A0A077ZMK2_TRITR Loading...

DUF4494 and SNF2 N domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZMK2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,308 aa.

						>A0A077ZMK2_TRITR|A0A077ZMK2
MILDQLLHDNENLALRKRLESEEETLHNGEGDGDNDGDSNVKCIEIKGNVAKEFFDKIASLVGYQKTMEDGSEKVVNELYVVDALSCTEAETSIIEEMSCYISGDSAVTSAKKTNYGEIFFSDLDDDDKWYKAKCQFITIDEKSQKEKRSNVTYMVQAKSLARALRYVDEVMGKSMSDYDIVGLNETKICDLARDKFIEVYNQKFGEGGEVFFEEQKALFNNELLNGSFKGYLEKATSLNIHDAFMNLAINGLSLEKGTTTLCYLMGYSNYDKNTRQSTYTAKITYTGYGEILLRQRAGQILRCGNPVVVYDCDDFRFGERDGHKFVDYVKTYPRPANSRIVACYVKIILPNNSYDYFVLDREGIDRLREYSAKFGGQDHKANALYGGSYTGNDGKMYFKDIDTGFLISKTCKHAFKTYPKLPVGLGGMLQADVDSQPQQQQQQEAFGASQAETQKNGVKAKLVQQQANNITRQIATLKSDTENAVQANRKSYEACVQAGESLLSDISASGMNDALDEKAAEFIKKAKLTEKAMTEKRKGVTQVFDIVRKGFTMMESLISAKNTDSVVYKIQEKRNEYAAYKLEQQRKAEQERLRQERIKEAKIKLKTDTIDTLNNLLTEHSSAAINSLNNTFSLLTLDNKDEVKKRITECSDVLDLGHLFVNNKPSYSSEIEENDAKDIMNGAYKEISASLLASYKQTVTTTRDELLMKFDSKIAELLEIKKAEEERKRKEEEARKAEEERKRKEEEARKAAEEERKKQEEIQRIKDEEERKRKEAELKAAEEERKRKEAELKAAEEERKRKEAEAAAAEAERKAKEEAIRKADEAAKEEQQRKLAAEQEKRDAENAAQHATAQAQSLFAQTSVDNTSKQKIKVTKRLIVTDKNAWLDIIQQWWTIEGSSMSPDKLASKLEFMRKACEKHANNEEEYIVSHYIKYEDEESDKKKAFHLGTLVDALVTEPEKCNHYAMTVDDEKYTEKDWKWGLDRLAVLKKQATKDSFLDFVLKNAVGQKTFINPHMKMEYQGFEFELPVRCKFDWWLGEFGGDLKTTAATSQEQFEAQIDFVDWDRSRAWYMDLTHSIDPRYGNQDFIFAVSKTKKKVFYKKIERGDELYLRDKPKLYDYQEEGVRMELAMKRCINGDDMGTGKTVQSIVAIERAKATPCLVICPAALKVNWEREIKKFTNLRPLILTDSVNATYGYHLTKMDLYDVVICNYESLAKYFVVSLGEKPLKLKNFIFRNEVDILKSVIIDESARVKDPTTRQSKIIMGICQGKEYIYELTGTPVVNHATDMACQLAILGRIDEFGGYG
					

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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	29.9	Very low	34.7	Very low	179 Å²	179	149.4 Å²	149.4	88%	0.882	76%	0.755	S	S	*	*				0	-79.4	0	-68.1	-166	78.1	0	0	113.3	L3 D4 Q5	M1-L3 VanDerWaalsContact C-N 3.3Å; M1-L3 PolarHBondContact O-N 2.86Å; M1-D4 PolarHBondContact N-OD2 3.05Å; M1-D4 PolarHBondContact O-N 3.11Å; M1-Q5 PolarHBondContact O-N 3.2Å; M1-Q5 VanDerWaalsContact O-N 3.11Å
2	I	30.4	Very low	35	Very low	145 Å²	145	146.3 Å²	146.3	74%	0.744	74%	0.742	S	S	*	*	H	α-helix	trans	-70.9	-29	173.9	-63.7	173.6	0	0	0	111.6
3	L	30.4	Very low	35.3	Very low	145 Å²	145	145.3 Å²	145.3	76%	0.759	74%	0.739	S	S	*	*	H	α-helix	trans	-75.5	-21.8	172.1	-136.3	79.5	0	0	0	113.6	M1 L7	M1-L3 VanDerWaalsContact C-N 3.3Å; M1-L3 PolarHBondContact O-N 2.86Å; L3-L7 WeakPolarHBondContact O-CD1 3.47Å
4	D	37.2	Very low	35.5	Very low	106 Å²	106	140.5 Å²	140.5	57%	0.567	73%	0.732	S	S	*	*	H	α-helix	trans	-85.3	-25.9	174.2	-71.7	-51.3	0	0	0	111.9	M1 L6	M1-D4 PolarHBondContact N-OD2 3.05Å; M1-D4 PolarHBondContact O-N 3.11Å; D4-L6 VanDerWaalsContact C-N 3.34Å
5	Q	38.5	Very low	35.8	Very low	160 Å²	160	137.7 Å²	137.7	75%	0.748	72%	0.718	S	S	*	*	H	α-helix	trans	-78.3	-18.4	178.5	-142.1	83.5	28.6	0	0	112.9	M1	M1-Q5 PolarHBondContact O-N 3.2Å; M1-Q5 VanDerWaalsContact O-N 3.11Å
6	L	36.6	Very low	35.8	Very low	144 Å²	144	140.6 Å²	140.6	75%	0.754	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-3.7	177.1	-77	163.9	0	0	0	113.4	D4	D4-L6 VanDerWaalsContact C-N 3.34Å
7	L	37.3	Very low	36.1	Very low	133 Å²	133	141.2 Å²	141.2	70%	0.696	71%	0.713	S	S	*	*	S	Bend	trans	-97.6	18.2	178.1	-79.9	164.2	0	0	0	112.7	L3	L3-L7 WeakPolarHBondContact O-CD1 3.47Å
8	H	36.8	Very low	36.2	Very low	150 Å²	150	143.8 Å²	143.8	69%	0.694	71%	0.713	S	S	*	*			trans	-125.1	7.6	-169.5	-96.3	35.7	0	0	0	117.5
9	D	36.5	Very low	36.3	Very low	167 Å²	167	143 Å²	143	89%	0.893	71%	0.711	S	S	*	*			trans	-110.2	115.9	175.8	-79	-24.9	0	0	0	113.7
10	N	33.2	Very low	36.4	Very low	154 Å²	154	142.9 Å²	142.9	82%	0.824	71%	0.708	S	S	*	*			trans	-64.1	119.6	-179.4	-77.2	-68.7	0	0	0	113.2
11	E	34.8	Very low	36.6	Very low	160 Å²	160	139.7 Å²	139.7	75%	0.748	70%	0.699	S	S	*	*			trans	-169.2	63.3	153.4	-111.1	178.6	-159.4	0	0	110.8	K400	E11-K400 IonicContact OE1-NZ 3.32Å
12	N	38.8	Very low	36.9	Very low	112 Å²	112	138.9 Å²	138.9	60%	0.599	69%	0.694	S	S	*	*			trans	-166.2	32.7	159.5	-102.7	-37.8	0	0	0	116.7	A14 L15	N12-A14 PolarHBondContact O-N 3.17Å; N12-L15 PolarHBondContact O-N 3.41Å; N12-L15 WeakPolarHBondContact OD1-CD1 3.47Å
13	L	38.1	Very low	37.2	Very low	134 Å²	134	140.4 Å²	140.4	70%	0.702	70%	0.697	S	S	*	*	H	α-helix	trans	-67.8	-10.6	174.2	-156.1	73.8	0	0	0	113.5
14	A	38.8	Very low	37.4	Very low	78 Å²	78	141.9 Å²	141.9	65%	0.645	70%	0.7	S	S	*	*	H	α-helix	trans	-86.6	-16.9	179.2	0	0	0	0	0	114.2	N12	N12-A14 PolarHBondContact O-N 3.17Å
15	L	40	Very low	37.3	Very low	99 Å²	99	142.7 Å²	142.7	52%	0.518	71%	0.71	S	S	.	*	H	α-helix	trans	-89.6	-27.7	177.5	-98.5	154.3	0	0	0	112.4	N12 L19	N12-L15 PolarHBondContact O-N 3.41Å; N12-L15 WeakPolarHBondContact OD1-CD1 3.47Å; L15-L19 PolarHBondContact O-N 3.16Å
16	R	36.1	Very low	37	Very low	184 Å²	184	143.7 Å²	143.7	69%	0.694	72%	0.719	S	S	*	*	H	α-helix	trans	-73.1	-36.2	174	-74.2	-175.1	174.3	-175	-2.6	113.3	R18 L19 E20	R16-R18 VanDerWaalsContact C-N 3.28Å; R16-R18 PolarHBondContact O-N 3.4Å; R16-L19 PolarHBondContact O-N 3.29Å; R16-E20 WeakPolarHBondContact O-CB 3.35Å; R16-E20 WeakPolarHBondContact O-CG 3.48Å; R16-E20 PolarHBondContact O-N 3.36Å; R16-E20 VanDerWaalsContact O-N 3.1Å
17	K	41.3	Very low	36.9	Very low	151 Å²	151	145.6 Å²	145.6	66%	0.657	72%	0.724	S	S	*	*	H	α-helix	trans	-74.6	-10.8	175.5	-74.7	-170.2	173.4	-173.4	0	115.5	S21	K17-S21 PolarHBondContact O-OG 3.14Å
18	R	37.8	Very low	36.9	Very low	188 Å²	188	147 Å²	147	71%	0.709	73%	0.732	S	S	*	*	H	α-helix	trans	-93.9	-26.7	173.7	-111.4	177.3	179.4	173.7	-1	112.7	R16 S21	R16-R18 VanDerWaalsContact C-N 3.28Å; R16-R18 PolarHBondContact O-N 3.4Å; R18-S21 PolarHBondContact O-OG 2.93Å
19	L	38.2	Very low	36.7	Very low	128 Å²	128	143.7 Å²	143.7	67%	0.67	74%	0.738	S	S	*	*	H	α-helix	trans	-83.8	-22.8	173.9	-83.4	154.7	0	0	0	112.5	L15 R16	L15-L19 PolarHBondContact O-N 3.16Å; R16-L19 PolarHBondContact O-N 3.29Å
20	E	38.5	Very low	36.5	Very low	141 Å²	141	145.4 Å²	145.4	66%	0.659	74%	0.741	S	S	*	*	S	Bend	trans	-87.9	-4.5	174.2	-71.6	167.6	177.1	0	0	113.7	R16	R16-E20 WeakPolarHBondContact O-CB 3.35Å; R16-E20 WeakPolarHBondContact O-CG 3.48Å; R16-E20 PolarHBondContact O-N 3.36Å; R16-E20 VanDerWaalsContact O-N 3.1Å
21	S	38.9	Very low	36.5	Very low	75 Å²	75	141.7 Å²	141.7	52%	0.524	74%	0.739	S	S	.	*	S	Bend	trans	-107.5	-0.3	-177.6	66.1	0	0	0	0	115.2	K17 R18	K17-S21 PolarHBondContact O-OG 3.14Å; R18-S21 PolarHBondContact O-OG 2.93Å
22	E	36.9	Very low	36.4	Very low	163 Å²	163	142.3 Å²	142.3	76%	0.762	75%	0.747	S	S	*	*	S	Bend	trans	-105.8	7.3	-180	-72.3	-175.1	167.6	0	0	113.5
23	E	36.1	Very low	36.1	Very low	176 Å²	176	140.6 Å²	140.6	82%	0.822	76%	0.756	S	S	*	*	S	Bend	trans	-103.7	7.5	177.9	-74.5	-172.5	151	0	0	114.9
24	E	34.4	Very low	35.8	Very low	176 Å²	176	141.4 Å²	141.4	82%	0.822	76%	0.761	S	S	*	*	S	Bend	trans	-113.1	23.9	-171.6	-94.4	-172.9	168.7	0	0	116.5
25	T	35.2	Very low	35.4	Very low	124 Å²	124	145.1 Å²	145.1	76%	0.761	77%	0.77	S	S	*	*			trans	-138.7	84.5	172.9	42.6	0	0	0	0	113.2
26	L	32.3	Very low	35	Very low	181 Å²	181	148.2 Å²	148.2	95%	0.948	79%	0.787	S	S	*	*			trans	-174.7	75.7	147.5	-95.9	150.2	0	0	0	108.6
27	H	35.5	Very low	34.6	Very low	183 Å²	183	142.6 Å²	142.6	85%	0.847	79%	0.787	S	S	*	*			trans	-97	132.8	165.7	-113.7	37.3	0	0	0	109.1
28	N	36.2	Very low	34	Very low	164 Å²	164	143.8 Å²	143.8	88%	0.877	80%	0.801	S	S	*	*			trans	118.8	104.5	159	-60.4	-19.6	0	0	0	114.5
29	G	32.5	Very low	33.6	Very low	80 Å²	80	139.4 Å²	139.4	83%	0.825	80%	0.798	S	S	*	*			trans	158.3	64.8	164.1	0	0	0	0	0	115.3
30	E	33.3	Very low	33.1	Very low	202 Å²	202	140 Å²	140	94%	0.944	80%	0.803	S	S	*	*			trans	-10.6	140.4	161.1	-62	167.8	158.9	0	0	119.6
31	G	33.3	Very low	32.5	Very low	76 Å²	76	140 Å²	140	78%	0.784	81%	0.812	S	S	*	*			trans	157.1	79.8	157.4	0	0	0	0	0	116.5
32	D	32.5	Very low	32	Very low	173 Å²	173	144.8 Å²	144.8	93%	0.925	82%	0.823	S	S	*	*			trans	8.4	134.5	155.6	-59.7	-25.2	0	0	0	121.4
33	G	32.5	Very low	31.4	Very low	76 Å²	76	142 Å²	142	78%	0.784	82%	0.821	S	S	*	*			trans	153.2	100.7	153.1	0	0	0	0	0	115.1
34	D	31.2	Very low	31	Very low	152 Å²	152	137.8 Å²	137.8	81%	0.813	80%	0.803	S	S	*	*			trans	-44.4	136.9	170.9	-61.9	-51.4	0	0	0	114.3
35	N	31.9	Very low	31	Very low	156 Å²	156	133.6 Å²	133.6	83%	0.834	78%	0.783	S	S	*	*				176.4	140.1	116.5	-93.6	-48.1	0	0	0	113.4
36	D	30.3	Very low	30.8	Very low	163 Å²	163	131.4 Å²	131.4	87%	0.872	77%	0.766	S	S	*	*			trans	-50.6	154.8	167.5	-64.1	-52.6	0	0	0	114.5
37	G	28.8	Very low	30.7	Very low	67 Å²	67	125.2 Å²	125.2	69%	0.691	73%	0.732	S	S	*	*			trans	136.9	94.6	153.9	0	0	0	0	0	115.9
38	D	28.5	Very low	30.3	Very low	176 Å²	176	118.8 Å²	118.8	94%	0.941	72%	0.715	S	S	*	*			trans	45.2	92.6	131.4	-144.6	8.1	0	0	0	117.7
39	S	29.3	Very low	30.1	Very low	95 Å²	95	118.5 Å²	118.5	66%	0.664	71%	0.713	S	S	*	*			trans	-155	116.7	168	66.3	0	0	0	0	111.6
40	N	27.9	Very low	29.8	Very low	142 Å²	142	118.8 Å²	118.8	76%	0.759	70%	0.698	S	S	*	*			trans	170.4	70.8	130.3	-84.3	-24.7	0	0	0	112.1
41	V	25.6	Very low	29.5	Very low	140 Å²	140	113.7 Å²	113.7	85%	0.848	69%	0.691	S	S	*	*			trans	-126.2	71	147.9	-173.5	0	0	0	0	106.6
42	K	27.3	Very low	29.1	Very low	176 Å²	176	119.2 Å²	119.2	77%	0.765	69%	0.693	S	S	*	*			trans	-84.8	104.9	165.7	-93.1	-178.2	172.4	177.1	0	107.4	I44	K42-I44 HydrophobicContact CB-CG1 4.09Å; K42-I44 PolarHBondContact O-N 3.18Å
43	C	24.5	Very low	28.8	Very low	105 Å²	105	118.7 Å²	118.7	71%	0.709	69%	0.686	S	S	*	*			trans	-60.6	92.9	157.9	-73.4	0	0	0	0	107.5	E45	C43-E45 PolarHBondContact O-N 3.22Å
44	I	28.1	Very low	28.5	Very low	87 Å²	87	123.9 Å²	123.9	45%	0.446	69%	0.687	S	S	.	*			trans	-79.2	119.1	175.7	-68.2	172	0	0	0	107.4	K42 N221 L225	K42-I44 HydrophobicContact CB-CG1 4.09Å; K42-I44 PolarHBondContact O-N 3.18Å; I44-N221 PolarHBondContact O-ND2 3.19Å; I44-L225 HydrophobicContact CB-CD1 4.18Å; I44-L225 HydrophobicContact CG2-CD1 4.26Å; I44-L225 HydrophobicContact CG2-CD2 4.47Å
45	E	33.4	Very low	28.5	Very low	88 Å²	88	122.5 Å²	122.5	41%	0.411	67%	0.674	S	S	.	*			trans	-33.4	149.1	166.6	-67.7	169.8	122.7	0	0	113.1	C43 K47 F121	C43-E45 PolarHBondContact O-N 3.22Å; E45-K47 PolarHBondContact O-N 2.91Å; E45-F121 VanDerWaalsContact OE1-CB 3.31Å; E45-F121 WeakPolarHBondContact OE1-CB 3.33Å
46	I	31.3	Very low	29.1	Very low	78 Å²	78	118 Å²	118	40%	0.4	65%	0.65	S	S	.	*	S	Bend	trans	-61.8	85	164.5	-61.1	171.9	0	0	0	107.7	N221 L224 I241	I46-N221 WeakPolarHBondContact CG1-OD1 3.34Å; I46-L224 HydrophobicContact CG2-CD1 4.46Å; I46-I241 HydrophobicContact CG2-CG2 3.91Å
47	K	31	Very low	30.4	Very low	51 Å²	51	111.9 Å²	111.9	22%	0.222	62%	0.615	C	S	.	*			trans	53.8	71.4	170.9	-65.9	-171.5	178.8	153.1	0	118.1	E45 N49 L233 I241	E45-K47 PolarHBondContact O-N 2.91Å; K47-N49 VanDerWaalsContact C-N 3.33Å; K47-N49 PolarHBondContact O-N 2.82Å; K47-L233 PolarHBondContact NZ-O 2.76Å; K47-I241 HydrophobicContact CD-CD1 3.67Å
48	G	27.6	Very low	31.6	Very low	48 Å²	48	108.8 Å²	108.8	50%	0.495	58%	0.583	S	S	.	*	S	Bend	trans	-77.4	8.2	164.5	0	0	0	0	0	117.2
49	N	30.6	Very low	33	Very low	158 Å²	158	100.8 Å²	100.8	85%	0.845	54%	0.541	S	S	*	.	S	Bend	trans	-134.7	13.7	-169	-90.4	-35.1	0	0	0	118.6	K47	K47-N49 VanDerWaalsContact C-N 3.33Å; K47-N49 PolarHBondContact O-N 2.82Å
50	V	27.7	Very low	34.4	Very low	85 Å²	85	96.2 Å²	96.2	52%	0.515	51%	0.51	S	S	.	.	S	Bend	trans	-120.9	-7.3	179.7	-169.8	0	0	0	0	115.3	E234	V50-E234 WeakPolarHBondContact CG1-O 3.26Å
51	A	26.3	Very low	36	Very low	95 Å²	95	91.8 Å²	91.8	79%	0.785	49%	0.485	S	S	*	.			trans	-112	72.9	178.8	0	0	0	0	0	112
52	K	25.8	Very low	37.7	Very low	192 Å²	192	85.2 Å²	85.2	84%	0.835	45%	0.446	S	S	*	.			trans	-100.8	8.7	175.8	-127.8	176.1	-173.1	173.6	0	114.4
53	E	26	Very low	39.4	Very low	163 Å²	163	77.2 Å²	77.2	76%	0.762	41%	0.414	S	S	*	.	S	Bend	trans	-146.1	120.2	-176.2	-70.3	-170.6	164.6	0	0	112.4
54	F	26.2	Very low	41.5	Very low	185 Å²	185	73.2 Å²	73.2	81%	0.811	38%	0.383	S	S	*	.			trans	70.9	64.4	159.8	-73.4	-86	0	0	0	122
55	F	29.5	Very low	43.3	Very low	123 Å²	123	72.4 Å²	72.4	54%	0.539	38%	0.378	S	S	.	.			trans	-141	140.9	155.4	-70.3	-79.6	0	0	0	113.1	D83 L85	F55-D83 HydrophobicContact CB-CB 4.37Å; F55-L85 HydrophobicContact CD1-CD2 3.82Å; F55-L85 HydrophobicContact CD1-CG 4.07Å; F55-L85 HydrophobicContact CE1-CD1 4.32Å; F55-L85 HydrophobicContact CE1-CD2 3.79Å; F55-L85 HydrophobicContact CE1-CG 3.87Å
56	D	45.6	Very low	44.8	Very low	62 Å²	62	71.8 Å²	71.8	33%	0.332	37%	0.374	S	S	.	.			trans	-89	130.4	171.5	-72	-72.6	0	0	0	109.6	I58 A84 K113	D56-I58 PolarHBondContact O-N 3.15Å; D56-A84 PolarHBondContact O-N 2.93Å; D56-K113 HydrophobicContact CB-CD 4.41Å; D56-K113 HydrophobicContact CB-CG 4.26Å; D56-K113 WeakPolarHBondContact OD1-CE 3.49Å; D56-K113 IonicContact OD1-NZ 3.1Å; D56-K113 PolarHBondContact OD1-NZ 3.25Å; D56-K113 WeakPolarHBondContact OD2-CE 3.11Å; D56-K113 IonicContact OD2-NZ 2.73Å; D56-K113 PolarHBondContact OD2-NZ 2.96Å
57	K	56.7	Low	46.3	Very low	33 Å²	33	71.9 Å²	71.9	14%	0.143	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	122.3	176.6	-74.9	166.7	-178	163.8	0	109.7	V81 D83 T114 Y116 I119	K57-V81 HydrophobicContact CB-CG1 3.91Å; K57-V81 HydrophobicContact CG-CG1 4.29Å; K57-D83 WeakPolarHBondContact CG-OD1 3.37Å; K57-T114 WeakPolarHBondContact O-CA 3.29Å; K57-T114 PolarHBondContact O-N 3.21Å; K57-T114 PolarHBondContact O-OG1 3.06Å; K57-Y116 HydrophobicContact CB-CD2 4.11Å; K57-Y116 HydrophobicContact CD-CD2 4.2Å; K57-I119 HydrophobicContact CD-CD1 4.08Å; K57-I119 VanDerWaalsContact CE-CD1 3.45Å
58	I	55.1	Low	48.1	Very low	2 Å²	2	72.5 Å²	72.5	1%	0.01	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.2	177.2	-59.7	-174.9	0	0	0	108.7	D56 V81 V82 A84 S86 A90 A111	D56-I58 PolarHBondContact O-N 3.15Å; I58-V81 WeakPolarHBondContact O-CA 3.21Å; I58-V82 PolarHBondContact N-O 2.77Å; I58-V82 PolarHBondContact O-N 3.34Å; I58-A84 HydrophobicContact CD1-CB 4.05Å; I58-A84 WeakPolarHBondContact CD1-O 3.38Å; I58-A84 HydrophobicContact CG1-CB 4.49Å; I58-S86 VanDerWaalsContact CD1-O 3.24Å; I58-S86 WeakPolarHBondContact CD1-O 3.34Å; I58-A90 HydrophobicContact CB-CB 3.85Å; I58-A90 HydrophobicContact CD1-CB 4.08Å; I58-A90 HydrophobicContact CG2-CB 3.59Å; I58-A111 HydrophobicContact CG2-CB 4.22Å
59	A	58.2	Low	49	Very low	8 Å²	8	76 Å²	76	7%	0.066	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	119.5	172.5	0	0	0	0	0	109.2	L79 Y80 V81 K112 T114	A59-L79 HydrophobicContact CB-CD1 4.25Å; A59-Y80 CarbonylContact C-O 3.54Å; A59-Y80 VanDerWaalsContact CA-O 3.27Å; A59-Y80 WeakPolarHBondContact CA-O 3.19Å; A59-V81 HydrophobicContact CB-CG2 4.12Å; A59-K112 PolarHBondContact N-O 2.87Å; A59-K112 PolarHBondContact O-N 2.83Å; A59-T114 HydrophobicContact CB-CG2 3.53Å
60	S	58.9	Low	50.1	Low	0 Å²	0	74.4 Å²	74.4	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	130.4	-177.6	-66.4	0	0	0	0	110.5	Y80 S110 A111	S60-Y80 PolarHBondContact N-O 2.98Å; S60-Y80 PolarHBondContact O-N 3.4Å; S60-S110 CarbonylContact C-O 3.57Å; S60-S110 VanDerWaalsContact CA-O 3.27Å; S60-S110 WeakPolarHBondContact CA-O 3.31Å; S60-A111 WeakPolarHBondContact OG-CB 3.28Å
