact CB-CB 4.03Å; C1098-C1101 PolarHBondContact O-N 3.03Å; C1098-C1101 VanDerWaalsContact SG-SG 3.69Å; C1098-K1102 WeakPolarHBondContact O-CB 3.49Å; C1098-K1102 PolarHBondContact O-N 2.87Å
1099	V	83	Confident	76.2	Confident	106 Å²	106	76 Å²	76	64%	0.642	40%	0.402	S	S	*	.	H	α-helix	trans	-65.8	-38.8	-174.9	179.5	0	0	0	0	111.1	N1097 K1102 A1103	N1097-V1099 PolarHBondContact O-N 2.9Å; V1099-K1102 PolarHBondContact O-N 3.48Å; V1099-A1103 WeakPolarHBondContact O-CB 3.17Å; V1099-A1103 PolarHBondContact O-N 2.86Å
1100	V	78.1	Confident	73.8	Confident	68 Å²	68	81.4 Å²	81.4	41%	0.412	42%	0.421	S	S	.	.	H	α-helix	trans	-62.8	-52.7	177.6	-177.8	0	0	0	0	110.5	C1098 K1102 A1103 Q1104	C1098-V1100 VanDerWaalsContact C-N 3.33Å; C1098-V1100 PolarHBondContact O-N 2.89Å; V1100-K1102 VanDerWaalsContact C-N 3.28Å; V1100-K1102 PolarHBondContact O-N 3.17Å; V1100-A1103 PolarHBondContact O-N 2.86Å; V1100-Q1104 WeakPolarHBondContact O-CG 3.4Å; V1100-Q1104 PolarHBondContact O-N 3.48Å
1101	C	82.3	Confident	71.7	Confident	10 Å²	10	89.1 Å²	89.1	7%	0.068	46%	0.457	C	S	.	.	H	α-helix	trans	-62.5	-35.9	176.4	-59.1	0	0	0	0	112.3	H1063 I1095 C1098 Q1104 R1105	H1063-C1101 PolarHBondContact CE1-SG 2.95Å; H1063-C1101 PolarHBondContact NE2-SG 2.84Å; I1095-C1101 HydrophobicContact CG2-CB 4.48Å; C1098-C1101 HydrophobicContact CB-CB 4.03Å; C1098-C1101 PolarHBondContact O-N 3.03Å; C1098-C1101 VanDerWaalsContact SG-SG 3.69Å; C1101-Q1104 PolarHBondContact O-N 2.94Å; C1101-R1105 WeakPolarHBondContact O-CB 3.48Å; C1101-R1105 VanDerWaalsContact O-CG 3.22Å; C1101-R1105 WeakPolarHBondContact O-CG 3.31Å; C1101-R1105 PolarHBondContact O-N 3.35Å
1102	K	78.5	Confident	69.3	Low	136 Å²	136	99.4 Å²	99.4	59%	0.591	50%	0.502	S	S	*	.	H	α-helix	trans	-66.8	-41.4	176.6	-171.7	177	-178.7	-177.9	0	111.6	C1098 V1099 V1100 R1105 T1106	C1098-K1102 WeakPolarHBondContact O-CB 3.49Å; C1098-K1102 PolarHBondContact O-N 2.87Å; V1099-K1102 PolarHBondContact O-N 3.48Å; V1100-K1102 VanDerWaalsContact C-N 3.28Å; V1100-K1102 PolarHBondContact O-N 3.17Å; K1102-R1105 PolarHBondContact O-N 3.45Å; K1102-T1106 PolarHBondContact O-N 3.07Å; K1102-T1106 PolarHBondContact O-OG1 2.88Å
1103	A	73.2	Confident	67.3	Low	64 Å²	64	101.5 Å²	101.5	53%	0.529	51%	0.513	S	S	.	.	H	α-helix	trans	-62.3	-46.8	175.5	0	0	0	0	0	110.7	V1099 V1100 R1105 T1106	V1099-A1103 WeakPolarHBondContact O-CB 3.17Å; V1099-A1103 PolarHBondContact O-N 2.86Å; V1100-A1103 PolarHBondContact O-N 2.86Å; A1103-R1105 VanDerWaalsContact C-N 3.28Å; A1103-R1105 PolarHBondContact O-N 2.7Å; A1103-T1106 WeakPolarHBondContact O-CB 3.07Å; A1103-T1106 PolarHBondContact O-N 3.17Å
1104	Q	66.9	Low	65.4	Low	154 Å²	154	101.6 Å²	101.6	72%	0.72	53%	0.526	S	S	*	.	H	α-helix	trans	-61.6	-32.6	175.5	-71.4	179.6	-22	0	0	113.2	V1100 C1101	V1100-Q1104 WeakPolarHBondContact O-CG 3.4Å; V1100-Q1104 PolarHBondContact O-N 3.48Å; C1101-Q1104 PolarHBondContact O-N 2.94Å
1105	R	66.5	Low	64	Low	154 Å²	154	106 Å²	106	58%	0.581	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-10.3	175.1	-71.5	174.4	-173	-170.7	2.2	114.3	C1101 K1102 A1103 V1107	C1101-R1105 WeakPolarHBondContact O-CB 3.48Å; C1101-R1105 VanDerWaalsContact O-CG 3.22Å; C1101-R1105 WeakPolarHBondContact O-CG 3.31Å; C1101-R1105 PolarHBondContact O-N 3.35Å; K1102-R1105 PolarHBondContact O-N 3.45Å; A1103-R1105 VanDerWaalsContact C-N 3.28Å; A1103-R1105 PolarHBondContact O-N 2.7Å; R1105-V1107 PolarHBondContact O-N 2.7Å
1106	T	53.4	Low	62.8	Low	97 Å²	97	110.1 Å²	110.1	60%	0.595	58%	0.579	S	S	*	*			trans	-74.7	99.1	-174.8	-60.3	0	0	0	0	109.4	K1102 A1103	K1102-T1106 PolarHBondContact O-N 3.07Å; K1102-T1106 PolarHBondContact O-OG1 2.88Å; A1103-T1106 WeakPolarHBondContact O-CB 3.07Å; A1103-T1106 PolarHBondContact O-N 3.17Å
1107	V	49.1	Very low	61.8	Low	106 Å²	106	105.4 Å²	105.4	64%	0.642	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-77.6	135.5	172.6	-171.1	0	0	0	0	109.2	R1105	R1105-V1107 PolarHBondContact O-N 2.7Å
1108	P	48.5	Very low	61.1	Low	95 Å²	95	106 Å²	106	62%	0.617	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-58.2	153.9	174	-21.2	31.8	0	0	0	112.5	E1110	P1108-E1110 PolarHBondContact O-N 2.86Å
1109	V	45.9	Very low	60.3	Low	142 Å²	142	109.3 Å²	109.3	86%	0.861	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-55	117.3	-178.9	178	0	0	0	0	111.1
1110	E	35.4	Very low	59.5	Low	171 Å²	171	109.3 Å²	109.3	80%	0.799	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-72.9	126.4	177.1	-68.4	177.7	168	0	0	111	P1108	P1108-E1110 PolarHBondContact O-N 2.86Å
1111	Q	43.8	Very low	59	Low	163 Å²	163	109 Å²	109	76%	0.762	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-74.6	143	168.5	-78.2	179.4	-20.1	0	0	110.1	M1113	Q1111-M1113 PolarHBondContact O-N 3.47Å
1112	K	42	Very low	58.4	Low	215 Å²	215	115.5 Å²	115.5	94%	0.935	60%	0.602	S	S	*	*			trans	-69.4	100	175.1	-169.3	179	-177.3	-177.7	0	109
1113	M	45.8	Very low	58.2	Low	125 Å²	125	113.9 Å²	113.9	62%	0.616	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-65.4	144.3	-178.6	-62.3	-64.9	-74.8	0	0	111.4	Q1111 T1234	Q1111-M1113 PolarHBondContact O-N 3.47Å; M1113-T1234 HydrophobicContact CE-CG2 4.36Å
1114	S	50.7	Low	58.3	Low	82 Å²	82	111.9 Å²	111.9	57%	0.573	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-68.3	166	174.6	64.6	0	0	0	0	112	L1116	S1114-L1116 PolarHBondContact O-N 3.25Å
1115	S	59.3	Low	59	Low	108 Å²	108	112.7 Å²	112.7	76%	0.755	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-49.8	138.7	169.5	-25.4	0	0	0	0	111.1
1116	L	62.3	Low	59.7	Low	90 Å²	90	108.4 Å²	108.4	47%	0.471	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-67	140.3	176.2	-63.5	177.4	0	0	0	110	S1114 V1121	S1114-L1116 PolarHBondContact O-N 3.25Å; L1116-V1121 HydrophobicContact CB-CG2 4.14Å
1117	P	63.8	Low	61.2	Low	37 Å²	37	104.7 Å²	104.7	24%	0.24	56%	0.563	C	S	.	*	P	Polyproline II helix	trans	-60.6	148.6	173.6	-15.8	28.2	0	0	0	111.1	E1119 R1120 V1121	P1117-E1119 WeakPolarHBondContact CB-OE2 3.44Å; P1117-E1119 PolarHBondContact O-N 3.23Å; P1117-R1120 WeakPolarHBondContact O-CB 3.44Å; P1117-R1120 PolarHBondContact O-N 3.43Å; P1117-V1121 VanDerWaalsContact O-CG2 3.25Å; P1117-V1121 WeakPolarHBondContact O-CG2 3.4Å
1118	V	69.8	Low	62.8	Low	101 Å²	101	102.7 Å²	102.7	61%	0.612	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-56.8	-35.3	-177.8	177.4	0	0	0	0	111.2	R1120 V1121 K1122	V1118-R1120 PolarHBondContact O-N 3.49Å; V1118-R1120 VanDerWaalsContact O-N 3.16Å; V1118-V1121 PolarHBondContact O-N 2.99Å; V1118-K1122 WeakPolarHBondContact O-CB 3.37Å; V1118-K1122 PolarHBondContact O-N 3.49Å
1119	E	67	Low	64.4	Low	72 Å²	72	98.8 Å²	98.8	34%	0.336	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	-62.7	-20.7	179.1	-56.7	72.6	-154.7	0	0	112.7	P1117 N1129 M1157 I1191	P1117-E1119 WeakPolarHBondContact CB-OE2 3.44Å; P1117-E1119 PolarHBondContact O-N 3.23Å; E1119-N1129 HydrophobicContact CB-CB 4.41Å; E1119-N1129 PolarHBondContact O-ND2 3.13Å; E1119-N1129 VanDerWaalsContact O-ND2 3.14Å; E1119-M1157 HydrophobicContact CB-SD 4.25Å; E1119-I1191 HydrophobicContact CG-CD1 4.06Å
1120	R	68	Low	66.3	Low	106 Å²	106	92 Å²	92	40%	0.4	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-92.1	-14	175.9	-151.8	-175.7	-162.9	166.1	4.9	113.3	P1117 V1118 M1157	P1117-R1120 WeakPolarHBondContact O-CB 3.44Å; P1117-R1120 PolarHBondContact O-N 3.43Å; V1118-R1120 PolarHBondContact O-N 3.49Å; V1118-R1120 VanDerWaalsContact O-N 3.16Å; R1120-M1157 HydrophobicContact CB-CB 4.48Å; R1120-M1157 HydrophobicContact CG-CB 4.15Å; R1120-M1157 WeakPolarHBondContact CG-O 3.39Å
1121	V	66.4	Low	68.6	Low	60 Å²	60	84.4 Å²	84.4	36%	0.364	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-23.6	-175.2	-147.5	0	0	0	0	111.5	L1116 P1117 V1118 I1298	L1116-V1121 HydrophobicContact CB-CG2 4.14Å; P1117-V1121 VanDerWaalsContact O-CG2 3.25Å; P1117-V1121 WeakPolarHBondContact O-CG2 3.4Å; V1118-V1121 PolarHBondContact O-N 2.99Å; V1121-I1298 HydrophobicContact CB-CD1 4.46Å; V1121-I1298 HydrophobicContact CG1-CD1 3.32Å; V1121-I1298 HydrophobicContact CG1-CG1 4.2Å; V1121-I1298 WeakPolarHBondContact O-CG2 3.46Å
1122	K	70.2	Confident	70.5	Confident	147 Å²	147	76.8 Å²	76.8	64%	0.639	41%	0.411	S	S	*	.	S	Bend	trans	-83.9	135.5	177.5	-163.9	179	-179.5	-175.5	0	110.4	V1118 A1124	V1118-K1122 WeakPolarHBondContact O-CB 3.37Å; V1118-K1122 PolarHBondContact O-N 3.49Å; K1122-A1124 PolarHBondContact O-N 3.01Å
1123	V	73.9	Confident	72.4	Confident	102 Å²	102	67 Å²	67	62%	0.618	37%	0.369	S	S	*	.			trans	-60.2	127.9	172.3	-176.5	0	0	0	0	108.8	I1298	V1123-I1298 HydrophobicContact CG2-CG2 4.37Å; V1123-I1298 WeakPolarHBondContact CG2-O 3.27Å
1124	A	76	Confident	74.3	Confident	23 Å²	23	62.1 Å²	62.1	19%	0.19	34%	0.344	C	S	.	.			trans	-148.2	163.2	-179.3	0	0	0	0	0	108.6	K1122 E1128	K1122-A1124 PolarHBondContact O-N 3.01Å; A1124-E1128 HydrophobicContact CB-CB 4.35Å
1125	F	81.1	Confident	75.5	Confident	170 Å²	170	58.2 Å²	58.2	75%	0.746	32%	0.317	S	S	*	.			trans	-65.6	154.8	176.1	-69.7	-74.4	0	0	0	111.4	L1127 E1128	F1125-L1127 PolarHBondContact O-N 3.37Å; F1125-E1128 HydrophobicContact CB-CB 4.2Å; F1125-E1128 WeakPolarHBondContact CD2-OE2 3.27Å; F1125-E1128 PolarHBondContact N-OE2 3.43Å; F1125-E1128 WeakPolarHBondContact O-CB 3.29Å; F1125-E1128 PolarHBondContact O-N 3.45Å
1126	A	82.2	Confident	76.3	Confident	65 Å²	65	54.4 Å²	54.4	54%	0.537	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	130.6	178.3	0	0	0	0	0	110.4	E1128 T1159	A1126-E1128 PolarHBondContact O-N 2.94Å; A1126-T1159 HydrophobicContact CB-CG2 4.36Å
1127	L	84.1	Confident	77	Confident	19 Å²	19	53.2 Å²	53.2	10%	0.099	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	11.3	-175.1	-61.2	164.2	0	0	0	115.7	F1125 T1130 C1156 F1182 R1186 P1189	F1125-L1127 PolarHBondContact O-N 3.37Å; L1127-T1130 PolarHBondContact O-OG1 3.47Å; L1127-C1156 HydrophobicContact CD2-CB 3.77Å; L1127-C1156 HydrophobicContact CG-CB 4.14Å; L1127-C1156 PolarHBondContact N-SG 3.41Å; L1127-F1182 HydrophobicContact CB-CZ 4.44Å; L1127-F1182 HydrophobicContact CD1-CE2 4.17Å; L1127-F1182 HydrophobicContact CD2-CE2 4.19Å; L1127-F1182 HydrophobicContact CD2-CZ 4.17Å; L1127-R1186 HydrophobicContact CD1-CB 3.76Å; L1127-R1186 HydrophobicContact CD1-CG 3.78Å; L1127-P1189 VanDerWaalsContact O-CB 3.29Å; L1127-P1189 WeakPolarHBondContact O-CB 3.27Å
1128	E	81.9	Confident	77.7	Confident	63 Å²	63	52.7 Å²	52.7	29%	0.294	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-46.8	172	-174.1	179.8	167	0	0	111.3	A1124 F1125 A1126 P1189 A1190 I1191	A1124-E1128 HydrophobicContact CB-CB 4.35Å; F1125-E1128 HydrophobicContact CB-CB 4.2Å; F1125-E1128 WeakPolarHBondContact CD2-OE2 3.27Å; F1125-E1128 PolarHBondContact N-OE2 3.43Å; F1125-E1128 WeakPolarHBondContact O-CB 3.29Å; F1125-E1128 PolarHBondContact O-N 3.45Å; A1126-E1128 PolarHBondContact O-N 2.94Å; E1128-P1189 CarbonylContact O-C 3.52Å; E1128-P1189 WeakPolarHBondContact O-CB 3.37Å; E1128-A1190 HydrophobicContact CG-CB 3.74Å; E1128-A1190 PolarHBondContact O-N 3.21Å; E1128-I1191 PolarHBondContact O-N 2.94Å
1129	N	84	Confident	78.2	Confident	13 Å²	13	54.4 Å²	54.4	7%	0.07	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	110.8	171.4	-61.6	-28.7	0	0	0	108.6	E1119 M1157	E1119-N1129 HydrophobicContact CB-CB 4.41Å; E1119-N1129 PolarHBondContact O-ND2 3.13Å; E1119-N1129 VanDerWaalsContact O-ND2 3.14Å; N1129-M1157 HydrophobicContact CB-CB 4.09Å; N1129-M1157 HydrophobicContact CB-CG 4.29Å; N1129-M1157 HydrophobicContact CB-SD 4.12Å; N1129-M1157 WeakPolarHBondContact O-CB 3.22Å; N1129-M1157 WeakPolarHBondContact O-CG 3.26Å; N1129-M1157 PolarHBondContact O-N 3.15Å
1130	T	84.9	Confident	78.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	126.5	-171	-67.4	0	0	0	0	111.7	L1127 F1154 T1155 M1157 F1182 I1191 I1192 Q1193	L1127-T1130 PolarHBondContact O-OG1 3.47Å; T1130-F1154 HydrophobicContact CG2-CB 3.84Å; T1130-F1154 HydrophobicContact CG2-CD1 4.07Å; T1130-F1154 HydrophobicContact CG2-CG 4.48Å; T1130-T1155 CarbonylContact C-O 3.56Å; T1130-T1155 WeakPolarHBondContact CA-O 3.17Å; T1130-M1157 VanDerWaalsContact C-CE 3.5Å; T1130-M1157 WeakPolarHBondContact O-CE 3.1Å; T1130-F1182 HydrophobicContact CG2-CE1 4.25Å; T1130-F1182 HydrophobicContact CG2-CZ 4Å; T1130-I1191 PolarHBondContact N-O 2.8Å; T1130-I1192 CarbonylContact O-C 3.33Å; T1130-I1192 VanDerWaalsContact O-CA 3.25Å; T1130-I1192 WeakPolarHBondContact O-CA 3.48Å; T1130-Q1193 PolarHBondContact O-N 2.89Å
1131	G	83.4	Confident	79.3	Confident	11 Å²	11	50.4 Å²	50.4	11%	0.113	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	146	165.4	0	0	0	0	0	110.9	F1154 T1155 Q1193	G1131-F1154 CarbonylContact O-C 3.46Å; G1131-F1154 WeakPolarHBondContact O-CA 3.47Å; G1131-T1155 PolarHBondContact N-O 3.31Å; G1131-T1155 PolarHBondContact O-N 3Å; G1131-Q1193 CarbonylContact C-O 3.56Å; G1131-Q1193 WeakPolarHBondContact CA-O 3.16Å
1132	L	83.8	Confident	79.7	Confident	3 Å²	3	51.8 Å²	51.8	2%	0.016	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	132.1	-175.4	167.6	63.9	0	0	0	110.6	C1152 L1153 F1154 F1175 I1192 Q1193 S1194 F1200	L1132-C1152 VanDerWaalsContact CD1-SG 3.53Å; L1132-L1153 CarbonylContact C-O 3.4Å; L1132-L1153 WeakPolarHBondContact CA-O 3.47Å; L1132-F1154 HydrophobicContact CD1-CD1 4.01Å; L1132-F1154 HydrophobicContact CD1-CE1 3.7Å; L1132-F1154 HydrophobicContact CD1-CZ 4.08Å; L1132-F1175 HydrophobicContact CD1-CE2 3.77Å; L1132-F1175 HydrophobicContact CD1-CZ 4.48Å; L1132-F1175 HydrophobicContact CD2-CE1 4.49Å; L1132-F1175 HydrophobicContact CD2-CE2 3.47Å; L1132-F1175 VanDerWaalsContact CD2-CE2 3.47Å; L1132-F1175 HydrophobicContact CD2-CZ 3.36Å; L1132-F1175 HydrophobicContact CG-CE2 4.23Å; L1132-I1192 HydrophobicContact CB-CG2 3.8Å; L1132-I1192 HydrophobicContact CD2-CG2 3.99Å; L1132-Q1193 PolarHBondContact N-O 3.48Å; L1132-S1194 WeakPolarHBondContact O-CA 3.49Å; L1132-F1200 HydrophobicContact CD1-CE1 4.08Å; L1132-F1200 HydrophobicContact CD1-CZ 4.19Å; L1132-F1200 HydrophobicContact CD2-CD1 3.72Å; L1132-F1200 HydrophobicContact CD2-CE1 3.67Å; L1132-F1200 HydrophobicContact CD2-CG 4.24Å; L1132-F1200 HydrophobicContact CD2-CZ 4.13Å; L1132-F1200 HydrophobicContact CG-CD1 4.35Å; L1132-F1200 HydrophobicContact CG-CE1 3.85Å; L1132-F1200 HydrophobicContact CG-CE2 4.37Å; L1132-F1200 HydrophobicContact CG-CZ 3.85Å
1133	D	82.8	Confident	79.9	Confident	11 Å²	11	56.2 Å²	56.2	6%	0.059	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	170.6	176	-140.9	-25.3	0	0	0	113.1	L1153 S1233	D1133-L1153 HydrophobicContact CB-CB 4.47Å; D1133-L1153 HydrophobicContact CB-CD2 4.26Å; D1133-L1153 PolarHBondContact N-O 3.39Å; D1133-L1153 PolarHBondContact O-N 3.27Å; D1133-S1233 VanDerWaalsContact OD2-CB 3.24Å; D1133-S1233 WeakPolarHBondContact OD2-CB 3.49Å; D1133-S1233 PolarHBondContact OD2-OG 3.22Å
1134	F	84.1	Confident	79.8	Confident	21 Å²	21	63 Å²	63	9%	0.092	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	115.4	168.6	-83.4	-58.8	0	0	0	111.5	I1151 C1152 V1167 M1170 F1175 F1197 T1199 F1200	F1134-I1151 CarbonylContact C-O 3.53Å; F1134-I1151 WeakPolarHBondContact CA-O 3.1Å; F1134-C1152 HydrophobicContact CD1-CB 4.17Å; F1134-C1152 HydrophobicContact CE1-CB 3.76Å; F1134-V1167 HydrophobicContact CD1-CG2 4.34Å; F1134-V1167 HydrophobicContact CE1-CG2 3.69Å; F1134-M1170 HydrophobicContact CB-SD 4.44Å; F1134-M1170 HydrophobicContact CD2-CG 4.26Å; F1134-M1170 HydrophobicContact CD2-SD 4.34Å; F1134-M1170 HydrophobicContact CE2-CB 4.24Å; F1134-M1170 HydrophobicContact CE2-CG 4.38Å; F1134-M1170 HydrophobicContact CG-CG 4.34Å; F1134-M1170 HydrophobicContact CG-SD 4.41Å; F1134-F1175 HydrophobicContact CZ-CB 4.19Å; F1134-F1175 HydrophobicContact CZ-CD2 4.13Å; F1134-F1175 HydrophobicContact CZ-CG 4.5Å; F1134-F1197 HydrophobicContact CD2-CD1 4.27Å; F1134-F1197 HydrophobicContact CD2-CE1 4.46Å; F1134-F1197 HydrophobicContact CE2-CD1 4.46Å; F1134-T1199 HydrophobicContact CE2-CG2 4.3Å; F1134-F1200 AromaticContact CD2-CE1 3.78Å; F1134-F1200 HydrophobicContact CD2-CE1 3.78Å; F1134-F1200 HydrophobicContact CD2-CE2 4.12Å; F1134-F1200 AromaticContact CD2-CZ 3.32Å; F1134-F1200 HydrophobicContact CD2-CZ 3.32Å; F1134-F1200 HydrophobicContact CE2-CD1 4.27Å; F1134-F1200 AromaticContact CE2-CE1 3.32Å; F1134-F1200 HydrophobicContact CE2-CE1 3.32Å; F1134-F1200 HydrophobicContact CE2-CE2 4.41Å; F1134-F1200 AromaticContact CE2-CZ 3.42Å; F1134-F1200 HydrophobicContact CE2-CZ 3.42Å; F1134-F1200 VanDerWaalsContact CE2-CZ 3.42Å; F1134-F1200 HydrophobicContact CG-CZ 4.11Å; F1134-F1200 AromaticContact CZ-CE1 3.93Å; F1134-F1200 HydrophobicContact CZ-CE1 3.93Å; F1134-F1200 HydrophobicContact CZ-CZ 4.28Å
1135	A	76.5	Confident	79.5	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124.6	169.8	0	0	0	0	0	110.6	I1151	A1135-I1151 HydrophobicContact CB-CB 4.28Å; A1135-I1151 PolarHBondContact N-O 3.31Å; A1135-I1151 PolarHBondContact O-N 3.16Å
1136	G	75.5	Confident	79.3	Confident	29 Å²	29	61.1 Å²	61.1	30%	0.299	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	160.2	-173	178.3	0	0	0	0	0	114.1
1137	P	77.3	Confident	79.2	Confident	65 Å²	65	62 Å²	62	42%	0.422	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-79.4	142.5	5.7	31.2	-34.3	0	0	0	113.4	K1148 Y1150	P1137-K1148 HydrophobicContact CB-CB 4.45Å; P1137-K1148 HydrophobicContact CB-CD 4.27Å; P1137-K1148 HydrophobicContact CB-CG 4.3Å; P1137-Y1150 HydrophobicContact CB-CD1 4.44Å; P1137-Y1150 HydrophobicContact CB-CE1 3.82Å
1138	I	77.9	Confident	79.2	Confident	26 Å²	26	66.4 Å²	66.4	13%	0.133	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	161.4	162.8	60	169.3	0	0	0	109.5	V1140 K1148 A1149 I1151 L1166 L1240 T1265	I1138-V1140 HydrophobicContact CD1-CG2 4.38Å; I1138-K1148 CarbonylContact O-C 3.52Å; I1138-K1148 WeakPolarHBondContact O-CA 3.16Å; I1138-A1149 HydrophobicContact CG1-CB 4.12Å; I1138-A1149 WeakPolarHBondContact CG1-O 3.19Å; I1138-A1149 PolarHBondContact N-O 2.88Å; I1138-A1149 PolarHBondContact O-N 3.32Å; I1138-A1149 VanDerWaalsContact O-O 3.14Å; I1138-I1151 HydrophobicContact CD1-CD1 4.14Å; I1138-I1151 HydrophobicContact CD1-CG1 3.9Å; I1138-I1151 HydrophobicContact CG2-CD1 4.39Å; I1138-L1166 HydrophobicContact CD1-CD1 3.73Å; I1138-L1240 HydrophobicContact CG2-CD2 3.97Å; I1138-T1265 HydrophobicContact CD1-CG2 3.8Å
1139	Y	81	Confident	79.4	Confident	136 Å²	136	63.7 Å²	63.7	53%	0.533	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	122.1	179.5	-68.7	-89.1	0	0	0	110.4	E1147 K1148	Y1139-E1147 WeakPolarHBondContact CA-O 3.35Å; Y1139-K1148 HydrophobicContact CD1-CG 4.07Å; Y1139-K1148 HydrophobicContact CE1-CD 4.42Å; Y1139-K1148 HydrophobicContact CE1-CG 3.54Å; Y1139-K1148 VanDerWaalsContact OH-CE 3.27Å; Y1139-K1148 WeakPolarHBondContact OH-CE 3.15Å
1140	V	80.1	Confident	79.6	Confident	6 Å²	6	65 Å²	65	4%	0.036	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	135.7	-178.7	178.4	0	0	0	0	108.7	I1138 R1142 E1147 A1149 L1166 E1262 T1265	I1138-V1140 HydrophobicContact CD1-CG2 4.38Å; V1140-R1142 PolarHBondContact O-N 3.25Å; V1140-E1147 PolarHBondContact N-O 3.36Å; V1140-E1147 PolarHBondContact O-N 3.17Å; V1140-A1149 HydrophobicContact CB-CB 4.3Å; V1140-A1149 HydrophobicContact CG2-CB 3.62Å; V1140-L1166 HydrophobicContact CG2-CD1 4.43Å; V1140-E1262 VanDerWaalsContact CG1-CA 3.46Å; V1140-E1262 HydrophobicContact CG1-CB 3.84Å; V1140-E1262 HydrophobicContact CG1-CG 4.49Å; V1140-T1265 HydrophobicContact CG2-CG2 4.07Å
1141	R	78.8	Confident	79.7	Confident	88 Å²	88	65 Å²	65	33%	0.332	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	117.2	178.4	-173.8	169.3	53.7	85.9	6.9	110	S1259 L1260 D1261 E1264	R1141-S1259 WeakPolarHBondContact CB-O 3.44Å; R1141-S1259 WeakPolarHBondContact CD-O 3.37Å; R1141-S1259 PolarHBondContact NE-O 2.75Å; R1141-L1260 PolarHBondContact N-O 2.93Å; R1141-D1261 IonicContact NH2-OD2 3.67Å; R1141-D1261 WeakPolarHBondContact O-CA 3.48Å; R1141-E1264 IonicContact NH2-OE2 3.65Å
1142	R	75	Confident	80	Confident	90 Å²	90	64.4 Å²	64.4	34%	0.34	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	113.2	169.7	-83.3	-174.6	164.3	-169	-1.8	109.6	V1140 R1144 T1145 E1147 E1262	V1140-R1142 PolarHBondContact O-N 3.25Å; R1142-R1144 PolarHBondContact O-N 2.89Å; R1142-T1145 PolarHBondContact N-O 3.13Å; R1142-T1145 PolarHBondContact O-N 2.68Å; R1142-T1145 VanDerWaalsContact O-O 3.07Å; R1142-T1145 PolarHBondContact O-OG1 3.2Å; R1142-E1147 WeakPolarHBondContact CD-OE2 3.29Å; R1142-E1262 IonicContact CZ-OE2 3.37Å; R1142-E1262 IonicContact NE-OE2 3.09Å; R1142-E1262 PolarHBondContact NE-OE2 3.48Å; R1142-E1262 VanDerWaalsContact NH2-CD 3.34Å; R1142-E1262 IonicContact NH2-OE1 2.67Å; R1142-E1262 PolarHBondContact NH2-OE1 3.38Å; R1142-E1262 IonicContact NH2-OE2 3.75Å; R1142-E1262 PolarHBondContact NH2-OE2 2.91Å
1143	R	72.6	Confident	80.2	Confident	240 Å²	240	64.3 Å²	64.3	91%	0.906	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	-102.4	-175.8	-58.8	177.8	176.3	-179.4	-1.8	111.8
1144	R	72.3	Confident	80.5	Confident	245 Å²	245	63.8 Å²	63.8	93%	0.925	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	0.2	-178.4	-66.1	-175.2	178.3	152.7	0.2	113	R1142	R1142-R1144 PolarHBondContact O-N 2.89Å
1145	T	70.7	Confident	80.5	Confident	77 Å²	77	63.9 Å²	63.9	47%	0.472	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	144.3	-176.9	46.8	0	0	0	0	111	R1142 E1147	R1142-T1145 PolarHBondContact N-O 3.13Å; R1142-T1145 PolarHBondContact O-N 2.68Å; R1142-T1145 VanDerWaalsContact O-O 3.07Å; R1142-T1145 PolarHBondContact O-OG1 3.2Å; T1145-E1147 PolarHBondContact OG1-OE1 3.18Å
1146	C	76.8	Confident	80.9	Confident	75 Å²	75	64 Å²	64	51%	0.507	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	118.2	168.8	-67.4	0	0	0	0	108.3	S1259	C1146-S1259 PolarHBondContact SG-OG 2.93Å
1147	E	80	Confident	80.9	Confident	85 Å²	85	63.3 Å²	63.3	40%	0.397	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	150.4	-179.7	-70	175.4	-166.2	0	0	110	Y1139 V1140 R1142 T1145	Y1139-E1147 WeakPolarHBondContact CA-O 3.35Å; V1140-E1147 PolarHBondContact N-O 3.36Å; V1140-E1147 PolarHBondContact O-N 3.17Å; R1142-E1147 WeakPolarHBondContact CD-OE2 3.29Å; T1145-E1147 PolarHBondContact OG1-OE1 3.18Å
1148	K	84.5	Confident	80.7	Confident	111 Å²	111	60.7 Å²	60.7	48%	0.483	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	137.1	173.3	-71.2	179.2	179	176.7	0	108.7	P1137 I1138 Y1139 Y1150	P1137-K1148 HydrophobicContact CB-CB 4.45Å; P1137-K1148 HydrophobicContact CB-CD 4.27Å; P1137-K1148 HydrophobicContact CB-CG 4.3Å; I1138-K1148 CarbonylContact O-C 3.52Å; I1138-K1148 WeakPolarHBondContact O-CA 3.16Å; Y1139-K1148 HydrophobicContact CD1-CG 4.07Å; Y1139-K1148 HydrophobicContact CE1-CD 4.42Å; Y1139-K1148 HydrophobicContact CE1-CG 3.54Å; Y1139-K1148 VanDerWaalsContact OH-CE 3.27Å; Y1139-K1148 WeakPolarHBondContact OH-CE 3.15Å; K1148-Y1150 HydrophobicContact CB-CE2 4.49Å
1149	A	85.1	Confident	80.6	Confident	5 Å²	5	61 Å²	61	4%	0.041	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	167.2	168.2	0	0	0	0	0	109.1	I1138 V1140 L1166 V1167	I1138-A1149 HydrophobicContact CG1-CB 4.12Å; I1138-A1149 WeakPolarHBondContact CG1-O 3.19Å; I1138-A1149 PolarHBondContact N-O 2.88Å; I1138-A1149 PolarHBondContact O-N 3.32Å; I1138-A1149 VanDerWaalsContact O-O 3.14Å; V1140-A1149 HydrophobicContact CB-CB 4.3Å; V1140-A1149 HydrophobicContact CG2-CB 3.62Å; A1149-L1166 HydrophobicContact CB-CD1 3.93Å; A1149-V1167 CarbonylContact C-O 3.58Å; A1149-V1167 WeakPolarHBondContact CA-O 3.16Å; A1149-V1167 WeakPolarHBondContact CB-O 3.44Å
1150	Y	89.2	Confident	80	Confident	40 Å²	40	62 Å²	62	16%	0.157	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	156.7	-178	-57.1	-97	0	0	0	109.4	P1137 K1148 V1167 M1170	P1137-Y1150 HydrophobicContact CB-CD1 4.44Å; P1137-Y1150 HydrophobicContact CB-CE1 3.82Å; K1148-Y1150 HydrophobicContact CB-CE2 4.49Å; Y1150-V1167 PolarHBondContact N-O 3.16Å; Y1150-V1167 WeakPolarHBondContact O-CG2 3.47Å; Y1150-V1167 PolarHBondContact O-N 3.41Å; Y1150-V1167 VanDerWaalsContact O-O 3.13Å; Y1150-M1170 HydrophobicContact CD1-CE 4.34Å; Y1150-M1170 HydrophobicContact CD1-CG 3.75Å; Y1150-M1170 HydrophobicContact CD1-SD 3.64Å; Y1150-M1170 HydrophobicContact CD2-CG 3.69Å; Y1150-M1170 HydrophobicContact CE1-CE 3.69Å; Y1150-M1170 HydrophobicContact CE1-CG 3.99Å; Y1150-M1170 HydrophobicContact CE1-SD 3.6Å; Y1150-M1170 VanDerWaalsContact CE1-SD 3.6Å; Y1150-M1170 HydrophobicContact CE2-CE 4.39Å; Y1150-M1170 HydrophobicContact CE2-CG 3.95Å; Y1150-M1170 HydrophobicContact CG-CG 3.6Å; Y1150-M1170 HydrophobicContact CG-SD 4.15Å
1151	I	86.5	Confident	80	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	116.6	176.8	-55.1	159.8	0	0	0	107	F1134 A1135 I1138 L1153 L1164 E1165 V1243 L1269	F1134-I1151 CarbonylContact C-O 3.53Å; F1134-I1151 WeakPolarHBondContact CA-O 3.1Å; A1135-I1151 HydrophobicContact CB-CB 4.28Å; A1135-I1151 PolarHBondContact N-O 3.31Å; A1135-I1151 PolarHBondContact O-N 3.16Å; I1138-I1151 HydrophobicContact CD1-CD1 4.14Å; I1138-I1151 HydrophobicContact CD1-CG1 3.9Å; I1138-I1151 HydrophobicContact CG2-CD1 4.39Å; I1151-L1153 PolarHBondContact O-N 2.63Å; I1151-L1164 HydrophobicContact CG2-CB 3.97Å; I1151-L1164 HydrophobicContact CG2-CD2 3.93Å; I1151-L1164 HydrophobicContact CG2-CG 4.41Å; I1151-E1165 CarbonylContact C-O 3.56Å; I1151-E1165 WeakPolarHBondContact CA-O 3.46Å; I1151-V1243 HydrophobicContact CD1-CG2 4.49Å; I1151-L1269 HydrophobicContact CD1-CD2 3.51Å; I1151-L1269 HydrophobicContact CG1-CD1 4.04Å; I1151-L1269 HydrophobicContact CG1-CD2 3.92Å; I1151-L1269 HydrophobicContact CG2-CD1 4.43Å; I1151-L1269 HydrophobicContact CG2-CD2 4.26Å
1152	C	89.7	Confident	80.3	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	113	167.8	-167.5	0	0	0	0	108.1	L1132 F1134 F1154 E1165 V1167 A1178	L1132-C1152 VanDerWaalsContact CD1-SG 3.53Å; F1134-C1152 HydrophobicContact CD1-CB 4.17Å; F1134-C1152 HydrophobicContact CE1-CB 3.76Å; C1152-F1154 HydrophobicContact CB-CE2 4.24Å; C1152-F1154 VanDerWaalsContact SG-CE2 3.58Å; C1152-F1154 VanDerWaalsContact SG-CZ 3.55Å; C1152-E1165 HydrophobicContact CB-CB 4.15Å; C1152-E1165 PolarHBondContact N-O 3Å; C1152-E1165 PolarHBondContact O-N 3.24Å; C1152-V1167 HydrophobicContact CB-CG1 4.4Å; C1152-A1178 HydrophobicContact CB-CB 4.21Å
1153	L	87.8	Confident	81	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	119.5	-174.3	166.7	63.1	0	0	0	109.7	L1132 D1133 I1151 I1162 L1164 L1235 I1239	L1132-L1153 CarbonylContact C-O 3.4Å; L1132-L1153 WeakPolarHBondContact CA-O 3.47Å; D1133-L1153 HydrophobicContact CB-CB 4.47Å; D1133-L1153 HydrophobicContact CB-CD2 4.26Å; D1133-L1153 PolarHBondContact N-O 3.39Å; D1133-L1153 PolarHBondContact O-N 3.27Å; I1151-L1153 PolarHBondContact O-N 2.63Å; L1153-I1162 HydrophobicContact CD1-CB 4.29Å; L1153-I1162 HydrophobicContact CD1-CG2 4.27Å; L1153-L1164 HydrophobicContact CB-CD2 4.31Å; L1153-L1164 HydrophobicContact CD1-CD2 3.39Å; L1153-L1164 HydrophobicContact CG-CD2 4.45Å; L1153-L1235 HydrophobicContact CD2-CB 4.19Å; L1153-L1235 HydrophobicContact CD2-CD2 3.96Å; L1153-L1235 HydrophobicContact CD2-CG 4.22Å; L1153-I1239 HydrophobicContact CD1-CD1 3.49Å; L1153-I1239 VanDerWaalsContact CD1-CD1 3.49Å; L1153-I1239 HydrophobicContact CD2-CD1 3.32Å; L1153-I1239 HydrophobicContact CG-CD1 4Å