61	L	60.7	Low	51.2	Low	48 Å²	48	72.9 Å²	72.9	25%	0.251	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	123.4	174.3	-163.4	82.7	0	0	0	108.2	N77 E78 L79 V108 T109 S110	L61-N77 HydrophobicContact CD1-CB 4.47Å; L61-N77 HydrophobicContact CD2-CB 4.14Å; L61-N77 HydrophobicContact CG-CB 4.23Å; L61-E78 WeakPolarHBondContact CA-O 3.43Å; L61-L79 HydrophobicContact CB-CD1 4.4Å; L61-L79 HydrophobicContact CD1-CB 4.15Å; L61-L79 HydrophobicContact CD1-CD1 4.09Å; L61-V108 CarbonylContact O-C 3.59Å; L61-T109 PolarHBondContact O-N 3.26Å; L61-T109 PolarHBondContact O-OG1 2.88Å; L61-S110 WeakPolarHBondContact CB-OG 3.18Å; L61-S110 PolarHBondContact N-O 2.81Å; L61-S110 PolarHBondContact O-N 3.43Å
62	V	61	Low	52.9	Low	2 Å²	2	70.9 Å²	70.9	1%	0.012	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	124.5	-178.7	-168.8	0	0	0	0	109.2	Y64 N77 E78 Y80 I94 M98	V62-Y64 HydrophobicContact CG1-CD1 4.14Å; V62-N77 VanDerWaalsContact O-CA 3.32Å; V62-N77 WeakPolarHBondContact O-CA 3.5Å; V62-E78 PolarHBondContact N-O 2.83Å; V62-E78 PolarHBondContact O-N 2.75Å; V62-Y80 HydrophobicContact CB-CD2 4.15Å; V62-Y80 HydrophobicContact CB-CE2 3.97Å; V62-Y80 HydrophobicContact CG2-CD2 3.59Å; V62-Y80 HydrophobicContact CG2-CE2 3.89Å; V62-I94 HydrophobicContact CB-CG2 4.41Å; V62-I94 HydrophobicContact CG1-CG2 4.37Å; V62-I94 HydrophobicContact CG2-CD1 4.49Å; V62-I94 HydrophobicContact CG2-CG2 3.2Å; V62-M98 HydrophobicContact CB-SD 4.08Å; V62-M98 HydrophobicContact CG1-SD 3.76Å; V62-M98 HydrophobicContact CG2-SD 4.23Å
63	G	64.1	Low	54.8	Low	9 Å²	9	67.2 Å²	67.2	9%	0.093	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	123	171.5	0	0	0	0	0	110.1	V76 N77 A107 T109	G63-V76 WeakPolarHBondContact CA-O 3.05Å; G63-N77 VanDerWaalsContact CA-OD1 3.27Å; G63-N77 WeakPolarHBondContact CA-OD1 3.38Å; G63-A107 PolarHBondContact N-O 3.43Å; G63-A107 PolarHBondContact O-N 2.99Å; G63-T109 PolarHBondContact N-OG1 2.8Å
64	Y	67.4	Low	56.9	Low	20 Å²	20	65.6 Å²	65.6	8%	0.078	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	156.7	176.5	65.1	-86.7	0	0	0	112.6	V62 K66 V75 V76 E78 M98 I102	V62-Y64 HydrophobicContact CG1-CD1 4.14Å; Y64-K66 HydrophobicContact CD2-CB 4.28Å; Y64-K66 HydrophobicContact CE2-CB 3.87Å; Y64-K66 HydrophobicContact CE2-CD 4.27Å; Y64-K66 HydrophobicContact CE2-CG 4.2Å; Y64-K66 PolarHBondContact O-N 3.32Å; Y64-V75 WeakPolarHBondContact O-CA 3.37Å; Y64-V76 PolarHBondContact N-O 2.88Å; Y64-V76 VanDerWaalsContact N-O 3.09Å; Y64-V76 PolarHBondContact O-N 2.86Å; Y64-E78 PolarHBondContact OH-OE2 3.49Å; Y64-M98 HydrophobicContact CD1-CE 4Å; Y64-M98 HydrophobicContact CD1-SD 4.21Å; Y64-M98 HydrophobicContact CE1-CE 3.56Å; Y64-M98 HydrophobicContact CE1-SD 4.12Å; Y64-M98 HydrophobicContact CE2-CE 4.35Å; Y64-I102 VanDerWaalsContact CB-CD1 3.44Å; Y64-I102 HydrophobicContact CD1-CD1 4.04Å; Y64-I102 HydrophobicContact CD2-CB 4.47Å; Y64-I102 HydrophobicContact CD2-CD1 3.9Å; Y64-I102 HydrophobicContact CD2-CG1 3.65Å; Y64-I102 HydrophobicContact CD2-CG2 4.03Å; Y64-I102 HydrophobicContact CE2-CG1 4.22Å; Y64-I102 HydrophobicContact CG-CD1 3.54Å; Y64-I102 HydrophobicContact CG-CG1 3.87Å; Y64-I102 HydrophobicContact CG-CG2 4.33Å
65	Q	66.9	Low	59.1	Low	71 Å²	71	61.3 Å²	61.3	33%	0.332	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	118.2	171.2	-75.3	-175.2	-55	0	0	109.9	V75	Q65-V75 HydrophobicContact CG-CG2 4.03Å
66	K	65.1	Low	60.9	Low	74 Å²	74	56.9 Å²	56.9	32%	0.322	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	129.7	174.1	-170.1	174	-174	169.3	0	108.5	Y64 M68 K74 V76 E78	Y64-K66 HydrophobicContact CD2-CB 4.28Å; Y64-K66 HydrophobicContact CE2-CB 3.87Å; Y64-K66 HydrophobicContact CE2-CD 4.27Å; Y64-K66 HydrophobicContact CE2-CG 4.2Å; Y64-K66 PolarHBondContact O-N 3.32Å; K66-M68 PolarHBondContact O-N 2.74Å; K66-K74 PolarHBondContact N-O 3.5Å; K66-K74 PolarHBondContact O-N 3.01Å; K66-V76 HydrophobicContact CB-CG2 3.27Å; K66-V76 HydrophobicContact CD-CG2 3.76Å; K66-V76 HydrophobicContact CG-CG2 4.17Å; K66-E78 IonicContact NZ-OE1 2.97Å; K66-E78 PolarHBondContact NZ-OE1 3.49Å
67	T	62.3	Low	62.1	Low	81 Å²	81	58.6 Å²	58.6	50%	0.497	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	114.6	167.9	-47.8	0	0	0	0	107.8	S72	T67-S72 CarbonylContact C-O 3.48Å; T67-S72 WeakPolarHBondContact CA-O 3.29Å
68	M	68.2	Low	62.4	Low	63 Å²	63	57.8 Å²	57.8	31%	0.31	31%	0.313	S	S	.	.			trans	-72.7	167.1	175.9	-61.8	-58.4	-140.4	0	0	110.2	K66 D70 G71 S72 K74	K66-M68 PolarHBondContact O-N 2.74Å; M68-D70 WeakPolarHBondContact CB-OD1 3.26Å; M68-D70 PolarHBondContact O-N 3.24Å; M68-D70 VanDerWaalsContact O-N 3.1Å; M68-G71 PolarHBondContact O-N 3.04Å; M68-S72 WeakPolarHBondContact CB-O 3.23Å; M68-S72 PolarHBondContact N-O 3.04Å; M68-K74 HydrophobicContact CE-CB 3.89Å; M68-K74 HydrophobicContact CE-CD 3.59Å; M68-K74 HydrophobicContact CE-CG 4.29Å; M68-K74 HydrophobicContact CG-CB 4.02Å
69	E	46.8	Very low	62.9	Low	121 Å²	121	60.3 Å²	60.3	57%	0.565	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-19	-176.1	-56.1	-157.8	131.5	0	0	114.3	G71 K874	E69-G71 VanDerWaalsContact C-N 3.32Å; E69-K874 WeakPolarHBondContact OE1-CD 3.46Å; E69-K874 WeakPolarHBondContact OE1-CE 3.48Å; E69-K874 VanDerWaalsContact OE1-CG 3.32Å; E69-K874 WeakPolarHBondContact OE1-CG 3.42Å; E69-K874 IonicContact OE1-NZ 3.92Å; E69-K874 PolarHBondContact OE1-NZ 3.12Å
70	D	53.6	Low	63.2	Low	125 Å²	125	61.5 Å²	61.5	67%	0.668	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-0.5	174.6	67.8	-8.2	0	0	0	113.7	M68 S72	M68-D70 WeakPolarHBondContact CB-OD1 3.26Å; M68-D70 PolarHBondContact O-N 3.24Å; M68-D70 VanDerWaalsContact O-N 3.1Å; D70-S72 VanDerWaalsContact C-N 3.33Å; D70-S72 VanDerWaalsContact CG-OG 3.29Å; D70-S72 VanDerWaalsContact OD1-CB 3.24Å; D70-S72 WeakPolarHBondContact OD1-CB 3.42Å; D70-S72 PolarHBondContact OD1-N 2.7Å; D70-S72 PolarHBondContact OD1-OG 2.96Å; D70-S72 PolarHBondContact OD2-OG 3.12Å
71	G	50	Low	63.4	Low	54 Å²	54	63.6 Å²	63.6	56%	0.557	34%	0.343	S	S	*	.	S	Bend	trans	82.8	0.5	-175.2	0	0	0	0	0	114.8	M68 E69	M68-G71 PolarHBondContact O-N 3.04Å; E69-G71 VanDerWaalsContact C-N 3.32Å
72	S	61.9	Low	63.4	Low	52 Å²	52	62.1 Å²	62.1	36%	0.364	34%	0.335	S	S	.	.			trans	-77	145.5	174	71	0	0	0	0	111.4	T67 M68 D70	T67-S72 CarbonylContact C-O 3.48Å; T67-S72 WeakPolarHBondContact CA-O 3.29Å; M68-S72 WeakPolarHBondContact CB-O 3.23Å; M68-S72 PolarHBondContact N-O 3.04Å; D70-S72 VanDerWaalsContact C-N 3.33Å; D70-S72 VanDerWaalsContact CG-OG 3.29Å; D70-S72 VanDerWaalsContact OD1-CB 3.24Å; D70-S72 WeakPolarHBondContact OD1-CB 3.42Å; D70-S72 PolarHBondContact OD1-N 2.7Å; D70-S72 PolarHBondContact OD1-OG 2.96Å; D70-S72 PolarHBondContact OD2-OG 3.12Å
73	E	66.6	Low	63.3	Low	116 Å²	116	66 Å²	66	54%	0.542	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	122.7	174.8	-67.8	-179.1	172.5	0	0	110.1
74	K	69.6	Low	63.1	Low	128 Å²	128	65.6 Å²	65.6	56%	0.557	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.7	140.3	177	-163.6	178.8	-173.5	177.2	0	110.8	K66 M68 V76	K66-K74 PolarHBondContact N-O 3.5Å; K66-K74 PolarHBondContact O-N 3.01Å; M68-K74 HydrophobicContact CE-CB 3.89Å; M68-K74 HydrophobicContact CE-CD 3.59Å; M68-K74 HydrophobicContact CE-CG 4.29Å; M68-K74 HydrophobicContact CG-CB 4.02Å; K74-V76 PolarHBondContact O-N 2.87Å
75	V	72.3	Confident	62.6	Low	95 Å²	95	69.8 Å²	69.8	58%	0.576	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	121.8	172.5	-177.6	0	0	0	0	109.1	Y64 Q65	Y64-V75 WeakPolarHBondContact O-CA 3.37Å; Q65-V75 HydrophobicContact CG-CG2 4.03Å
76	V	68.3	Low	62.1	Low	31 Å²	31	68.9 Å²	68.9	19%	0.188	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	140.1	177.2	-120.7	0	0	0	0	109.6	G63 Y64 K66 K74	G63-V76 WeakPolarHBondContact CA-O 3.05Å; Y64-V76 PolarHBondContact N-O 2.88Å; Y64-V76 VanDerWaalsContact N-O 3.09Å; Y64-V76 PolarHBondContact O-N 2.86Å; K66-V76 HydrophobicContact CB-CG2 3.27Å; K66-V76 HydrophobicContact CD-CG2 3.76Å; K66-V76 HydrophobicContact CG-CG2 4.17Å; K74-V76 PolarHBondContact O-N 2.87Å
77	N	70.1	Confident	62.2	Low	97 Å²	97	67.8 Å²	67.8	52%	0.519	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	108.3	174.6	-69.6	-24.3	0	0	0	109	L61 V62 G63	L61-N77 HydrophobicContact CD1-CB 4.47Å; L61-N77 HydrophobicContact CD2-CB 4.14Å; L61-N77 HydrophobicContact CG-CB 4.23Å; V62-N77 VanDerWaalsContact O-CA 3.32Å; V62-N77 WeakPolarHBondContact O-CA 3.5Å; G63-N77 VanDerWaalsContact CA-OD1 3.27Å; G63-N77 WeakPolarHBondContact CA-OD1 3.38Å
78	E	64.5	Low	62.5	Low	16 Å²	16	68.3 Å²	68.3	8%	0.075	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	143.5	-178.4	-68	-179	165.2	0	0	110.2	L61 V62 Y64 K66 Y80 Q871	L61-E78 WeakPolarHBondContact CA-O 3.43Å; V62-E78 PolarHBondContact N-O 2.83Å; V62-E78 PolarHBondContact O-N 2.75Å; Y64-E78 PolarHBondContact OH-OE2 3.49Å; K66-E78 IonicContact NZ-OE1 2.97Å; K66-E78 PolarHBondContact NZ-OE1 3.49Å; E78-Y80 HydrophobicContact CB-CE2 3.65Å; E78-Y80 WeakPolarHBondContact O-CD2 3.49Å; E78-Y80 PolarHBondContact OE2-OH 2.89Å; E78-Q871 PolarHBondContact OE1-NE2 2.8Å
79	L	65.4	Low	62.5	Low	55 Å²	55	69.1 Å²	69.1	29%	0.288	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	120.6	-175.9	-174	76.4	0	0	0	110.1	A59 L61 I189	A59-L79 HydrophobicContact CB-CD1 4.25Å; L61-L79 HydrophobicContact CB-CD1 4.4Å; L61-L79 HydrophobicContact CD1-CB 4.15Å; L61-L79 HydrophobicContact CD1-CD1 4.09Å; L79-I189 HydrophobicContact CD2-CG1 4.43Å
80	Y	63.4	Low	63.4	Low	33 Å²	33	63.4 Å²	63.4	13%	0.129	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	147.2	178.7	-59.1	-88.9	0	0	0	110.1	A59 S60 V62 E78 M98 L192	A59-Y80 CarbonylContact C-O 3.54Å; A59-Y80 VanDerWaalsContact CA-O 3.27Å; A59-Y80 WeakPolarHBondContact CA-O 3.19Å; S60-Y80 PolarHBondContact N-O 2.98Å; S60-Y80 PolarHBondContact O-N 3.4Å; V62-Y80 HydrophobicContact CB-CD2 4.15Å; V62-Y80 HydrophobicContact CB-CE2 3.97Å; V62-Y80 HydrophobicContact CG2-CD2 3.59Å; V62-Y80 HydrophobicContact CG2-CE2 3.89Å; E78-Y80 HydrophobicContact CB-CE2 3.65Å; E78-Y80 WeakPolarHBondContact O-CD2 3.49Å; E78-Y80 PolarHBondContact OE2-OH 2.89Å; Y80-M98 HydrophobicContact CE2-SD 3.78Å; Y80-M98 WeakPolarHBondContact OH-CE 3.31Å; Y80-L192 HydrophobicContact CE1-CD1 4.19Å; Y80-L192 HydrophobicContact CE1-CD2 4.24Å
81	V	63.3	Low	64.1	Low	45 Å²	45	60.8 Å²	60.8	27%	0.273	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	119.5	171	-179.4	0	0	0	0	107.7	K57 I58 A59 Y116 I189	K57-V81 HydrophobicContact CB-CG1 3.91Å; K57-V81 HydrophobicContact CG-CG1 4.29Å; I58-V81 WeakPolarHBondContact O-CA 3.21Å; A59-V81 HydrophobicContact CB-CG2 4.12Å; V81-Y116 HydrophobicContact CG2-CE2 4.46Å; V81-I189 HydrophobicContact CG2-CD1 3.55Å; V81-I189 HydrophobicContact CG2-CG1 4.01Å
82	V	61.5	Low	64.8	Low	16 Å²	16	61.3 Å²	61.3	10%	0.097	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	145.4	177.9	-78.2	0	0	0	0	109.9	I58 A84 A90 I94	I58-V82 PolarHBondContact N-O 2.77Å; I58-V82 PolarHBondContact O-N 3.34Å; V82-A84 PolarHBondContact O-N 3.3Å; V82-A90 HydrophobicContact CG2-CB 3.69Å; V82-I94 HydrophobicContact CG1-CD1 4.16Å; V82-I94 HydrophobicContact CG1-CG1 3.76Å; V82-I94 HydrophobicContact CG2-CD1 3.69Å; V82-I94 HydrophobicContact CG2-CG1 3.98Å
83	D	59.2	Low	64.9	Low	84 Å²	84	59.9 Å²	59.9	45%	0.449	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	111.1	168.4	-74.7	-29.3	0	0	0	108.3	F55 K57	F55-D83 HydrophobicContact CB-CB 4.37Å; K57-D83 WeakPolarHBondContact CG-OD1 3.37Å
84	A	57.9	Low	64.8	Low	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.298	C	S	.	.			trans	-151.2	142.7	-178.6	0	0	0	0	0	111	D56 I58 V82 S86 E89 A90	D56-A84 PolarHBondContact O-N 2.93Å; I58-A84 HydrophobicContact CD1-CB 4.05Å; I58-A84 WeakPolarHBondContact CD1-O 3.38Å; I58-A84 HydrophobicContact CG1-CB 4.49Å; V82-A84 PolarHBondContact O-N 3.3Å; A84-S86 VanDerWaalsContact C-N 3.31Å; A84-S86 PolarHBondContact O-N 2.85Å; A84-E89 HydrophobicContact CB-CB 4.21Å; A84-E89 HydrophobicContact CB-CG 4.1Å; A84-A90 HydrophobicContact CB-CB 3.74Å
85	L	56.9	Low	64.6	Low	109 Å²	109	51.9 Å²	51.9	57%	0.571	29%	0.29	S	S	*	.	S	Bend	trans	-73.5	-25.1	179.6	-59.7	160.1	0	0	0	112.1	F55 E89	F55-L85 HydrophobicContact CD1-CD2 3.82Å; F55-L85 HydrophobicContact CD1-CG 4.07Å; F55-L85 HydrophobicContact CE1-CD1 4.32Å; F55-L85 HydrophobicContact CE1-CD2 3.79Å; F55-L85 HydrophobicContact CE1-CG 3.87Å; L85-E89 WeakPolarHBondContact CA-OE2 3.23Å; L85-E89 WeakPolarHBondContact CB-OE2 3.46Å; L85-E89 PolarHBondContact N-OE2 2.8Å
86	S	58.4	Low	64.1	Low	52 Å²	52	52.8 Å²	52.8	36%	0.364	29%	0.287	S	S	.	.	S	Bend	trans	-143.1	156.6	-177.5	71.9	0	0	0	0	112.9	I58 A84 T88 E89 A90	I58-S86 VanDerWaalsContact CD1-O 3.24Å; I58-S86 WeakPolarHBondContact CD1-O 3.34Å; A84-S86 VanDerWaalsContact C-N 3.31Å; A84-S86 PolarHBondContact O-N 2.85Å; S86-T88 PolarHBondContact O-N 2.88Å; S86-E89 PolarHBondContact O-N 3.23Å; S86-E89 VanDerWaalsContact O-N 3.15Å; S86-E89 WeakPolarHBondContact OG-CB 3.41Å; S86-E89 PolarHBondContact OG-N 2.89Å; S86-E89 VanDerWaalsContact OG-N 3.09Å; S86-A90 PolarHBondContact O-N 3.44Å
87	C	65.9	Low	63.7	Low	50 Å²	50	53.3 Å²	53.3	34%	0.338	29%	0.288	S	S	.	.	H	α-helix	trans	-59	-32.9	175.6	-64.9	0	0	0	0	112	A90 E91 A111	C87-A90 PolarHBondContact O-N 3.38Å; C87-E91 WeakPolarHBondContact O-CB 3.37Å; C87-E91 VanDerWaalsContact O-CG 3.28Å; C87-E91 WeakPolarHBondContact O-CG 3.25Å; C87-E91 PolarHBondContact O-N 2.86Å; C87-A111 HydrophobicContact CB-CB 3.86Å
88	T	69.3	Low	63.2	Low	93 Å²	93	49.3 Å²	49.3	57%	0.571	27%	0.266	S	S	*	.	H	α-helix	trans	-69.7	-38.9	176.3	-50.1	0	0	0	0	112.4	S86 E91 T92	S86-T88 PolarHBondContact O-N 2.88Å; T88-E91 PolarHBondContact O-N 2.92Å; T88-T92 WeakPolarHBondContact O-CB 3.09Å; T88-T92 PolarHBondContact O-N 3.44Å; T88-T92 PolarHBondContact O-OG1 3.01Å
89	E	68.7	Low	63	Low	80 Å²	80	51.7 Å²	51.7	37%	0.374	29%	0.285	S	S	.	.	H	α-helix	trans	-67.1	-41.6	172.7	-176.1	-179.4	-167.8	0	0	111.1	A84 L85 S86 E91 T92 S93	A84-E89 HydrophobicContact CB-CB 4.21Å; A84-E89 HydrophobicContact CB-CG 4.1Å; L85-E89 WeakPolarHBondContact CA-OE2 3.23Å; L85-E89 WeakPolarHBondContact CB-OE2 3.46Å; L85-E89 PolarHBondContact N-OE2 2.8Å; S86-E89 PolarHBondContact O-N 3.23Å; S86-E89 VanDerWaalsContact O-N 3.15Å; S86-E89 WeakPolarHBondContact OG-CB 3.41Å; S86-E89 PolarHBondContact OG-N 2.89Å; S86-E89 VanDerWaalsContact OG-N 3.09Å; E89-E91 PolarHBondContact O-N 3.43Å; E89-T92 PolarHBondContact O-N 2.7Å; E89-S93 WeakPolarHBondContact O-CB 3.49Å; E89-S93 PolarHBondContact O-N 2.94Å
90	A	65.3	Low	62.2	Low	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61	-43.5	173	0	0	0	0	0	111.7	I58 V82 A84 S86 C87 T92 I94	I58-A90 HydrophobicContact CB-CB 3.85Å; I58-A90 HydrophobicContact CD1-CB 4.08Å; I58-A90 HydrophobicContact CG2-CB 3.59Å; V82-A90 HydrophobicContact CG2-CB 3.69Å; A84-A90 HydrophobicContact CB-CB 3.74Å; S86-A90 PolarHBondContact O-N 3.44Å; C87-A90 PolarHBondContact O-N 3.38Å; A90-T92 VanDerWaalsContact C-N 3.34Å; A90-I94 VanDerWaalsContact O-CB 3.23Å; A90-I94 WeakPolarHBondContact O-CB 3.39Å; A90-I94 WeakPolarHBondContact O-CD1 3.35Å; A90-I94 WeakPolarHBondContact O-CG1 3.47Å; A90-I94 PolarHBondContact O-N 2.98Å
91	E	68	Low	61.6	Low	71 Å²	71	53.6 Å²	53.6	33%	0.332	30%	0.298	S	S	.	.	H	α-helix	trans	-60.4	-43.8	174.9	-80.9	174	179.9	0	0	111.6	C87 T88 E89 I95 V108 A111	C87-E91 WeakPolarHBondContact O-CB 3.37Å; C87-E91 VanDerWaalsContact O-CG 3.28Å; C87-E91 WeakPolarHBondContact O-CG 3.25Å; C87-E91 PolarHBondContact O-N 2.86Å; T88-E91 PolarHBondContact O-N 2.92Å; E89-E91 PolarHBondContact O-N 3.43Å; E91-I95 WeakPolarHBondContact O-CB 3.47Å; E91-I95 WeakPolarHBondContact O-CD1 3.47Å; E91-I95 WeakPolarHBondContact O-CG1 3.43Å; E91-I95 PolarHBondContact O-N 3.19Å; E91-V108 HydrophobicContact CB-CG2 4.29Å; E91-V108 HydrophobicContact CG-CB 3.83Å; E91-V108 HydrophobicContact CG-CG1 3.72Å; E91-V108 HydrophobicContact CG-CG2 4.05Å; E91-A111 HydrophobicContact CG-CB 4.38Å
92	T	65.5	Low	61.4	Low	65 Å²	65	52.4 Å²	52.4	40%	0.399	29%	0.29	S	S	.	.	H	α-helix	trans	-69.8	-48.4	-178.1	-53.3	0	0	0	0	110.9	T88 E89 A90 I94 I95 E96	T88-T92 WeakPolarHBondContact O-CB 3.09Å; T88-T92 PolarHBondContact O-N 3.44Å; T88-T92 PolarHBondContact O-OG1 3.01Å; E89-T92 PolarHBondContact O-N 2.7Å; A90-T92 VanDerWaalsContact C-N 3.34Å; T92-I94 VanDerWaalsContact C-N 3.31Å; T92-I94 PolarHBondContact O-N 2.94Å; T92-I95 PolarHBondContact O-N 2.8Å; T92-E96 HydrophobicContact CG2-CG 4.36Å; T92-E96 WeakPolarHBondContact O-CB 3.45Å; T92-E96 VanDerWaalsContact O-CG 3.3Å; T92-E96 WeakPolarHBondContact O-CG 3.41Å; T92-E96 PolarHBondContact O-N 2.83Å
93	S	62.6	Low	60.9	Low	22 Å²	22	55.9 Å²	55.9	15%	0.154	32%	0.315	C	S	.	.	H	α-helix	trans	-54.8	-48.7	176	-166.3	0	0	0	0	110.9	E89 E96 E97 L239	E89-S93 WeakPolarHBondContact O-CB 3.49Å; E89-S93 PolarHBondContact O-N 2.94Å; S93-E96 PolarHBondContact O-N 2.92Å; S93-E97 VanDerWaalsContact O-CB 3.28Å; S93-E97 WeakPolarHBondContact O-CB 3.17Å; S93-E97 WeakPolarHBondContact O-CG 3.33Å; S93-E97 PolarHBondContact O-N 3.15Å; S93-E97 PolarHBondContact OG-OE1 2.88Å; S93-L239 WeakPolarHBondContact OG-CD2 3.47Å
94	I	64.8	Low	60.9	Low	1 Å²	1	54.2 Å²	54.2	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-67.9	-42.9	-179.6	-73.2	174.7	0	0	0	112.1	V62 V82 A90 T92 E96 M98 V108	V62-I94 HydrophobicContact CB-CG2 4.41Å; V62-I94 HydrophobicContact CG1-CG2 4.37Å; V62-I94 HydrophobicContact CG2-CD1 4.49Å; V62-I94 HydrophobicContact CG2-CG2 3.2Å; V82-I94 HydrophobicContact CG1-CD1 4.16Å; V82-I94 HydrophobicContact CG1-CG1 3.76Å; V82-I94 HydrophobicContact CG2-CD1 3.69Å; V82-I94 HydrophobicContact CG2-CG1 3.98Å; A90-I94 VanDerWaalsContact O-CB 3.23Å; A90-I94 WeakPolarHBondContact O-CB 3.39Å; A90-I94 WeakPolarHBondContact O-CD1 3.35Å; A90-I94 WeakPolarHBondContact O-CG1 3.47Å; A90-I94 PolarHBondContact O-N 2.98Å; T92-I94 VanDerWaalsContact C-N 3.31Å; T92-I94 PolarHBondContact O-N 2.94Å; I94-E96 VanDerWaalsContact C-N 3.32Å; I94-E96 PolarHBondContact O-N 3.1Å; I94-M98 HydrophobicContact CG2-CG 4.1Å; I94-M98 WeakPolarHBondContact O-CB 3.38Å; I94-M98 WeakPolarHBondContact O-CG 3.49Å; I94-M98 PolarHBondContact O-N 2.79Å; I94-V108 HydrophobicContact CG2-CG2 4.26Å
95	I	65.8	Low	60.9	Low	75 Å²	75	61.6 Å²	61.6	39%	0.385	36%	0.357	S	S	.	.	H	α-helix	trans	-64.2	-41.6	177.8	-71.6	166.8	0	0	0	110	E91 T92 S99 V108	E91-I95 WeakPolarHBondContact O-CB 3.47Å; E91-I95 WeakPolarHBondContact O-CD1 3.47Å; E91-I95 WeakPolarHBondContact O-CG1 3.43Å; E91-I95 PolarHBondContact O-N 3.19Å; T92-I95 PolarHBondContact O-N 2.8Å; I95-S99 WeakPolarHBondContact O-CA 3.36Å; I95-S99 WeakPolarHBondContact O-CB 3.48Å; I95-S99 PolarHBondContact O-N 2.81Å; I95-V108 HydrophobicContact CD1-CG2 4.07Å; I95-V108 HydrophobicContact CG1-CG2 3.86Å
96	E	62.5	Low	61.3	Low	113 Å²	113	58.3 Å²	58.3	53%	0.528	34%	0.343	S	S	.	.	H	α-helix	trans	-63.9	-49.8	177.3	-74.3	-179.1	172.3	0	0	111.5	T92 S93 I94 M98 S99	T92-E96 HydrophobicContact CG2-CG 4.36Å; T92-E96 WeakPolarHBondContact O-CB 3.45Å; T92-E96 VanDerWaalsContact O-CG 3.3Å; T92-E96 WeakPolarHBondContact O-CG 3.41Å; T92-E96 PolarHBondContact O-N 2.83Å; S93-E96 PolarHBondContact O-N 2.92Å; I94-E96 VanDerWaalsContact C-N 3.32Å; I94-E96 PolarHBondContact O-N 3.1Å; E96-M98 PolarHBondContact O-N 3.45Å; E96-S99 PolarHBondContact O-N 2.83Å; E96-S99 PolarHBondContact O-OG 3.3Å
97	E	58.8	Low	61.7	Low	42 Å²	42	58.5 Å²	58.5	20%	0.196	35%	0.347	C	S	.	.	H	α-helix	trans	-57.8	-49.7	175.3	-76.2	172.8	-127.2	0	0	111.4	S93 S99 Y101 L239	S93-E97 VanDerWaalsContact O-CB 3.28Å; S93-E97 WeakPolarHBondContact O-CB 3.17Å; S93-E97 WeakPolarHBondContact O-CG 3.33Å; S93-E97 PolarHBondContact O-N 3.15Å; S93-E97 PolarHBondContact OG-OE1 2.88Å; E97-S99 VanDerWaalsContact C-N 3.35Å; E97-S99 PolarHBondContact O-N 3.34Å; E97-Y101 WeakPolarHBondContact O-CD2 3.33Å; E97-Y101 WeakPolarHBondContact O-CE2 3.39Å; E97-L239 HydrophobicContact CG-CD1 3.55Å; E97-L239 HydrophobicContact CG-CD2 3.87Å; E97-L239 HydrophobicContact CG-CG 4.14Å; E97-L239 WeakPolarHBondContact OE1-CD1 3.35Å; E97-L239 WeakPolarHBondContact OE1-CD2 3.3Å; E97-L239 WeakPolarHBondContact OE2-CD1 3.46Å
98	M	60.5	Low	61.8	Low	13 Å²	13	57.2 Å²	57.2	6%	0.064	34%	0.338	C	S	.	.	H	α-helix	trans	-74.8	-22.9	-175.9	-65.7	-139.7	73.7	0	0	113.4	V62 Y64 Y80 I94 E96 C100 Y101 I102	V62-M98 HydrophobicContact CB-SD 4.08Å; V62-M98 HydrophobicContact CG1-SD 3.76Å; V62-M98 HydrophobicContact CG2-SD 4.23Å; Y64-M98 HydrophobicContact CD1-CE 4Å; Y64-M98 HydrophobicContact CD1-SD 4.21Å; Y64-M98 HydrophobicContact CE1-CE 3.56Å; Y64-M98 HydrophobicContact CE1-SD 4.12Å; Y64-M98 HydrophobicContact CE2-CE 4.35Å; Y80-M98 HydrophobicContact CE2-SD 3.78Å; Y80-M98 WeakPolarHBondContact OH-CE 3.31Å; I94-M98 HydrophobicContact CG2-CG 4.1Å; I94-M98 WeakPolarHBondContact O-CB 3.38Å; I94-M98 WeakPolarHBondContact O-CG 3.49Å; I94-M98 PolarHBondContact O-N 2.79Å; E96-M98 PolarHBondContact O-N 3.45Å; M98-C100 PolarHBondContact O-N 2.89Å; M98-C100 VanDerWaalsContact O-N 3.12Å; M98-Y101 PolarHBondContact O-N 3.47Å; M98-I102 HydrophobicContact CB-CD1 3.51Å; M98-I102 HydrophobicContact CB-CG1 4.22Å; M98-I102 HydrophobicContact CE-CD1 3.87Å; M98-I102 HydrophobicContact CE-CG1 4.08Å; M98-I102 HydrophobicContact CG-CD1 4.41Å; M98-I102 VanDerWaalsContact O-CG1 3.29Å; M98-I102 WeakPolarHBondContact O-CG1 3.23Å; M98-I102 PolarHBondContact O-N 2.95Å; M98-I102 HydrophobicContact SD-CD1 4.09Å
99	S	58.6	Low	62	Low	67 Å²	67	56.8 Å²	56.8	47%	0.469	34%	0.335	S	S	.	.	H	α-helix	trans	-60.6	-24	178.5	70.9	0	0	0	0	113.3	I95 E96 E97 Y101	I95-S99 WeakPolarHBondContact O-CA 3.36Å; I95-S99 WeakPolarHBondContact O-CB 3.48Å; I95-S99 PolarHBondContact O-N 2.81Å; E96-S99 PolarHBondContact O-N 2.83Å; E96-S99 PolarHBondContact O-OG 3.3Å; E97-S99 VanDerWaalsContact C-N 3.35Å; E97-S99 PolarHBondContact O-N 3.34Å; S99-Y101 VanDerWaalsContact C-N 3.3Å
100	C	49.5	Very low	62.1	Low	66 Å²	66	55.9 Å²	55.9	45%	0.446	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-20.7	175.4	-57.5	0	0	0	0	112.7	M98	M98-C100 PolarHBondContact O-N 2.89Å; M98-C100 VanDerWaalsContact O-N 3.12Å
101	Y	50.7	Low	62.3	Low	61 Å²	61	57 Å²	57	24%	0.239	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-13.8	-171.4	-51.5	-61.9	0	0	0	113.7	E97 M98 S99 K196 V200 M246	E97-Y101 WeakPolarHBondContact O-CD2 3.33Å; E97-Y101 WeakPolarHBondContact O-CE2 3.39Å; M98-Y101 PolarHBondContact O-N 3.47Å; S99-Y101 VanDerWaalsContact C-N 3.3Å; Y101-K196 HydrophobicContact CE1-CG 4.4Å; Y101-V200 HydrophobicContact CE1-CG2 4.38Å; Y101-M246 HydrophobicContact CE1-CE 4.02Å
102	I	60.1	Low	62.3	Low	21 Å²	21	61 Å²	61	11%	0.108	36%	0.363	C	S	.	.			trans	-116.5	126.3	-176.9	-48.3	164.5	0	0	0	109.9	Y64 M98	Y64-I102 VanDerWaalsContact CB-CD1 3.44Å; Y64-I102 HydrophobicContact CD1-CD1 4.04Å; Y64-I102 HydrophobicContact CD2-CB 4.47Å; Y64-I102 HydrophobicContact CD2-CD1 3.9Å; Y64-I102 HydrophobicContact CD2-CG1 3.65Å; Y64-I102 HydrophobicContact CD2-CG2 4.03Å; Y64-I102 HydrophobicContact CE2-CG1 4.22Å; Y64-I102 HydrophobicContact CG-CD1 3.54Å; Y64-I102 HydrophobicContact CG-CG1 3.87Å; Y64-I102 HydrophobicContact CG-CG2 4.33Å; M98-I102 HydrophobicContact CB-CD1 3.51Å; M98-I102 HydrophobicContact CB-CG1 4.22Å; M98-I102 HydrophobicContact CE-CD1 3.87Å; M98-I102 HydrophobicContact CE-CG1 4.08Å; M98-I102 HydrophobicContact CG-CD1 4.41Å; M98-I102 VanDerWaalsContact O-CG1 3.29Å; M98-I102 WeakPolarHBondContact O-CG1 3.23Å; M98-I102 PolarHBondContact O-N 2.95Å; M98-I102 HydrophobicContact SD-CD1 4.09Å
103	S	50.6	Low	62.4	Low	89 Å²	89	63.4 Å²	63.4	62%	0.622	37%	0.368	S	S	*	.			trans	-99.7	113.8	161.9	52.7	0	0	0	0	109.4
104	G	59.5	Low	62.6	Low	48 Å²	48	63.4 Å²	63.4	50%	0.495	37%	0.368	S	S	.	.	S	Bend	trans	132.4	-177	-180	0	0	0	0	0	113.2	S106	G104-S106 PolarHBondContact O-N 2.72Å
105	D	58	Low	62.8	Low	156 Å²	156	70.1 Å²	70.1	83%	0.834	40%	0.404	S	S	*	.			trans	-69.3	121.2	174.2	-75.4	-22.3	0	0	0	109.5
106	S	64.7	Low	63	Low	40 Å²	40	67.9 Å²	67.9	28%	0.28	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	146.2	171.2	63.2	0	0	0	0	109.9	G104	G104-S106 PolarHBondContact O-N 2.72Å
107	A	66.6	Low	63.1	Low	55 Å²	55	64.7 Å²	64.7	46%	0.455	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	132.2	177.4	0	0	0	0	0	110.6	G63 T109	G63-A107 PolarHBondContact N-O 3.43Å; G63-A107 PolarHBondContact O-N 2.99Å; A107-T109 PolarHBondContact O-N 2.74Å
108	V	68.4	Low	63.7	Low	23 Å²	23	67.6 Å²	67.6	14%	0.139	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	111.9	166.9	-176.5	0	0	0	0	107.3	L61 E91 I94 I95	L61-V108 CarbonylContact O-C 3.59Å; E91-V108 HydrophobicContact CB-CG2 4.29Å; E91-V108 HydrophobicContact CG-CB 3.83Å; E91-V108 HydrophobicContact CG-CG1 3.72Å; E91-V108 HydrophobicContact CG-CG2 4.05Å; I94-V108 HydrophobicContact CG2-CG2 4.26Å; I95-V108 HydrophobicContact CD1-CG2 4.07Å; I95-V108 HydrophobicContact CG1-CG2 3.86Å
109	T	72.8	Confident	64.3	Low	84 Å²	84	69 Å²	69	52%	0.515	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-28	-174.3	6.9	0	0	0	0	112.1	L61 G63 A107	L61-T109 PolarHBondContact O-N 3.26Å; L61-T109 PolarHBondContact O-OG1 2.88Å; G63-T109 PolarHBondContact N-OG1 2.8Å; A107-T109 PolarHBondContact O-N 2.74Å
110	S	72	Confident	65.3	Low	61 Å²	61	66.4 Å²	66.4	43%	0.427	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	138.7	171.3	68.6	0	0	0	0	111.1	S60 L61	S60-S110 CarbonylContact C-O 3.57Å; S60-S110 VanDerWaalsContact CA-O 3.27Å; S60-S110 WeakPolarHBondContact CA-O 3.31Å; L61-S110 WeakPolarHBondContact CB-OG 3.18Å; L61-S110 PolarHBondContact N-O 2.81Å; L61-S110 PolarHBondContact O-N 3.43Å
111	A	68.7	Low	66.4	Low	25 Å²	25	68.3 Å²	68.3	21%	0.207	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.1	168.1	0	0	0	0	0	109.5	I58 S60 C87 E91	I58-A111 HydrophobicContact CG2-CB 4.22Å; S60-A111 WeakPolarHBondContact OG-CB 3.28Å; C87-A111 HydrophobicContact CB-CB 3.86Å; E91-A111 HydrophobicContact CG-CB 4.38Å
112	K	68.2	Low	67.4	Low	153 Å²	153	66.1 Å²	66.1	67%	0.665	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.1	123.9	-179	-172.1	176.7	-179.6	177.2	0	111	A59 T114	A59-K112 PolarHBondContact N-O 2.87Å; A59-K112 PolarHBondContact O-N 2.83Å; K112-T114 PolarHBondContact O-N 3.4Å
113	K	68	Low	67.9	Low	116 Å²	116	71.8 Å²	71.8	50%	0.504	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	125.6	172.2	-161.9	175	-173.5	175.5	0	110.6	D56	D56-K113 HydrophobicContact CB-CD 4.41Å; D56-K113 HydrophobicContact CB-CG 4.26Å; D56-K113 WeakPolarHBondContact OD1-CE 3.49Å; D56-K113 IonicContact OD1-NZ 3.1Å; D56-K113 PolarHBondContact OD1-NZ 3.25Å; D56-K113 WeakPolarHBondContact OD2-CE 3.11Å; D56-K113 IonicContact OD2-NZ 2.73Å; D56-K113 PolarHBondContact OD2-NZ 2.96Å
114	T	66.7	Low	68.8	Low	22 Å²	22	71.2 Å²	71.2	14%	0.135	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130.3	179	52.8	0	0	0	0	110.8	K57 A59 K112 Y116	K57-T114 WeakPolarHBondContact O-CA 3.29Å; K57-T114 PolarHBondContact O-N 3.21Å; K57-T114 PolarHBondContact O-OG1 3.06Å; A59-T114 HydrophobicContact CB-CG2 3.53Å; K112-T114 PolarHBondContact O-N 3.4Å; T114-Y116 VanDerWaalsContact CB-CE2 3.43Å; T114-Y116 HydrophobicContact CG2-CE2 3.91Å; T114-Y116 PolarHBondContact O-N 2.73Å; T114-Y116 VanDerWaalsContact OG1-CD2 3.27Å; T114-Y116 WeakPolarHBondContact OG1-CD2 3.11Å; T114-Y116 WeakPolarHBondContact OG1-CE2 3.5Å
115	N	67.6	Low	68.7	Low	143 Å²	143	76.2 Å²	76.2	77%	0.765	42%	0.419	S	S	*	.			trans	-94.5	70.4	179.9	-163.1	5	0	0	0	109.8
116	Y	70.2	Confident	69.5	Low	28 Å²	28	71.8 Å²	71.8	11%	0.11	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	119.4	170.8	-60	-60.4	0	0	0	108.8	K57 V81 T114 K132 T153 M155	K57-Y116 HydrophobicContact CB-CD2 4.11Å; K57-Y116 HydrophobicContact CD-CD2 4.2Å; V81-Y116 HydrophobicContact CG2-CE2 4.46Å; T114-Y116 VanDerWaalsContact CB-CE2 3.43Å; T114-Y116 HydrophobicContact CG2-CE2 3.91Å; T114-Y116 PolarHBondContact O-N 2.73Å; T114-Y116 VanDerWaalsContact OG1-CD2 3.27Å; T114-Y116 WeakPolarHBondContact OG1-CD2 3.11Å; T114-Y116 WeakPolarHBondContact OG1-CE2 3.5Å; Y116-K132 HydrophobicContact CE1-CD 4.02Å; Y116-K132 HydrophobicContact CE1-CG 4.08Å; Y116-T153 CarbonylContact C-O 3.51Å; Y116-T153 WeakPolarHBondContact CA-O 3.39Å; Y116-T153 HydrophobicContact CD1-CG2 3.79Å; Y116-T153 HydrophobicContact CE1-CG2 4Å; Y116-M155 HydrophobicContact CD1-CG 3.64Å; Y116-M155 HydrophobicContact CD1-SD 4.13Å; Y116-M155 HydrophobicContact CD2-CG 4.1Å; Y116-M155 HydrophobicContact CE1-CG 3.77Å; Y116-M155 HydrophobicContact CE1-SD 3.65Å; Y116-M155 HydrophobicContact CE2-CG 4.21Å; Y116-M155 HydrophobicContact CG-CG 3.83Å
117	G	64.7	Low	70	Confident	45 Å²	45	70 Å²	70	46%	0.464	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	-55.9	-178.1	0	0	0	0	0	112.5	T153	G117-T153 PolarHBondContact N-O 2.98Å
118	E	70.9	Confident	70	Confident	103 Å²	103	71.9 Å²	71.9	48%	0.481	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	156.6	177.5	-158.2	166.8	-164.6	0	0	109.6	F120 Y154 M155	E118-F120 HydrophobicContact CB-CE1 4.09Å; E118-F120 HydrophobicContact CG-CE1 4.39Å; E118-Y154 HydrophobicContact CB-CD1 3.63Å; E118-Y154 HydrophobicContact CB-CE1 3.67Å; E118-Y154 WeakPolarHBondContact O-CA 3.47Å; E118-M155 PolarHBondContact O-N 3.47Å; E118-M155 VanDerWaalsContact O-N 3.11Å
119	I	73.2	Confident	70.2	Confident	42 Å²	42	74.3 Å²	74.3	22%	0.215	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	126.3	171.3	-71	160.9	0	0	0	107.4	K57 F121 W130 M155	K57-I119 HydrophobicContact CD-CD1 4.08Å; K57-I119 VanDerWaalsContact CE-CD1 3.45Å; I119-F121 HydrophobicContact CB-CD2 4.44Å; I119-F121 HydrophobicContact CB-CE2 3.94Å; I119-F121 HydrophobicContact CB-CZ 4.32Å; I119-F121 HydrophobicContact CD1-CZ 4.47Å; I119-F121 HydrophobicContact CG2-CD1 4.3Å; I119-F121 HydrophobicContact CG2-CD2 3.78Å; I119-F121 HydrophobicContact CG2-CE1 4.06Å; I119-F121 HydrophobicContact CG2-CE2 3.49Å; I119-F121 VanDerWaalsContact CG2-CE2 3.49Å; I119-F121 HydrophobicContact CG2-CG 4.18Å; I119-F121 HydrophobicContact CG2-CZ 3.64Å; I119-W130 HydrophobicContact CG2-CH2 3.47Å; I119-W130 VanDerWaalsContact CG2-CH2 3.47Å; I119-W130 HydrophobicContact CG2-CZ3 3.33Å; I119-M155 CarbonylContact C-O 3.38Å; I119-M155 WeakPolarHBondContact CA-O 3.25Å; I119-M155 HydrophobicContact CB-CB 4.42Å; I119-M155 HydrophobicContact CG1-CB 3.76Å; I119-M155 HydrophobicContact CG2-CB 4.4Å