1154	F	88.9	Confident	81.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	128.1	168.8	-57.1	-90.8	0	0	0	108.2	T1130 G1131 L1132 C1152 I1162 H1163 E1165 F1175 L1179 F1182	T1130-F1154 HydrophobicContact CG2-CB 3.84Å; T1130-F1154 HydrophobicContact CG2-CD1 4.07Å; T1130-F1154 HydrophobicContact CG2-CG 4.48Å; G1131-F1154 CarbonylContact O-C 3.46Å; G1131-F1154 WeakPolarHBondContact O-CA 3.47Å; L1132-F1154 HydrophobicContact CD1-CD1 4.01Å; L1132-F1154 HydrophobicContact CD1-CE1 3.7Å; L1132-F1154 HydrophobicContact CD1-CZ 4.08Å; C1152-F1154 HydrophobicContact CB-CE2 4.24Å; C1152-F1154 VanDerWaalsContact SG-CE2 3.58Å; C1152-F1154 VanDerWaalsContact SG-CZ 3.55Å; F1154-I1162 CarbonylContact O-C 3.19Å; F1154-I1162 WeakPolarHBondContact O-CA 3.45Å; F1154-H1163 HydrophobicContact CB-CB 4.15Å; F1154-H1163 AromaticContact CD2-CD2 3.97Å; F1154-H1163 PolarHBondContact N-O 2.79Å; F1154-H1163 PolarHBondContact O-N 3.27Å; F1154-E1165 HydrophobicContact CE2-CB 4.45Å; F1154-E1165 HydrophobicContact CE2-CG 4.26Å; F1154-F1175 HydrophobicContact CZ-CE2 4.45Å; F1154-L1179 HydrophobicContact CE1-CD1 3.71Å; F1154-L1179 HydrophobicContact CZ-CD1 4.15Å; F1154-F1182 HydrophobicContact CB-CD2 4.09Å; F1154-F1182 HydrophobicContact CB-CE2 3.83Å; F1154-F1182 HydrophobicContact CB-CZ 4.09Å; F1154-F1182 AromaticContact CD1-CD1 3.69Å; F1154-F1182 HydrophobicContact CD1-CD1 3.69Å; F1154-F1182 HydrophobicContact CD1-CD2 4.3Å; F1154-F1182 AromaticContact CD1-CE1 3.87Å; F1154-F1182 HydrophobicContact CD1-CE1 3.87Å; F1154-F1182 HydrophobicContact CD1-CE2 4.44Å; F1154-F1182 AromaticContact CD1-CG 3.93Å; F1154-F1182 HydrophobicContact CD1-CG 3.93Å; F1154-F1182 HydrophobicContact CD1-CZ 4.25Å; F1154-F1182 HydrophobicContact CD2-CB 4.18Å; F1154-F1182 HydrophobicContact CD2-CD2 4.05Å; F1154-F1182 HydrophobicContact CD2-CG 4.03Å; F1154-F1182 HydrophobicContact CE1-CB 4.28Å; F1154-F1182 AromaticContact CE1-CD1 3.8Å; F1154-F1182 HydrophobicContact CE1-CD1 3.8Å; F1154-F1182 HydrophobicContact CE1-CE1 4.37Å; F1154-F1182 HydrophobicContact CE1-CG 4.06Å; F1154-F1182 HydrophobicContact CE2-CB 3.88Å; F1154-F1182 HydrophobicContact CE2-CG 4.17Å; F1154-F1182 HydrophobicContact CG-CD1 4.12Å; F1154-F1182 AromaticContact CG-CD2 3.88Å; F1154-F1182 HydrophobicContact CG-CD2 3.88Å; F1154-F1182 HydrophobicContact CG-CE1 4.31Å; F1154-F1182 HydrophobicContact CG-CE2 4.06Å; F1154-F1182 AromaticContact CG-CG 3.91Å; F1154-F1182 HydrophobicContact CG-CG 3.91Å; F1154-F1182 HydrophobicContact CG-CZ 4.29Å; F1154-F1182 HydrophobicContact CZ-CB 3.94Å; F1154-F1182 HydrophobicContact CZ-CD1 4.32Å; F1154-F1182 HydrophobicContact CZ-CG 4.18Å
1155	T	85.2	Confident	82.8	Confident	24 Å²	24	32.2 Å²	32.2	15%	0.147	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	128	178.8	-179.4	0	0	0	0	110.2	T1130 G1131 M1157 A1161 L1235	T1130-T1155 CarbonylContact C-O 3.56Å; T1130-T1155 WeakPolarHBondContact CA-O 3.17Å; G1131-T1155 PolarHBondContact N-O 3.31Å; G1131-T1155 PolarHBondContact O-N 3Å; T1155-M1157 PolarHBondContact O-N 3.44Å; T1155-A1161 CarbonylContact C-O 3.56Å; T1155-L1235 HydrophobicContact CG2-CD2 4.21Å
1156	C	82.9	Confident	83.8	Confident	2 Å²	2	29 Å²	29	1%	0.014	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	125.1	169.6	-178	0	0	0	0	109.2	L1127 T1158 T1159 R1160 A1161	L1127-C1156 HydrophobicContact CD2-CB 3.77Å; L1127-C1156 HydrophobicContact CG-CB 4.14Å; L1127-C1156 PolarHBondContact N-SG 3.41Å; C1156-T1158 PolarHBondContact O-N 2.72Å; C1156-T1158 PolarHBondContact SG-N 3.35Å; C1156-T1159 PolarHBondContact SG-N 3.47Å; C1156-T1159 VanDerWaalsContact SG-N 3.38Å; C1156-T1159 PolarHBondContact SG-OG1 3.28Å; C1156-R1160 PolarHBondContact O-N 2.86Å; C1156-A1161 HydrophobicContact CB-CB 4.08Å; C1156-A1161 WeakPolarHBondContact CB-O 3.39Å; C1156-A1161 PolarHBondContact N-O 3.37Å
1157	M	76.6	Confident	84.4	Confident	14 Å²	14	25.7 Å²	25.7	7%	0.069	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-30.6	179	-66.3	-169.5	-166.5	0	0	112.2	E1119 R1120 N1129 T1130 T1155 Q1193	E1119-M1157 HydrophobicContact CB-SD 4.25Å; R1120-M1157 HydrophobicContact CB-CB 4.48Å; R1120-M1157 HydrophobicContact CG-CB 4.15Å; R1120-M1157 WeakPolarHBondContact CG-O 3.39Å; N1129-M1157 HydrophobicContact CB-CB 4.09Å; N1129-M1157 HydrophobicContact CB-CG 4.29Å; N1129-M1157 HydrophobicContact CB-SD 4.12Å; N1129-M1157 WeakPolarHBondContact O-CB 3.22Å; N1129-M1157 WeakPolarHBondContact O-CG 3.26Å; N1129-M1157 PolarHBondContact O-N 3.15Å; T1130-M1157 VanDerWaalsContact C-CE 3.5Å; T1130-M1157 WeakPolarHBondContact O-CE 3.1Å; T1155-M1157 PolarHBondContact O-N 3.44Å; M1157-Q1193 HydrophobicContact CE-CB 3.27Å; M1157-Q1193 HydrophobicContact CE-CG 4.26Å; M1157-Q1193 VanDerWaalsContact CE-OE1 3.25Å
1158	T	73.7	Confident	84.8	Confident	11 Å²	11	23.1 Å²	23.1	7%	0.067	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-56.8	-174.9	-39.3	0	0	0	0	111.7	C1156 F1299	C1156-T1158 PolarHBondContact O-N 2.72Å; C1156-T1158 PolarHBondContact SG-N 3.35Å; T1158-F1299 HydrophobicContact CG2-CZ 4.13Å; T1158-F1299 WeakPolarHBondContact O-CZ 3.44Å
1159	T	74	Confident	84.9	Confident	33 Å²	33	20.2 Å²	20.2	20%	0.202	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-4.2	-168.3	64.1	0	0	0	0	115.2	A1126 C1156 A1161 L1281	A1126-T1159 HydrophobicContact CB-CG2 4.36Å; C1156-T1159 PolarHBondContact SG-N 3.47Å; C1156-T1159 VanDerWaalsContact SG-N 3.38Å; C1156-T1159 PolarHBondContact SG-OG1 3.28Å; T1159-A1161 PolarHBondContact O-N 2.87Å; T1159-A1161 WeakPolarHBondContact OG1-CB 3.4Å; T1159-A1161 PolarHBondContact OG1-N 3.02Å; T1159-L1281 WeakPolarHBondContact O-CD2 3.4Å
1160	R	70.5	Confident	85	Confident	156 Å²	156	22.7 Å²	22.7	59%	0.589	11%	0.112	S	C	*	.			trans	62.4	6.1	-169.5	-53.8	-176.4	170.8	-177.1	-1	115.6	C1156 I1162	C1156-R1160 PolarHBondContact O-N 2.86Å; R1160-I1162 PolarHBondContact O-N 3.44Å
1161	A	80	Confident	85	Confident	22 Å²	22	24 Å²	24	18%	0.182	13%	0.125	C	C	.	.			trans	-55.4	137.5	169.1	0	0	0	0	0	109.3	T1155 C1156 T1159	T1155-A1161 CarbonylContact C-O 3.56Å; C1156-A1161 HydrophobicContact CB-CB 4.08Å; C1156-A1161 WeakPolarHBondContact CB-O 3.39Å; C1156-A1161 PolarHBondContact N-O 3.37Å; T1159-A1161 PolarHBondContact O-N 2.87Å; T1159-A1161 WeakPolarHBondContact OG1-CB 3.4Å; T1159-A1161 PolarHBondContact OG1-N 3.02Å
1162	I	84.8	Confident	84.9	Confident	4 Å²	4	24.8 Å²	24.8	2%	0.021	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	165.4	177.9	62.1	167.7	0	0	0	110.6	L1153 F1154 R1160 L1164 V1276 S1277	L1153-I1162 HydrophobicContact CD1-CB 4.29Å; L1153-I1162 HydrophobicContact CD1-CG2 4.27Å; F1154-I1162 CarbonylContact O-C 3.19Å; F1154-I1162 WeakPolarHBondContact O-CA 3.45Å; R1160-I1162 PolarHBondContact O-N 3.44Å; I1162-L1164 HydrophobicContact CD1-CD1 4.16Å; I1162-L1164 HydrophobicContact CD1-CD2 4.19Å; I1162-L1164 HydrophobicContact CD1-CG 4.14Å; I1162-V1276 HydrophobicContact CD1-CB 3.58Å; I1162-V1276 HydrophobicContact CD1-CG1 3.73Å; I1162-V1276 HydrophobicContact CD1-CG2 3.78Å; I1162-V1276 HydrophobicContact CG1-CB 3.92Å; I1162-V1276 HydrophobicContact CG1-CG1 3.91Å; I1162-V1276 HydrophobicContact CG2-CG1 4.23Å; I1162-S1277 PolarHBondContact N-OG 3.24Å
1163	H	90	Very high	84.7	Confident	4 Å²	4	27.6 Å²	27.6	2%	0.019	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	128.9	167.1	-179.3	97.5	0	0	0	107.6	F1154 E1165 F1182 R1186	F1154-H1163 HydrophobicContact CB-CB 4.15Å; F1154-H1163 AromaticContact CD2-CD2 3.97Å; F1154-H1163 PolarHBondContact N-O 2.79Å; F1154-H1163 PolarHBondContact O-N 3.27Å; H1163-E1165 IonicContact CD2-OE1 3.96Å; H1163-E1165 IonicContact CE1-OE1 3.26Å; H1163-E1165 IonicContact NE2-OE1 3.48Å; H1163-E1165 PolarHBondContact NE2-OE1 2.89Å; H1163-F1182 HydrophobicContact CB-CD2 3.85Å; H1163-F1182 HydrophobicContact CB-CE2 3.88Å; H1163-F1182 AromaticContact CD2-CD2 3.6Å; H1163-F1182 AromaticContact CG-CD2 3.61Å; H1163-R1186 PolarHBondContact ND1-NE 2.81Å
1164	L	90.6	Very high	84.8	Confident	11 Å²	11	33.2 Å²	33.2	6%	0.058	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	129.8	-174	-58.1	-179	0	0	0	110.7	I1151 L1153 I1162 L1269 V1272	I1151-L1164 HydrophobicContact CG2-CB 3.97Å; I1151-L1164 HydrophobicContact CG2-CD2 3.93Å; I1151-L1164 HydrophobicContact CG2-CG 4.41Å; L1153-L1164 HydrophobicContact CB-CD2 4.31Å; L1153-L1164 HydrophobicContact CD1-CD2 3.39Å; L1153-L1164 HydrophobicContact CG-CD2 4.45Å; I1162-L1164 HydrophobicContact CD1-CD1 4.16Å; I1162-L1164 HydrophobicContact CD1-CD2 4.19Å; I1162-L1164 HydrophobicContact CD1-CG 4.14Å; L1164-L1269 HydrophobicContact CB-CB 4.28Å; L1164-L1269 HydrophobicContact CD1-CB 4.46Å; L1164-L1269 HydrophobicContact CD1-CD2 4.07Å; L1164-V1272 HydrophobicContact CD1-CB 4.03Å; L1164-V1272 HydrophobicContact CD1-CG1 3.87Å
1165	E	92.1	Very high	84.9	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.009	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	122.3	176.2	-76.5	-65.7	154.1	0	0	111.5	I1151 C1152 F1154 H1163 A1178 R1181 R1185	I1151-E1165 CarbonylContact C-O 3.56Å; I1151-E1165 WeakPolarHBondContact CA-O 3.46Å; C1152-E1165 HydrophobicContact CB-CB 4.15Å; C1152-E1165 PolarHBondContact N-O 3Å; C1152-E1165 PolarHBondContact O-N 3.24Å; F1154-E1165 HydrophobicContact CE2-CB 4.45Å; F1154-E1165 HydrophobicContact CE2-CG 4.26Å; H1163-E1165 IonicContact CD2-OE1 3.96Å; H1163-E1165 IonicContact CE1-OE1 3.26Å; H1163-E1165 IonicContact NE2-OE1 3.48Å; H1163-E1165 PolarHBondContact NE2-OE1 2.89Å; E1165-A1178 HydrophobicContact CB-CB 3.98Å; E1165-A1178 HydrophobicContact CG-CB 4.43Å; E1165-R1181 IonicContact OE2-CZ 3.96Å; E1165-R1181 IonicContact OE2-NE 3.65Å; E1165-R1181 PolarHBondContact OE2-NE 3.4Å; E1165-R1181 IonicContact OE2-NH2 3.2Å; E1165-R1181 PolarHBondContact OE2-NH2 3.21Å; E1165-R1185 IonicContact OE1-CZ 2.72Å; E1165-R1185 IonicContact OE1-NH1 3.63Å; E1165-R1185 PolarHBondContact OE1-NH1 2.74Å
1166	L	91	Very high	84.9	Confident	9 Å²	9	33.8 Å²	33.8	5%	0.047	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	130	173.2	-172.9	63.3	0	0	0	110.7	I1138 V1140 A1149 R1181 E1262 T1265 L1269	I1138-L1166 HydrophobicContact CD1-CD1 3.73Å; V1140-L1166 HydrophobicContact CG2-CD1 4.43Å; A1149-L1166 HydrophobicContact CB-CD1 3.93Å; L1166-R1181 PolarHBondContact O-NH2 3.44Å; L1166-E1262 HydrophobicContact CD2-CG 3.77Å; L1166-T1265 HydrophobicContact CD1-CG2 4.02Å; L1166-T1265 HydrophobicContact CD2-CG2 3.96Å; L1166-L1269 HydrophobicContact CB-CD1 3.95Å; L1166-L1269 HydrophobicContact CD1-CD1 4.21Å
1167	V	90.3	Very high	85.2	Confident	7 Å²	7	37.4 Å²	37.4	4%	0.042	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	142.7	172.6	-62.4	0	0	0	0	110.8	F1134 A1149 Y1150 C1152 D1169 A1178	F1134-V1167 HydrophobicContact CD1-CG2 4.34Å; F1134-V1167 HydrophobicContact CE1-CG2 3.69Å; A1149-V1167 CarbonylContact C-O 3.58Å; A1149-V1167 WeakPolarHBondContact CA-O 3.16Å; A1149-V1167 WeakPolarHBondContact CB-O 3.44Å; Y1150-V1167 PolarHBondContact N-O 3.16Å; Y1150-V1167 WeakPolarHBondContact O-CG2 3.47Å; Y1150-V1167 PolarHBondContact O-N 3.41Å; Y1150-V1167 VanDerWaalsContact O-O 3.13Å; C1152-V1167 HydrophobicContact CB-CG1 4.4Å; V1167-D1169 VanDerWaalsContact C-N 3.34Å; V1167-D1169 WeakPolarHBondContact CG2-O 3.24Å; V1167-A1178 HydrophobicContact CG1-CB 3.73Å
1168	T	86.9	Confident	85.9	Confident	30 Å²	30	36.7 Å²	36.7	18%	0.184	19%	0.194	C	C	.	.	S	Bend	trans	-72.7	-28.6	-178.8	50.6	0	0	0	0	113
1169	D	86.3	Confident	86.6	Confident	51 Å²	51	36.4 Å²	36.4	27%	0.273	19%	0.192	S	C	.	.	S	Bend	trans	-153.3	168.4	-178.9	58.3	59.8	0	0	0	109	V1167 T1171 R1174	V1167-D1169 VanDerWaalsContact C-N 3.34Å; V1167-D1169 WeakPolarHBondContact CG2-O 3.24Å; D1169-T1171 VanDerWaalsContact C-N 3.29Å; D1169-T1171 HydrophobicContact CB-CG2 4.48Å; D1169-T1171 PolarHBondContact O-N 2.9Å; D1169-T1171 WeakPolarHBondContact OD1-CB 3.41Å; D1169-T1171 WeakPolarHBondContact OD1-CG2 3.32Å; D1169-T1171 PolarHBondContact OD1-N 3.1Å; D1169-T1171 PolarHBondContact OD1-OG1 3.41Å; D1169-R1174 WeakPolarHBondContact OD1-CG 3.48Å
1170	M	87.8	Confident	87.2	Confident	56 Å²	56	43.9 Å²	43.9	28%	0.276	22%	0.217	S	C	.	.			trans	-93.1	32.6	178.7	-57.3	-179	-68.7	0	0	112	F1134 Y1150 F1197 T1199	F1134-M1170 HydrophobicContact CB-SD 4.44Å; F1134-M1170 HydrophobicContact CD2-CG 4.26Å; F1134-M1170 HydrophobicContact CD2-SD 4.34Å; F1134-M1170 HydrophobicContact CE2-CB 4.24Å; F1134-M1170 HydrophobicContact CE2-CG 4.38Å; F1134-M1170 HydrophobicContact CG-CG 4.34Å; F1134-M1170 HydrophobicContact CG-SD 4.41Å; Y1150-M1170 HydrophobicContact CD1-CE 4.34Å; Y1150-M1170 HydrophobicContact CD1-CG 3.75Å; Y1150-M1170 HydrophobicContact CD1-SD 3.64Å; Y1150-M1170 HydrophobicContact CD2-CG 3.69Å; Y1150-M1170 HydrophobicContact CE1-CE 3.69Å; Y1150-M1170 HydrophobicContact CE1-CG 3.99Å; Y1150-M1170 HydrophobicContact CE1-SD 3.6Å; Y1150-M1170 VanDerWaalsContact CE1-SD 3.6Å; Y1150-M1170 HydrophobicContact CE2-CE 4.39Å; Y1150-M1170 HydrophobicContact CE2-CG 3.95Å; Y1150-M1170 HydrophobicContact CG-CG 3.6Å; Y1150-M1170 HydrophobicContact CG-SD 4.15Å; M1170-F1197 HydrophobicContact CB-CE1 3.96Å; M1170-F1197 HydrophobicContact CE-CE1 4.36Å; M1170-F1197 HydrophobicContact CE-CZ 3.83Å; M1170-F1197 HydrophobicContact SD-CE1 3.95Å; M1170-F1197 HydrophobicContact SD-CZ 3.86Å; M1170-T1199 WeakPolarHBondContact O-CB 3.4Å; M1170-T1199 WeakPolarHBondContact O-CG2 3.37Å; M1170-T1199 PolarHBondContact O-OG1 3.18Å
1171	T	88.6	Confident	88.2	Confident	68 Å²	68	39.6 Å²	39.6	42%	0.417	20%	0.2	S	C	.	.			trans	-78.3	155.9	175.7	64.4	0	0	0	0	111.9	D1169 A1173 R1174 F1175 T1199	D1169-T1171 VanDerWaalsContact C-N 3.29Å; D1169-T1171 HydrophobicContact CB-CG2 4.48Å; D1169-T1171 PolarHBondContact O-N 2.9Å; D1169-T1171 WeakPolarHBondContact OD1-CB 3.41Å; D1169-T1171 WeakPolarHBondContact OD1-CG2 3.32Å; D1169-T1171 PolarHBondContact OD1-N 3.1Å; D1169-T1171 PolarHBondContact OD1-OG1 3.41Å; T1171-A1173 VanDerWaalsContact C-N 3.32Å; T1171-A1173 PolarHBondContact O-N 2.85Å; T1171-R1174 PolarHBondContact O-N 3.43Å; T1171-R1174 WeakPolarHBondContact OG1-CG 3.41Å; T1171-F1175 PolarHBondContact O-N 3.19Å; T1171-T1199 VanDerWaalsContact C-CG2 3.49Å
1172	A	84.3	Confident	88.7	Confident	17 Å²	17	38.5 Å²	38.5	14%	0.14	19%	0.192	C	C	.	.	H	α-helix	trans	-60.2	-42.8	-177.8	0	0	0	0	0	111.4	R1174 F1175 V1176 T1199 A1203	A1172-R1174 PolarHBondContact O-N 3.17Å; A1172-F1175 WeakPolarHBondContact O-CB 3.22Å; A1172-F1175 PolarHBondContact O-N 3.35Å; A1172-V1176 VanDerWaalsContact O-CG2 3.31Å; A1172-V1176 WeakPolarHBondContact O-CG2 3.38Å; A1172-V1176 PolarHBondContact O-N 2.86Å; A1172-T1199 HydrophobicContact CB-CG2 4.41Å; A1172-A1203 HydrophobicContact CB-CB 4.49Å
1173	A	87	Confident	88.9	Confident	58 Å²	58	40.7 Å²	40.7	48%	0.479	20%	0.201	S	C	.	.	H	α-helix	trans	-59.3	-44.2	177.3	0	0	0	0	0	112.9	T1171 V1176 L1177	T1171-A1173 VanDerWaalsContact C-N 3.32Å; T1171-A1173 PolarHBondContact O-N 2.85Å; A1173-V1176 PolarHBondContact O-N 3.25Å; A1173-L1177 WeakPolarHBondContact O-CG 3.45Å; A1173-L1177 PolarHBondContact O-N 3.34Å; A1173-L1177 VanDerWaalsContact O-N 3.17Å
1174	R	89.6	Confident	88.8	Confident	118 Å²	118	44.7 Å²	44.7	45%	0.445	23%	0.234	S	C	.	.	H	α-helix	trans	-69.2	-36.3	177.9	-65.2	-57.6	178.6	175	-6.4	112.3	D1169 T1171 A1172 L1177 A1178	D1169-R1174 WeakPolarHBondContact OD1-CG 3.48Å; T1171-R1174 PolarHBondContact O-N 3.43Å; T1171-R1174 WeakPolarHBondContact OG1-CG 3.41Å; A1172-R1174 PolarHBondContact O-N 3.17Å; R1174-L1177 PolarHBondContact O-N 3.36Å; R1174-A1178 PolarHBondContact O-N 2.94Å; R1174-A1178 VanDerWaalsContact O-N 3.09Å
1175	F	90.2	Very high	88.7	Confident	1 Å²	1	50.3 Å²	50.3	0%	0.004	26%	0.255	C	S	.	.	H	α-helix	trans	-63.3	-46.3	172.1	169.8	-107.5	0	0	0	112.2	L1132 F1134 F1154 T1171 A1172 L1177 A1178 L1179 T1199 F1200 A1203	L1132-F1175 HydrophobicContact CD1-CE2 3.77Å; L1132-F1175 HydrophobicContact CD1-CZ 4.48Å; L1132-F1175 HydrophobicContact CD2-CE1 4.49Å; L1132-F1175 HydrophobicContact CD2-CE2 3.47Å; L1132-F1175 VanDerWaalsContact CD2-CE2 3.47Å; L1132-F1175 HydrophobicContact CD2-CZ 3.36Å; L1132-F1175 HydrophobicContact CG-CE2 4.23Å; F1134-F1175 HydrophobicContact CZ-CB 4.19Å; F1134-F1175 HydrophobicContact CZ-CD2 4.13Å; F1134-F1175 HydrophobicContact CZ-CG 4.5Å; F1154-F1175 HydrophobicContact CZ-CE2 4.45Å; T1171-F1175 PolarHBondContact O-N 3.19Å; A1172-F1175 WeakPolarHBondContact O-CB 3.22Å; A1172-F1175 PolarHBondContact O-N 3.35Å; F1175-L1177 VanDerWaalsContact C-N 3.25Å; F1175-L1177 PolarHBondContact O-N 3.17Å; F1175-A1178 CarbonylContact O-C 3.44Å; F1175-A1178 WeakPolarHBondContact O-CA 3.43Å; F1175-A1178 WeakPolarHBondContact O-CB 3.43Å; F1175-A1178 PolarHBondContact O-N 3.15Å; F1175-L1179 HydrophobicContact CE1-CD2 4.28Å; F1175-L1179 HydrophobicContact CZ-CB 4.31Å; F1175-L1179 HydrophobicContact CZ-CD1 4.2Å; F1175-L1179 HydrophobicContact CZ-CD2 4.26Å; F1175-L1179 WeakPolarHBondContact O-CB 3.45Å; F1175-L1179 PolarHBondContact O-N 3.4Å; F1175-T1199 HydrophobicContact CB-CG2 3.99Å; F1175-F1200 HydrophobicContact CD1-CD1 4.17Å; F1175-F1200 HydrophobicContact CD2-CD1 4Å; F1175-F1200 AromaticContact CD2-CE1 3.68Å; F1175-F1200 HydrophobicContact CD2-CE1 3.68Å; F1175-F1200 HydrophobicContact CE1-CD1 4.01Å; F1175-F1200 AromaticContact CE2-CD1 3.86Å; F1175-F1200 HydrophobicContact CE2-CD1 3.86Å; F1175-F1200 AromaticContact CE2-CE1 3.65Å; F1175-F1200 HydrophobicContact CE2-CE1 3.65Å; F1175-F1200 HydrophobicContact CG-CD1 4.16Å; F1175-F1200 HydrophobicContact CG-CE1 4.2Å; F1175-F1200 AromaticContact CZ-CD1 3.86Å; F1175-F1200 HydrophobicContact CZ-CD1 3.86Å; F1175-F1200 HydrophobicContact CZ-CE1 4.13Å; F1175-A1203 HydrophobicContact CD1-CB 3.42Å; F1175-A1203 VanDerWaalsContact CD1-CB 3.42Å; F1175-A1203 HydrophobicContact CE1-CB 3.64Å
1176	V	85.5	Confident	88.5	Confident	36 Å²	36	55.9 Å²	55.9	22%	0.218	28%	0.276	C	S	.	.	H	α-helix	trans	-58	-39.5	177.5	170.5	0	0	0	0	111.1	A1172 A1173 L1179 R1180 A1203	A1172-V1176 VanDerWaalsContact O-CG2 3.31Å; A1172-V1176 WeakPolarHBondContact O-CG2 3.38Å; A1172-V1176 PolarHBondContact O-N 2.86Å; A1173-V1176 PolarHBondContact O-N 3.25Å; V1176-L1179 PolarHBondContact O-N 2.91Å; V1176-R1180 WeakPolarHBondContact O-CB 3.25Å; V1176-R1180 PolarHBondContact O-N 3.16Å; V1176-A1203 HydrophobicContact CG2-CB 3.92Å
1177	L	89.9	Confident	88.2	Confident	77 Å²	77	57.3 Å²	57.3	40%	0.403	29%	0.293	S	S	.	.	H	α-helix	trans	-65.4	-38.3	173.5	-67.7	174.8	0	0	0	112.8	A1173 R1174 F1175 R1181	A1173-L1177 WeakPolarHBondContact O-CG 3.45Å; A1173-L1177 PolarHBondContact O-N 3.34Å; A1173-L1177 VanDerWaalsContact O-N 3.17Å; R1174-L1177 PolarHBondContact O-N 3.36Å; F1175-L1177 VanDerWaalsContact C-N 3.25Å; F1175-L1177 PolarHBondContact O-N 3.17Å; L1177-R1181 WeakPolarHBondContact O-CG 3.48Å; L1177-R1181 PolarHBondContact O-N 3.3Å; L1177-R1181 VanDerWaalsContact O-N 3.16Å; L1177-R1181 PolarHBondContact O-NH1 3.22Å; L1177-R1181 VanDerWaalsContact O-NH1 3.16Å
1178	A	90.6	Very high	87.8	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-66.1	-43.3	174.5	0	0	0	0	0	111.7	C1152 E1165 V1167 R1174 F1175 R1180 R1181 F1182	C1152-A1178 HydrophobicContact CB-CB 4.21Å; E1165-A1178 HydrophobicContact CB-CB 3.98Å; E1165-A1178 HydrophobicContact CG-CB 4.43Å; V1167-A1178 HydrophobicContact CG1-CB 3.73Å; R1174-A1178 PolarHBondContact O-N 2.94Å; R1174-A1178 VanDerWaalsContact O-N 3.09Å; F1175-A1178 CarbonylContact O-C 3.44Å; F1175-A1178 WeakPolarHBondContact O-CA 3.43Å; F1175-A1178 WeakPolarHBondContact O-CB 3.43Å; F1175-A1178 PolarHBondContact O-N 3.15Å; A1178-R1180 VanDerWaalsContact C-N 3.34Å; A1178-R1180 PolarHBondContact O-N 3.4Å; A1178-R1181 PolarHBondContact O-N 3.46Å; A1178-F1182 PolarHBondContact O-N 3.09Å
1179	L	88	Confident	87.6	Confident	4 Å²	4	60.9 Å²	60.9	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-60	-43.3	176	-171.3	68.1	0	0	0	111.6	F1154 F1175 V1176 R1181 F1182 F1183 I1192 L1207	F1154-L1179 HydrophobicContact CE1-CD1 3.71Å; F1154-L1179 HydrophobicContact CZ-CD1 4.15Å; F1175-L1179 HydrophobicContact CE1-CD2 4.28Å; F1175-L1179 HydrophobicContact CZ-CB 4.31Å; F1175-L1179 HydrophobicContact CZ-CD1 4.2Å; F1175-L1179 HydrophobicContact CZ-CD2 4.26Å; F1175-L1179 WeakPolarHBondContact O-CB 3.45Å; F1175-L1179 PolarHBondContact O-N 3.4Å; V1176-L1179 PolarHBondContact O-N 2.91Å; L1179-R1181 VanDerWaalsContact C-N 3.35Å; L1179-R1181 PolarHBondContact O-N 3.25Å; L1179-F1182 HydrophobicContact CD1-CD1 4.5Å; L1179-F1182 WeakPolarHBondContact O-CB 3.46Å; L1179-F1182 PolarHBondContact O-N 3Å; L1179-F1183 HydrophobicContact CD1-CD1 4.36Å; L1179-F1183 HydrophobicContact CD1-CE1 3.53Å; L1179-F1183 HydrophobicContact CD1-CE2 4.46Å; L1179-F1183 HydrophobicContact CD1-CZ 3.61Å; L1179-F1183 HydrophobicContact CD2-CE2 4.16Å; L1179-F1183 HydrophobicContact CD2-CZ 3.88Å; L1179-F1183 HydrophobicContact CG-CD1 4.49Å; L1179-F1183 HydrophobicContact CG-CE1 3.86Å; L1179-F1183 HydrophobicContact CG-CE2 3.94Å; L1179-F1183 HydrophobicContact CG-CZ 3.56Å; L1179-F1183 WeakPolarHBondContact O-CD1 3.43Å; L1179-F1183 WeakPolarHBondContact O-CG 3.03Å; L1179-F1183 PolarHBondContact O-N 2.85Å; L1179-I1192 HydrophobicContact CD1-CD1 3.68Å; L1179-L1207 HydrophobicContact CD2-CD1 3.77Å
1180	R	86.7	Confident	87.3	Confident	191 Å²	191	60.1 Å²	60.1	72%	0.721	30%	0.303	S	S	*	.	H	α-helix	trans	-61.6	-41	175.3	-173.3	175.7	177.9	175.2	0.3	112.3	V1176 A1178 F1183 A1184	V1176-R1180 WeakPolarHBondContact O-CB 3.25Å; V1176-R1180 PolarHBondContact O-N 3.16Å; A1178-R1180 VanDerWaalsContact C-N 3.34Å; A1178-R1180 PolarHBondContact O-N 3.4Å; R1180-F1183 PolarHBondContact O-N 3.39Å; R1180-A1184 WeakPolarHBondContact O-CB 3.4Å; R1180-A1184 PolarHBondContact O-N 3.29Å
1181	R	92.4	Very high	86.8	Confident	65 Å²	65	60.3 Å²	60.3	25%	0.245	31%	0.305	C	S	.	.	H	α-helix	trans	-65.8	-39.1	175.5	-71.8	-171.9	-57.9	-86.5	4.4	112	E1165 L1166 L1177 A1178 L1179 A1184 R1185	E1165-R1181 IonicContact OE2-CZ 3.96Å; E1165-R1181 IonicContact OE2-NE 3.65Å; E1165-R1181 PolarHBondContact OE2-NE 3.4Å; E1165-R1181 IonicContact OE2-NH2 3.2Å; E1165-R1181 PolarHBondContact OE2-NH2 3.21Å; L1166-R1181 PolarHBondContact O-NH2 3.44Å; L1177-R1181 WeakPolarHBondContact O-CG 3.48Å; L1177-R1181 PolarHBondContact O-N 3.3Å; L1177-R1181 VanDerWaalsContact O-N 3.16Å; L1177-R1181 PolarHBondContact O-NH1 3.22Å; L1177-R1181 VanDerWaalsContact O-NH1 3.16Å; A1178-R1181 PolarHBondContact O-N 3.46Å; L1179-R1181 VanDerWaalsContact C-N 3.35Å; L1179-R1181 PolarHBondContact O-N 3.25Å; R1181-A1184 PolarHBondContact O-N 2.95Å; R1181-R1185 WeakPolarHBondContact O-CB 3.43Å; R1181-R1185 WeakPolarHBondContact O-CG 3.35Å; R1181-R1185 PolarHBondContact O-N 3.2Å; R1181-R1185 VanDerWaalsContact O-N 3.15Å
1182	F	91.5	Very high	86.5	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-61	-50.7	173.9	172.1	-114.4	0	0	0	111.3	L1127 T1130 F1154 H1163 A1178 L1179 A1184 R1185 R1186 P1189	L1127-F1182 HydrophobicContact CB-CZ 4.44Å; L1127-F1182 HydrophobicContact CD1-CE2 4.17Å; L1127-F1182 HydrophobicContact CD2-CE2 4.19Å; L1127-F1182 HydrophobicContact CD2-CZ 4.17Å; T1130-F1182 HydrophobicContact CG2-CE1 4.25Å; T1130-F1182 HydrophobicContact CG2-CZ 4Å; F1154-F1182 HydrophobicContact CB-CD2 4.09Å; F1154-F1182 HydrophobicContact CB-CE2 3.83Å; F1154-F1182 HydrophobicContact CB-CZ 4.09Å; F1154-F1182 AromaticContact CD1-CD1 3.69Å; F1154-F1182 HydrophobicContact CD1-CD1 3.69Å; F1154-F1182 HydrophobicContact CD1-CD2 4.3Å; F1154-F1182 AromaticContact CD1-CE1 3.87Å; F1154-F1182 HydrophobicContact CD1-CE1 3.87Å; F1154-F1182 HydrophobicContact CD1-CE2 4.44Å; F1154-F1182 AromaticContact CD1-CG 3.93Å; F1154-F1182 HydrophobicContact CD1-CG 3.93Å; F1154-F1182 HydrophobicContact CD1-CZ 4.25Å; F1154-F1182 HydrophobicContact CD2-CB 4.18Å; F1154-F1182 HydrophobicContact CD2-CD2 4.05Å; F1154-F1182 HydrophobicContact CD2-CG 4.03Å; F1154-F1182 HydrophobicContact CE1-CB 4.28Å; F1154-F1182 AromaticContact CE1-CD1 3.8Å; F1154-F1182 HydrophobicContact CE1-CD1 3.8Å; F1154-F1182 HydrophobicContact CE1-CE1 4.37Å; F1154-F1182 HydrophobicContact CE1-CG 4.06Å; F1154-F1182 HydrophobicContact CE2-CB 3.88Å; F1154-F1182 HydrophobicContact CE2-CG 4.17Å; F1154-F1182 HydrophobicContact CG-CD1 4.12Å; F1154-F1182 AromaticContact CG-CD2 3.88Å; F1154-F1182 HydrophobicContact CG-CD2 3.88Å; F1154-F1182 HydrophobicContact CG-CE1 4.31Å; F1154-F1182 HydrophobicContact CG-CE2 4.06Å; F1154-F1182 AromaticContact CG-CG 3.91Å; F1154-F1182 HydrophobicContact CG-CG 3.91Å; F1154-F1182 HydrophobicContact CG-CZ 4.29Å; F1154-F1182 HydrophobicContact CZ-CB 3.94Å; F1154-F1182 HydrophobicContact CZ-CD1 4.32Å; F1154-F1182 HydrophobicContact CZ-CG 4.18Å; H1163-F1182 HydrophobicContact CB-CD2 3.85Å; H1163-F1182 HydrophobicContact CB-CE2 3.88Å; H1163-F1182 AromaticContact CD2-CD2 3.6Å; H1163-F1182 AromaticContact CG-CD2 3.61Å; A1178-F1182 PolarHBondContact O-N 3.09Å; L1179-F1182 HydrophobicContact CD1-CD1 4.5Å; L1179-F1182 WeakPolarHBondContact O-CB 3.46Å; L1179-F1182 PolarHBondContact O-N 3Å; F1182-A1184 VanDerWaalsContact C-N 3.32Å; F1182-A1184 PolarHBondContact O-N 3.37Å; F1182-R1185 PolarHBondContact O-N 3.01Å; F1182-R1185 VanDerWaalsContact O-N 3.12Å; F1182-R1186 HydrophobicContact CD2-CB 4.07Å; F1182-R1186 HydrophobicContact CD2-CG 3.82Å; F1182-R1186 HydrophobicContact CE2-CB 3.76Å; F1182-R1186 HydrophobicContact CE2-CG 3.72Å; F1182-R1186 HydrophobicContact CZ-CB 4.33Å; F1182-R1186 PolarHBondContact O-N 3.45Å; F1182-P1189 HydrophobicContact CE1-CG 4.07Å
1183	F	87.7	Confident	86.2	Confident	50 Å²	50	58 Å²	58	22%	0.219	29%	0.287	C	S	.	.	H	α-helix	trans	-59.6	-42.3	178.5	-67.4	-5	0	0	0	112.5	L1179 R1180 R1185 G1187 P1189 I1192 L1226	L1179-F1183 HydrophobicContact CD1-CD1 4.36Å; L1179-F1183 HydrophobicContact CD1-CE1 3.53Å; L1179-F1183 HydrophobicContact CD1-CE2 4.46Å; L1179-F1183 HydrophobicContact CD1-CZ 3.61Å; L1179-F1183 HydrophobicContact CD2-CE2 4.16Å; L1179-F1183 HydrophobicContact CD2-CZ 3.88Å; L1179-F1183 HydrophobicContact CG-CD1 4.49Å; L1179-F1183 HydrophobicContact CG-CE1 3.86Å; L1179-F1183 HydrophobicContact CG-CE2 3.94Å; L1179-F1183 HydrophobicContact CG-CZ 3.56Å; L1179-F1183 WeakPolarHBondContact O-CD1 3.43Å; L1179-F1183 WeakPolarHBondContact O-CG 3.03Å; L1179-F1183 PolarHBondContact O-N 2.85Å; R1180-F1183 PolarHBondContact O-N 3.39Å; F1183-R1185 VanDerWaalsContact C-N 3.27Å; F1183-R1185 PolarHBondContact O-N 3.13Å; F1183-G1187 CarbonylContact O-C 3.26Å; F1183-G1187 VanDerWaalsContact O-CA 3.25Å; F1183-G1187 WeakPolarHBondContact O-CA 3.15Å; F1183-G1187 PolarHBondContact O-N 3.15Å; F1183-P1189 HydrophobicContact CE1-CG 3.85Å; F1183-I1192 HydrophobicContact CE1-CD1 3.76Å; F1183-I1192 HydrophobicContact CZ-CD1 3.89Å; F1183-L1226 HydrophobicContact CZ-CD1 4.07Å
1184	A	87.6	Confident	85.9	Confident	87 Å²	87	55.4 Å²	55.4	72%	0.719	27%	0.265	S	S	*	.	H	α-helix	trans	-65	-29.8	178.8	0	0	0	0	0	113.3	R1180 R1181 F1182	R1180-A1184 WeakPolarHBondContact O-CB 3.4Å; R1180-A1184 PolarHBondContact O-N 3.29Å; R1181-A1184 PolarHBondContact O-N 2.95Å; F1182-A1184 VanDerWaalsContact C-N 3.32Å; F1182-A1184 PolarHBondContact O-N 3.37Å