120	F	80.3	Confident	70.6	Confident	13 Å²	13	71.1 Å²	71.1	6%	0.057	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	102.6	171.3	-52.3	-23.5	0	0	0	107.7	E118 Y154 M155 V156 Q157 V168 V171 M172	E118-F120 HydrophobicContact CB-CE1 4.09Å; E118-F120 HydrophobicContact CG-CE1 4.39Å; F120-Y154 AromaticContact CE1-CD1 3.63Å; F120-Y154 HydrophobicContact CE1-CD1 3.63Å; F120-Y154 HydrophobicContact CE1-CE1 4.13Å; F120-Y154 HydrophobicContact CE1-CG 4.23Å; F120-Y154 HydrophobicContact CE2-CD1 4.23Å; F120-Y154 AromaticContact CE2-CG 3.99Å; F120-Y154 HydrophobicContact CE2-CG 3.99Å; F120-Y154 AromaticContact CZ-CD1 3.39Å; F120-Y154 HydrophobicContact CZ-CD1 3.39Å; F120-Y154 HydrophobicContact CZ-CD2 4.25Å; F120-Y154 AromaticContact CZ-CE1 3.91Å; F120-Y154 HydrophobicContact CZ-CE1 3.91Å; F120-Y154 AromaticContact CZ-CG 3.58Å; F120-Y154 HydrophobicContact CZ-CG 3.58Å; F120-M155 PolarHBondContact N-O 2.95Å; F120-V156 HydrophobicContact CB-CG1 4.2Å; F120-V156 HydrophobicContact CB-CG2 4.41Å; F120-V156 HydrophobicContact CD2-CG1 4.45Å; F120-V156 HydrophobicContact CD2-CG2 3.71Å; F120-V156 HydrophobicContact CE2-CG2 4.43Å; F120-V156 HydrophobicContact CG-CG2 4.41Å; F120-V156 CarbonylContact O-C 3.59Å; F120-V156 WeakPolarHBondContact O-CA 3.49Å; F120-Q157 PolarHBondContact O-N 3.45Å; F120-V168 HydrophobicContact CD2-CG2 4.18Å; F120-V168 HydrophobicContact CE2-CB 4.45Å; F120-V168 HydrophobicContact CE2-CG1 4.43Å; F120-V168 HydrophobicContact CE2-CG2 4.13Å; F120-V171 HydrophobicContact CD1-CG1 4.05Å; F120-V171 HydrophobicContact CD1-CG2 4.35Å; F120-V171 HydrophobicContact CD2-CB 4.46Å; F120-V171 HydrophobicContact CD2-CG2 4.43Å; F120-V171 HydrophobicContact CE1-CB 4.34Å; F120-V171 HydrophobicContact CE1-CG1 3.62Å; F120-V171 HydrophobicContact CE2-CB 4.29Å; F120-V171 HydrophobicContact CE2-CG1 4.36Å; F120-V171 HydrophobicContact CG-CG2 4.26Å; F120-V171 HydrophobicContact CZ-CB 4.23Å; F120-V171 HydrophobicContact CZ-CG1 3.8Å; F120-M172 HydrophobicContact CE2-CG 4.39Å; F120-M172 HydrophobicContact CZ-CG 4.36Å; F120-M172 HydrophobicContact CZ-SD 4.1Å
121	F	72.5	Confident	71.2	Confident	107 Å²	107	68.7 Å²	68.7	47%	0.469	35%	0.354	S	S	.	.			trans	-77.3	156	172.1	-68.2	-84.8	0	0	0	110.3	E45 I119 W130	E45-F121 VanDerWaalsContact OE1-CB 3.31Å; E45-F121 WeakPolarHBondContact OE1-CB 3.33Å; I119-F121 HydrophobicContact CB-CD2 4.44Å; I119-F121 HydrophobicContact CB-CE2 3.94Å; I119-F121 HydrophobicContact CB-CZ 4.32Å; I119-F121 HydrophobicContact CD1-CZ 4.47Å; I119-F121 HydrophobicContact CG2-CD1 4.3Å; I119-F121 HydrophobicContact CG2-CD2 3.78Å; I119-F121 HydrophobicContact CG2-CE1 4.06Å; I119-F121 HydrophobicContact CG2-CE2 3.49Å; I119-F121 VanDerWaalsContact CG2-CE2 3.49Å; I119-F121 HydrophobicContact CG2-CG 4.18Å; I119-F121 HydrophobicContact CG2-CZ 3.64Å; F121-W130 AromaticContact CD1-CH2 3.63Å; F121-W130 HydrophobicContact CD1-CH2 3.63Å; F121-W130 HydrophobicContact CD1-CZ2 4.23Å; F121-W130 AromaticContact CE1-CH2 3.46Å; F121-W130 HydrophobicContact CE1-CH2 3.46Å; F121-W130 VanDerWaalsContact CE1-CH2 3.46Å; F121-W130 AromaticContact CE1-CZ2 3.9Å; F121-W130 HydrophobicContact CE1-CZ2 3.9Å; F121-W130 HydrophobicContact CG-CH2 4.49Å; F121-W130 HydrophobicContact CZ-CH2 4.18Å
122	S	72.3	Confident	72.1	Confident	14 Å²	14	71.7 Å²	71.7	10%	0.098	36%	0.362	C	S	.	.			trans	-108.7	139.4	172.6	-177.9	0	0	0	0	110.8	L124 D127 Q157 Y167	S122-L124 PolarHBondContact O-N 2.92Å; S122-L124 PolarHBondContact OG-N 2.86Å; S122-L124 VanDerWaalsContact OG-N 3.17Å; S122-D127 WeakPolarHBondContact CB-OD2 3.49Å; S122-D127 PolarHBondContact OG-OD2 2.82Å; S122-Q157 VanDerWaalsContact N-OE1 3.16Å; S122-Y167 WeakPolarHBondContact OG-CE2 3.37Å; S122-Y167 PolarHBondContact OG-OH 3.14Å
123	D	69	Low	73.2	Confident	141 Å²	141	64.4 Å²	64.4	75%	0.754	33%	0.33	S	S	*	.	S	Bend	trans	-76.1	-5.5	173.2	-65.4	-31.1	0	0	0	112.9
124	L	70.6	Confident	74.3	Confident	76 Å²	76	62.8 Å²	62.8	40%	0.398	32%	0.323	S	S	.	.			trans	-96	121	-175.5	-61.1	177.5	0	0	0	111.1	S122 D126 D127 Y167	S122-L124 PolarHBondContact O-N 2.92Å; S122-L124 PolarHBondContact OG-N 2.86Å; S122-L124 VanDerWaalsContact OG-N 3.17Å; L124-D126 PolarHBondContact O-N 3.38Å; L124-D127 WeakPolarHBondContact O-CB 3.4Å; L124-D127 PolarHBondContact O-N 3.43Å; L124-Y167 VanDerWaalsContact CD1-OH 3.26Å; L124-Y167 WeakPolarHBondContact CD1-OH 3.15Å
125	D	57	Low	75.3	Confident	153 Å²	153	61.8 Å²	61.8	82%	0.818	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-19	-176.9	-65	-43.2	0	0	0	114.3
126	D	75.5	Confident	76.3	Confident	64 Å²	64	56.7 Å²	56.7	34%	0.342	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	3.1	179.9	76.9	-33.8	0	0	0	114.5	L124 D128 K159 R163	L124-D126 PolarHBondContact O-N 3.38Å; D126-D128 PolarHBondContact O-N 3.35Å; D126-K159 HydrophobicContact CB-CD 4.31Å; D126-K159 WeakPolarHBondContact O-CB 3.49Å; D126-K159 WeakPolarHBondContact O-CG 3.36Å; D126-K159 WeakPolarHBondContact OD2-CD 3.44Å; D126-K159 IonicContact OD2-NZ 2.74Å; D126-K159 PolarHBondContact OD2-NZ 3.45Å; D126-R163 IonicContact OD1-CZ 3.01Å; D126-R163 IonicContact OD1-NH1 3.88Å; D126-R163 PolarHBondContact OD1-NH1 3.38Å; D126-R163 IonicContact OD1-NH2 3.63Å; D126-R163 IonicContact OD2-NH1 3.6Å; D126-R163 PolarHBondContact OD2-NH1 2.97Å
127	D	75.2	Confident	77.1	Confident	3 Å²	3	56.5 Å²	56.5	2%	0.016	29%	0.288	C	S	.	.			trans	-90.3	75.5	176.5	-72.4	-24.9	0	0	0	112	S122 L124 Q157 K159 R163 Y167	S122-D127 WeakPolarHBondContact CB-OD2 3.49Å; S122-D127 PolarHBondContact OG-OD2 2.82Å; L124-D127 WeakPolarHBondContact O-CB 3.4Å; L124-D127 PolarHBondContact O-N 3.43Å; D127-Q157 HydrophobicContact CB-CG 4.41Å; D127-Q157 WeakPolarHBondContact O-CG 3.3Å; D127-Q157 PolarHBondContact O-NE2 2.85Å; D127-K159 WeakPolarHBondContact OD1-CB 3.38Å; D127-K159 PolarHBondContact OD1-N 3.09Å; D127-R163 WeakPolarHBondContact OD1-CD 3.34Å; D127-R163 IonicContact OD1-CZ 2.78Å; D127-R163 IonicContact OD1-NE 3.81Å; D127-R163 IonicContact OD1-NH1 3.5Å; D127-R163 PolarHBondContact OD1-NH1 3.47Å; D127-R163 WeakPolarHBondContact OD2-CD 3.34Å; D127-R163 IonicContact OD2-NE 2.89Å; D127-R163 IonicContact OD2-NH1 2.7Å; D127-Y167 VanDerWaalsContact OD2-CE2 3.23Å; D127-Y167 WeakPolarHBondContact OD2-CE2 3.36Å; D127-Y167 PolarHBondContact OD2-OH 2.84Å
128	D	65.3	Low	77.9	Confident	93 Å²	93	56.3 Å²	56.3	50%	0.497	28%	0.276	S	S	.	.			trans	-92.3	2.5	-171.4	63.2	-19.4	0	0	0	115.1	D126	D126-D128 PolarHBondContact O-N 3.35Å
129	K	73.3	Confident	78.2	Confident	74 Å²	74	54.3 Å²	54.3	32%	0.322	27%	0.271	S	S	.	.			trans	-120.1	151	-176.6	-63.1	167.1	169.9	-134.8	0	112.3	Y131 Q157 A158 E186	K129-Y131 HydrophobicContact CB-CE2 3.98Å; K129-Q157 WeakPolarHBondContact O-CA 3.31Å; K129-A158 CarbonylContact C-O 3.57Å; K129-A158 VanDerWaalsContact CB-O 3.31Å; K129-A158 WeakPolarHBondContact CB-O 3.07Å; K129-A158 PolarHBondContact N-O 3.2Å; K129-A158 PolarHBondContact O-N 3.32Å; K129-E186 WeakPolarHBondContact CD-OE1 3.29Å; K129-E186 WeakPolarHBondContact CE-OE1 3.42Å; K129-E186 IonicContact NZ-OE1 2.63Å; K129-E186 PolarHBondContact NZ-OE1 3.13Å; K129-E186 IonicContact NZ-OE2 3.22Å
130	W	80.4	Confident	78.3	Confident	18 Å²	18	57.9 Å²	57.9	7%	0.068	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	125.1	-179.9	-78.7	102.3	0	0	0	111.7	I119 F121 M155 Q157 T187 I189 D191	I119-W130 HydrophobicContact CG2-CH2 3.47Å; I119-W130 VanDerWaalsContact CG2-CH2 3.47Å; I119-W130 HydrophobicContact CG2-CZ3 3.33Å; F121-W130 AromaticContact CD1-CH2 3.63Å; F121-W130 HydrophobicContact CD1-CH2 3.63Å; F121-W130 HydrophobicContact CD1-CZ2 4.23Å; F121-W130 AromaticContact CE1-CH2 3.46Å; F121-W130 HydrophobicContact CE1-CH2 3.46Å; F121-W130 VanDerWaalsContact CE1-CH2 3.46Å; F121-W130 AromaticContact CE1-CZ2 3.9Å; F121-W130 HydrophobicContact CE1-CZ2 3.9Å; F121-W130 HydrophobicContact CG-CH2 4.49Å; F121-W130 HydrophobicContact CZ-CH2 4.18Å; W130-M155 HydrophobicContact CB-CE 3.63Å; W130-M155 HydrophobicContact CD2-CE 4.2Å; W130-M155 HydrophobicContact CE3-CB 4.3Å; W130-M155 HydrophobicContact CE3-CE 3.78Å; W130-M155 HydrophobicContact CG-CE 4.21Å; W130-M155 HydrophobicContact CZ3-CB 4.41Å; W130-Q157 HydrophobicContact CD2-CB 4.49Å; W130-Q157 HydrophobicContact CE3-CB 4.08Å; W130-Q157 HydrophobicContact CH2-CB 3.84Å; W130-Q157 HydrophobicContact CH2-CG 4.33Å; W130-Q157 HydrophobicContact CZ2-CB 4.28Å; W130-Q157 HydrophobicContact CZ2-CG 4.29Å; W130-Q157 HydrophobicContact CZ3-CB 3.7Å; W130-T187 WeakPolarHBondContact CB-OG1 3.15Å; W130-T187 WeakPolarHBondContact O-CA 3.46Å; W130-T187 WeakPolarHBondContact O-CB 3.39Å; W130-T187 PolarHBondContact O-N 3.48Å; W130-T187 PolarHBondContact O-OG1 3.45Å; W130-I189 HydrophobicContact CB-CB 4.12Å; W130-I189 HydrophobicContact CG-CB 4.21Å; W130-I189 HydrophobicContact CG-CG2 4.2Å; W130-D191 PolarHBondContact NE1-OD1 2.91Å; W130-D191 PolarHBondContact NE1-OD2 2.48Å; W130-D191 VanDerWaalsContact NE1-OD2 3.17Å
131	Y	86.5	Confident	77.8	Confident	10 Å²	10	60.4 Å²	60.4	4%	0.039	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	141.6	176.4	-67.4	-100.1	0	0	0	111.1	K129 M155 V156 A158 S160 L161 A164 N185 E186	K129-Y131 HydrophobicContact CB-CE2 3.98Å; Y131-M155 CarbonylContact O-C 3.39Å; Y131-M155 WeakPolarHBondContact O-CA 3.31Å; Y131-V156 PolarHBondContact N-O 3.5Å; Y131-V156 PolarHBondContact O-N 2.83Å; Y131-A158 HydrophobicContact CD2-CB 4.01Å; Y131-A158 HydrophobicContact CE2-CB 4.12Å; Y131-A158 VanDerWaalsContact CE2-O 3.26Å; Y131-A158 WeakPolarHBondContact CE2-O 3.22Å; Y131-S160 VanDerWaalsContact CZ-C 3.47Å; Y131-S160 VanDerWaalsContact OH-C 3.23Å; Y131-S160 WeakPolarHBondContact OH-CA 3.49Å; Y131-L161 HydrophobicContact CD1-CD1 3.72Å; Y131-L161 HydrophobicContact CE1-CB 3.86Å; Y131-L161 HydrophobicContact CE1-CD1 3.72Å; Y131-L161 HydrophobicContact CE1-CG 4.44Å; Y131-L161 VanDerWaalsContact CZ-N 3.33Å; Y131-L161 PolarHBondContact OH-N 3.49Å; Y131-L161 VanDerWaalsContact OH-N 3.09Å; Y131-A164 HydrophobicContact CD1-CB 4.14Å; Y131-A164 HydrophobicContact CD2-CB 3.7Å; Y131-A164 HydrophobicContact CE2-CB 4.35Å; Y131-A164 HydrophobicContact CG-CB 3.6Å; Y131-N185 CarbonylContact C-O 3.59Å; Y131-N185 WeakPolarHBondContact CA-O 3.41Å; Y131-E186 HydrophobicContact CD1-CB 4.04Å; Y131-E186 HydrophobicContact CE1-CB 3.74Å; Y131-E186 HydrophobicContact CE1-CG 4.29Å
132	K	87.5	Confident	77.7	Confident	88 Å²	88	64.3 Å²	64.3	38%	0.383	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	107.9	173.2	-178.4	178.2	-177.7	177.9	0	109.3	Y116 T153 Y154 M155 L184 N185 T187	Y116-K132 HydrophobicContact CE1-CD 4.02Å; Y116-K132 HydrophobicContact CE1-CG 4.08Å; K132-T153 HydrophobicContact CD-CG2 3.97Å; K132-T153 HydrophobicContact CG-CG2 3.39Å; K132-Y154 CarbonylContact C-O 3.55Å; K132-Y154 WeakPolarHBondContact CA-O 3.39Å; K132-M155 HydrophobicContact CB-SD 3.95Å; K132-M155 HydrophobicContact CG-SD 4.37Å; K132-L184 WeakPolarHBondContact O-CA 3.27Å; K132-N185 PolarHBondContact N-O 3.28Å; K132-N185 PolarHBondContact O-N 3.32Å; K132-T187 HydrophobicContact CB-CG2 3.62Å
133	A	89.7	Confident	77.6	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	132.3	175.3	0	0	0	0	0	110.3	T153 Y154 V156 V168 G183 L184	A133-T153 CarbonylContact O-C 3.53Å; A133-T153 VanDerWaalsContact O-CA 3.24Å; A133-T153 WeakPolarHBondContact O-CA 3.04Å; A133-T153 WeakPolarHBondContact O-CG2 3.13Å; A133-Y154 PolarHBondContact N-O 3.48Å; A133-Y154 PolarHBondContact O-N 3.18Å; A133-V156 HydrophobicContact CB-CG2 3.85Å; A133-V168 HydrophobicContact CB-CG2 3.65Å; A133-G183 CarbonylContact C-O 3.55Å; A133-G183 WeakPolarHBondContact CA-O 3.26Å; A133-L184 HydrophobicContact CB-CD1 3.52Å
134	K	91	Very high	78	Confident	82 Å²	82	69.1 Å²	69.1	36%	0.357	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	108.6	174.8	-173.8	-178.8	179.7	-174.5	0	107.9	V152 I181 V182 G183	K134-V152 CarbonylContact C-O 3.46Å; K134-I181 CarbonylContact O-C 3.6Å; K134-V182 HydrophobicContact CD-CB 4.43Å; K134-V182 HydrophobicContact CD-CG1 4.45Å; K134-V182 HydrophobicContact CG-CB 4.36Å; K134-V182 WeakPolarHBondContact O-CA 3.1Å; K134-V182 WeakPolarHBondContact O-CB 3.26Å; K134-V182 PolarHBondContact O-N 2.83Å; K134-G183 PolarHBondContact N-O 2.83Å; K134-G183 PolarHBondContact O-N 3.41Å
135	C	88.3	Confident	78	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	135.8	-179.8	-53.8	0	0	0	0	110.1	F137 N151 V152 Y154 M172 D180	C135-F137 HydrophobicContact CB-CE2 4.5Å; C135-N151 CarbonylContact O-C 3.56Å; C135-N151 WeakPolarHBondContact O-CA 3.5Å; C135-V152 PolarHBondContact N-O 3.09Å; C135-V152 PolarHBondContact O-N 3.16Å; C135-V152 VanDerWaalsContact O-O 3.1Å; C135-Y154 HydrophobicContact CB-CD2 4.16Å; C135-Y154 HydrophobicContact CB-CE2 3.98Å; C135-M172 HydrophobicContact CB-CE 3.62Å; C135-D180 CarbonylContact C-O 3.6Å; C135-D180 WeakPolarHBondContact CA-O 3.23Å
136	Q	89.3	Confident	78.7	Confident	36 Å²	36	73.3 Å²	73.3	17%	0.168	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	109.8	176.2	177.1	170.1	100.7	0	0	108.9	R149 S150 N151 Y179 D180 V182	Q136-R149 HydrophobicContact CG-CB 3.83Å; Q136-R149 HydrophobicContact CG-CG 4.14Å; Q136-R149 VanDerWaalsContact OE1-CD 3.28Å; Q136-S150 WeakPolarHBondContact CA-O 3.47Å; Q136-N151 WeakPolarHBondContact CB-OD1 3.39Å; Q136-N151 WeakPolarHBondContact CG-OD1 3.42Å; Q136-N151 PolarHBondContact NE2-OD1 3.4Å; Q136-Y179 CarbonylContact O-C 3.49Å; Q136-Y179 VanDerWaalsContact O-CA 3.3Å; Q136-Y179 WeakPolarHBondContact O-CA 3.49Å; Q136-D180 HydrophobicContact CB-CB 4.47Å; Q136-D180 PolarHBondContact N-O 3.42Å; Q136-D180 PolarHBondContact O-N 3.01Å; Q136-V182 HydrophobicContact CB-CG2 3.45Å; Q136-V182 VanDerWaalsContact CB-CG2 3.45Å
137	F	86.6	Confident	78.8	Confident	25 Å²	25	76.1 Å²	76.1	11%	0.11	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	135.8	174.3	-66.6	-87.2	0	0	0	110.4	C135 R149 S150 V152 Y154 M172 D178	C135-F137 HydrophobicContact CB-CE2 4.5Å; F137-R149 WeakPolarHBondContact O-CA 3.42Å; F137-S150 PolarHBondContact N-O 3.41Å; F137-S150 PolarHBondContact O-N 3.5Å; F137-V152 HydrophobicContact CD2-CB 4.25Å; F137-V152 HydrophobicContact CD2-CG2 3.76Å; F137-V152 HydrophobicContact CE2-CB 3.88Å; F137-V152 HydrophobicContact CE2-CG2 3.73Å; F137-Y154 AromaticContact CE2-CE2 3.96Å; F137-Y154 HydrophobicContact CE2-CE2 3.96Å; F137-Y154 VanDerWaalsContact CE2-OH 3.25Å; F137-Y154 WeakPolarHBondContact CE2-OH 3.42Å; F137-Y154 HydrophobicContact CZ-CE2 4.22Å; F137-Y154 VanDerWaalsContact CZ-OH 3.23Å; F137-Y154 WeakPolarHBondContact CZ-OH 3.33Å; F137-M172 HydrophobicContact CE1-CE 3.5Å; F137-M172 VanDerWaalsContact CE1-CE 3.5Å; F137-M172 HydrophobicContact CE2-CE 3.89Å; F137-M172 HydrophobicContact CZ-CE 3.12Å; F137-M172 HydrophobicContact CZ-SD 3.99Å; F137-D178 WeakPolarHBondContact CA-O 3.31Å
138	I	82.1	Confident	78.9	Confident	40 Å²	40	82.4 Å²	82.4	21%	0.205	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	115.4	176.4	-55.8	172.3	0	0	0	107.4	E147 R149 D178	I138-E147 HydrophobicContact CG2-CB 4.49Å; I138-E147 HydrophobicContact CG2-CG 4.25Å; I138-R149 HydrophobicContact CG1-CG 4.37Å; I138-D178 HydrophobicContact CB-CB 4.47Å; I138-D178 PolarHBondContact N-O 3.1Å
139	T	77	Confident	79.7	Confident	61 Å²	61	83.7 Å²	83.7	37%	0.374	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	143.8	174.2	46.1	0	0	0	0	109.4	K148	T139-K148 PolarHBondContact N-O 3.45Å; T139-K148 PolarHBondContact O-N 2.95Å; T139-K148 PolarHBondContact OG1-O 2.82Å