1185	R	89	Confident	85.1	Confident	129 Å²	129	51.9 Å²	51.9	49%	0.487	26%	0.255	S	S	.	.	H	α-helix	trans	-94.4	-31.5	-176.9	-71.9	178.4	179	166.2	4.4	114	E1165 R1181 F1182 F1183	E1165-R1185 IonicContact OE1-CZ 2.72Å; E1165-R1185 IonicContact OE1-NH1 3.63Å; E1165-R1185 PolarHBondContact OE1-NH1 2.74Å; R1181-R1185 WeakPolarHBondContact O-CB 3.43Å; R1181-R1185 WeakPolarHBondContact O-CG 3.35Å; R1181-R1185 PolarHBondContact O-N 3.2Å; R1181-R1185 VanDerWaalsContact O-N 3.15Å; F1182-R1185 PolarHBondContact O-N 3.01Å; F1182-R1185 VanDerWaalsContact O-N 3.12Å; F1183-R1185 VanDerWaalsContact C-N 3.27Å; F1183-R1185 PolarHBondContact O-N 3.13Å
1186	R	88.1	Confident	84.3	Confident	120 Å²	120	56.4 Å²	56.4	45%	0.453	28%	0.279	S	S	.	.	H	α-helix	trans	-120.7	-3.5	-169.8	-56	-59.3	-172.2	177.9	7.1	113.8	L1127 H1163 F1182 D1273	L1127-R1186 HydrophobicContact CD1-CB 3.76Å; L1127-R1186 HydrophobicContact CD1-CG 3.78Å; H1163-R1186 PolarHBondContact ND1-NE 2.81Å; F1182-R1186 HydrophobicContact CD2-CB 4.07Å; F1182-R1186 HydrophobicContact CD2-CG 3.82Å; F1182-R1186 HydrophobicContact CE2-CB 3.76Å; F1182-R1186 HydrophobicContact CE2-CG 3.72Å; F1182-R1186 HydrophobicContact CZ-CB 4.33Å; F1182-R1186 PolarHBondContact O-N 3.45Å; R1186-D1273 IonicContact NH2-OD1 3.96Å; R1186-D1273 IonicContact NH2-OD2 3.38Å; R1186-D1273 PolarHBondContact NH2-OD2 3.24Å
1187	G	83.9	Confident	83.8	Confident	39 Å²	39	58.2 Å²	58.2	40%	0.402	28%	0.284	S	S	.	.			trans	83.1	168.7	-170.5	0	0	0	0	0	112.3	F1183	F1183-G1187 CarbonylContact O-C 3.26Å; F1183-G1187 VanDerWaalsContact O-CA 3.25Å; F1183-G1187 WeakPolarHBondContact O-CA 3.15Å; F1183-G1187 PolarHBondContact O-N 3.15Å
1188	R	82.1	Confident	83.4	Confident	106 Å²	106	63.3 Å²	63.3	40%	0.4	30%	0.303	S	S	.	.			trans	-80.9	121.6	178.2	-178.6	175.7	172.6	154	-2.8	109.4	R1224	R1188-R1224 PolarHBondContact NH2-O 3.07Å
1189	P	83.9	Confident	83.1	Confident	6 Å²	6	64 Å²	64	4%	0.039	31%	0.308	C	S	.	.			trans	-66.9	153.7	173.6	30.6	-36.2	0	0	0	110.5	L1127 E1128 F1182 F1183 I1192	L1127-P1189 VanDerWaalsContact O-CB 3.29Å; L1127-P1189 WeakPolarHBondContact O-CB 3.27Å; E1128-P1189 CarbonylContact O-C 3.52Å; E1128-P1189 WeakPolarHBondContact O-CB 3.37Å; F1182-P1189 HydrophobicContact CE1-CG 4.07Å; F1183-P1189 HydrophobicContact CE1-CG 3.85Å; P1189-I1192 HydrophobicContact CB-CG1 4.17Å; P1189-I1192 HydrophobicContact CG-CD1 3.54Å; P1189-I1192 HydrophobicContact CG-CG1 3.37Å
1190	A	78.4	Confident	82.8	Confident	34 Å²	34	63.9 Å²	63.9	28%	0.281	31%	0.307	S	S	.	.	S	Bend	trans	-70.9	-39.7	170.6	0	0	0	0	0	111.1	E1128	E1128-A1190 HydrophobicContact CG-CB 3.74Å; E1128-A1190 PolarHBondContact O-N 3.21Å
1191	I	78.3	Confident	82.4	Confident	60 Å²	60	59.1 Å²	59.1	31%	0.308	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	134.9	-177.2	-58.2	176.3	0	0	0	110	E1119 E1128 T1130	E1119-I1191 HydrophobicContact CG-CD1 4.06Å; E1128-I1191 PolarHBondContact O-N 2.94Å; T1130-I1191 PolarHBondContact N-O 2.8Å
1192	I	82	Confident	81.9	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.6	168.5	-56.6	-177.2	0	0	0	109.3	T1130 L1132 L1179 F1183 P1189 L1226 I1228	T1130-I1192 CarbonylContact O-C 3.33Å; T1130-I1192 VanDerWaalsContact O-CA 3.25Å; T1130-I1192 WeakPolarHBondContact O-CA 3.48Å; L1132-I1192 HydrophobicContact CB-CG2 3.8Å; L1132-I1192 HydrophobicContact CD2-CG2 3.99Å; L1179-I1192 HydrophobicContact CD1-CD1 3.68Å; F1183-I1192 HydrophobicContact CE1-CD1 3.76Å; F1183-I1192 HydrophobicContact CZ-CD1 3.89Å; P1189-I1192 HydrophobicContact CB-CG1 4.17Å; P1189-I1192 HydrophobicContact CG-CD1 3.54Å; P1189-I1192 HydrophobicContact CG-CG1 3.37Å; I1192-L1226 HydrophobicContact CD1-CD1 3.89Å; I1192-L1226 HydrophobicContact CD1-CD2 4.49Å; I1192-L1226 HydrophobicContact CG1-CD1 4.21Å; I1192-I1228 WeakPolarHBondContact O-CA 3.31Å
1193	Q	77.5	Confident	81.4	Confident	37 Å²	37	58.3 Å²	58.3	17%	0.173	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	129.8	178.8	-166.4	178.6	11.7	0	0	110.5	T1130 G1131 L1132 M1157 Y1229	T1130-Q1193 PolarHBondContact O-N 2.89Å; G1131-Q1193 CarbonylContact C-O 3.56Å; G1131-Q1193 WeakPolarHBondContact CA-O 3.16Å; L1132-Q1193 PolarHBondContact N-O 3.48Å; M1157-Q1193 HydrophobicContact CE-CB 3.27Å; M1157-Q1193 HydrophobicContact CE-CG 4.26Å; M1157-Q1193 VanDerWaalsContact CE-OE1 3.25Å; Q1193-Y1229 WeakPolarHBondContact CG-O 3.49Å
1194	S	80.7	Confident	81	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.014	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	177.4	178.8	75.6	0	0	0	0	111.8	L1132 F1200 I1228 Y1229 N1230 R1231	L1132-S1194 WeakPolarHBondContact O-CA 3.49Å; S1194-F1200 WeakPolarHBondContact OG-CD2 3.46Å; S1194-I1228 WeakPolarHBondContact OG-CG2 3.41Å; S1194-Y1229 PolarHBondContact N-O 3.47Å; S1194-N1230 VanDerWaalsContact O-CA 3.31Å; S1194-N1230 WeakPolarHBondContact O-CA 3.48Å; S1194-R1231 PolarHBondContact O-N 3.5Å
1195	D	72.6	Confident	80.6	Confident	44 Å²	44	60 Å²	60	24%	0.235	28%	0.284	C	S	.	.			trans	-76.2	-178.6	164.3	82	-24.8	0	0	0	111.4	F1197 F1200	D1195-F1197 PolarHBondContact O-N 2.92Å; D1195-F1197 VanDerWaalsContact O-N 3.13Å; D1195-F1197 VanDerWaalsContact OD1-CB 3.23Å; D1195-F1197 WeakPolarHBondContact OD1-CB 3.38Å; D1195-F1197 PolarHBondContact OD1-N 2.75Å; D1195-F1200 WeakPolarHBondContact OD1-CD2 3.41Å; D1195-F1200 VanDerWaalsContact OD1-CE2 3.3Å; D1195-F1200 WeakPolarHBondContact OD1-CE2 3.35Å
1196	N	73.6	Confident	80	Confident	97 Å²	97	57.7 Å²	57.7	52%	0.519	28%	0.279	S	S	.	.	S	Bend	trans	-84.5	29	-176	-167.7	5.2	0	0	0	112.8	K1201 N1230	N1196-K1201 VanDerWaalsContact OD1-CD 3.26Å; N1196-K1201 WeakPolarHBondContact OD1-CD 3.3Å; N1196-K1201 WeakPolarHBondContact OD1-CE 3.43Å; N1196-K1201 PolarHBondContact OD1-NZ 3.22Å; N1196-N1230 WeakPolarHBondContact CA-OD1 3.4Å
1197	F	75.3	Confident	79.4	Confident	73 Å²	73	53.1 Å²	53.1	32%	0.32	26%	0.263	S	S	.	.			trans	-67.6	136.8	-178.8	-159.5	-115.2	0	0	0	111.2	F1134 M1170 D1195 T1199 F1200 K1201	F1134-F1197 HydrophobicContact CD2-CD1 4.27Å; F1134-F1197 HydrophobicContact CD2-CE1 4.46Å; F1134-F1197 HydrophobicContact CE2-CD1 4.46Å; M1170-F1197 HydrophobicContact CB-CE1 3.96Å; M1170-F1197 HydrophobicContact CE-CE1 4.36Å; M1170-F1197 HydrophobicContact CE-CZ 3.83Å; M1170-F1197 HydrophobicContact SD-CE1 3.95Å; M1170-F1197 HydrophobicContact SD-CZ 3.86Å; D1195-F1197 PolarHBondContact O-N 2.92Å; D1195-F1197 VanDerWaalsContact O-N 3.13Å; D1195-F1197 VanDerWaalsContact OD1-CB 3.23Å; D1195-F1197 WeakPolarHBondContact OD1-CB 3.38Å; D1195-F1197 PolarHBondContact OD1-N 2.75Å; F1197-T1199 WeakPolarHBondContact CD1-OG1 3.38Å; F1197-T1199 VanDerWaalsContact CE1-OG1 3.23Å; F1197-T1199 WeakPolarHBondContact CE1-OG1 3.24Å; F1197-T1199 PolarHBondContact O-N 3.27Å; F1197-T1199 VanDerWaalsContact O-N 3.11Å; F1197-F1200 HydrophobicContact CB-CD2 3.73Å; F1197-F1200 HydrophobicContact CB-CE2 4.01Å; F1197-F1200 PolarHBondContact O-N 3.32Å; F1197-F1200 VanDerWaalsContact O-N 3.14Å; F1197-K1201 PolarHBondContact O-N 3.27Å
1198	K	82	Confident	78.9	Confident	184 Å²	184	56.2 Å²	56.2	80%	0.8	27%	0.268	S	S	*	.	H	α-helix	trans	-57	-33	-173.1	-71.4	-176.3	179.6	179.7	0	112.6	K1201 S1202	K1198-K1201 PolarHBondContact O-N 3.35Å; K1198-S1202 WeakPolarHBondContact O-CB 3.38Å; K1198-S1202 PolarHBondContact O-N 3.38Å
1199	T	83	Confident	78.5	Confident	16 Å²	16	57.1 Å²	57.1	10%	0.098	28%	0.276	C	S	.	.	H	α-helix	trans	-63.1	-48.3	178.9	-54.3	0	0	0	0	112.1	F1134 M1170 T1171 A1172 F1175 F1197 K1201 S1202 A1203	F1134-T1199 HydrophobicContact CE2-CG2 4.3Å; M1170-T1199 WeakPolarHBondContact O-CB 3.4Å; M1170-T1199 WeakPolarHBondContact O-CG2 3.37Å; M1170-T1199 PolarHBondContact O-OG1 3.18Å; T1171-T1199 VanDerWaalsContact C-CG2 3.49Å; A1172-T1199 HydrophobicContact CB-CG2 4.41Å; F1175-T1199 HydrophobicContact CB-CG2 3.99Å; F1197-T1199 WeakPolarHBondContact CD1-OG1 3.38Å; F1197-T1199 VanDerWaalsContact CE1-OG1 3.23Å; F1197-T1199 WeakPolarHBondContact CE1-OG1 3.24Å; F1197-T1199 PolarHBondContact O-N 3.27Å; F1197-T1199 VanDerWaalsContact O-N 3.11Å; T1199-K1201 VanDerWaalsContact C-N 3.35Å; T1199-K1201 PolarHBondContact O-N 3.05Å; T1199-S1202 PolarHBondContact O-N 3.05Å; T1199-A1203 WeakPolarHBondContact O-CB 3.41Å; T1199-A1203 PolarHBondContact O-N 3.23Å
1200	F	82.5	Confident	77.6	Confident	1 Å²	1	61.5 Å²	61.5	0%	0.004	30%	0.299	C	S	.	.	H	α-helix	trans	-64.9	-41	178.9	-57.3	-40.8	0	0	0	111.1	L1132 F1134 F1175 S1194 D1195 F1197 S1202 A1203 S1204	L1132-F1200 HydrophobicContact CD1-CE1 4.08Å; L1132-F1200 HydrophobicContact CD1-CZ 4.19Å; L1132-F1200 HydrophobicContact CD2-CD1 3.72Å; L1132-F1200 HydrophobicContact CD2-CE1 3.67Å; L1132-F1200 HydrophobicContact CD2-CG 4.24Å; L1132-F1200 HydrophobicContact CD2-CZ 4.13Å; L1132-F1200 HydrophobicContact CG-CD1 4.35Å; L1132-F1200 HydrophobicContact CG-CE1 3.85Å; L1132-F1200 HydrophobicContact CG-CE2 4.37Å; L1132-F1200 HydrophobicContact CG-CZ 3.85Å; F1134-F1200 AromaticContact CD2-CE1 3.78Å; F1134-F1200 HydrophobicContact CD2-CE1 3.78Å; F1134-F1200 HydrophobicContact CD2-CE2 4.12Å; F1134-F1200 AromaticContact CD2-CZ 3.32Å; F1134-F1200 HydrophobicContact CD2-CZ 3.32Å; F1134-F1200 HydrophobicContact CE2-CD1 4.27Å; F1134-F1200 AromaticContact CE2-CE1 3.32Å; F1134-F1200 HydrophobicContact CE2-CE1 3.32Å; F1134-F1200 HydrophobicContact CE2-CE2 4.41Å; F1134-F1200 AromaticContact CE2-CZ 3.42Å; F1134-F1200 HydrophobicContact CE2-CZ 3.42Å; F1134-F1200 VanDerWaalsContact CE2-CZ 3.42Å; F1134-F1200 HydrophobicContact CG-CZ 4.11Å; F1134-F1200 AromaticContact CZ-CE1 3.93Å; F1134-F1200 HydrophobicContact CZ-CE1 3.93Å; F1134-F1200 HydrophobicContact CZ-CZ 4.28Å; F1175-F1200 HydrophobicContact CD1-CD1 4.17Å; F1175-F1200 HydrophobicContact CD2-CD1 4Å; F1175-F1200 AromaticContact CD2-CE1 3.68Å; F1175-F1200 HydrophobicContact CD2-CE1 3.68Å; F1175-F1200 HydrophobicContact CE1-CD1 4.01Å; F1175-F1200 AromaticContact CE2-CD1 3.86Å; F1175-F1200 HydrophobicContact CE2-CD1 3.86Å; F1175-F1200 AromaticContact CE2-CE1 3.65Å; F1175-F1200 HydrophobicContact CE2-CE1 3.65Å; F1175-F1200 HydrophobicContact CG-CD1 4.16Å; F1175-F1200 HydrophobicContact CG-CE1 4.2Å; F1175-F1200 AromaticContact CZ-CD1 3.86Å; F1175-F1200 HydrophobicContact CZ-CD1 3.86Å; F1175-F1200 HydrophobicContact CZ-CE1 4.13Å; S1194-F1200 WeakPolarHBondContact OG-CD2 3.46Å; D1195-F1200 WeakPolarHBondContact OD1-CD2 3.41Å; D1195-F1200 VanDerWaalsContact OD1-CE2 3.3Å; D1195-F1200 WeakPolarHBondContact OD1-CE2 3.35Å; F1197-F1200 HydrophobicContact CB-CD2 3.73Å; F1197-F1200 HydrophobicContact CB-CE2 4.01Å; F1197-F1200 PolarHBondContact O-N 3.32Å; F1197-F1200 VanDerWaalsContact O-N 3.14Å; F1200-S1202 VanDerWaalsContact C-N 3.33Å; F1200-S1202 PolarHBondContact O-N 3.45Å; F1200-A1203 PolarHBondContact O-N 2.92Å; F1200-S1204 WeakPolarHBondContact O-CB 3.4Å; F1200-S1204 PolarHBondContact O-N 3.12Å
1201	K	79.2	Confident	77	Confident	91 Å²	91	64.9 Å²	64.9	40%	0.396	31%	0.307	S	S	.	.	H	α-helix	trans	-63.1	-35.4	173.3	-78.9	-170.6	157	177.6	0	114.2	N1196 F1197 K1198 T1199 R1205	N1196-K1201 VanDerWaalsContact OD1-CD 3.26Å; N1196-K1201 WeakPolarHBondContact OD1-CD 3.3Å; N1196-K1201 WeakPolarHBondContact OD1-CE 3.43Å; N1196-K1201 PolarHBondContact OD1-NZ 3.22Å; F1197-K1201 PolarHBondContact O-N 3.27Å; K1198-K1201 PolarHBondContact O-N 3.35Å; T1199-K1201 VanDerWaalsContact C-N 3.35Å; T1199-K1201 PolarHBondContact O-N 3.05Å; K1201-R1205 PolarHBondContact O-N 3.45Å; K1201-R1205 PolarHBondContact O-NE 2.98Å
1202	S	81.3	Confident	76.3	Confident	47 Å²	47	66.3 Å²	66.3	33%	0.329	32%	0.323	S	S	.	.	H	α-helix	trans	-69.5	-48.8	176	-163.8	0	0	0	0	110.6	K1198 T1199 F1200 S1204 R1205 E1206	K1198-S1202 WeakPolarHBondContact O-CB 3.38Å; K1198-S1202 PolarHBondContact O-N 3.38Å; T1199-S1202 PolarHBondContact O-N 3.05Å; F1200-S1202 VanDerWaalsContact C-N 3.33Å; F1200-S1202 PolarHBondContact O-N 3.45Å; S1202-S1204 VanDerWaalsContact C-N 3.32Å; S1202-S1204 PolarHBondContact O-N 3.47Å; S1202-R1205 PolarHBondContact O-N 3.48Å; S1202-R1205 VanDerWaalsContact O-N 3.16Å; S1202-E1206 PolarHBondContact O-N 3.27Å
1203	A	80.7	Confident	75	Confident	0 Å²	0	74 Å²	74	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-63.2	-36.8	178.3	0	0	0	0	0	112.6	A1172 F1175 V1176 T1199 F1200 R1205 E1206 L1207	A1172-A1203 HydrophobicContact CB-CB 4.49Å; F1175-A1203 HydrophobicContact CD1-CB 3.42Å; F1175-A1203 VanDerWaalsContact CD1-CB 3.42Å; F1175-A1203 HydrophobicContact CE1-CB 3.64Å; V1176-A1203 HydrophobicContact CG2-CB 3.92Å; T1199-A1203 WeakPolarHBondContact O-CB 3.41Å; T1199-A1203 PolarHBondContact O-N 3.23Å; F1200-A1203 PolarHBondContact O-N 2.92Å; A1203-R1205 VanDerWaalsContact C-N 3.32Å; A1203-R1205 PolarHBondContact O-N 3.44Å; A1203-E1206 PolarHBondContact O-N 3.45Å; A1203-L1207 WeakPolarHBondContact O-CB 3.12Å; A1203-L1207 VanDerWaalsContact O-CG 3.23Å; A1203-L1207 WeakPolarHBondContact O-CG 3.35Å; A1203-L1207 PolarHBondContact O-N 3.07Å
1204	S	79.4	Confident	73.5	Confident	17 Å²	17	78.1 Å²	78.1	12%	0.119	38%	0.382	C	S	.	.	H	α-helix	trans	-57.8	-44.2	173.5	-165.7	0	0	0	0	112	F1200 S1202 Q1208	F1200-S1204 WeakPolarHBondContact O-CB 3.4Å; F1200-S1204 PolarHBondContact O-N 3.12Å; S1202-S1204 VanDerWaalsContact C-N 3.32Å; S1202-S1204 PolarHBondContact O-N 3.47Å; S1204-Q1208 WeakPolarHBondContact O-CB 3.34Å; S1204-Q1208 VanDerWaalsContact O-CG 3.24Å; S1204-Q1208 WeakPolarHBondContact O-CG 3.22Å; S1204-Q1208 PolarHBondContact O-N 3.01Å
1205	R	79.1	Confident	71.8	Confident	156 Å²	156	84.3 Å²	84.3	59%	0.589	42%	0.415	S	S	*	.	H	α-helix	trans	-68.6	-42.4	179	-77.1	-177.5	-75.3	167	0.2	111.7	K1201 S1202 A1203 Q1208 Q1209	K1201-R1205 PolarHBondContact O-N 3.45Å; K1201-R1205 PolarHBondContact O-NE 2.98Å; S1202-R1205 PolarHBondContact O-N 3.48Å; S1202-R1205 VanDerWaalsContact O-N 3.16Å; A1203-R1205 VanDerWaalsContact C-N 3.32Å; A1203-R1205 PolarHBondContact O-N 3.44Å; R1205-Q1208 PolarHBondContact O-N 2.81Å; R1205-Q1209 PolarHBondContact O-N 3.04Å
1206	E	77	Confident	70.6	Confident	81 Å²	81	87.9 Å²	87.9	38%	0.379	44%	0.443	S	S	.	.	H	α-helix	trans	-62.9	-42.8	177.8	-168.8	175.4	178.9	0	0	111.5	S1202 A1203 Q1209 L1210	S1202-E1206 PolarHBondContact O-N 3.27Å; A1203-E1206 PolarHBondContact O-N 3.45Å; E1206-Q1209 PolarHBondContact O-N 3.32Å; E1206-L1210 HydrophobicContact CG-CD1 4.4Å; E1206-L1210 WeakPolarHBondContact O-CB 3.42Å; E1206-L1210 WeakPolarHBondContact O-CG 3.18Å; E1206-L1210 PolarHBondContact O-N 3.41Å
1207	L	74.5	Confident	69.3	Low	23 Å²	23	92.2 Å²	92.2	12%	0.12	46%	0.46	C	S	.	.	H	α-helix	trans	-64.2	-45.2	173.8	-71.4	170.3	0	0	0	111.6	L1179 A1203 Q1209 L1210 F1211 L1226	L1179-L1207 HydrophobicContact CD2-CD1 3.77Å; A1203-L1207 WeakPolarHBondContact O-CB 3.12Å; A1203-L1207 VanDerWaalsContact O-CG 3.23Å; A1203-L1207 WeakPolarHBondContact O-CG 3.35Å; A1203-L1207 PolarHBondContact O-N 3.07Å; L1207-Q1209 VanDerWaalsContact C-N 3.3Å; L1207-Q1209 PolarHBondContact O-N 2.76Å; L1207-L1210 PolarHBondContact O-N 3Å; L1207-F1211 HydrophobicContact CB-CD2 4.3Å; L1207-F1211 HydrophobicContact CB-CE2 4.1Å; L1207-F1211 HydrophobicContact CD2-CE2 4.16Å; L1207-F1211 WeakPolarHBondContact O-CB 3.27Å; L1207-F1211 WeakPolarHBondContact O-CD2 3.03Å; L1207-F1211 WeakPolarHBondContact O-CG 3.37Å; L1207-F1211 PolarHBondContact O-N 3.47Å; L1207-L1226 HydrophobicContact CD1-CD2 4.01Å
1208	Q	74.5	Confident	67.9	Low	105 Å²	105	99.5 Å²	99.5	49%	0.491	49%	0.486	S	S	.	.	H	α-helix	trans	-59.8	-40.1	176.7	-77.6	172.4	-7.7	0	0	112.3	S1204 R1205 S1212	S1204-Q1208 WeakPolarHBondContact O-CB 3.34Å; S1204-Q1208 VanDerWaalsContact O-CG 3.24Å; S1204-Q1208 WeakPolarHBondContact O-CG 3.22Å; S1204-Q1208 PolarHBondContact O-N 3.01Å; R1205-Q1208 PolarHBondContact O-N 2.81Å; Q1208-S1212 WeakPolarHBondContact O-CB 3.01Å; Q1208-S1212 PolarHBondContact O-N 3.47Å; Q1208-S1212 PolarHBondContact O-OG 2.85Å
1209	Q	72.4	Confident	66.1	Low	125 Å²	125	98.6 Å²	98.6	58%	0.584	48%	0.482	S	S	*	.	H	α-helix	trans	-65.3	-49.2	175.2	-79.5	-179.8	-34.7	0	0	112.1	R1205 E1206 L1207 F1211 S1212 E1213	R1205-Q1209 PolarHBondContact O-N 3.04Å; E1206-Q1209 PolarHBondContact O-N 3.32Å; L1207-Q1209 VanDerWaalsContact C-N 3.3Å; L1207-Q1209 PolarHBondContact O-N 2.76Å; Q1209-F1211 VanDerWaalsContact C-N 3.27Å; Q1209-F1211 PolarHBondContact O-N 2.91Å; Q1209-S1212 WeakPolarHBondContact CA-OG 3.24Å; Q1209-S1212 PolarHBondContact O-N 2.9Å; Q1209-S1212 PolarHBondContact O-OG 3.42Å; Q1209-E1213 PolarHBondContact O-N 3.49Å; Q1209-E1213 VanDerWaalsContact O-N 3.1Å
1210	L	66.6	Low	64.2	Low	97 Å²	97	106.2 Å²	106.2	51%	0.508	52%	0.522	S	S	.	.	H	α-helix	trans	-56.2	-41.6	176.4	-79.9	161.9	0	0	0	112	E1206 L1207 S1212	E1206-L1210 HydrophobicContact CG-CD1 4.4Å; E1206-L1210 WeakPolarHBondContact O-CB 3.42Å; E1206-L1210 WeakPolarHBondContact O-CG 3.18Å; E1206-L1210 PolarHBondContact O-N 3.41Å; L1207-L1210 PolarHBondContact O-N 3Å; L1210-S1212 VanDerWaalsContact C-N 3.31Å
1211	F	64.5	Low	62.1	Low	105 Å²	105	113.9 Å²	113.9	46%	0.461	56%	0.558	S	S	.	*	H	α-helix	trans	-76.5	-15.8	177.2	-68.2	-57.3	0	0	0	113.8	L1207 Q1209 P1223	L1207-F1211 HydrophobicContact CB-CD2 4.3Å; L1207-F1211 HydrophobicContact CB-CE2 4.1Å; L1207-F1211 HydrophobicContact CD2-CE2 4.16Å; L1207-F1211 WeakPolarHBondContact O-CB 3.27Å; L1207-F1211 WeakPolarHBondContact O-CD2 3.03Å; L1207-F1211 WeakPolarHBondContact O-CG 3.37Å; L1207-F1211 PolarHBondContact O-N 3.47Å; Q1209-F1211 VanDerWaalsContact C-N 3.27Å; Q1209-F1211 PolarHBondContact O-N 2.91Å; F1211-P1223 HydrophobicContact CD1-CG 4.25Å
1212	S	63.6	Low	60.1	Low	91 Å²	91	115.2 Å²	115.2	64%	0.636	58%	0.576	S	S	*	*	H	α-helix	trans	-87.1	-23.6	175.1	65.9	0	0	0	0	113.6	Q1208 Q1209 L1210	Q1208-S1212 WeakPolarHBondContact O-CB 3.01Å; Q1208-S1212 PolarHBondContact O-N 3.47Å; Q1208-S1212 PolarHBondContact O-OG 2.85Å; Q1209-S1212 WeakPolarHBondContact CA-OG 3.24Å; Q1209-S1212 PolarHBondContact O-N 2.9Å; Q1209-S1212 PolarHBondContact O-OG 3.42Å; L1210-S1212 VanDerWaalsContact C-N 3.31Å
1213	E	54.8	Low	58.1	Low	161 Å²	161	116.2 Å²	116.2	75%	0.752	58%	0.582	S	S	*	*	H	α-helix	trans	-98.2	-15.9	-175.4	-72.3	-176.3	172.3	0	0	114.5	Q1209	Q1209-E1213 PolarHBondContact O-N 3.49Å; Q1209-E1213 VanDerWaalsContact O-N 3.1Å
1214	D	45.5	Very low	56.5	Low	125 Å²	125	125.5 Å²	125.5	67%	0.668	62%	0.616	S	S	*	*	S	Bend	trans	-104.3	134	-168.3	-141.6	-4.1	0	0	0	115.3
1215	N	45.9	Very low	54.8	Low	132 Å²	132	129.7 Å²	129.7	71%	0.706	64%	0.642	S	S	*	*			trans	-66.7	138.5	-165.7	-74.3	-65.2	0	0	0	114.3	E1217	N1215-E1217 PolarHBondContact O-N 2.8Å
1216	S	47.2	Very low	53.1	Low	119 Å²	119	123.2 Å²	123.2	83%	0.832	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	17	-175.3	52.4	0	0	0	0	117.3
1217	E	46.4	Very low	51.7	Low	187 Å²	187	123.6 Å²	123.6	87%	0.874	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	0.5	-174.9	-73.7	-168.6	167.8	0	0	115.4	N1215	N1215-E1217 PolarHBondContact O-N 2.8Å
1218	R	46.2	Very low	50.3	Low	226 Å²	226	123.8 Å²	123.8	85%	0.853	62%	0.621	S	S	*	*	S	Bend	trans	-120.9	2.9	-178.9	-95.3	-176	178.2	173.1	1.4	117.4
1219	F	43.2	Very low	48.6	Very low	166 Å²	166	125 Å²	125	73%	0.728	62%	0.622	S	S	*	*			trans	-136.7	109.8	176.1	-62.5	-77.7	0	0	0	109.6	E1221	F1219-E1221 PolarHBondContact O-N 3.3Å
1220	D	43.4	Very low	46.8	Very low	176 Å²	176	122.7 Å²	122.7	94%	0.941	61%	0.614	S	S	*	*	S	Bend	trans	-64.9	2.3	-176.3	-76.1	-39.9	0	0	0	115
1221	E	39	Very low	45.5	Very low	161 Å²	161	126 Å²	126	75%	0.752	62%	0.62	S	S	*	*	S	Bend	trans	-139.4	133	170.1	-73.5	-171.3	156.9	0	0	111.6	F1219	F1219-E1221 PolarHBondContact O-N 3.3Å
1222	P	37.1	Very low	44.1	Very low	120 Å²	120	129.3 Å²	129.3	78%	0.779	64%	0.637	S	S	*	*			trans	-65.2	129.7	178.4	25.9	-31.4	0	0	0	110.1	R1224	P1222-R1224 PolarHBondContact O-N 3.22Å; P1222-R1224 VanDerWaalsContact O-N 3.15Å
1223	P	39.6	Very low	43.1	Very low	68 Å²	68	127.2 Å²	127.2	44%	0.442	62%	0.622	S	S	.	*			trans	-72.7	112.9	-166.2	25.8	-31.9	0	0	0	111.5	F1211 T1225	F1211-P1223 HydrophobicContact CD1-CG 4.25Å; P1223-T1225 PolarHBondContact O-N 2.88Å
1224	R	46	Very low	42.6	Very low	194 Å²	194	125 Å²	125	73%	0.732	62%	0.619	S	S	*	*			trans	-49.2	126	170.3	-67	-179.5	-176.2	179.6	2.6	109.9	R1188 P1222 L1226	R1188-R1224 PolarHBondContact NH2-O 3.07Å; P1222-R1224 PolarHBondContact O-N 3.22Å; P1222-R1224 VanDerWaalsContact O-N 3.15Å; R1224-L1226 PolarHBondContact O-N 3.17Å
1225	T	43.6	Very low	42.7	Very low	106 Å²	106	121.7 Å²	121.7	65%	0.65	60%	0.601	S	S	*	*			trans	-49.7	115.5	-172	-11.6	0	0	0	0	111.1	P1223 E1227	P1223-T1225 PolarHBondContact O-N 2.88Å; T1225-E1227 VanDerWaalsContact C-N 3.35Å; T1225-E1227 HydrophobicContact CG2-CG 4.32Å; T1225-E1227 PolarHBondContact O-N 3.1Å
1226	L	45.2	Very low	42.8	Very low	19 Å²	19	117.7 Å²	117.7	10%	0.099	58%	0.58	C	S	.	*			trans	-77.6	87.7	173.3	-160.3	107.5	0	0	0	108.3	F1183 I1192 L1207 R1224 I1228	F1183-L1226 HydrophobicContact CZ-CD1 4.07Å; I1192-L1226 HydrophobicContact CD1-CD1 3.89Å; I1192-L1226 HydrophobicContact CD1-CD2 4.49Å; I1192-L1226 HydrophobicContact CG1-CD1 4.21Å; L1207-L1226 HydrophobicContact CD1-CD2 4.01Å; R1224-L1226 PolarHBondContact O-N 3.17Å; L1226-I1228 HydrophobicContact CD2-CD1 4.22Å; L1226-I1228 HydrophobicContact CD2-CG1 4.15Å
1227	E	46.4	Very low	42.8	Very low	89 Å²	89	122.1 Å²	122.1	42%	0.416	58%	0.578	S	S	.	*			trans	-92	106.3	176.9	-68.7	-174.4	167.5	0	0	110.5	T1225 Y1229	T1225-E1227 VanDerWaalsContact C-N 3.35Å; T1225-E1227 HydrophobicContact CG2-CG 4.32Å; T1225-E1227 PolarHBondContact O-N 3.1Å; E1227-Y1229 HydrophobicContact CB-CD2 3.97Å; E1227-Y1229 HydrophobicContact CB-CE2 3.45Å; E1227-Y1229 VanDerWaalsContact CB-CE2 3.45Å; E1227-Y1229 HydrophobicContact CG-CE2 4.36Å; E1227-Y1229 WeakPolarHBondContact O-CD2 3.47Å; E1227-Y1229 PolarHBondContact O-N 3.37Å; E1227-Y1229 WeakPolarHBondContact OE2-CE2 3.33Å; E1227-Y1229 PolarHBondContact OE2-OH 2.85Å
1228	I	44.5	Very low	43	Very low	27 Å²	27	118.3 Å²	118.3	14%	0.138	56%	0.556	C	S	.	*			trans	-80.7	100	175.1	-59.3	-178.3	0	0	0	109.2	I1192 S1194 L1226	I1192-I1228 WeakPolarHBondContact O-CA 3.31Å; S1194-I1228 WeakPolarHBondContact OG-CG2 3.41Å; L1226-I1228 HydrophobicContact CD2-CD1 4.22Å; L1226-I1228 HydrophobicContact CD2-CG1 4.15Å
1229	Y	39	Very low	43.1	Very low	132 Å²	132	107.6 Å²	107.6	52%	0.518	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	140.9	176	-76.7	-83.6	0	0	0	112.4	Q1193 S1194 E1227	Q1193-Y1229 WeakPolarHBondContact CG-O 3.49Å; S1194-Y1229 PolarHBondContact N-O 3.47Å; E1227-Y1229 HydrophobicContact CB-CD2 3.97Å; E1227-Y1229 HydrophobicContact CB-CE2 3.45Å; E1227-Y1229 VanDerWaalsContact CB-CE2 3.45Å; E1227-Y1229 HydrophobicContact CG-CE2 4.36Å; E1227-Y1229 WeakPolarHBondContact O-CD2 3.47Å; E1227-Y1229 PolarHBondContact O-N 3.37Å; E1227-Y1229 WeakPolarHBondContact OE2-CE2 3.33Å; E1227-Y1229 PolarHBondContact OE2-OH 2.85Å
1230	N	35.4	Very low	43.5	Very low	76 Å²	76	102.8 Å²	102.8	41%	0.406	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	116.7	-175.7	-57.1	-75.8	0	0	0	111.9	S1194 N1196	S1194-N1230 VanDerWaalsContact O-CA 3.31Å; S1194-N1230 WeakPolarHBondContact O-CA 3.48Å; N1196-N1230 WeakPolarHBondContact CA-OD1 3.4Å
1231	R	40.1	Very low	44	Very low	166 Å²	166	96.2 Å²	96.2	63%	0.626	47%	0.471	S	S	*	.			trans	-166.1	137.1	158	-104.8	170.3	-156.2	-155	8.4	111.6	S1194	S1194-R1231 PolarHBondContact O-N 3.5Å
1232	E	34.1	Very low	44.5	Very low	175 Å²	175	89.1 Å²	89.1	82%	0.818	44%	0.439	S	S	*	.			trans	-57.6	135	-170.9	-77.9	171.6	152.4	0	0	114.7
1233	S	41.9	Very low	45.1	Very low	46 Å²	46	84.5 Å²	84.5	32%	0.322	41%	0.409	S	S	.	.			trans	-106.7	135.9	174	132.7	0	0	0	0	109.5	D1133	D1133-S1233 VanDerWaalsContact OD2-CB 3.24Å; D1133-S1233 WeakPolarHBondContact OD2-CB 3.49Å; D1133-S1233 PolarHBondContact OD2-OG 3.22Å
1234	T	44.7	Very low	45.7	Very low	114 Å²	114	82.4 Å²	82.4	70%	0.699	40%	0.399	S	S	*	.			trans	-101	14.3	-175.5	47.5	0	0	0	0	113.7	M1113	M1113-T1234 HydrophobicContact CE-CG2 4.36Å
1235	L	48.2	Very low	45.8	Very low	56 Å²	56	78.6 Å²	78.6	29%	0.293	39%	0.39	S	S	.	.			trans	-83.1	-20.8	-165.8	-160.4	60.1	0	0	0	114	L1153 T1155 R1237 W1238 I1239	L1153-L1235 HydrophobicContact CD2-CB 4.19Å; L1153-L1235 HydrophobicContact CD2-CD2 3.96Å; L1153-L1235 HydrophobicContact CD2-CG 4.22Å; T1155-L1235 HydrophobicContact CG2-CD2 4.21Å; L1235-R1237 VanDerWaalsContact C-N 3.33Å; L1235-R1237 PolarHBondContact O-N 2.84Å; L1235-W1238 PolarHBondContact O-N 3.39Å; L1235-I1239 HydrophobicContact CD2-CD1 4.2Å; L1235-I1239 HydrophobicContact CG-CD1 3.97Å
1236	D	48.1	Very low	45.8	Very low	48 Å²	48	75.2 Å²	75.2	26%	0.257	37%	0.367	S	S	.	.	H	α-helix	trans	-53.8	-41.9	-170.8	-59.6	-23.6	0	0	0	114.8	W1238 L1240	D1236-W1238 VanDerWaalsContact C-N 3.35Å; D1236-W1238 PolarHBondContact O-N 3.26Å; D1236-L1240 WeakPolarHBondContact O-CG 3.42Å; D1236-L1240 PolarHBondContact O-N 3.21Å
1237	R	47.5	Very low	45.8	Very low	213 Å²	213	76.8 Å²	76.8	80%	0.804	38%	0.38	S	S	*	.	H	α-helix	trans	-71.1	-32.3	-170.1	-135.1	178.4	-164.8	179.4	4.5	112.9	L1235 G1241	L1235-R1237 VanDerWaalsContact C-N 3.33Å; L1235-R1237 PolarHBondContact O-N 2.84Å; R1237-G1241 PolarHBondContact O-N 2.92Å
1238	W	49.3	Very low	45.6	Very low	106 Å²	106	79 Å²	79	40%	0.402	39%	0.391	S	S	.	.	H	α-helix	trans	-78.2	-38.1	-177.4	-175.7	74.2	0	0	0	111.8	L1235 D1236 G1241 T1242 V1276 R1279	L1235-W1238 PolarHBondContact O-N 3.39Å; D1236-W1238 VanDerWaalsContact C-N 3.35Å; D1236-W1238 PolarHBondContact O-N 3.26Å; W1238-G1241 PolarHBondContact O-N 3.01Å; W1238-T1242 HydrophobicContact CH2-CG2 4.45Å; W1238-T1242 WeakPolarHBondContact CZ2-OG1 3.38Å; W1238-T1242 PolarHBondContact O-N 2.74Å; W1238-T1242 PolarHBondContact O-OG1 3.36Å; W1238-V1276 HydrophobicContact CH2-CG2 3.79Å; W1238-V1276 HydrophobicContact CZ3-CG1 4.25Å; W1238-V1276 HydrophobicContact CZ3-CG2 3.72Å; W1238-R1279 VanDerWaalsContact CH2-CZ 3.49Å; W1238-R1279 VanDerWaalsContact CZ2-CZ 3.43Å; W1238-R1279 VanDerWaalsContact CZ2-NH2 3.29Å
1239	I	49.6	Very low	45.2	Very low	2 Å²	2	86.8 Å²	86.8	1%	0.01	42%	0.418	C	S	.	.	H	α-helix	trans	-66.3	-44.1	176.6	-67.9	168.2	0	0	0	110.5	L1153 L1235 G1241 T1242 V1243	L1153-I1239 HydrophobicContact CD1-CD1 3.49Å; L1153-I1239 VanDerWaalsContact CD1-CD1 3.49Å; L1153-I1239 HydrophobicContact CD2-CD1 3.32Å; L1153-I1239 HydrophobicContact CG-CD1 4Å; L1235-I1239 HydrophobicContact CD2-CD1 4.2Å; L1235-I1239 HydrophobicContact CG-CD1 3.97Å; I1239-G1241 VanDerWaalsContact C-N 3.28Å; I1239-G1241 PolarHBondContact O-N 3.18Å; I1239-T1242 PolarHBondContact O-N 2.88Å; I1239-T1242 VanDerWaalsContact O-N 3.11Å; I1239-V1243 HydrophobicContact CG2-CG2 4.18Å; I1239-V1243 WeakPolarHBondContact O-CG2 3.44Å; I1239-V1243 PolarHBondContact O-N 3.06Å
1240	L	51.2	Low	45.3	Very low	64 Å²	64	85.7 Å²	85.7	34%	0.335	43%	0.427	S	S	.	.	H	α-helix	trans	-59.5	-39.6	175.4	-73.3	169.3	0	0	0	112.1	I1138 D1236 G1244	I1138-L1240 HydrophobicContact CG2-CD2 3.97Å; D1236-L1240 WeakPolarHBondContact O-CG 3.42Å; D1236-L1240 PolarHBondContact O-N 3.21Å; L1240-G1244 PolarHBondContact O-N 3.41Å
1241	G	52.9	Low	45.3	Very low	39 Å²	39	87.5 Å²	87.5	40%	0.402	44%	0.441	S	S	.	.	H	α-helix	trans	-63.3	-42.7	173.2	0	0	0	0	0	112.7	R1237 W1238 I1239 G1244 E1245	R1237-G1241 PolarHBondContact O-N 2.92Å; W1238-G1241 PolarHBondContact O-N 3.01Å; I1239-G1241 VanDerWaalsContact C-N 3.28Å; I1239-G1241 PolarHBondContact O-N 3.18Å; G1241-G1244 WeakPolarHBondContact O-CA 3.37Å; G1241-G1244 PolarHBondContact O-N 2.79Å; G1241-E1245 WeakPolarHBondContact O-CG 3.25Å; G1241-E1245 PolarHBondContact O-N 3.17Å