140	I	75.2	Confident	80.2	Confident	118 Å²	118	82.5 Å²	82.5	61%	0.605	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	122.7	174.5	-59.1	175.4	0	0	0	107.8	E142	I140-E142 PolarHBondContact O-N 2.9Å
141	D	69.7	Low	80.5	Confident	66 Å²	66	85.4 Å²	85.4	35%	0.353	41%	0.407	S	S	.	.			trans	-71	111.2	172.7	173	4.3	0	0	0	109.6	K143 S144 Q145 K146	D141-K143 PolarHBondContact O-N 2.92Å; D141-K143 PolarHBondContact OD1-N 3.49Å; D141-S144 WeakPolarHBondContact CB-OG 3.32Å; D141-S144 PolarHBondContact O-N 2.72Å; D141-S144 VanDerWaalsContact O-N 3.11Å; D141-S144 WeakPolarHBondContact OD2-CB 3.39Å; D141-S144 PolarHBondContact OD2-OG 3.37Å; D141-Q145 PolarHBondContact O-N 2.83Å; D141-K146 PolarHBondContact N-O 3.27Å; D141-K146 VanDerWaalsContact N-O 3.12Å
142	E	69.7	Low	80.4	Confident	189 Å²	189	86.9 Å²	86.9	88%	0.883	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-26.3	-177.6	-68.1	-173.1	163	0	0	113.7	I140	I140-E142 PolarHBondContact O-N 2.9Å
143	K	70.6	Confident	80.3	Confident	202 Å²	202	83.9 Å²	83.9	88%	0.878	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-33.2	179.7	-70.9	-176.2	-179.2	177.3	0	113.5	D141	D141-K143 PolarHBondContact O-N 2.92Å; D141-K143 PolarHBondContact OD1-N 3.49Å
144	S	77.4	Confident	80.1	Confident	53 Å²	53	85 Å²	85	37%	0.371	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-9.6	-172.3	69.7	0	0	0	0	114.3	D141 K146	D141-S144 WeakPolarHBondContact CB-OG 3.32Å; D141-S144 PolarHBondContact O-N 2.72Å; D141-S144 VanDerWaalsContact O-N 3.11Å; D141-S144 WeakPolarHBondContact OD2-CB 3.39Å; D141-S144 PolarHBondContact OD2-OG 3.37Å; S144-K146 PolarHBondContact O-N 3.49Å
145	Q	70.3	Confident	79.7	Confident	166 Å²	166	81.3 Å²	81.3	78%	0.776	39%	0.394	S	S	*	.			trans	54.2	19.6	-173.6	-71.8	-102.6	-13.3	0	0	112.9	D141	D141-Q145 PolarHBondContact O-N 2.83Å
146	K	72	Confident	79.5	Confident	152 Å²	152	81.3 Å²	81.3	66%	0.661	39%	0.394	S	S	*	.			trans	-97.9	140.5	177.5	-70.2	-177.1	178.9	-178.3	0	110.2	D141 S144 K148	D141-K146 PolarHBondContact N-O 3.27Å; D141-K146 VanDerWaalsContact N-O 3.12Å; S144-K146 PolarHBondContact O-N 3.49Å; K146-K148 PolarHBondContact O-N 3.24Å
147	E	77.7	Confident	79.2	Confident	122 Å²	122	81 Å²	81	57%	0.57	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.1	122.6	168.2	-71.3	-179.5	-165.7	0	0	110	I138 R149	I138-E147 HydrophobicContact CG2-CB 4.49Å; I138-E147 HydrophobicContact CG2-CG 4.25Å; E147-R149 IonicContact OE2-CZ 3.75Å; E147-R149 IonicContact OE2-NE 3.61Å; E147-R149 IonicContact OE2-NH2 2.99Å; E147-R149 PolarHBondContact OE2-NH2 2.85Å
148	K	77.2	Confident	79	Confident	135 Å²	135	79.8 Å²	79.8	59%	0.587	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	116.8	170.3	-170.2	179.3	-179.8	-175.8	0	108.2	T139 K146	T139-K148 PolarHBondContact N-O 3.45Å; T139-K148 PolarHBondContact O-N 2.95Å; T139-K148 PolarHBondContact OG1-O 2.82Å; K146-K148 PolarHBondContact O-N 3.24Å
149	R	83.2	Confident	79.1	Confident	121 Å²	121	82.7 Å²	82.7	46%	0.457	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	121.3	178.1	-72.8	167.2	-177	-94.8	-5.4	109.6	Q136 F137 I138 E147 D180	Q136-R149 HydrophobicContact CG-CB 3.83Å; Q136-R149 HydrophobicContact CG-CG 4.14Å; Q136-R149 VanDerWaalsContact OE1-CD 3.28Å; F137-R149 WeakPolarHBondContact O-CA 3.42Å; I138-R149 HydrophobicContact CG1-CG 4.37Å; E147-R149 IonicContact OE2-CZ 3.75Å; E147-R149 IonicContact OE2-NE 3.61Å; E147-R149 IonicContact OE2-NH2 2.99Å; E147-R149 PolarHBondContact OE2-NH2 2.85Å; R149-D180 IonicContact NH1-OD2 3.31Å
150	S	82.2	Confident	79.6	Confident	49 Å²	49	82 Å²	82	34%	0.343	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	119.8	177.2	50.3	0	0	0	0	110.8	Q136 F137	Q136-S150 WeakPolarHBondContact CA-O 3.47Å; F137-S150 PolarHBondContact N-O 3.41Å; F137-S150 PolarHBondContact O-N 3.5Å
151	N	86.8	Confident	80.2	Confident	79 Å²	79	80.6 Å²	80.6	42%	0.422	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	125.8	176.8	-62.3	-34	0	0	0	110.3	C135 Q136	C135-N151 CarbonylContact O-C 3.56Å; C135-N151 WeakPolarHBondContact O-CA 3.5Å; Q136-N151 WeakPolarHBondContact CB-OD1 3.39Å; Q136-N151 WeakPolarHBondContact CG-OD1 3.42Å; Q136-N151 PolarHBondContact NE2-OD1 3.4Å
152	V	84.6	Confident	81	Confident	41 Å²	41	80.2 Å²	80.2	25%	0.248	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	140.2	169.9	-174.8	0	0	0	0	107.8	K134 C135 F137 Y154	K134-V152 CarbonylContact C-O 3.46Å; C135-V152 PolarHBondContact N-O 3.09Å; C135-V152 PolarHBondContact O-N 3.16Å; C135-V152 VanDerWaalsContact O-O 3.1Å; F137-V152 HydrophobicContact CD2-CB 4.25Å; F137-V152 HydrophobicContact CD2-CG2 3.76Å; F137-V152 HydrophobicContact CE2-CB 3.88Å; F137-V152 HydrophobicContact CE2-CG2 3.73Å; V152-Y154 HydrophobicContact CB-CE2 3.83Å; V152-Y154 HydrophobicContact CG1-CD2 4.37Å; V152-Y154 HydrophobicContact CG1-CE1 4.14Å; V152-Y154 HydrophobicContact CG1-CE2 3.68Å
153	T	85.7	Confident	81.9	Confident	25 Å²	25	73.8 Å²	73.8	15%	0.153	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125.7	178.5	-53.6	0	0	0	0	109.2	Y116 G117 K132 A133	Y116-T153 CarbonylContact C-O 3.51Å; Y116-T153 WeakPolarHBondContact CA-O 3.39Å; Y116-T153 HydrophobicContact CD1-CG2 3.79Å; Y116-T153 HydrophobicContact CE1-CG2 4Å; G117-T153 PolarHBondContact N-O 2.98Å; K132-T153 HydrophobicContact CD-CG2 3.97Å; K132-T153 HydrophobicContact CG-CG2 3.39Å; A133-T153 CarbonylContact O-C 3.53Å; A133-T153 VanDerWaalsContact O-CA 3.24Å; A133-T153 WeakPolarHBondContact O-CA 3.04Å; A133-T153 WeakPolarHBondContact O-CG2 3.13Å
154	Y	85.2	Confident	82.9	Confident	23 Å²	23	64.2 Å²	64.2	9%	0.09	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	154.8	174.9	-60	-85	0	0	0	110.4	E118 F120 K132 A133 C135 F137 V152 M172	E118-Y154 HydrophobicContact CB-CD1 3.63Å; E118-Y154 HydrophobicContact CB-CE1 3.67Å; E118-Y154 WeakPolarHBondContact O-CA 3.47Å; F120-Y154 AromaticContact CE1-CD1 3.63Å; F120-Y154 HydrophobicContact CE1-CD1 3.63Å; F120-Y154 HydrophobicContact CE1-CE1 4.13Å; F120-Y154 HydrophobicContact CE1-CG 4.23Å; F120-Y154 HydrophobicContact CE2-CD1 4.23Å; F120-Y154 AromaticContact CE2-CG 3.99Å; F120-Y154 HydrophobicContact CE2-CG 3.99Å; F120-Y154 AromaticContact CZ-CD1 3.39Å; F120-Y154 HydrophobicContact CZ-CD1 3.39Å; F120-Y154 HydrophobicContact CZ-CD2 4.25Å; F120-Y154 AromaticContact CZ-CE1 3.91Å; F120-Y154 HydrophobicContact CZ-CE1 3.91Å; F120-Y154 AromaticContact CZ-CG 3.58Å; F120-Y154 HydrophobicContact CZ-CG 3.58Å; K132-Y154 CarbonylContact C-O 3.55Å; K132-Y154 WeakPolarHBondContact CA-O 3.39Å; A133-Y154 PolarHBondContact N-O 3.48Å; A133-Y154 PolarHBondContact O-N 3.18Å; C135-Y154 HydrophobicContact CB-CD2 4.16Å; C135-Y154 HydrophobicContact CB-CE2 3.98Å; F137-Y154 AromaticContact CE2-CE2 3.96Å; F137-Y154 HydrophobicContact CE2-CE2 3.96Å; F137-Y154 VanDerWaalsContact CE2-OH 3.25Å; F137-Y154 WeakPolarHBondContact CE2-OH 3.42Å; F137-Y154 HydrophobicContact CZ-CE2 4.22Å; F137-Y154 VanDerWaalsContact CZ-OH 3.23Å; F137-Y154 WeakPolarHBondContact CZ-OH 3.33Å; V152-Y154 HydrophobicContact CB-CE2 3.83Å; V152-Y154 HydrophobicContact CG1-CD2 4.37Å; V152-Y154 HydrophobicContact CG1-CE1 4.14Å; V152-Y154 HydrophobicContact CG1-CE2 3.68Å; Y154-M172 HydrophobicContact CE2-CE 4.01Å; Y154-M172 HydrophobicContact CE2-SD 4Å
155	M	83.3	Confident	83.5	Confident	5 Å²	5	65.2 Å²	65.2	3%	0.025	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	139	168.6	-80.3	-58.4	-53	0	0	108.3	Y116 E118 I119 F120 W130 Y131 K132 T187 I189	Y116-M155 HydrophobicContact CD1-CG 3.64Å; Y116-M155 HydrophobicContact CD1-SD 4.13Å; Y116-M155 HydrophobicContact CD2-CG 4.1Å; Y116-M155 HydrophobicContact CE1-CG 3.77Å; Y116-M155 HydrophobicContact CE1-SD 3.65Å; Y116-M155 HydrophobicContact CE2-CG 4.21Å; Y116-M155 HydrophobicContact CG-CG 3.83Å; E118-M155 PolarHBondContact O-N 3.47Å; E118-M155 VanDerWaalsContact O-N 3.11Å; I119-M155 CarbonylContact C-O 3.38Å; I119-M155 WeakPolarHBondContact CA-O 3.25Å; I119-M155 HydrophobicContact CB-CB 4.42Å; I119-M155 HydrophobicContact CG1-CB 3.76Å; I119-M155 HydrophobicContact CG2-CB 4.4Å; F120-M155 PolarHBondContact N-O 2.95Å; W130-M155 HydrophobicContact CB-CE 3.63Å; W130-M155 HydrophobicContact CD2-CE 4.2Å; W130-M155 HydrophobicContact CE3-CB 4.3Å; W130-M155 HydrophobicContact CE3-CE 3.78Å; W130-M155 HydrophobicContact CG-CE 4.21Å; W130-M155 HydrophobicContact CZ3-CB 4.41Å; Y131-M155 CarbonylContact O-C 3.39Å; Y131-M155 WeakPolarHBondContact O-CA 3.31Å; K132-M155 HydrophobicContact CB-SD 3.95Å; K132-M155 HydrophobicContact CG-SD 4.37Å; M155-T187 HydrophobicContact CE-CG2 3.73Å; M155-T187 HydrophobicContact SD-CG2 3.93Å; M155-I189 HydrophobicContact CE-CD1 3.67Å; M155-I189 HydrophobicContact SD-CD1 4.18Å
156	V	84.5	Confident	84.4	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	118	-170.4	-170.1	0	0	0	0	108.8	F120 Y131 A133 A164 Y167 V168	F120-V156 HydrophobicContact CB-CG1 4.2Å; F120-V156 HydrophobicContact CB-CG2 4.41Å; F120-V156 HydrophobicContact CD2-CG1 4.45Å; F120-V156 HydrophobicContact CD2-CG2 3.71Å; F120-V156 HydrophobicContact CE2-CG2 4.43Å; F120-V156 HydrophobicContact CG-CG2 4.41Å; F120-V156 CarbonylContact O-C 3.59Å; F120-V156 WeakPolarHBondContact O-CA 3.49Å; Y131-V156 PolarHBondContact N-O 3.5Å; Y131-V156 PolarHBondContact O-N 2.83Å; A133-V156 HydrophobicContact CB-CG2 3.85Å; V156-A164 HydrophobicContact CB-CB 4.42Å; V156-A164 HydrophobicContact CG1-CB 4.07Å; V156-Y167 HydrophobicContact CG1-CD2 4.26Å; V156-V168 HydrophobicContact CG1-CG2 4.44Å; V156-V168 HydrophobicContact CG2-CG2 3.58Å
157	Q	82.2	Confident	85.3	Confident	29 Å²	29	58.6 Å²	58.6	14%	0.136	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	123.6	173.9	-166.6	-179.9	28	0	0	109	F120 S122 D127 K129 W130 Y167 D191	F120-Q157 PolarHBondContact O-N 3.45Å; S122-Q157 VanDerWaalsContact N-OE1 3.16Å; D127-Q157 HydrophobicContact CB-CG 4.41Å; D127-Q157 WeakPolarHBondContact O-CG 3.3Å; D127-Q157 PolarHBondContact O-NE2 2.85Å; K129-Q157 WeakPolarHBondContact O-CA 3.31Å; W130-Q157 HydrophobicContact CD2-CB 4.49Å; W130-Q157 HydrophobicContact CE3-CB 4.08Å; W130-Q157 HydrophobicContact CH2-CB 3.84Å; W130-Q157 HydrophobicContact CH2-CG 4.33Å; W130-Q157 HydrophobicContact CZ2-CB 4.28Å; W130-Q157 HydrophobicContact CZ2-CG 4.29Å; W130-Q157 HydrophobicContact CZ3-CB 3.7Å; Q157-Y167 VanDerWaalsContact O-CD2 3.31Å; Q157-Y167 WeakPolarHBondContact O-CD2 3.2Å; Q157-Y167 WeakPolarHBondContact O-CE2 3.23Å; Q157-D191 PolarHBondContact NE2-OD2 2.91Å
158	A	82.8	Confident	85.8	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.259	C	S	.	.			trans	-164.1	151.8	-178.1	0	0	0	0	0	110.5	K129 Y131 S160 R163 A164 Y167	K129-A158 CarbonylContact C-O 3.57Å; K129-A158 VanDerWaalsContact CB-O 3.31Å; K129-A158 WeakPolarHBondContact CB-O 3.07Å; K129-A158 PolarHBondContact N-O 3.2Å; K129-A158 PolarHBondContact O-N 3.32Å; Y131-A158 HydrophobicContact CD2-CB 4.01Å; Y131-A158 HydrophobicContact CE2-CB 4.12Å; Y131-A158 VanDerWaalsContact CE2-O 3.26Å; Y131-A158 WeakPolarHBondContact CE2-O 3.22Å; A158-S160 VanDerWaalsContact C-N 3.32Å; A158-S160 PolarHBondContact O-N 3.46Å; A158-R163 HydrophobicContact CB-CB 4.18Å; A158-A164 HydrophobicContact CB-CB 3.65Å; A158-A164 VanDerWaalsContact CB-N 3.31Å; A158-Y167 HydrophobicContact CB-CD2 4.13Å; A158-Y167 HydrophobicContact CB-CE2 4.18Å
159	K	84.2	Confident	86.3	Confident	101 Å²	101	49.8 Å²	49.8	44%	0.439	25%	0.249	S	C	.	.	S	Bend	trans	-70.6	-29	174.5	-175	175.7	-165.8	169.8	0	113.3	D126 D127	D126-K159 HydrophobicContact CB-CD 4.31Å; D126-K159 WeakPolarHBondContact O-CB 3.49Å; D126-K159 WeakPolarHBondContact O-CG 3.36Å; D126-K159 WeakPolarHBondContact OD2-CD 3.44Å; D126-K159 IonicContact OD2-NZ 2.74Å; D126-K159 PolarHBondContact OD2-NZ 3.45Å; D127-K159 WeakPolarHBondContact OD1-CB 3.38Å; D127-K159 PolarHBondContact OD1-N 3.09Å
160	S	86.4	Confident	86.5	Confident	45 Å²	45	49.7 Å²	49.7	32%	0.315	25%	0.254	S	S	.	.	S	Bend	trans	-148.6	155.6	-171.9	67.1	0	0	0	0	111.5	Y131 A158 A162 R163 A164	Y131-S160 VanDerWaalsContact CZ-C 3.47Å; Y131-S160 VanDerWaalsContact OH-C 3.23Å; Y131-S160 WeakPolarHBondContact OH-CA 3.49Å; A158-S160 VanDerWaalsContact C-N 3.32Å; A158-S160 PolarHBondContact O-N 3.46Å; S160-A162 PolarHBondContact O-N 2.73Å; S160-R163 PolarHBondContact O-N 2.86Å; S160-R163 PolarHBondContact OG-N 3.09Å; S160-A164 PolarHBondContact O-N 3.26Å
161	L	87.7	Confident	86.5	Confident	90 Å²	90	50.4 Å²	50.4	47%	0.471	26%	0.256	S	S	.	.	H	α-helix	trans	-52.7	-39.5	176.6	-171.7	74.5	0	0	0	112.5	Y131 R163 A164 L165 L184	Y131-L161 HydrophobicContact CD1-CD1 3.72Å; Y131-L161 HydrophobicContact CE1-CB 3.86Å; Y131-L161 HydrophobicContact CE1-CD1 3.72Å; Y131-L161 HydrophobicContact CE1-CG 4.44Å; Y131-L161 VanDerWaalsContact CZ-N 3.33Å; Y131-L161 PolarHBondContact OH-N 3.49Å; Y131-L161 VanDerWaalsContact OH-N 3.09Å; L161-R163 VanDerWaalsContact C-N 3.31Å; L161-R163 PolarHBondContact O-N 3.4Å; L161-A164 PolarHBondContact O-N 2.86Å; L161-L165 WeakPolarHBondContact O-CB 3.43Å; L161-L165 PolarHBondContact O-N 2.92Å; L161-L184 HydrophobicContact CD1-CB 4.12Å; L161-L184 HydrophobicContact CD1-CD2 3.68Å; L161-L184 HydrophobicContact CD1-CG 3.65Å; L161-L184 WeakPolarHBondContact CD1-O 3.4Å; L161-L184 HydrophobicContact CG-CD2 4.18Å
162	A	87.1	Confident	86.4	Confident	57 Å²	57	47 Å²	47	47%	0.471	24%	0.238	S	C	.	.	H	α-helix	trans	-69.3	-28.1	179.5	0	0	0	0	0	113.2	S160 R166	S160-A162 PolarHBondContact O-N 2.73Å; A162-R166 WeakPolarHBondContact O-CG 3.48Å; A162-R166 PolarHBondContact O-N 2.83Å; A162-R166 PolarHBondContact O-NE 2.75Å
163	R	89.8	Confident	86	Confident	55 Å²	55	47.7 Å²	47.7	21%	0.208	25%	0.253	C	S	.	.	H	α-helix	trans	-82.1	-39.1	175	-159.7	-173	-126.8	161	0.1	110.6	D126 D127 A158 S160 L161 L165 R166 Y167	D126-R163 IonicContact OD1-CZ 3.01Å; D126-R163 IonicContact OD1-NH1 3.88Å; D126-R163 PolarHBondContact OD1-NH1 3.38Å; D126-R163 IonicContact OD1-NH2 3.63Å; D126-R163 IonicContact OD2-NH1 3.6Å; D126-R163 PolarHBondContact OD2-NH1 2.97Å; D127-R163 WeakPolarHBondContact OD1-CD 3.34Å; D127-R163 IonicContact OD1-CZ 2.78Å; D127-R163 IonicContact OD1-NE 3.81Å; D127-R163 IonicContact OD1-NH1 3.5Å; D127-R163 PolarHBondContact OD1-NH1 3.47Å; D127-R163 WeakPolarHBondContact OD2-CD 3.34Å; D127-R163 IonicContact OD2-NE 2.89Å; D127-R163 IonicContact OD2-NH1 2.7Å; A158-R163 HydrophobicContact CB-CB 4.18Å; S160-R163 PolarHBondContact O-N 2.86Å; S160-R163 PolarHBondContact OG-N 3.09Å; L161-R163 VanDerWaalsContact C-N 3.31Å; L161-R163 PolarHBondContact O-N 3.4Å; R163-L165 VanDerWaalsContact C-N 3.31Å; R163-L165 PolarHBondContact O-N 2.97Å; R163-R166 WeakPolarHBondContact O-CB 3.35Å; R163-R166 PolarHBondContact O-N 2.84Å; R163-R166 VanDerWaalsContact O-N 3.16Å; R163-Y167 VanDerWaalsContact CD-OH 3.31Å; R163-Y167 WeakPolarHBondContact CD-OH 3.49Å; R163-Y167 HydrophobicContact CG-CD2 4.34Å; R163-Y167 HydrophobicContact CG-CE1 4.31Å; R163-Y167 HydrophobicContact CG-CE2 3.65Å; R163-Y167 PolarHBondContact NE-OH 2.92Å; R163-Y167 WeakPolarHBondContact O-CD2 3.19Å; R163-Y167 PolarHBondContact O-N 3.06Å