1242	T	49.4	Very low	45.1	Very low	11 Å²	11	85.3 Å²	85.3	7%	0.067	45%	0.446	C	S	.	.	H	α-helix	trans	-71.2	-37.7	-179.8	-48.2	0	0	0	0	112	W1238 I1239 G1244 E1245 I1246 V1272	W1238-T1242 HydrophobicContact CH2-CG2 4.45Å; W1238-T1242 WeakPolarHBondContact CZ2-OG1 3.38Å; W1238-T1242 PolarHBondContact O-N 2.74Å; W1238-T1242 PolarHBondContact O-OG1 3.36Å; I1239-T1242 PolarHBondContact O-N 2.88Å; I1239-T1242 VanDerWaalsContact O-N 3.11Å; T1242-G1244 VanDerWaalsContact C-N 3.3Å; T1242-E1245 PolarHBondContact O-N 3.48Å; T1242-I1246 HydrophobicContact CG2-CD1 3.79Å; T1242-I1246 HydrophobicContact CG2-CG1 4.33Å; T1242-I1246 WeakPolarHBondContact O-CB 3.47Å; T1242-I1246 VanDerWaalsContact O-CG1 3.27Å; T1242-I1246 WeakPolarHBondContact O-CG1 3.24Å; T1242-I1246 PolarHBondContact O-N 3.47Å; T1242-V1272 HydrophobicContact CG2-CG1 4.49Å
1243	V	50.6	Low	45.2	Very low	24 Å²	24	85.9 Å²	85.9	15%	0.145	45%	0.446	C	S	.	.	H	α-helix	trans	-62.9	-39.9	171.1	172.2	0	0	0	0	110	I1151 I1239 S1247 L1269 V1272	I1151-V1243 HydrophobicContact CD1-CG2 4.49Å; I1239-V1243 HydrophobicContact CG2-CG2 4.18Å; I1239-V1243 WeakPolarHBondContact O-CG2 3.44Å; I1239-V1243 PolarHBondContact O-N 3.06Å; V1243-S1247 VanDerWaalsContact O-CB 3.27Å; V1243-S1247 WeakPolarHBondContact O-CB 3.34Å; V1243-S1247 PolarHBondContact O-N 2.83Å; V1243-S1247 PolarHBondContact O-OG 3.05Å; V1243-L1269 HydrophobicContact CG2-CD2 4.1Å; V1243-V1272 HydrophobicContact CG2-CG1 4.45Å; V1243-V1272 HydrophobicContact CG2-CG2 3.98Å
1244	G	51.7	Low	44.9	Very low	24 Å²	24	91.3 Å²	91.3	25%	0.247	47%	0.472	C	S	.	.	H	α-helix	trans	-58.5	-55.5	170.2	0	0	0	0	0	112.3	L1240 G1241 T1242 I1246 S1247 E1248	L1240-G1244 PolarHBondContact O-N 3.41Å; G1241-G1244 WeakPolarHBondContact O-CA 3.37Å; G1241-G1244 PolarHBondContact O-N 2.79Å; T1242-G1244 VanDerWaalsContact C-N 3.3Å; G1244-I1246 PolarHBondContact O-N 2.84Å; G1244-S1247 PolarHBondContact O-N 3.04Å; G1244-S1247 PolarHBondContact O-OG 3.39Å; G1244-E1248 VanDerWaalsContact O-CG 3.28Å; G1244-E1248 WeakPolarHBondContact O-CG 3.24Å; G1244-E1248 PolarHBondContact O-N 3.05Å
1245	E	47.7	Very low	44.2	Very low	114 Å²	114	89.7 Å²	89.7	53%	0.533	47%	0.465	S	S	.	.	H	α-helix	trans	-63	-35.2	-179.1	-76.5	-178.1	178.8	0	0	114	G1241 T1242 E1248	G1241-E1245 WeakPolarHBondContact O-CG 3.25Å; G1241-E1245 PolarHBondContact O-N 3.17Å; T1242-E1245 PolarHBondContact O-N 3.48Å; E1245-E1248 WeakPolarHBondContact O-CB 3.39Å; E1245-E1248 PolarHBondContact O-N 2.86Å
1246	I	44.8	Very low	43.6	Very low	34 Å²	34	92 Å²	92	17%	0.174	47%	0.47	C	S	.	.	H	α-helix	trans	-75.5	-38.4	176.5	-69.7	170.2	0	0	0	110.2	T1242 G1244 E1248 R1249 V1268 V1272 M1275	T1242-I1246 HydrophobicContact CG2-CD1 3.79Å; T1242-I1246 HydrophobicContact CG2-CG1 4.33Å; T1242-I1246 WeakPolarHBondContact O-CB 3.47Å; T1242-I1246 VanDerWaalsContact O-CG1 3.27Å; T1242-I1246 WeakPolarHBondContact O-CG1 3.24Å; T1242-I1246 PolarHBondContact O-N 3.47Å; G1244-I1246 PolarHBondContact O-N 2.84Å; I1246-E1248 PolarHBondContact O-N 3.26Å; I1246-R1249 PolarHBondContact O-N 3.44Å; I1246-V1268 HydrophobicContact CG2-CG1 4.12Å; I1246-V1272 HydrophobicContact CD1-CB 4.19Å; I1246-V1272 HydrophobicContact CD1-CG2 3.53Å; I1246-M1275 HydrophobicContact CD1-SD 3.71Å; I1246-M1275 HydrophobicContact CG1-SD 4.25Å
1247	S	45.5	Very low	43.2	Very low	52 Å²	52	101.7 Å²	101.7	36%	0.364	50%	0.503	S	S	.	.	H	α-helix	trans	-58	-35.9	171.1	74.1	0	0	0	0	110.3	V1243 G1244 R1249 W1256	V1243-S1247 VanDerWaalsContact O-CB 3.27Å; V1243-S1247 WeakPolarHBondContact O-CB 3.34Å; V1243-S1247 PolarHBondContact O-N 2.83Å; V1243-S1247 PolarHBondContact O-OG 3.05Å; G1244-S1247 PolarHBondContact O-N 3.04Å; G1244-S1247 PolarHBondContact O-OG 3.39Å; S1247-R1249 VanDerWaalsContact C-N 3.29Å; S1247-R1249 PolarHBondContact O-N 2.99Å; S1247-W1256 WeakPolarHBondContact O-CH2 3.42Å; S1247-W1256 WeakPolarHBondContact O-CZ3 3.41Å
1248	E	41.9	Very low	43	Very low	137 Å²	137	94.6 Å²	94.6	64%	0.64	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	3.5	-179.8	-74.6	174.5	-177.5	0	0	116.7	G1244 E1245 I1246	G1244-E1248 VanDerWaalsContact O-CG 3.28Å; G1244-E1248 WeakPolarHBondContact O-CG 3.24Å; G1244-E1248 PolarHBondContact O-N 3.05Å; E1245-E1248 WeakPolarHBondContact O-CB 3.39Å; E1245-E1248 PolarHBondContact O-N 2.86Å; I1246-E1248 PolarHBondContact O-N 3.26Å
1249	R	35.7	Very low	43.6	Very low	189 Å²	189	91 Å²	91	71%	0.713	48%	0.48	S	S	*	.			trans	-134.6	139.8	-178.6	-66.7	179.6	177.6	172.6	2.1	112.9	I1246 S1247	I1246-R1249 PolarHBondContact O-N 3.44Å; S1247-R1249 VanDerWaalsContact C-N 3.29Å; S1247-R1249 PolarHBondContact O-N 2.99Å
1250	P	40.7	Very low	44.7	Very low	109 Å²	109	93.9 Å²	93.9	71%	0.708	50%	0.495	S	S	*	.	S	Bend		-124.7	145.4	-51.5	35.9	-20.9	0	0	0	113.1
1251	T	35.6	Very low	46.2	Very low	115 Å²	115	93.2 Å²	93.2	71%	0.706	49%	0.492	S	S	*	.	S	Bend	trans	172.1	113.5	134.3	29.5	0	0	0	0	108.8
1252	T	35.2	Very low	47.6	Very low	119 Å²	119	94.6 Å²	94.6	73%	0.73	49%	0.488	S	S	*	.			trans	57.5	117.6	173.2	55.4	0	0	0	0	118.7	D1254 W1256	T1252-D1254 PolarHBondContact O-N 3.27Å; T1252-W1256 VanDerWaalsContact O-CD1 3.22Å; T1252-W1256 PolarHBondContact O-NE1 3.33Å
1253	K	36.5	Very low	49.3	Very low	188 Å²	188	101.5 Å²	101.5	82%	0.817	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-0.5	-168.4	-134.8	175.8	-176	178.4	0	117.1	W1256	K1253-W1256 VanDerWaalsContact CA-NE1 3.33Å
1254	D	35.4	Very low	50.8	Low	160 Å²	160	104.3 Å²	104.3	86%	0.856	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-13.3	-169.7	-66.6	-29.8	0	0	0	116.2	T1252 W1256	T1252-D1254 PolarHBondContact O-N 3.27Å; D1254-W1256 VanDerWaalsContact C-N 3.33Å
1255	S	30.9	Very low	52.2	Low	79 Å²	79	103.8 Å²	103.8	55%	0.552	52%	0.523	S	S	*	.	S	Bend	trans	-85	-1.7	172.8	61	0	0	0	0	114.5	R1257 A1258	S1255-R1257 VanDerWaalsContact C-N 3.34Å; S1255-R1257 PolarHBondContact O-N 3.46Å; S1255-R1257 VanDerWaalsContact O-N 3.15Å; S1255-A1258 WeakPolarHBondContact O-CB 3.35Å; S1255-A1258 PolarHBondContact O-N 2.94Å; S1255-A1258 VanDerWaalsContact O-N 3.1Å
1256	W	34.4	Very low	54.1	Low	106 Å²	106	102.8 Å²	102.8	40%	0.402	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-5.5	-159	-69.3	72.9	0	0	0	117.3	S1247 T1252 K1253 D1254	S1247-W1256 WeakPolarHBondContact O-CH2 3.42Å; S1247-W1256 WeakPolarHBondContact O-CZ3 3.41Å; T1252-W1256 VanDerWaalsContact O-CD1 3.22Å; T1252-W1256 PolarHBondContact O-NE1 3.33Å; K1253-W1256 VanDerWaalsContact CA-NE1 3.33Å; D1254-W1256 VanDerWaalsContact C-N 3.33Å
1257	R	41.2	Very low	55.9	Low	251 Å²	251	105 Å²	105	95%	0.947	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-2.7	171.4	-70.6	-174.2	180	174.4	2.5	113	S1255 S1259	S1255-R1257 VanDerWaalsContact C-N 3.34Å; S1255-R1257 PolarHBondContact O-N 3.46Å; S1255-R1257 VanDerWaalsContact O-N 3.15Å; R1257-S1259 PolarHBondContact O-N 3.31Å
1258	A	43.4	Very low	57.5	Low	63 Å²	63	103.9 Å²	103.9	52%	0.521	52%	0.52	S	S	.	.	S	Bend	trans	-77.9	108.3	171.1	0	0	0	0	0	108.6	S1255 L1260	S1255-A1258 WeakPolarHBondContact O-CB 3.35Å; S1255-A1258 PolarHBondContact O-N 2.94Å; S1255-A1258 VanDerWaalsContact O-N 3.1Å; A1258-L1260 PolarHBondContact O-N 3.09Å
1259	S	60.5	Low	59.5	Low	30 Å²	30	97.5 Å²	97.5	21%	0.21	49%	0.491	C	S	.	.			trans	-50.5	129.3	166.8	25	0	0	0	0	109.9	R1141 C1146 R1257	R1141-S1259 WeakPolarHBondContact CB-O 3.44Å; R1141-S1259 WeakPolarHBondContact CD-O 3.37Å; R1141-S1259 PolarHBondContact NE-O 2.75Å; C1146-S1259 PolarHBondContact SG-OG 2.93Å; R1257-S1259 PolarHBondContact O-N 3.31Å
1260	L	74.1	Confident	61.7	Low	63 Å²	63	91.7 Å²	91.7	33%	0.33	48%	0.478	S	S	.	.			trans	-58.4	138.9	176.3	-63.6	176.4	0	0	0	108.9	R1141 A1258 E1264 T1265 V1268	R1141-L1260 PolarHBondContact N-O 2.93Å; A1258-L1260 PolarHBondContact O-N 3.09Å; L1260-E1264 WeakPolarHBondContact CA-OE2 3.43Å; L1260-E1264 HydrophobicContact CB-CB 3.97Å; L1260-E1264 HydrophobicContact CD2-CB 4.09Å; L1260-E1264 HydrophobicContact CG-CB 4.48Å; L1260-T1265 WeakPolarHBondContact CB-OG1 3.34Å; L1260-V1268 HydrophobicContact CD1-CG2 4.07Å
1261	D	82.6	Confident	63.4	Low	51 Å²	51	90.7 Å²	90.7	27%	0.273	47%	0.467	S	S	.	.	B	Isolated β-bridge	trans	-71.5	176.5	169.5	71.6	36.1	0	0	0	111.3	R1141 E1263 E1264 T1265	R1141-D1261 IonicContact NH2-OD2 3.67Å; R1141-D1261 WeakPolarHBondContact O-CA 3.48Å; D1261-E1263 VanDerWaalsContact C-N 3.28Å; D1261-E1263 PolarHBondContact O-N 3.34Å; D1261-E1263 PolarHBondContact OD1-N 2.93Å; D1261-E1264 PolarHBondContact N-OE2 2.88Å; D1261-E1264 WeakPolarHBondContact OD1-CG 3.49Å; D1261-E1264 PolarHBondContact OD1-N 3.2Å; D1261-T1265 VanDerWaalsContact O-CB 3.28Å; D1261-T1265 WeakPolarHBondContact O-CB 3.37Å; D1261-T1265 PolarHBondContact O-N 3.27Å; D1261-T1265 PolarHBondContact O-OG1 3.41Å
1262	E	82.7	Confident	65.3	Low	68 Å²	68	85.2 Å²	85.2	32%	0.318	43%	0.433	S	S	.	.	H	α-helix	trans	-65.1	-32.1	-173.1	-169.6	172.4	171.1	0	0	113	V1140 R1142 L1166 R1266	V1140-E1262 VanDerWaalsContact CG1-CA 3.46Å; V1140-E1262 HydrophobicContact CG1-CB 3.84Å; V1140-E1262 HydrophobicContact CG1-CG 4.49Å; R1142-E1262 IonicContact CZ-OE2 3.37Å; R1142-E1262 IonicContact NE-OE2 3.09Å; R1142-E1262 PolarHBondContact NE-OE2 3.48Å; R1142-E1262 VanDerWaalsContact NH2-CD 3.34Å; R1142-E1262 IonicContact NH2-OE1 2.67Å; R1142-E1262 PolarHBondContact NH2-OE1 3.38Å; R1142-E1262 IonicContact NH2-OE2 3.75Å; R1142-E1262 PolarHBondContact NH2-OE2 2.91Å; L1166-E1262 HydrophobicContact CD2-CG 3.77Å; E1262-R1266 WeakPolarHBondContact O-CB 3.49Å; E1262-R1266 PolarHBondContact O-N 3.47Å; E1262-R1266 VanDerWaalsContact O-N 3.08Å
1263	E	83.4	Confident	67.3	Low	155 Å²	155	80.2 Å²	80.2	72%	0.724	40%	0.402	S	S	*	.	H	α-helix	trans	-80.3	-42.7	-178.7	-170.8	168.6	-170.6	0	0	111.1	D1261 T1265 R1266 T1267	D1261-E1263 VanDerWaalsContact C-N 3.28Å; D1261-E1263 PolarHBondContact O-N 3.34Å; D1261-E1263 PolarHBondContact OD1-N 2.93Å; E1263-T1265 VanDerWaalsContact C-N 3.33Å; E1263-T1265 PolarHBondContact O-N 3.43Å; E1263-R1266 PolarHBondContact O-N 3.28Å; E1263-T1267 PolarHBondContact O-N 3.41Å; E1263-T1267 PolarHBondContact O-OG1 2.79Å
1264	E	82.4	Confident	69.2	Low	84 Å²	84	74.1 Å²	74.1	39%	0.393	39%	0.387	S	S	.	.	H	α-helix	trans	-57.9	-47	171.2	-69.4	173.3	148.6	0	0	110.8	R1141 L1260 D1261 R1266 T1267 V1268	R1141-E1264 IonicContact NH2-OE2 3.65Å; L1260-E1264 WeakPolarHBondContact CA-OE2 3.43Å; L1260-E1264 HydrophobicContact CB-CB 3.97Å; L1260-E1264 HydrophobicContact CD2-CB 4.09Å; L1260-E1264 HydrophobicContact CG-CB 4.48Å; D1261-E1264 PolarHBondContact N-OE2 2.88Å; D1261-E1264 WeakPolarHBondContact OD1-CG 3.49Å; D1261-E1264 PolarHBondContact OD1-N 3.2Å; E1264-R1266 PolarHBondContact O-N 3.38Å; E1264-T1267 WeakPolarHBondContact O-CB 3.4Å; E1264-T1267 PolarHBondContact O-N 2.85Å; E1264-V1268 WeakPolarHBondContact O-CG2 3.43Å; E1264-V1268 PolarHBondContact O-N 3.21Å
1265	T	82.4	Confident	70.8	Confident	13 Å²	13	71.5 Å²	71.5	8%	0.08	37%	0.371	C	S	.	.	H	α-helix	trans	-61	-44.7	178.2	-56.9	0	0	0	0	111.1	I1138 V1140 L1166 L1260 D1261 E1263 T1267 V1268 L1269	I1138-T1265 HydrophobicContact CD1-CG2 3.8Å; V1140-T1265 HydrophobicContact CG2-CG2 4.07Å; L1166-T1265 HydrophobicContact CD1-CG2 4.02Å; L1166-T1265 HydrophobicContact CD2-CG2 3.96Å; L1260-T1265 WeakPolarHBondContact CB-OG1 3.34Å; D1261-T1265 VanDerWaalsContact O-CB 3.28Å; D1261-T1265 WeakPolarHBondContact O-CB 3.37Å; D1261-T1265 PolarHBondContact O-N 3.27Å; D1261-T1265 PolarHBondContact O-OG1 3.41Å; E1263-T1265 VanDerWaalsContact C-N 3.33Å; E1263-T1265 PolarHBondContact O-N 3.43Å; T1265-T1267 VanDerWaalsContact C-N 3.32Å; T1265-T1267 PolarHBondContact O-N 3Å; T1265-V1268 PolarHBondContact O-N 3.2Å; T1265-L1269 HydrophobicContact CG2-CD1 4.37Å; T1265-L1269 VanDerWaalsContact O-CG 3.31Å; T1265-L1269 WeakPolarHBondContact O-CG 3.46Å; T1265-L1269 PolarHBondContact O-N 3.29Å
1266	R	85.9	Confident	72.4	Confident	93 Å²	93	68.7 Å²	68.7	35%	0.351	35%	0.35	S	S	.	.	H	α-helix	trans	-62.9	-39.6	178.1	-176	179.9	-90.2	-159.9	-3.9	111.7	E1262 E1263 E1264 L1269 C1270	E1262-R1266 WeakPolarHBondContact O-CB 3.49Å; E1262-R1266 PolarHBondContact O-N 3.47Å; E1262-R1266 VanDerWaalsContact O-N 3.08Å; E1263-R1266 PolarHBondContact O-N 3.28Å; E1264-R1266 PolarHBondContact O-N 3.38Å; R1266-L1269 PolarHBondContact O-N 2.87Å; R1266-C1270 PolarHBondContact O-N 3.48Å; R1266-C1270 VanDerWaalsContact O-N 3.09Å; R1266-C1270 PolarHBondContact O-SG 2.84Å
1267	T	84.5	Confident	74.1	Confident	80 Å²	80	66.2 Å²	66.2	49%	0.491	35%	0.349	S	S	.	.	H	α-helix	trans	-62.8	-45.1	176.6	-59.2	0	0	0	0	111.7	E1263 E1264 T1265 L1269 C1270 N1271	E1263-T1267 PolarHBondContact O-N 3.41Å; E1263-T1267 PolarHBondContact O-OG1 2.79Å; E1264-T1267 WeakPolarHBondContact O-CB 3.4Å; E1264-T1267 PolarHBondContact O-N 2.85Å; T1265-T1267 VanDerWaalsContact C-N 3.32Å; T1265-T1267 PolarHBondContact O-N 3Å; T1267-L1269 VanDerWaalsContact C-N 3.29Å; T1267-L1269 PolarHBondContact O-N 3.11Å; T1267-C1270 WeakPolarHBondContact O-CB 3.46Å; T1267-C1270 PolarHBondContact O-N 3.48Å; T1267-C1270 VanDerWaalsContact O-N 3.16Å; T1267-N1271 PolarHBondContact O-N 3.11Å; T1267-N1271 VanDerWaalsContact O-N 3.15Å
1268	V	78.5	Confident	75.3	Confident	28 Å²	28	58.2 Å²	58.2	17%	0.17	34%	0.336	C	S	.	.	H	α-helix	trans	-60.2	-41.2	175.7	172.5	0	0	0	0	111.1	I1246 L1260 E1264 T1265 C1270 N1271 V1272	I1246-V1268 HydrophobicContact CG2-CG1 4.12Å; L1260-V1268 HydrophobicContact CD1-CG2 4.07Å; E1264-V1268 WeakPolarHBondContact O-CG2 3.43Å; E1264-V1268 PolarHBondContact O-N 3.21Å; T1265-V1268 PolarHBondContact O-N 3.2Å; V1268-C1270 VanDerWaalsContact C-N 3.32Å; V1268-C1270 PolarHBondContact O-N 2.92Å; V1268-N1271 WeakPolarHBondContact O-CB 3.43Å; V1268-N1271 PolarHBondContact O-N 3.42Å; V1268-V1272 HydrophobicContact CG1-CG2 4.3Å; V1268-V1272 WeakPolarHBondContact O-CG2 3.33Å; V1268-V1272 PolarHBondContact O-N 2.91Å