164	A	90.3	Very high	85.4	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-56.9	-43.5	170.5	0	0	0	0	0	112	Y131 V156 A158 S160 L161 R166 Y167 V168 L184	Y131-A164 HydrophobicContact CD1-CB 4.14Å; Y131-A164 HydrophobicContact CD2-CB 3.7Å; Y131-A164 HydrophobicContact CE2-CB 4.35Å; Y131-A164 HydrophobicContact CG-CB 3.6Å; V156-A164 HydrophobicContact CB-CB 4.42Å; V156-A164 HydrophobicContact CG1-CB 4.07Å; A158-A164 HydrophobicContact CB-CB 3.65Å; A158-A164 VanDerWaalsContact CB-N 3.31Å; S160-A164 PolarHBondContact O-N 3.26Å; L161-A164 PolarHBondContact O-N 2.86Å; A164-R166 PolarHBondContact O-N 3.49Å; A164-Y167 PolarHBondContact O-N 3.41Å; A164-V168 WeakPolarHBondContact O-CG2 3.5Å; A164-V168 PolarHBondContact O-N 3.45Å; A164-L184 HydrophobicContact CB-CD1 4.21Å; A164-L184 HydrophobicContact CB-CD2 3.94Å; A164-L184 HydrophobicContact CB-CG 4.41Å
165	L	90.8	Very high	84.6	Confident	74 Å²	74	56.3 Å²	56.3	39%	0.387	30%	0.295	S	S	.	.	H	α-helix	trans	-60.6	-45.9	176.2	-172.9	70.4	0	0	0	111.4	L161 R163 Y167 V168 D169 I181 L184	L161-L165 WeakPolarHBondContact O-CB 3.43Å; L161-L165 PolarHBondContact O-N 2.92Å; R163-L165 VanDerWaalsContact C-N 3.31Å; R163-L165 PolarHBondContact O-N 2.97Å; L165-Y167 PolarHBondContact O-N 2.95Å; L165-V168 PolarHBondContact O-N 3.21Å; L165-D169 PolarHBondContact O-N 2.83Å; L165-I181 HydrophobicContact CD1-CD1 3.63Å; L165-L184 HydrophobicContact CB-CD2 3.88Å; L165-L184 HydrophobicContact CD1-CD2 4.21Å
166	R	89.5	Confident	83.5	Confident	147 Å²	147	65.7 Å²	65.7	56%	0.555	34%	0.341	S	S	*	.	H	α-helix	trans	-60	-43	176.8	-79.9	-176.8	-84.5	-175.2	-3.3	112.7	A162 R163 A164 D169 E170	A162-R166 WeakPolarHBondContact O-CG 3.48Å; A162-R166 PolarHBondContact O-N 2.83Å; A162-R166 PolarHBondContact O-NE 2.75Å; R163-R166 WeakPolarHBondContact O-CB 3.35Å; R163-R166 PolarHBondContact O-N 2.84Å; R163-R166 VanDerWaalsContact O-N 3.16Å; A164-R166 PolarHBondContact O-N 3.49Å; R166-D169 PolarHBondContact O-N 2.93Å; R166-E170 WeakPolarHBondContact O-CB 3.24Å; R166-E170 WeakPolarHBondContact O-CG 3.27Å; R166-E170 PolarHBondContact O-N 3.31Å
167	Y	90	Very high	82.9	Confident	33 Å²	33	68.4 Å²	68.4	13%	0.129	36%	0.36	C	S	.	.	H	α-helix	trans	-66.6	-37	177.3	-64.7	-31.1	0	0	0	112.8	S122 L124 D127 V156 Q157 A158 R163 A164 L165 V171	S122-Y167 WeakPolarHBondContact OG-CE2 3.37Å; S122-Y167 PolarHBondContact OG-OH 3.14Å; L124-Y167 VanDerWaalsContact CD1-OH 3.26Å; L124-Y167 WeakPolarHBondContact CD1-OH 3.15Å; D127-Y167 VanDerWaalsContact OD2-CE2 3.23Å; D127-Y167 WeakPolarHBondContact OD2-CE2 3.36Å; D127-Y167 PolarHBondContact OD2-OH 2.84Å; V156-Y167 HydrophobicContact CG1-CD2 4.26Å; Q157-Y167 VanDerWaalsContact O-CD2 3.31Å; Q157-Y167 WeakPolarHBondContact O-CD2 3.2Å; Q157-Y167 WeakPolarHBondContact O-CE2 3.23Å; A158-Y167 HydrophobicContact CB-CD2 4.13Å; A158-Y167 HydrophobicContact CB-CE2 4.18Å; R163-Y167 VanDerWaalsContact CD-OH 3.31Å; R163-Y167 WeakPolarHBondContact CD-OH 3.49Å; R163-Y167 HydrophobicContact CG-CD2 4.34Å; R163-Y167 HydrophobicContact CG-CE1 4.31Å; R163-Y167 HydrophobicContact CG-CE2 3.65Å; R163-Y167 PolarHBondContact NE-OH 2.92Å; R163-Y167 WeakPolarHBondContact O-CD2 3.19Å; R163-Y167 PolarHBondContact O-N 3.06Å; A164-Y167 PolarHBondContact O-N 3.41Å; L165-Y167 PolarHBondContact O-N 2.95Å; Y167-V171 WeakPolarHBondContact O-CB 3.21Å; Y167-V171 VanDerWaalsContact O-CG2 3.27Å; Y167-V171 WeakPolarHBondContact O-CG2 3.36Å; Y167-V171 PolarHBondContact O-N 2.74Å; Y167-V171 VanDerWaalsContact O-N 3.09Å
168	V	89	Confident	82.8	Confident	0 Å²	0	73 Å²	73	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-61.7	-48.4	171.8	179.1	0	0	0	0	110.1	F120 A133 V156 A164 L165 E170 V171 M172 I181 L184	F120-V168 HydrophobicContact CD2-CG2 4.18Å; F120-V168 HydrophobicContact CE2-CB 4.45Å; F120-V168 HydrophobicContact CE2-CG1 4.43Å; F120-V168 HydrophobicContact CE2-CG2 4.13Å; A133-V168 HydrophobicContact CB-CG2 3.65Å; V156-V168 HydrophobicContact CG1-CG2 4.44Å; V156-V168 HydrophobicContact CG2-CG2 3.58Å; A164-V168 WeakPolarHBondContact O-CG2 3.5Å; A164-V168 PolarHBondContact O-N 3.45Å; L165-V168 PolarHBondContact O-N 3.21Å; V168-E170 PolarHBondContact O-N 3.32Å; V168-V171 PolarHBondContact O-N 2.81Å; V168-M172 HydrophobicContact CG1-CG 3.83Å; V168-M172 WeakPolarHBondContact O-CB 3.48Å; V168-M172 WeakPolarHBondContact O-CG 3.26Å; V168-M172 PolarHBondContact O-N 3.03Å; V168-I181 HydrophobicContact CB-CD1 4.04Å; V168-I181 HydrophobicContact CG1-CD1 3.49Å; V168-I181 VanDerWaalsContact CG1-CD1 3.49Å; V168-I181 HydrophobicContact CG1-CG1 3.95Å; V168-L184 HydrophobicContact CG2-CD1 4.48Å
169	D	87.5	Confident	83	Confident	71 Å²	71	75.5 Å²	75.5	38%	0.38	40%	0.395	S	S	.	.	H	α-helix	trans	-65.2	-38.8	-179.2	-71.7	-22.5	0	0	0	112.7	L165 R166 G173 I181	L165-D169 PolarHBondContact O-N 2.83Å; R166-D169 PolarHBondContact O-N 2.93Å; D169-G173 WeakPolarHBondContact O-CA 3.31Å; D169-G173 PolarHBondContact O-N 3.11Å; D169-I181 WeakPolarHBondContact OD1-CD1 3.38Å
170	E	86.1	Confident	83.1	Confident	120 Å²	120	74.3 Å²	74.3	56%	0.561	39%	0.394	S	S	*	.	H	α-helix	trans	-65.6	-38.7	177.5	-82.6	-179	172.5	0	0	113	R166 V168 K174	R166-E170 WeakPolarHBondContact O-CB 3.24Å; R166-E170 WeakPolarHBondContact O-CG 3.27Å; R166-E170 PolarHBondContact O-N 3.31Å; V168-E170 PolarHBondContact O-N 3.32Å; E170-K174 WeakPolarHBondContact O-CE 3.34Å
171	V	82.9	Confident	83.2	Confident	63 Å²	63	74.7 Å²	74.7	38%	0.382	39%	0.392	S	S	.	.	H	α-helix	trans	-77.6	-47.7	178.4	176.1	0	0	0	0	110.3	F120 Y167 V168 K174	F120-V171 HydrophobicContact CD1-CG1 4.05Å; F120-V171 HydrophobicContact CD1-CG2 4.35Å; F120-V171 HydrophobicContact CD2-CB 4.46Å; F120-V171 HydrophobicContact CD2-CG2 4.43Å; F120-V171 HydrophobicContact CE1-CB 4.34Å; F120-V171 HydrophobicContact CE1-CG1 3.62Å; F120-V171 HydrophobicContact CE2-CB 4.29Å; F120-V171 HydrophobicContact CE2-CG1 4.36Å; F120-V171 HydrophobicContact CG-CG2 4.26Å; F120-V171 HydrophobicContact CZ-CB 4.23Å; F120-V171 HydrophobicContact CZ-CG1 3.8Å; Y167-V171 WeakPolarHBondContact O-CB 3.21Å; Y167-V171 VanDerWaalsContact O-CG2 3.27Å; Y167-V171 WeakPolarHBondContact O-CG2 3.36Å; Y167-V171 PolarHBondContact O-N 2.74Å; Y167-V171 VanDerWaalsContact O-N 3.09Å; V168-V171 PolarHBondContact O-N 2.81Å; V171-K174 PolarHBondContact O-N 2.7Å
172	M	84.3	Confident	83.2	Confident	8 Å²	8	74.1 Å²	74.1	4%	0.039	39%	0.392	C	S	.	.	H	α-helix	trans	-77.9	-29.3	-172.8	-60.1	-77.4	-72	0	0	112.2	F120 C135 F137 Y154 V168 K174 S175 Y179	F120-M172 HydrophobicContact CE2-CG 4.39Å; F120-M172 HydrophobicContact CZ-CG 4.36Å; F120-M172 HydrophobicContact CZ-SD 4.1Å; C135-M172 HydrophobicContact CB-CE 3.62Å; F137-M172 HydrophobicContact CE1-CE 3.5Å; F137-M172 VanDerWaalsContact CE1-CE 3.5Å; F137-M172 HydrophobicContact CE2-CE 3.89Å; F137-M172 HydrophobicContact CZ-CE 3.12Å; F137-M172 HydrophobicContact CZ-SD 3.99Å; Y154-M172 HydrophobicContact CE2-CE 4.01Å; Y154-M172 HydrophobicContact CE2-SD 4Å; V168-M172 HydrophobicContact CG1-CG 3.83Å; V168-M172 WeakPolarHBondContact O-CB 3.48Å; V168-M172 WeakPolarHBondContact O-CG 3.26Å; V168-M172 PolarHBondContact O-N 3.03Å; M172-K174 PolarHBondContact O-N 3.35Å; M172-S175 VanDerWaalsContact O-CB 3.31Å; M172-S175 WeakPolarHBondContact O-CB 3Å; M172-S175 PolarHBondContact O-N 3.27Å; M172-Y179 VanDerWaalsContact C-CE1 3.44Å; M172-Y179 HydrophobicContact CB-CD1 3.92Å; M172-Y179 HydrophobicContact CB-CD2 3.98Å; M172-Y179 HydrophobicContact CB-CE1 3.43Å; M172-Y179 VanDerWaalsContact CB-CE1 3.43Å; M172-Y179 HydrophobicContact CB-CE2 3.48Å; M172-Y179 VanDerWaalsContact CB-CE2 3.48Å; M172-Y179 HydrophobicContact CB-CG 4.18Å; M172-Y179 WeakPolarHBondContact CB-OH 3.32Å; M172-Y179 HydrophobicContact CE-CD1 4.3Å; M172-Y179 HydrophobicContact CE-CD2 3.77Å; M172-Y179 HydrophobicContact CE-CE2 4.39Å; M172-Y179 HydrophobicContact CE-CG 3.72Å; M172-Y179 HydrophobicContact CG-CD2 4.44Å; M172-Y179 HydrophobicContact CG-CE2 4.17Å; M172-Y179 WeakPolarHBondContact O-CE1 3.11Å
173	G	75.9	Confident	83.2	Confident	56 Å²	56	72.5 Å²	72.5	58%	0.577	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-16.5	173.7	0	0	0	0	0	114.1	D169 Y179	D169-G173 WeakPolarHBondContact O-CA 3.31Å; D169-G173 PolarHBondContact O-N 3.11Å; G173-Y179 PolarHBondContact N-OH 3.14Å
174	K	74.8	Confident	83.2	Confident	181 Å²	181	71.1 Å²	71.1	79%	0.787	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-11.6	171.4	-64.3	174.4	-173.1	171.6	0	113	E170 V171 M172	E170-K174 WeakPolarHBondContact O-CE 3.34Å; V171-K174 PolarHBondContact O-N 2.7Å; M172-K174 PolarHBondContact O-N 3.35Å
175	S	67.3	Low	83.1	Confident	47 Å²	47	76.4 Å²	76.4	33%	0.329	41%	0.405	S	S	.	.	S	Bend	trans	-81.2	139.2	177.9	121.5	0	0	0	0	110.6	M172 S177	M172-S175 VanDerWaalsContact O-CB 3.31Å; M172-S175 WeakPolarHBondContact O-CB 3Å; M172-S175 PolarHBondContact O-N 3.27Å; S175-S177 PolarHBondContact O-N 2.72Å; S175-S177 PolarHBondContact OG-N 2.96Å; S175-S177 VanDerWaalsContact OG-N 3.1Å; S175-S177 PolarHBondContact OG-O 3.21Å
176	M	61.3	Low	82.8	Confident	202 Å²	202	77.9 Å²	77.9	100%	0.995	41%	0.41	S	S	*	.	S	Bend	trans	-72.9	2.7	173.5	-74.7	-151.8	-82.4	0	0	114.1
177	S	70.9	Confident	82	Confident	57 Å²	57	72 Å²	72	40%	0.399	39%	0.391	S	S	.	.	S	Bend	trans	-101.4	133.7	-179.2	-53.7	0	0	0	0	111.1	S175	S175-S177 PolarHBondContact O-N 2.72Å; S175-S177 PolarHBondContact OG-N 2.96Å; S175-S177 VanDerWaalsContact OG-N 3.1Å; S175-S177 PolarHBondContact OG-O 3.21Å
178	D	81.2	Confident	80.8	Confident	125 Å²	125	77.2 Å²	77.2	67%	0.668	41%	0.414	S	S	*	.			trans	-65	134.6	171.1	-69.3	-33.3	0	0	0	110.6	F137 I138	F137-D178 WeakPolarHBondContact CA-O 3.31Å; I138-D178 HydrophobicContact CB-CB 4.47Å; I138-D178 PolarHBondContact N-O 3.1Å
179	Y	86.2	Confident	79.4	Confident	53 Å²	53	78.5 Å²	78.5	21%	0.208	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	147.2	-179.2	70.6	-82	0	0	0	112.1	Q136 M172 G173 I181	Q136-Y179 CarbonylContact O-C 3.49Å; Q136-Y179 VanDerWaalsContact O-CA 3.3Å; Q136-Y179 WeakPolarHBondContact O-CA 3.49Å; M172-Y179 VanDerWaalsContact C-CE1 3.44Å; M172-Y179 HydrophobicContact CB-CD1 3.92Å; M172-Y179 HydrophobicContact CB-CD2 3.98Å; M172-Y179 HydrophobicContact CB-CE1 3.43Å; M172-Y179 VanDerWaalsContact CB-CE1 3.43Å; M172-Y179 HydrophobicContact CB-CE2 3.48Å; M172-Y179 VanDerWaalsContact CB-CE2 3.48Å; M172-Y179 HydrophobicContact CB-CG 4.18Å; M172-Y179 WeakPolarHBondContact CB-OH 3.32Å; M172-Y179 HydrophobicContact CE-CD1 4.3Å; M172-Y179 HydrophobicContact CE-CD2 3.77Å; M172-Y179 HydrophobicContact CE-CE2 4.39Å; M172-Y179 HydrophobicContact CE-CG 3.72Å; M172-Y179 HydrophobicContact CG-CD2 4.44Å; M172-Y179 HydrophobicContact CG-CE2 4.17Å; M172-Y179 WeakPolarHBondContact O-CE1 3.11Å; G173-Y179 PolarHBondContact N-OH 3.14Å; Y179-I181 HydrophobicContact CD2-CG1 4.32Å; Y179-I181 HydrophobicContact CE2-CD1 4.45Å; Y179-I181 HydrophobicContact CE2-CG1 4.13Å
180	D	85.4	Confident	77.4	Confident	77 Å²	77	78.2 Å²	78.2	41%	0.412	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132.4	170.2	-71.1	-39.1	0	0	0	110	C135 Q136 R149 V182	C135-D180 CarbonylContact C-O 3.6Å; C135-D180 WeakPolarHBondContact CA-O 3.23Å; Q136-D180 HydrophobicContact CB-CB 4.47Å; Q136-D180 PolarHBondContact N-O 3.42Å; Q136-D180 PolarHBondContact O-N 3.01Å; R149-D180 IonicContact NH1-OD2 3.31Å; D180-V182 PolarHBondContact O-N 2.79Å
181	I	88.9	Confident	75.7	Confident	53 Å²	53	75.3 Å²	75.3	27%	0.272	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	104.9	171.4	-56.5	174.7	0	0	0	109	K134 L165 V168 D169 Y179	K134-I181 CarbonylContact O-C 3.6Å; L165-I181 HydrophobicContact CD1-CD1 3.63Å; V168-I181 HydrophobicContact CB-CD1 4.04Å; V168-I181 HydrophobicContact CG1-CD1 3.49Å; V168-I181 VanDerWaalsContact CG1-CD1 3.49Å; V168-I181 HydrophobicContact CG1-CG1 3.95Å; D169-I181 WeakPolarHBondContact OD1-CD1 3.38Å; Y179-I181 HydrophobicContact CD2-CG1 4.32Å; Y179-I181 HydrophobicContact CE2-CD1 4.45Å; Y179-I181 HydrophobicContact CE2-CG1 4.13Å
182	V	87.6	Confident	74.1	Confident	77 Å²	77	75 Å²	75	47%	0.467	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	-22.4	-178.2	-173.9	0	0	0	0	112.6	K134 Q136 D180	K134-V182 HydrophobicContact CD-CB 4.43Å; K134-V182 HydrophobicContact CD-CG1 4.45Å; K134-V182 HydrophobicContact CG-CB 4.36Å; K134-V182 WeakPolarHBondContact O-CA 3.1Å; K134-V182 WeakPolarHBondContact O-CB 3.26Å; K134-V182 PolarHBondContact O-N 2.83Å; Q136-V182 HydrophobicContact CB-CG2 3.45Å; Q136-V182 VanDerWaalsContact CB-CG2 3.45Å; D180-V182 PolarHBondContact O-N 2.79Å
183	G	86.7	Confident	72.7	Confident	23 Å²	23	76.6 Å²	76.6	24%	0.237	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.5	148.6	174.3	0	0	0	0	0	113.4	A133 K134	A133-G183 CarbonylContact C-O 3.55Å; A133-G183 WeakPolarHBondContact CA-O 3.26Å; K134-G183 PolarHBondContact N-O 2.83Å; K134-G183 PolarHBondContact O-N 3.41Å
184	L	91.1	Very high	72.1	Confident	26 Å²	26	78.2 Å²	78.2	14%	0.136	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	114.2	178.8	-174.6	68.2	0	0	0	107.9	K132 A133 L161 A164 L165 V168	K132-L184 WeakPolarHBondContact O-CA 3.27Å; A133-L184 HydrophobicContact CB-CD1 3.52Å; L161-L184 HydrophobicContact CD1-CB 4.12Å; L161-L184 HydrophobicContact CD1-CD2 3.68Å; L161-L184 HydrophobicContact CD1-CG 3.65Å; L161-L184 WeakPolarHBondContact CD1-O 3.4Å; L161-L184 HydrophobicContact CG-CD2 4.18Å; A164-L184 HydrophobicContact CB-CD1 4.21Å; A164-L184 HydrophobicContact CB-CD2 3.94Å; A164-L184 HydrophobicContact CB-CG 4.41Å; L165-L184 HydrophobicContact CB-CD2 3.88Å; L165-L184 HydrophobicContact CD1-CD2 4.21Å; V168-L184 HydrophobicContact CG2-CD1 4.48Å
185	N	87.4	Confident	71.6	Confident	111 Å²	111	74.3 Å²	74.3	59%	0.594	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.2	137.2	-175.2	-61.8	-72	0	0	0	111.1	Y131 K132	Y131-N185 CarbonylContact C-O 3.59Å; Y131-N185 WeakPolarHBondContact CA-O 3.41Å; K132-N185 PolarHBondContact N-O 3.28Å; K132-N185 PolarHBondContact O-N 3.32Å
186	E	84.9	Confident	71.4	Confident	105 Å²	105	73.8 Å²	73.8	49%	0.491	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	138.8	171	-170.6	175.1	166.4	0	0	110.3	K129 Y131	K129-E186 WeakPolarHBondContact CD-OE1 3.29Å; K129-E186 WeakPolarHBondContact CE-OE1 3.42Å; K129-E186 IonicContact NZ-OE1 2.63Å; K129-E186 PolarHBondContact NZ-OE1 3.13Å; K129-E186 IonicContact NZ-OE2 3.22Å; Y131-E186 HydrophobicContact CD1-CB 4.04Å; Y131-E186 HydrophobicContact CE1-CB 3.74Å; Y131-E186 HydrophobicContact CE1-CG 4.29Å
187	T	73.1	Confident	72.3	Confident	25 Å²	25	64.2 Å²	64.2	15%	0.153	34%	0.343	C	S	.	.			trans	-104.8	162.5	178.5	71.7	0	0	0	0	110.6	W130 K132 M155 I189	W130-T187 WeakPolarHBondContact CB-OG1 3.15Å; W130-T187 WeakPolarHBondContact O-CA 3.46Å; W130-T187 WeakPolarHBondContact O-CB 3.39Å; W130-T187 PolarHBondContact O-N 3.48Å; W130-T187 PolarHBondContact O-OG1 3.45Å; K132-T187 HydrophobicContact CB-CG2 3.62Å; M155-T187 HydrophobicContact CE-CG2 3.73Å; M155-T187 HydrophobicContact SD-CG2 3.93Å; T187-I189 VanDerWaalsContact C-N 3.26Å; T187-I189 HydrophobicContact CG2-CD1 4.49Å; T187-I189 PolarHBondContact O-N 2.72Å; T187-I189 PolarHBondContact OG1-N 3.47Å
188	K	64.9	Low	72.6	Confident	141 Å²	141	62.4 Å²	62.4	61%	0.613	33%	0.329	S	S	*	.			trans	-90.6	20.6	173.1	-61.2	-170.5	177.8	-171.3	0	112.9	S869	K188-S869 PolarHBondContact NZ-OG 2.86Å
189	I	59.2	Low	72.4	Confident	27 Å²	27	60.8 Å²	60.8	14%	0.138	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-78.9	131	178.9	-61.3	167	0	0	0	107.5	L79 V81 W130 M155 T187	L79-I189 HydrophobicContact CD2-CG1 4.43Å; V81-I189 HydrophobicContact CG2-CD1 3.55Å; V81-I189 HydrophobicContact CG2-CG1 4.01Å; W130-I189 HydrophobicContact CB-CB 4.12Å; W130-I189 HydrophobicContact CG-CB 4.21Å; W130-I189 HydrophobicContact CG-CG2 4.2Å; M155-I189 HydrophobicContact CE-CD1 3.67Å; M155-I189 HydrophobicContact SD-CD1 4.18Å; T187-I189 VanDerWaalsContact C-N 3.26Å; T187-I189 HydrophobicContact CG2-CD1 4.49Å; T187-I189 PolarHBondContact O-N 2.72Å; T187-I189 PolarHBondContact OG1-N 3.47Å
190	C	45.7	Very low	72	Confident	65 Å²	65	59.1 Å²	59.1	44%	0.439	31%	0.313	S	S	.	.			trans	-103.5	126.7	-172	-140.1	0	0	0	0	110.4	L192	C190-L192 VanDerWaalsContact C-N 3.27Å; C190-L192 HydrophobicContact CB-CD1 3.64Å; C190-L192 PolarHBondContact O-N 2.71Å
191	D	50.1	Low	72.1	Confident	59 Å²	59	57.3 Å²	57.3	32%	0.316	30%	0.301	S	S	.	.			trans	-74.7	77.9	170.7	-92.6	-27	0	0	0	110.3	W130 Q157 A193	W130-D191 PolarHBondContact NE1-OD1 2.91Å; W130-D191 PolarHBondContact NE1-OD2 2.48Å; W130-D191 VanDerWaalsContact NE1-OD2 3.17Å; Q157-D191 PolarHBondContact NE2-OD2 2.91Å; D191-A193 PolarHBondContact O-N 2.69Å
192	L	49.3	Very low	72	Confident	56 Å²	56	57.4 Å²	57.4	29%	0.293	30%	0.302	S	S	.	.	H	α-helix	trans	-72.6	-25.2	-167.6	-127.4	87.5	0	0	0	113.9	Y80 C190 K196	Y80-L192 HydrophobicContact CE1-CD1 4.19Å; Y80-L192 HydrophobicContact CE1-CD2 4.24Å; C190-L192 VanDerWaalsContact C-N 3.27Å; C190-L192 HydrophobicContact CB-CD1 3.64Å; C190-L192 PolarHBondContact O-N 2.71Å; L192-K196 HydrophobicContact CD2-CG 4.46Å; L192-K196 HydrophobicContact CG-CB 4.48Å; L192-K196 WeakPolarHBondContact O-CA 3.34Å; L192-K196 WeakPolarHBondContact O-CB 3.43Å; L192-K196 PolarHBondContact O-N 2.75Å
193	A	54	Low	71.8	Confident	42 Å²	42	61.3 Å²	61.3	35%	0.347	32%	0.315	S	S	.	.	H	α-helix	trans	-67.6	-46.9	-159	0	0	0	0	0	114.8	D191 F197 H242	D191-A193 PolarHBondContact O-N 2.69Å; A193-F197 VanDerWaalsContact O-CB 3.23Å; A193-F197 WeakPolarHBondContact O-CB 3.4Å; A193-F197 PolarHBondContact O-N 3.38Å; A193-H242 VanDerWaalsContact CB-CE1 3.47Å; A193-H242 WeakPolarHBondContact CB-CE1 3.43Å
194	R	63.9	Low	71.6	Confident	90 Å²	90	66 Å²	66	34%	0.34	33%	0.329	S	S	.	.	H	α-helix	trans	-68.5	-57.1	-179.5	175.6	175.1	-171.2	-84.7	4.8	110.9	K196 F197 I198 E210 F213 E214	R194-K196 VanDerWaalsContact C-N 3.25Å; R194-K196 PolarHBondContact O-N 3.48Å; R194-F197 WeakPolarHBondContact O-CB 3.31Å; R194-F197 PolarHBondContact O-N 2.9Å; R194-F197 VanDerWaalsContact O-N 3.12Å; R194-I198 HydrophobicContact CG-CD1 3.79Å; R194-I198 WeakPolarHBondContact O-CG1 3.3Å; R194-I198 PolarHBondContact O-N 2.89Å; R194-E210 IonicContact CZ-OE1 3.81Å; R194-E210 IonicContact NH1-OE1 3.85Å; R194-E210 IonicContact NH2-OE1 2.91Å; R194-E210 PolarHBondContact NH2-OE1 3.47Å; R194-F213 HydrophobicContact CB-CE1 4.14Å; R194-F213 HydrophobicContact CB-CE2 3.96Å; R194-F213 HydrophobicContact CB-CZ 3.64Å; R194-F213 HydrophobicContact CG-CD1 3.96Å; R194-F213 HydrophobicContact CG-CD2 4.44Å; R194-F213 HydrophobicContact CG-CE1 3.56Å; R194-F213 HydrophobicContact CG-CE2 4.04Å; R194-F213 HydrophobicContact CG-CG 4.39Å; R194-F213 HydrophobicContact CG-CZ 3.6Å; R194-E214 IonicContact NE-OE1 3.51Å; R194-E214 PolarHBondContact NE-OE1 3.37Å; R194-E214 IonicContact NH2-OE1 2.71Å
195	D	63.4	Low	71.3	Confident	100 Å²	100	67.7 Å²	67.7	54%	0.535	34%	0.335	S	S	.	.	H	α-helix	trans	-62.7	-37.3	-176.2	-68.8	-10.7	0	0	0	110.8	I198 E199	D195-I198 PolarHBondContact O-N 2.82Å; D195-E199 WeakPolarHBondContact O-CB 3.14Å; D195-E199 PolarHBondContact O-N 2.82Å
196	K	64	Low	71	Confident	36 Å²	36	64 Å²	64	16%	0.157	32%	0.324	C	S	.	.	H	α-helix	trans	-69.2	-38.9	175.4	-163.3	63.5	176.7	176.2	0	112.6	Y101 L192 R194 I198 E199 V200 M246	Y101-K196 HydrophobicContact CE1-CG 4.4Å; L192-K196 HydrophobicContact CD2-CG 4.46Å; L192-K196 HydrophobicContact CG-CB 4.48Å; L192-K196 WeakPolarHBondContact O-CA 3.34Å; L192-K196 WeakPolarHBondContact O-CB 3.43Å; L192-K196 PolarHBondContact O-N 2.75Å; R194-K196 VanDerWaalsContact C-N 3.25Å; R194-K196 PolarHBondContact O-N 3.48Å; K196-I198 VanDerWaalsContact C-N 3.33Å; K196-E199 VanDerWaalsContact CD-OE2 3.3Å; K196-E199 WeakPolarHBondContact CD-OE2 3.27Å; K196-E199 VanDerWaalsContact NZ-CD 3.27Å; K196-E199 IonicContact NZ-OE1 3.2Å; K196-E199 PolarHBondContact NZ-OE1 2.74Å; K196-E199 IonicContact NZ-OE2 3.3Å; K196-E199 PolarHBondContact NZ-OE2 2.76Å; K196-E199 VanDerWaalsContact NZ-OE2 3.11Å; K196-E199 PolarHBondContact O-N 2.78Å; K196-V200 HydrophobicContact CD-CG2 4.34Å; K196-V200 HydrophobicContact CG-CG2 4.16Å; K196-V200 VanDerWaalsContact O-CB 3.26Å; K196-V200 WeakPolarHBondContact O-CB 3.44Å; K196-V200 WeakPolarHBondContact O-CG2 3.43Å; K196-V200 PolarHBondContact O-N 2.85Å; K196-M246 HydrophobicContact CB-CE 4.22Å; K196-M246 HydrophobicContact CG-CE 3.92Å
197	F	79.6	Confident	70.9	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-59.4	-47.5	173.8	-175.4	-73.8	0	0	0	110.6	A193 R194 V200 Y201 F212 F213 Q216 F245 M246 L248 A249	A193-F197 VanDerWaalsContact O-CB 3.23Å; A193-F197 WeakPolarHBondContact O-CB 3.4Å; A193-F197 PolarHBondContact O-N 3.38Å; R194-F197 WeakPolarHBondContact O-CB 3.31Å; R194-F197 PolarHBondContact O-N 2.9Å; R194-F197 VanDerWaalsContact O-N 3.12Å; F197-V200 PolarHBondContact O-N 2.86Å; F197-Y201 WeakPolarHBondContact O-CB 3.35Å; F197-Y201 PolarHBondContact O-N 2.84Å; F197-F212 AromaticContact CE1-CD1 3.7Å; F197-F212 HydrophobicContact CE1-CD1 3.7Å; F197-F212 HydrophobicContact CE1-CE1 4.23Å; F197-F212 AromaticContact CZ-CD1 3.9Å; F197-F212 HydrophobicContact CZ-CD1 3.9Å; F197-F212 AromaticContact CZ-CE1 3.97Å; F197-F212 HydrophobicContact CZ-CE1 3.97Å; F197-F213 HydrophobicContact CB-CD2 3.8Å; F197-F213 HydrophobicContact CB-CE2 4.27Å; F197-F213 HydrophobicContact CD1-CB 3.66Å; F197-F213 AromaticContact CD1-CD2 3.57Å; F197-F213 HydrophobicContact CD1-CD2 3.57Å; F197-F213 HydrophobicContact CD1-CG 4.09Å; F197-F213 HydrophobicContact CD2-CD2 4.21Å; F197-F213 HydrophobicContact CE1-CB 3.76Å; F197-F213 HydrophobicContact CE1-CD2 4.11Å; F197-F213 HydrophobicContact CE1-CG 4.44Å; F197-F213 AromaticContact CG-CD2 3.62Å; F197-F213 HydrophobicContact CG-CD2 3.62Å; F197-F213 HydrophobicContact CG-CE2 4.39Å; F197-Q216 HydrophobicContact CZ-CB 4.3Å; F197-F245 AromaticContact CD2-CD1 3.73Å; F197-F245 HydrophobicContact CD2-CD1 3.73Å; F197-F245 AromaticContact CD2-CE1 3.43Å; F197-F245 HydrophobicContact CD2-CE1 3.43Å; F197-F245 VanDerWaalsContact CD2-CE1 3.43Å; F197-F245 HydrophobicContact CD2-CZ 4.03Å; F197-F245 AromaticContact CE2-CD1 3.92Å; F197-F245 HydrophobicContact CE2-CD1 3.92Å; F197-F245 HydrophobicContact CE2-CD2 4.42Å; F197-F245 AromaticContact CE2-CE1 3.58Å; F197-F245 HydrophobicContact CE2-CE1 3.58Å; F197-F245 HydrophobicContact CE2-CE2 4.14Å; F197-F245 HydrophobicContact CE2-CG 4.33Å; F197-F245 AromaticContact CE2-CZ 3.71Å; F197-F245 HydrophobicContact CE2-CZ 3.71Å; F197-F245 WeakPolarHBondContact CE2-O 3.22Å; F197-F245 HydrophobicContact CG-CE1 4.21Å; F197-F245 HydrophobicContact CZ-CE1 4.45Å; F197-F245 HydrophobicContact CZ-CZ 4.24Å; F197-M246 HydrophobicContact CB-CE 4.46Å; F197-M246 HydrophobicContact CB-SD 3.76Å; F197-M246 HydrophobicContact CD2-SD 3.95Å; F197-M246 HydrophobicContact CG-SD 4.31Å; F197-L248 HydrophobicContact CE2-CB 4.21Å; F197-L248 HydrophobicContact CZ-CB 4.32Å; F197-A249 HydrophobicContact CB-CB 4.43Å; F197-A249 HydrophobicContact CD1-CB 3.75Å; F197-A249 HydrophobicContact CD2-CB 3.52Å; F197-A249 HydrophobicContact CE1-CB 3.82Å; F197-A249 HydrophobicContact CE2-CB 3.58Å; F197-A249 HydrophobicContact CG-CB 3.6Å; F197-A249 HydrophobicContact CZ-CB 3.73Å
198	I	78.8	Confident	71.3	Confident	20 Å²	20	67.5 Å²	67.5	10%	0.103	35%	0.349	C	S	.	.	H	α-helix	trans	-64.3	-45.3	179	-64.4	172.1	0	0	0	110.6	R194 D195 K196 Y201 N202 E210 F213	R194-I198 HydrophobicContact CG-CD1 3.79Å; R194-I198 WeakPolarHBondContact O-CG1 3.3Å; R194-I198 PolarHBondContact O-N 2.89Å; D195-I198 PolarHBondContact O-N 2.82Å; K196-I198 VanDerWaalsContact C-N 3.33Å; I198-Y201 PolarHBondContact O-N 2.8Å; I198-N202 WeakPolarHBondContact CG2-ND2 3.42Å; I198-N202 WeakPolarHBondContact O-CB 3.42Å; I198-N202 PolarHBondContact O-N 3.17Å; I198-N202 PolarHBondContact O-ND2 3.02Å; I198-E210 HydrophobicContact CD1-CB 4.05Å; I198-E210 HydrophobicContact CD1-CG 4.18Å; I198-F213 HydrophobicContact CD1-CB 4.48Å; I198-F213 HydrophobicContact CG1-CB 3.96Å; I198-F213 HydrophobicContact CG1-CG 4.36Å
199	E	76.4	Confident	72.3	Confident	91 Å²	91	60.8 Å²	60.8	43%	0.425	32%	0.32	S	S	.	.	H	α-helix	trans	-59.2	-50.9	176.8	-173.6	-162.1	144.3	0	0	111.1	D195 K196 Y201 N202 Q203	D195-E199 WeakPolarHBondContact O-CB 3.14Å; D195-E199 PolarHBondContact O-N 2.82Å; K196-E199 VanDerWaalsContact CD-OE2 3.3Å; K196-E199 WeakPolarHBondContact CD-OE2 3.27Å; K196-E199 VanDerWaalsContact NZ-CD 3.27Å; K196-E199 IonicContact NZ-OE1 3.2Å; K196-E199 PolarHBondContact NZ-OE1 2.74Å; K196-E199 IonicContact NZ-OE2 3.3Å; K196-E199 PolarHBondContact NZ-OE2 2.76Å; K196-E199 VanDerWaalsContact NZ-OE2 3.11Å; K196-E199 PolarHBondContact O-N 2.78Å; E199-Y201 PolarHBondContact O-N 3.47Å; E199-N202 PolarHBondContact O-N 3.02Å; E199-Q203 VanDerWaalsContact O-CB 3.24Å; E199-Q203 WeakPolarHBondContact O-CB 3.06Å; E199-Q203 PolarHBondContact O-N 2.88Å
200	V	76.5	Confident	73.2	Confident	18 Å²	18	64.1 Å²	64.1	11%	0.109	34%	0.335	C	S	.	.	H	α-helix	trans	-62.7	-43.8	-179.4	167.8	0	0	0	0	111.1	Y101 K196 F197 K204 M246 A249 I250	Y101-V200 HydrophobicContact CE1-CG2 4.38Å; K196-V200 HydrophobicContact CD-CG2 4.34Å; K196-V200 HydrophobicContact CG-CG2 4.16Å; K196-V200 VanDerWaalsContact O-CB 3.26Å; K196-V200 WeakPolarHBondContact O-CB 3.44Å; K196-V200 WeakPolarHBondContact O-CG2 3.43Å; K196-V200 PolarHBondContact O-N 2.85Å; F197-V200 PolarHBondContact O-N 2.86Å; V200-K204 PolarHBondContact O-N 3.33Å; V200-M246 HydrophobicContact CB-CE 4.48Å; V200-M246 HydrophobicContact CG2-CE 4.09Å; V200-A249 HydrophobicContact CB-CB 4.49Å; V200-A249 HydrophobicContact CG1-CB 4.24Å; V200-I250 HydrophobicContact CG1-CB 4.46Å; V200-I250 HydrophobicContact CG1-CG1 3.69Å
201	Y	87.5	Confident	74.9	Confident	38 Å²	38	65.1 Å²	65.1	15%	0.149	34%	0.338	C	S	.	.	H	α-helix	trans	-62.2	-51.3	175.2	-175.5	-82.6	0	0	0	110.6	F197 I198 E199 Q203 K204 F205 F212	F197-Y201 WeakPolarHBondContact O-CB 3.35Å; F197-Y201 PolarHBondContact O-N 2.84Å; I198-Y201 PolarHBondContact O-N 2.8Å; E199-Y201 PolarHBondContact O-N 3.47Å; Y201-Q203 VanDerWaalsContact C-N 3.32Å; Y201-Q203 PolarHBondContact O-N 2.72Å; Y201-K204 PolarHBondContact O-N 2.78Å; Y201-K204 VanDerWaalsContact O-N 3.13Å; Y201-F205 HydrophobicContact CD1-CB 4.23Å; Y201-F205 AromaticContact CD2-CD2 3.81Å; Y201-F205 HydrophobicContact CD2-CD2 3.81Å; Y201-F205 HydrophobicContact CD2-CE2 4.47Å; Y201-F205 HydrophobicContact CE1-CB 3.89Å; Y201-F205 HydrophobicContact CE2-CB 4.47Å; Y201-F205 AromaticContact CE2-CD2 3.94Å; Y201-F205 HydrophobicContact CE2-CD2 3.94Å; Y201-F205 HydrophobicContact CE2-CG 4.41Å; Y201-F205 HydrophobicContact CG-CD2 4.15Å; Y201-F205 PolarHBondContact O-N 2.62Å; Y201-F212 HydrophobicContact CD2-CB 4.29Å; Y201-F212 AromaticContact CD2-CD1 3.23Å; Y201-F212 HydrophobicContact CD2-CD1 3.23Å; Y201-F212 AromaticContact CD2-CE1 3.64Å; Y201-F212 HydrophobicContact CD2-CE1 3.64Å; Y201-F212 AromaticContact CD2-CG 3.83Å; Y201-F212 HydrophobicContact CD2-CG 3.83Å; Y201-F212 HydrophobicContact CD2-CZ 4.5Å; Y201-F212 HydrophobicContact CE1-CB 4.33Å; Y201-F212 HydrophobicContact CE2-CB 3.91Å; Y201-F212 AromaticContact CE2-CD1 3.17Å; Y201-F212 HydrophobicContact CE2-CD1 3.17Å; Y201-F212 AromaticContact CE2-CD2 3.82Å; Y201-F212 HydrophobicContact CE2-CD2 3.82Å; Y201-F212 AromaticContact CE2-CE1 3.52Å; Y201-F212 HydrophobicContact CE2-CE1 3.52Å; Y201-F212 HydrophobicContact CE2-CE2 4.11Å; Y201-F212 AromaticContact CE2-CG 3.34Å; Y201-F212 HydrophobicContact CE2-CG 3.34Å; Y201-F212 AromaticContact CE2-CZ 3.97Å; Y201-F212 HydrophobicContact CE2-CZ 3.97Å; Y201-F212 HydrophobicContact CG-CD1 4.14Å; Y201-F212 AromaticContact CZ-CG 3.78Å
202	N	88.3	Confident	76.8	Confident	56 Å²	56	63.2 Å²	63.2	30%	0.299	33%	0.327	S	S	.	.	H	α-helix	trans	-64.1	-37.2	-175.7	-74.5	-18.2	0	0	0	112.6	I198 E199 K204 G206 G208 G209	I198-N202 WeakPolarHBondContact CG2-ND2 3.42Å; I198-N202 WeakPolarHBondContact O-CB 3.42Å; I198-N202 PolarHBondContact O-N 3.17Å; I198-N202 PolarHBondContact O-ND2 3.02Å; E199-N202 PolarHBondContact O-N 3.02Å; N202-K204 VanDerWaalsContact C-N 3.27Å; N202-K204 PolarHBondContact O-N 2.7Å; N202-G206 VanDerWaalsContact CA-O 3.27Å; N202-G206 WeakPolarHBondContact CA-O 3.33Å; N202-G206 VanDerWaalsContact O-CA 3.26Å; N202-G206 WeakPolarHBondContact O-CA 2.92Å; N202-G206 PolarHBondContact O-N 2.99Å; N202-G206 PolarHBondContact OD1-O 3.39Å; N202-G206 VanDerWaalsContact OD1-O 3.04Å; N202-G208 PolarHBondContact OD1-N 3.42Å; N202-G209 VanDerWaalsContact OD1-CA 3.3Å; N202-G209 WeakPolarHBondContact OD1-CA 3.37Å; N202-G209 PolarHBondContact OD1-N 2.62Å
203	Q	82	Confident	78.5	Confident	159 Å²	159	61.3 Å²	61.3	74%	0.743	32%	0.316	S	S	*	.	H	α-helix	trans	-62.8	-34.5	176.6	-171.2	-179.1	17.3	0	0	112.1	E199 Y201	E199-Q203 VanDerWaalsContact O-CB 3.24Å; E199-Q203 WeakPolarHBondContact O-CB 3.06Å; E199-Q203 PolarHBondContact O-N 2.88Å; Y201-Q203 VanDerWaalsContact C-N 3.32Å; Y201-Q203 PolarHBondContact O-N 2.72Å
204	K	82.4	Confident	79.5	Confident	122 Å²	122	63 Å²	63	53%	0.53	32%	0.317	S	S	.	.	H	α-helix	trans	-96.9	-30.9	-175	-162.8	172.7	179.6	176.4	0	114.2	V200 Y201 N202 I250	V200-K204 PolarHBondContact O-N 3.33Å; Y201-K204 PolarHBondContact O-N 2.78Å; Y201-K204 VanDerWaalsContact O-N 3.13Å; N202-K204 VanDerWaalsContact C-N 3.27Å; N202-K204 PolarHBondContact O-N 2.7Å; K204-I250 WeakPolarHBondContact CD-O 3.39Å; K204-I250 VanDerWaalsContact CE-O 3.3Å; K204-I250 WeakPolarHBondContact CE-O 3.3Å; K204-I250 PolarHBondContact NZ-O 2.91Å
205	F	84.7	Confident	80.4	Confident	60 Å²	60	62.7 Å²	62.7	26%	0.263	32%	0.32	S	S	.	.	H	α-helix	trans	-121.3	-4.2	-172.2	-57.7	-69.7	0	0	0	114.5	Y201 A249 N251 G252	Y201-F205 HydrophobicContact CD1-CB 4.23Å; Y201-F205 AromaticContact CD2-CD2 3.81Å; Y201-F205 HydrophobicContact CD2-CD2 3.81Å; Y201-F205 HydrophobicContact CD2-CE2 4.47Å; Y201-F205 HydrophobicContact CE1-CB 3.89Å; Y201-F205 HydrophobicContact CE2-CB 4.47Å; Y201-F205 AromaticContact CE2-CD2 3.94Å; Y201-F205 HydrophobicContact CE2-CD2 3.94Å; Y201-F205 HydrophobicContact CE2-CG 4.41Å; Y201-F205 HydrophobicContact CG-CD2 4.15Å; Y201-F205 PolarHBondContact O-N 2.62Å; F205-A249 WeakPolarHBondContact CE2-O 3.44Å; F205-N251 VanDerWaalsContact CZ-C 3.41Å; F205-N251 WeakPolarHBondContact CZ-O 3.47Å; F205-G252 VanDerWaalsContact CE2-CA 3.5Å; F205-G252 VanDerWaalsContact CE2-N 3.33Å
206	G	81.4	Confident	81.6	Confident	35 Å²	35	58 Å²	58	36%	0.361	29%	0.294	S	S	.	.			trans	84.7	-175.2	-174.5	0	0	0	0	0	112.8	N202	N202-G206 VanDerWaalsContact CA-O 3.27Å; N202-G206 WeakPolarHBondContact CA-O 3.33Å; N202-G206 VanDerWaalsContact O-CA 3.26Å; N202-G206 WeakPolarHBondContact O-CA 2.92Å; N202-G206 PolarHBondContact O-N 2.99Å; N202-G206 PolarHBondContact OD1-O 3.39Å; N202-G206 VanDerWaalsContact OD1-O 3.04Å