1269	L	83.4	Confident	76.2	Confident	4 Å²	4	62 Å²	62	2%	0.021	34%	0.337	C	S	.	.	H	α-helix	trans	-63.6	-35.8	176.7	-66.8	172.5	0	0	0	112.7	I1151 L1164 L1166 V1243 T1265 R1266 T1267 V1272 D1273	I1151-L1269 HydrophobicContact CD1-CD2 3.51Å; I1151-L1269 HydrophobicContact CG1-CD1 4.04Å; I1151-L1269 HydrophobicContact CG1-CD2 3.92Å; I1151-L1269 HydrophobicContact CG2-CD1 4.43Å; I1151-L1269 HydrophobicContact CG2-CD2 4.26Å; L1164-L1269 HydrophobicContact CB-CB 4.28Å; L1164-L1269 HydrophobicContact CD1-CB 4.46Å; L1164-L1269 HydrophobicContact CD1-CD2 4.07Å; L1166-L1269 HydrophobicContact CB-CD1 3.95Å; L1166-L1269 HydrophobicContact CD1-CD1 4.21Å; V1243-L1269 HydrophobicContact CG2-CD2 4.1Å; T1265-L1269 HydrophobicContact CG2-CD1 4.37Å; T1265-L1269 VanDerWaalsContact O-CG 3.31Å; T1265-L1269 WeakPolarHBondContact O-CG 3.46Å; T1265-L1269 PolarHBondContact O-N 3.29Å; R1266-L1269 PolarHBondContact O-N 2.87Å; T1267-L1269 VanDerWaalsContact C-N 3.29Å; T1267-L1269 PolarHBondContact O-N 3.11Å; L1269-V1272 PolarHBondContact O-N 3.08Å; L1269-D1273 WeakPolarHBondContact O-CB 3.38Å; L1269-D1273 PolarHBondContact O-N 3.19Å
1270	C	82.9	Confident	75.7	Confident	66 Å²	66	68.3 Å²	68.3	45%	0.446	37%	0.368	S	S	.	.	H	α-helix	trans	-64.2	-39.2	173.1	-69.2	0	0	0	0	112.3	R1266 T1267 V1268 D1273 A1274	R1266-C1270 PolarHBondContact O-N 3.48Å; R1266-C1270 VanDerWaalsContact O-N 3.09Å; R1266-C1270 PolarHBondContact O-SG 2.84Å; T1267-C1270 WeakPolarHBondContact O-CB 3.46Å; T1267-C1270 PolarHBondContact O-N 3.48Å; T1267-C1270 VanDerWaalsContact O-N 3.16Å; V1268-C1270 VanDerWaalsContact C-N 3.32Å; V1268-C1270 PolarHBondContact O-N 2.92Å; C1270-D1273 PolarHBondContact O-N 2.86Å; C1270-A1274 PolarHBondContact O-N 3.41Å
1271	N	76.4	Confident	74.8	Confident	88 Å²	88	70.2 Å²	70.2	47%	0.471	38%	0.378	S	S	.	.	H	α-helix	trans	-65.6	-41.2	175	-70	-21.5	0	0	0	111.6	T1267 V1268 A1274 M1275	T1267-N1271 PolarHBondContact O-N 3.11Å; T1267-N1271 VanDerWaalsContact O-N 3.15Å; V1268-N1271 WeakPolarHBondContact O-CB 3.43Å; V1268-N1271 PolarHBondContact O-N 3.42Å; N1271-A1274 PolarHBondContact O-N 2.88Å; N1271-M1275 WeakPolarHBondContact O-CB 3.3Å; N1271-M1275 VanDerWaalsContact O-CG 3.3Å; N1271-M1275 WeakPolarHBondContact O-CG 3.16Å; N1271-M1275 PolarHBondContact O-N 3.06Å
1272	V	75.3	Confident	73.1	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-61.3	-47.6	175.6	-179.7	0	0	0	0	110.3	L1164 T1242 V1243 I1246 V1268 L1269 A1274 M1275 V1276	L1164-V1272 HydrophobicContact CD1-CB 4.03Å; L1164-V1272 HydrophobicContact CD1-CG1 3.87Å; T1242-V1272 HydrophobicContact CG2-CG1 4.49Å; V1243-V1272 HydrophobicContact CG2-CG1 4.45Å; V1243-V1272 HydrophobicContact CG2-CG2 3.98Å; I1246-V1272 HydrophobicContact CD1-CB 4.19Å; I1246-V1272 HydrophobicContact CD1-CG2 3.53Å; V1268-V1272 HydrophobicContact CG1-CG2 4.3Å; V1268-V1272 WeakPolarHBondContact O-CG2 3.33Å; V1268-V1272 PolarHBondContact O-N 2.91Å; L1269-V1272 PolarHBondContact O-N 3.08Å; V1272-A1274 PolarHBondContact O-N 3.16Å; V1272-M1275 PolarHBondContact O-N 3.28Å; V1272-V1276 HydrophobicContact CG1-CG2 4.29Å; V1272-V1276 VanDerWaalsContact O-CG2 3.25Å; V1272-V1276 WeakPolarHBondContact O-CG2 3.47Å; V1272-V1276 PolarHBondContact O-N 3.15Å
1273	D	77.2	Confident	71.2	Confident	15 Å²	15	76.4 Å²	76.4	8%	0.08	41%	0.409	C	S	.	.	H	α-helix	trans	-53.8	-54	175.6	-179.7	-8.2	0	0	0	110.8	R1186 L1269 C1270 M1275 V1276 S1277	R1186-D1273 IonicContact NH2-OD1 3.96Å; R1186-D1273 IonicContact NH2-OD2 3.38Å; R1186-D1273 PolarHBondContact NH2-OD2 3.24Å; L1269-D1273 WeakPolarHBondContact O-CB 3.38Å; L1269-D1273 PolarHBondContact O-N 3.19Å; C1270-D1273 PolarHBondContact O-N 2.86Å; D1273-M1275 PolarHBondContact O-N 3.1Å; D1273-V1276 PolarHBondContact O-N 3.47Å; D1273-S1277 VanDerWaalsContact O-CB 3.27Å; D1273-S1277 WeakPolarHBondContact O-CB 3.49Å; D1273-S1277 PolarHBondContact O-N 2.9Å; D1273-S1277 PolarHBondContact O-OG 2.98Å; D1273-S1277 VanDerWaalsContact O-OG 3.08Å; D1273-S1277 PolarHBondContact OD1-OG 3.2Å
1274	A	75.1	Confident	69.5	Low	59 Å²	59	75 Å²	75	49%	0.488	41%	0.41	S	S	.	.	H	α-helix	trans	-59.4	-45	-179.8	0	0	0	0	0	112.8	C1270 N1271 V1272 S1277 A1278	C1270-A1274 PolarHBondContact O-N 3.41Å; N1271-A1274 PolarHBondContact O-N 2.88Å; V1272-A1274 PolarHBondContact O-N 3.16Å; A1274-S1277 PolarHBondContact O-N 3.15Å; A1274-A1278 WeakPolarHBondContact O-CB 3.49Å; A1274-A1278 PolarHBondContact O-N 3.14Å
1275	M	68.7	Low	67.8	Low	105 Å²	105	71.7 Å²	71.7	52%	0.517	40%	0.399	S	S	.	.	H	α-helix	trans	-65.7	-39.6	-179.3	-75.7	-176.3	70.6	0	0	112.9	I1246 N1271 V1272 D1273	I1246-M1275 HydrophobicContact CD1-SD 3.71Å; I1246-M1275 HydrophobicContact CG1-SD 4.25Å; N1271-M1275 WeakPolarHBondContact O-CB 3.3Å; N1271-M1275 VanDerWaalsContact O-CG 3.3Å; N1271-M1275 WeakPolarHBondContact O-CG 3.16Å; N1271-M1275 PolarHBondContact O-N 3.06Å; V1272-M1275 PolarHBondContact O-N 3.28Å; D1273-M1275 PolarHBondContact O-N 3.1Å
1276	V	66.4	Low	66	Low	21 Å²	21	79.4 Å²	79.4	13%	0.127	44%	0.44	C	S	.	.	H	α-helix	trans	-70.3	-44.8	178.6	176.5	0	0	0	0	110.1	I1162 W1238 V1272 D1273 A1278 R1279	I1162-V1276 HydrophobicContact CD1-CB 3.58Å; I1162-V1276 HydrophobicContact CD1-CG1 3.73Å; I1162-V1276 HydrophobicContact CD1-CG2 3.78Å; I1162-V1276 HydrophobicContact CG1-CB 3.92Å; I1162-V1276 HydrophobicContact CG1-CG1 3.91Å; I1162-V1276 HydrophobicContact CG2-CG1 4.23Å; W1238-V1276 HydrophobicContact CH2-CG2 3.79Å; W1238-V1276 HydrophobicContact CZ3-CG1 4.25Å; W1238-V1276 HydrophobicContact CZ3-CG2 3.72Å; V1272-V1276 HydrophobicContact CG1-CG2 4.29Å; V1272-V1276 VanDerWaalsContact O-CG2 3.25Å; V1272-V1276 WeakPolarHBondContact O-CG2 3.47Å; V1272-V1276 PolarHBondContact O-N 3.15Å; D1273-V1276 PolarHBondContact O-N 3.47Å; V1276-A1278 PolarHBondContact O-N 2.74Å; V1276-R1279 PolarHBondContact O-N 3Å
1277	S	69.4	Low	64.2	Low	54 Å²	54	78.9 Å²	78.9	38%	0.378	44%	0.444	S	S	.	.	H	α-helix	trans	-67.5	-21.8	179.4	-64.2	0	0	0	0	113	I1162 D1273 A1274	I1162-S1277 PolarHBondContact N-OG 3.24Å; D1273-S1277 VanDerWaalsContact O-CB 3.27Å; D1273-S1277 WeakPolarHBondContact O-CB 3.49Å; D1273-S1277 PolarHBondContact O-N 2.9Å; D1273-S1277 PolarHBondContact O-OG 2.98Å; D1273-S1277 VanDerWaalsContact O-OG 3.08Å; D1273-S1277 PolarHBondContact OD1-OG 3.2Å; A1274-S1277 PolarHBondContact O-N 3.15Å
1278	A	66.9	Low	62.5	Low	82 Å²	82	80.7 Å²	80.7	68%	0.678	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-2.6	177.2	0	0	0	0	0	115.2	A1274 V1276	A1274-A1278 WeakPolarHBondContact O-CB 3.49Å; A1274-A1278 PolarHBondContact O-N 3.14Å; V1276-A1278 PolarHBondContact O-N 2.74Å
1279	R	62.4	Low	61	Low	144 Å²	144	87.6 Å²	87.6	54%	0.543	49%	0.485	S	S	.	.	S	Bend	trans	-69.3	142.3	179.2	-72.5	-178.6	175.8	-171.9	-2.8	111.5	W1238 V1276 L1281	W1238-R1279 VanDerWaalsContact CH2-CZ 3.49Å; W1238-R1279 VanDerWaalsContact CZ2-CZ 3.43Å; W1238-R1279 VanDerWaalsContact CZ2-NH2 3.29Å; V1276-R1279 PolarHBondContact O-N 3Å; R1279-L1281 PolarHBondContact O-N 3.24Å
1280	L	49.5	Very low	59.2	Low	161 Å²	161	90.6 Å²	90.6	84%	0.843	50%	0.501	S	S	*	.			trans	-54.9	129.1	171.4	-74.3	162.8	0	0	0	110.2	T1282	L1280-T1282 PolarHBondContact O-N 3.42Å
1281	L	54.4	Low	57.5	Low	104 Å²	104	94.6 Å²	94.6	55%	0.545	52%	0.517	S	S	.	.	S	Bend	trans	-63.8	-23.6	-179.6	-70.6	168.1	0	0	0	112.5	T1159 R1279	T1159-L1281 WeakPolarHBondContact O-CD2 3.4Å; R1279-L1281 PolarHBondContact O-N 3.24Å
1282	T	47.5	Very low	55.8	Low	86 Å²	86	92.6 Å²	92.6	53%	0.528	51%	0.513	S	S	.	.			trans	-130	130.4	-175.5	51.9	0	0	0	0	112.1	L1280 H1296	L1280-T1282 PolarHBondContact O-N 3.42Å; T1282-H1296 HydrophobicContact CG2-CB 4.46Å
1283	F	43	Very low	54.1	Low	163 Å²	163	97 Å²	97	72%	0.715	54%	0.536	S	S	*	.			trans	-137.1	137.3	165.9	176	-99	0	0	0	108.1
1284	V	47.4	Very low	52.5	Low	125 Å²	125	99.6 Å²	99.6	76%	0.758	56%	0.555	S	S	*	*			trans	-109	108.2	-178	-176	0	0	0	0	108.4
1285	G	47.5	Very low	50.8	Low	15 Å²	15	99.8 Å²	99.8	16%	0.155	54%	0.543	C	S	.	.			trans	-99.7	152.6	173.6	0	0	0	0	0	112.4	D1287 D1290	G1285-D1287 PolarHBondContact O-N 3Å; G1285-D1290 WeakPolarHBondContact CA-OD2 3.49Å
1286	D	44.7	Very low	49.5	Very low	174 Å²	174	99.1 Å²	99.1	93%	0.93	54%	0.538	S	S	*	.	S	Bend	trans	-76.3	-4.6	-180	-71.2	-31.8	0	0	0	113.8	P1288	D1286-P1288 WeakPolarHBondContact O-CD 3.35Å
1287	D	48.1	Very low	48.5	Very low	83 Å²	83	104.8 Å²	104.8	44%	0.444	57%	0.567	S	S	.	*			trans	-84.1	118.3	177.3	-166.4	-22.9	0	0	0	109.7	G1285 K1289 D1290	G1285-D1287 PolarHBondContact O-N 3Å; D1287-K1289 PolarHBondContact O-N 2.98Å; D1287-K1289 WeakPolarHBondContact OD1-CB 3.43Å; D1287-K1289 PolarHBondContact OD1-N 2.55Å; D1287-D1290 WeakPolarHBondContact O-CB 3.28Å; D1287-D1290 PolarHBondContact O-N 3Å
1288	P	48.2	Very low	47.2	Very low	118 Å²	118	104.9 Å²	104.9	77%	0.766	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-6.8	175.5	24.1	-33.3	0	0	0	114.1	D1286	D1286-P1288 WeakPolarHBondContact O-CD 3.35Å
1289	K	47.3	Very low	45.7	Very low	173 Å²	173	107.5 Å²	107.5	75%	0.752	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-8.6	170.4	-63.8	-176.7	179.5	-178.1	0	114.5	D1287 L1291	D1287-K1289 PolarHBondContact O-N 2.98Å; D1287-K1289 WeakPolarHBondContact OD1-CB 3.43Å; D1287-K1289 PolarHBondContact OD1-N 2.55Å; K1289-L1291 PolarHBondContact O-N 2.91Å
1290	D	45.8	Very low	44.9	Very low	67 Å²	67	105.7 Å²	105.7	36%	0.358	56%	0.56	S	S	.	*			trans	-67.5	98.8	174.2	-88.8	-29.4	0	0	0	109.5	G1285 D1287 A1292 I1293	G1285-D1290 WeakPolarHBondContact CA-OD2 3.49Å; D1287-D1290 WeakPolarHBondContact O-CB 3.28Å; D1287-D1290 PolarHBondContact O-N 3Å; D1290-A1292 PolarHBondContact O-N 3.19Å; D1290-I1293 WeakPolarHBondContact O-CG1 3.33Å; D1290-I1293 PolarHBondContact O-N 3.3Å; D1290-I1293 VanDerWaalsContact O-N 3.08Å
1291	L	47.4	Very low	44.7	Very low	149 Å²	149	102.8 Å²	102.8	78%	0.78	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-55.7	-10	177.3	-77.4	159.9	0	0	0	113.7	K1289 I1293 S1294	K1289-L1291 PolarHBondContact O-N 2.91Å; L1291-I1293 PolarHBondContact O-N 2.95Å; L1291-S1294 PolarHBondContact O-N 3.33Å; L1291-S1294 PolarHBondContact O-OG 3.39Å
1292	A	40.5	Very low	44.1	Very low	47 Å²	47	102.7 Å²	102.7	39%	0.388	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-57.6	-21.9	170.4	0	0	0	0	0	113.5	D1290 S1294 R1295 H1296	D1290-A1292 PolarHBondContact O-N 3.19Å; A1292-S1294 PolarHBondContact O-N 3.24Å; A1292-S1294 VanDerWaalsContact O-N 3.08Å; A1292-R1295 PolarHBondContact O-N 2.62Å; A1292-H1296 PolarHBondContact O-ND1 2.6Å
1293	I	39.4	Very low	43.9	Very low	93 Å²	93	103.7 Å²	103.7	48%	0.477	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-63.5	-13.7	176.6	-58.8	167.5	0	0	0	112.4	D1290 L1291 H1296	D1290-I1293 WeakPolarHBondContact O-CG1 3.33Å; D1290-I1293 PolarHBondContact O-N 3.3Å; D1290-I1293 VanDerWaalsContact O-N 3.08Å; L1291-I1293 PolarHBondContact O-N 2.95Å; I1293-H1296 VanDerWaalsContact C-CE1 3.44Å; I1293-H1296 PolarHBondContact O-CE1 2.91Å; I1293-H1296 PolarHBondContact O-ND1 3.03Å; I1293-H1296 VanDerWaalsContact O-ND1 3.09Å
1294	S	42.2	Very low	44	Very low	69 Å²	69	100 Å²	100	48%	0.483	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-101.5	-17.6	-179.3	53.2	0	0	0	0	115.6	L1291 A1292	L1291-S1294 PolarHBondContact O-N 3.33Å; L1291-S1294 PolarHBondContact O-OG 3.39Å; A1292-S1294 PolarHBondContact O-N 3.24Å; A1292-S1294 VanDerWaalsContact O-N 3.08Å
1295	R	39.8	Very low	43.8	Very low	62 Å²	62	98.3 Å²	98.3	23%	0.234	52%	0.521	C	S	.	.	G	3₁₀ helix	trans	-91.7	-21.8	-174.7	-74.2	-170.2	-177.2	-167.4	0.3	115.2	A1292 L1297 I1298	A1292-R1295 PolarHBondContact O-N 2.62Å; R1295-L1297 PolarHBondContact O-N 3.07Å; R1295-I1298 PolarHBondContact O-N 3.11Å; R1295-I1298 VanDerWaalsContact O-N 3.14Å
1296	H	42.2	Very low	43.5	Very low	91 Å²	91	104.3 Å²	104.3	42%	0.421	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-69.3	-6.1	174	69.6	-95.1	0	0	0	113.4	T1282 A1292 I1293 F1299	T1282-H1296 HydrophobicContact CG2-CB 4.46Å; A1292-H1296 PolarHBondContact O-ND1 2.6Å; I1293-H1296 VanDerWaalsContact C-CE1 3.44Å; I1293-H1296 PolarHBondContact O-CE1 2.91Å; I1293-H1296 PolarHBondContact O-ND1 3.03Å; I1293-H1296 VanDerWaalsContact O-ND1 3.09Å; H1296-F1299 VanDerWaalsContact O-OXT 3.05Å
1297	L	44.5	Very low	43.4	Very low	140 Å²	140	98.9 Å²	98.9	73%	0.733	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-88.1	-8.8	173.4	-69.9	169.2	0	0	0	112.6	R1295	R1295-L1297 PolarHBondContact O-N 3.07Å
1298	I	42.8	Very low	43	Very low	57 Å²	57	100.3 Å²	100.3	29%	0.292	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-27.2	-175.7	-63.9	161.9	0	0	0	111.7	V1121 V1123 R1295	V1121-I1298 HydrophobicContact CB-CD1 4.46Å; V1121-I1298 HydrophobicContact CG1-CD1 3.32Å; V1121-I1298 HydrophobicContact CG1-CG1 4.2Å; V1121-I1298 WeakPolarHBondContact O-CG2 3.46Å; V1123-I1298 HydrophobicContact CG2-CG2 4.37Å; V1123-I1298 WeakPolarHBondContact CG2-O 3.27Å; R1295-I1298 PolarHBondContact O-N 3.11Å; R1295-I1298 VanDerWaalsContact O-N 3.14Å
1299	F	36.1	Very low	42.5	Very low	137 Å²	137	98.6 Å²	98.6	60%	0.601	50%	0.502	S	S	*	.			trans	-101.8	0	168.3	-68.3	-79	0	0	0	108.7	T1158 H1296	T1158-F1299 HydrophobicContact CG2-CZ 4.13Å; T1158-F1299 WeakPolarHBondContact O-CZ 3.44Å; H1296-F1299 VanDerWaalsContact O-OXT 3.05Å

Retrieved 1,299 of 1,299 residues in 3570.7 ms (Link to these results)

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