207	E	82.7	Confident	82.3	Confident	165 Å²	165	58.5 Å²	58.5	77%	0.771	30%	0.297	S	S	*	.	S	Bend	trans	-51.4	148.2	-179.4	-67.9	174.1	-162.6	0	0	113.2
208	G	82.7	Confident	82	Confident	38 Å²	38	61.5 Å²	61.5	39%	0.392	32%	0.321	S	S	.	.			trans	123.4	-4.3	177	0	0	0	0	0	114.9	N202 E210 V211 F212	N202-G208 PolarHBondContact OD1-N 3.42Å; G208-E210 PolarHBondContact O-N 2.97Å; G208-E210 VanDerWaalsContact O-N 3.17Å; G208-V211 PolarHBondContact O-N 2.93Å; G208-V211 VanDerWaalsContact O-N 3.12Å; G208-F212 PolarHBondContact O-N 2.78Å
209	G	84.7	Confident	82.3	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-57.5	-29.3	-178.9	0	0	0	0	0	114.5	N202 F213	N202-G209 VanDerWaalsContact OD1-CA 3.3Å; N202-G209 WeakPolarHBondContact OD1-CA 3.37Å; N202-G209 PolarHBondContact OD1-N 2.62Å; G209-F213 WeakPolarHBondContact O-CB 3.4Å; G209-F213 PolarHBondContact O-N 3.23Å
210	E	79	Confident	82.8	Confident	97 Å²	97	58.4 Å²	58.4	45%	0.453	31%	0.308	S	S	.	.	H	α-helix	trans	-67.6	-47.3	175.1	-173.7	170.3	-145.4	0	0	112.2	R194 I198 G208 F212 F213 E214	R194-E210 IonicContact CZ-OE1 3.81Å; R194-E210 IonicContact NH1-OE1 3.85Å; R194-E210 IonicContact NH2-OE1 2.91Å; R194-E210 PolarHBondContact NH2-OE1 3.47Å; I198-E210 HydrophobicContact CD1-CB 4.05Å; I198-E210 HydrophobicContact CD1-CG 4.18Å; G208-E210 PolarHBondContact O-N 2.97Å; G208-E210 VanDerWaalsContact O-N 3.17Å; E210-F212 VanDerWaalsContact C-N 3.33Å; E210-F212 PolarHBondContact O-N 3.04Å; E210-F213 PolarHBondContact O-N 2.8Å; E210-E214 PolarHBondContact O-N 3.33Å
211	V	81.9	Confident	82.7	Confident	85 Å²	85	58.4 Å²	58.4	52%	0.515	31%	0.307	S	S	.	.	H	α-helix	trans	-64.4	-42.9	176.5	179.3	0	0	0	0	110	G208 F213 E214 E215	G208-V211 PolarHBondContact O-N 2.93Å; G208-V211 VanDerWaalsContact O-N 3.12Å; V211-F213 PolarHBondContact O-N 3.2Å; V211-E214 PolarHBondContact O-N 2.87Å; V211-E215 WeakPolarHBondContact O-CB 3.45Å; V211-E215 PolarHBondContact O-N 3.45Å; V211-E215 VanDerWaalsContact O-N 3.08Å
212	F	89.2	Confident	82.3	Confident	20 Å²	20	60.3 Å²	60.3	9%	0.088	32%	0.32	C	S	.	.	H	α-helix	trans	-63.7	-40.1	177.1	-170.1	-104.8	0	0	0	111.9	F197 Y201 G208 E210 Q216 L253	F197-F212 AromaticContact CE1-CD1 3.7Å; F197-F212 HydrophobicContact CE1-CD1 3.7Å; F197-F212 HydrophobicContact CE1-CE1 4.23Å; F197-F212 AromaticContact CZ-CD1 3.9Å; F197-F212 HydrophobicContact CZ-CD1 3.9Å; F197-F212 AromaticContact CZ-CE1 3.97Å; F197-F212 HydrophobicContact CZ-CE1 3.97Å; Y201-F212 HydrophobicContact CD2-CB 4.29Å; Y201-F212 AromaticContact CD2-CD1 3.23Å; Y201-F212 HydrophobicContact CD2-CD1 3.23Å; Y201-F212 AromaticContact CD2-CE1 3.64Å; Y201-F212 HydrophobicContact CD2-CE1 3.64Å; Y201-F212 AromaticContact CD2-CG 3.83Å; Y201-F212 HydrophobicContact CD2-CG 3.83Å; Y201-F212 HydrophobicContact CD2-CZ 4.5Å; Y201-F212 HydrophobicContact CE1-CB 4.33Å; Y201-F212 HydrophobicContact CE2-CB 3.91Å; Y201-F212 AromaticContact CE2-CD1 3.17Å; Y201-F212 HydrophobicContact CE2-CD1 3.17Å; Y201-F212 AromaticContact CE2-CD2 3.82Å; Y201-F212 HydrophobicContact CE2-CD2 3.82Å; Y201-F212 AromaticContact CE2-CE1 3.52Å; Y201-F212 HydrophobicContact CE2-CE1 3.52Å; Y201-F212 HydrophobicContact CE2-CE2 4.11Å; Y201-F212 AromaticContact CE2-CG 3.34Å; Y201-F212 HydrophobicContact CE2-CG 3.34Å; Y201-F212 AromaticContact CE2-CZ 3.97Å; Y201-F212 HydrophobicContact CE2-CZ 3.97Å; Y201-F212 HydrophobicContact CG-CD1 4.14Å; Y201-F212 AromaticContact CZ-CG 3.78Å; G208-F212 PolarHBondContact O-N 2.78Å; E210-F212 VanDerWaalsContact C-N 3.33Å; E210-F212 PolarHBondContact O-N 3.04Å; F212-Q216 HydrophobicContact CD1-CG 3.98Å; F212-Q216 HydrophobicContact CD2-CG 4.14Å; F212-Q216 HydrophobicContact CE1-CG 3.64Å; F212-Q216 HydrophobicContact CE2-CG 3.82Å; F212-Q216 HydrophobicContact CG-CG 4.22Å; F212-Q216 HydrophobicContact CZ-CG 3.56Å; F212-Q216 VanDerWaalsContact O-CB 3.28Å; F212-Q216 WeakPolarHBondContact O-CB 3.22Å; F212-Q216 WeakPolarHBondContact O-CG 3.28Å; F212-Q216 PolarHBondContact O-N 3.39Å; F212-L253 WeakPolarHBondContact CZ-O 3.46Å
213	F	85.2	Confident	82	Confident	15 Å²	15	58.5 Å²	58.5	7%	0.066	31%	0.31	C	S	.	.	H	α-helix	trans	-60.6	-50.7	175.2	172.5	-93.7	0	0	0	111.5	R194 F197 I198 G209 E210 V211 E215 Q216 K217 F245	R194-F213 HydrophobicContact CB-CE1 4.14Å; R194-F213 HydrophobicContact CB-CE2 3.96Å; R194-F213 HydrophobicContact CB-CZ 3.64Å; R194-F213 HydrophobicContact CG-CD1 3.96Å; R194-F213 HydrophobicContact CG-CD2 4.44Å; R194-F213 HydrophobicContact CG-CE1 3.56Å; R194-F213 HydrophobicContact CG-CE2 4.04Å; R194-F213 HydrophobicContact CG-CG 4.39Å; R194-F213 HydrophobicContact CG-CZ 3.6Å; F197-F213 HydrophobicContact CB-CD2 3.8Å; F197-F213 HydrophobicContact CB-CE2 4.27Å; F197-F213 HydrophobicContact CD1-CB 3.66Å; F197-F213 AromaticContact CD1-CD2 3.57Å; F197-F213 HydrophobicContact CD1-CD2 3.57Å; F197-F213 HydrophobicContact CD1-CG 4.09Å; F197-F213 HydrophobicContact CD2-CD2 4.21Å; F197-F213 HydrophobicContact CE1-CB 3.76Å; F197-F213 HydrophobicContact CE1-CD2 4.11Å; F197-F213 HydrophobicContact CE1-CG 4.44Å; F197-F213 AromaticContact CG-CD2 3.62Å; F197-F213 HydrophobicContact CG-CD2 3.62Å; F197-F213 HydrophobicContact CG-CE2 4.39Å; I198-F213 HydrophobicContact CD1-CB 4.48Å; I198-F213 HydrophobicContact CG1-CB 3.96Å; I198-F213 HydrophobicContact CG1-CG 4.36Å; G209-F213 WeakPolarHBondContact O-CB 3.4Å; G209-F213 PolarHBondContact O-N 3.23Å; E210-F213 PolarHBondContact O-N 2.8Å; V211-F213 PolarHBondContact O-N 3.2Å; F213-E215 PolarHBondContact O-N 3.48Å; F213-Q216 PolarHBondContact O-N 2.86Å; F213-K217 HydrophobicContact CE1-CD 3.76Å; F213-K217 HydrophobicContact CZ-CD 4.02Å; F213-K217 WeakPolarHBondContact O-CB 3.4Å; F213-K217 PolarHBondContact O-N 3.39Å; F213-F245 AromaticContact CD2-CE1 3.87Å; F213-F245 HydrophobicContact CD2-CE1 3.87Å; F213-F245 HydrophobicContact CD2-CZ 4.01Å; F213-F245 AromaticContact CE2-CE1 3.62Å; F213-F245 HydrophobicContact CE2-CE1 3.62Å; F213-F245 HydrophobicContact CE2-CZ 4.01Å
214	E	75.9	Confident	81.6	Confident	78 Å²	78	51 Å²	51	36%	0.364	28%	0.275	S	S	.	.	H	α-helix	trans	-63.4	-41.5	-177.9	-65.5	-54.7	151.6	0	0	111.9	R194 E210 V211 K217 A218	R194-E214 IonicContact NE-OE1 3.51Å; R194-E214 PolarHBondContact NE-OE1 3.37Å; R194-E214 IonicContact NH2-OE1 2.71Å; E210-E214 PolarHBondContact O-N 3.33Å; V211-E214 PolarHBondContact O-N 2.87Å; E214-K217 IonicContact OE2-NZ 3.63Å; E214-A218 PolarHBondContact O-N 3.32Å
215	E	82.5	Confident	81.1	Confident	84 Å²	84	48 Å²	48	39%	0.393	26%	0.264	S	S	.	.	H	α-helix	trans	-63.7	-50.5	175.9	-170.3	-166.1	149.1	0	0	111.7	V211 F213 K217 A218 L219	V211-E215 WeakPolarHBondContact O-CB 3.45Å; V211-E215 PolarHBondContact O-N 3.45Å; V211-E215 VanDerWaalsContact O-N 3.08Å; F213-E215 PolarHBondContact O-N 3.48Å; E215-K217 PolarHBondContact O-N 3.49Å; E215-A218 PolarHBondContact O-N 3.03Å; E215-L219 HydrophobicContact CG-CD1 4.28Å; E215-L219 WeakPolarHBondContact O-CG 3.21Å; E215-L219 PolarHBondContact O-N 3.48Å; E215-L219 VanDerWaalsContact O-N 3.14Å
216	Q	87.9	Confident	80.8	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-69.4	-33.5	-178.1	-66.5	-44.2	-60.2	0	0	112.4	F197 F212 F213 L219 F220 F245 L248 S254	F197-Q216 HydrophobicContact CZ-CB 4.3Å; F212-Q216 HydrophobicContact CD1-CG 3.98Å; F212-Q216 HydrophobicContact CD2-CG 4.14Å; F212-Q216 HydrophobicContact CE1-CG 3.64Å; F212-Q216 HydrophobicContact CE2-CG 3.82Å; F212-Q216 HydrophobicContact CG-CG 4.22Å; F212-Q216 HydrophobicContact CZ-CG 3.56Å; F212-Q216 VanDerWaalsContact O-CB 3.28Å; F212-Q216 WeakPolarHBondContact O-CB 3.22Å; F212-Q216 WeakPolarHBondContact O-CG 3.28Å; F212-Q216 PolarHBondContact O-N 3.39Å; F213-Q216 PolarHBondContact O-N 2.86Å; Q216-L219 PolarHBondContact O-N 3.28Å; Q216-F220 WeakPolarHBondContact O-CB 3.4Å; Q216-F220 PolarHBondContact O-N 2.8Å; Q216-F245 HydrophobicContact CB-CE2 4.26Å; Q216-L248 HydrophobicContact CB-CD1 4.1Å; Q216-L248 HydrophobicContact CG-CD1 4.42Å; Q216-S254 PolarHBondContact NE2-OG 2.72Å; Q216-S254 VanDerWaalsContact OE1-CA 3.3Å
217	K	79.4	Confident	80.5	Confident	47 Å²	47	49.5 Å²	49.5	20%	0.204	27%	0.268	C	S	.	.	H	α-helix	trans	-57.6	-48.5	173.2	175.1	-175.8	171.3	-170.4	0	110.4	F213 E214 E215 N221 F245	F213-K217 HydrophobicContact CE1-CD 3.76Å; F213-K217 HydrophobicContact CZ-CD 4.02Å; F213-K217 WeakPolarHBondContact O-CB 3.4Å; F213-K217 PolarHBondContact O-N 3.39Å; E214-K217 IonicContact OE2-NZ 3.63Å; E215-K217 PolarHBondContact O-N 3.49Å; K217-N221 VanDerWaalsContact O-CB 3.27Å; K217-N221 WeakPolarHBondContact O-CB 3.43Å; K217-N221 VanDerWaalsContact O-CG 3.24Å; K217-N221 PolarHBondContact O-N 2.86Å; K217-F245 HydrophobicContact CB-CE2 4.49Å; K217-F245 HydrophobicContact CB-CZ 4.08Å
218	A	71.7	Confident	80.4	Confident	63 Å²	63	47.1 Å²	47.1	52%	0.521	27%	0.27	S	S	.	.	H	α-helix	trans	-62.5	-47	178.6	0	0	0	0	0	112.2	E214 E215 N222	E214-A218 PolarHBondContact O-N 3.32Å; E215-A218 PolarHBondContact O-N 3.03Å; A218-N222 WeakPolarHBondContact O-CB 3.37Å; A218-N222 PolarHBondContact O-N 3.4Å
219	L	85.8	Confident	80.4	Confident	46 Å²	46	48.5 Å²	48.5	24%	0.241	27%	0.265	C	S	.	.	H	α-helix	trans	-65.1	-44.2	179	-68.4	170.5	0	0	0	112.4	E215 Q216 N222 E223 L255 E256	E215-L219 HydrophobicContact CG-CD1 4.28Å; E215-L219 WeakPolarHBondContact O-CG 3.21Å; E215-L219 PolarHBondContact O-N 3.48Å; E215-L219 VanDerWaalsContact O-N 3.14Å; Q216-L219 PolarHBondContact O-N 3.28Å; L219-N222 PolarHBondContact O-N 3.05Å; L219-E223 PolarHBondContact O-N 2.98Å; L219-L255 HydrophobicContact CB-CB 4Å; L219-L255 HydrophobicContact CD1-CB 4.5Å; L219-E256 HydrophobicContact CD1-CB 4.08Å
220	F	86.4	Confident	80.1	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64.5	-43.7	178.9	-167.2	-88.2	0	0	0	111.3	Q216 N222 E223 L224 I241 A244 F245 L248 L255 L265 I284	Q216-F220 WeakPolarHBondContact O-CB 3.4Å; Q216-F220 PolarHBondContact O-N 2.8Å; F220-N222 VanDerWaalsContact C-N 3.33Å; F220-N222 PolarHBondContact O-N 3.04Å; F220-E223 PolarHBondContact O-N 3.5Å; F220-L224 HydrophobicContact CD1-CD1 3.62Å; F220-L224 HydrophobicContact CD1-CG 3.9Å; F220-L224 HydrophobicContact CE1-CD1 3.59Å; F220-L224 HydrophobicContact CE1-CD2 4.11Å; F220-L224 HydrophobicContact CE1-CG 3.87Å; F220-L224 WeakPolarHBondContact O-CG 3.49Å; F220-L224 PolarHBondContact O-N 3.38Å; F220-I241 HydrophobicContact CE1-CG2 3.62Å; F220-I241 HydrophobicContact CZ-CG2 4.02Å; F220-I241 WeakPolarHBondContact CZ-O 3.27Å; F220-A244 HydrophobicContact CE2-CB 4.23Å; F220-A244 HydrophobicContact CZ-CB 4.12Å; F220-F245 HydrophobicContact CB-CD2 3.78Å; F220-F245 HydrophobicContact CB-CE2 3.87Å; F220-F245 HydrophobicContact CD1-CB 4.45Å; F220-F245 AromaticContact CD1-CD2 3.84Å; F220-F245 HydrophobicContact CD1-CD2 3.84Å; F220-F245 HydrophobicContact CD1-CG 4.46Å; F220-F245 HydrophobicContact CD2-CB 4.34Å; F220-F245 AromaticContact CD2-CD2 3.62Å; F220-F245 HydrophobicContact CD2-CD2 3.62Å; F220-F245 HydrophobicContact CD2-CE2 4.48Å; F220-F245 HydrophobicContact CD2-CG 4.47Å; F220-F245 HydrophobicContact CE1-CB 4.02Å; F220-F245 HydrophobicContact CE1-CD2 4.25Å; F220-F245 HydrophobicContact CE1-CG 4.49Å; F220-F245 HydrophobicContact CE2-CB 3.93Å; F220-F245 HydrophobicContact CE2-CD2 4.09Å; F220-F245 AromaticContact CG-CD2 3.5Å; F220-F245 HydrophobicContact CG-CD2 3.5Å; F220-F245 VanDerWaalsContact CG-CD2 3.5Å; F220-F245 HydrophobicContact CG-CE2 4.12Å; F220-F245 HydrophobicContact CG-CG 4.46Å; F220-F245 HydrophobicContact CZ-CB 3.77Å; F220-F245 HydrophobicContact CZ-CD2 4.4Å; F220-L248 HydrophobicContact CD2-CD1 3.89Å; F220-L255 HydrophobicContact CB-CD1 3.79Å; F220-L255 HydrophobicContact CD2-CD1 3.5Å; F220-L255 HydrophobicContact CG-CD1 4.05Å; F220-L265 HydrophobicContact CD1-CD2 4.28Å; F220-L265 HydrophobicContact CD2-CD1 4.45Å; F220-L265 HydrophobicContact CD2-CD2 3.93Å; F220-L265 HydrophobicContact CE1-CD2 4.09Å; F220-L265 HydrophobicContact CE2-CD1 3.61Å; F220-L265 HydrophobicContact CE2-CD2 3.71Å; F220-L265 HydrophobicContact CE2-CG 4.2Å; F220-L265 HydrophobicContact CG-CD2 4.2Å; F220-L265 HydrophobicContact CZ-CD1 3.85Å; F220-L265 HydrophobicContact CZ-CD2 3.78Å; F220-L265 HydrophobicContact CZ-CG 4.48Å; F220-I284 HydrophobicContact CE2-CD1 4.12Å
221	N	74.6	Confident	80	Confident	19 Å²	19	49.6 Å²	49.6	10%	0.102	28%	0.28	C	S	.	.	H	α-helix	trans	-62.8	-40.2	175	-76.4	-10.4	0	0	0	111.9	I44 I46 K217 L224 L225	I44-N221 PolarHBondContact O-ND2 3.19Å; I46-N221 WeakPolarHBondContact CG1-OD1 3.34Å; K217-N221 VanDerWaalsContact O-CB 3.27Å; K217-N221 WeakPolarHBondContact O-CB 3.43Å; K217-N221 VanDerWaalsContact O-CG 3.24Å; K217-N221 PolarHBondContact O-N 2.86Å; N221-L224 PolarHBondContact O-N 3.43Å; N221-L225 WeakPolarHBondContact O-CB 3.14Å; N221-L225 VanDerWaalsContact O-CG 3.28Å; N221-L225 WeakPolarHBondContact O-CG 3.24Å; N221-L225 PolarHBondContact O-N 3.17Å
222	N	80.5	Confident	80.1	Confident	77 Å²	77	50.5 Å²	50.5	41%	0.412	28%	0.275	S	S	.	.	H	α-helix	trans	-62.5	-42.9	174.4	-169.3	24.4	0	0	0	111.8	A218 L219 F220 L224 L225 N226 G227	A218-N222 WeakPolarHBondContact O-CB 3.37Å; A218-N222 PolarHBondContact O-N 3.4Å; L219-N222 PolarHBondContact O-N 3.05Å; F220-N222 VanDerWaalsContact C-N 3.33Å; F220-N222 PolarHBondContact O-N 3.04Å; N222-L224 PolarHBondContact O-N 2.76Å; N222-L225 PolarHBondContact O-N 3.46Å; N222-N226 WeakPolarHBondContact O-CA 3.31Å; N222-N226 WeakPolarHBondContact O-CB 3.44Å; N222-N226 PolarHBondContact O-N 2.75Å; N222-N226 PolarHBondContact OD1-ND2 3.21Å; N222-G227 PolarHBondContact O-N 3.32Å
223	E	80.8	Confident	79.7	Confident	18 Å²	18	49.6 Å²	49.6	8%	0.084	27%	0.271	C	S	.	.	H	α-helix	trans	-65	-36.7	174.7	-73.7	-54.1	113.2	0	0	113	L219 F220 G227 K257 L265	L219-E223 PolarHBondContact O-N 2.98Å; F220-E223 PolarHBondContact O-N 3.5Å; E223-G227 WeakPolarHBondContact O-CA 3.25Å; E223-G227 PolarHBondContact O-N 3.05Å; E223-K257 WeakPolarHBondContact OE1-CE 3.48Å; E223-K257 IonicContact OE1-NZ 3.71Å; E223-K257 PolarHBondContact OE1-NZ 2.94Å; E223-K257 IonicContact OE2-NZ 3.85Å; E223-L265 HydrophobicContact CB-CB 4.09Å; E223-L265 HydrophobicContact CB-CD2 3.92Å; E223-L265 HydrophobicContact CG-CB 4.44Å
224	L	74.3	Confident	79.2	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-64.3	-41.4	175	-73.8	176.5	0	0	0	112.3	I46 F220 N221 N222 L233 I241 L265	I46-L224 HydrophobicContact CG2-CD1 4.46Å; F220-L224 HydrophobicContact CD1-CD1 3.62Å; F220-L224 HydrophobicContact CD1-CG 3.9Å; F220-L224 HydrophobicContact CE1-CD1 3.59Å; F220-L224 HydrophobicContact CE1-CD2 4.11Å; F220-L224 HydrophobicContact CE1-CG 3.87Å; F220-L224 WeakPolarHBondContact O-CG 3.49Å; F220-L224 PolarHBondContact O-N 3.38Å; N221-L224 PolarHBondContact O-N 3.43Å; N222-L224 PolarHBondContact O-N 2.76Å; L224-L233 HydrophobicContact CD2-CB 4.06Å; L224-L233 HydrophobicContact CD2-CD1 4.26Å; L224-I241 HydrophobicContact CD1-CG2 4.05Å; L224-I241 HydrophobicContact CD2-CD1 4.47Å; L224-I241 HydrophobicContact CD2-CG2 4.07Å; L224-L265 HydrophobicContact CD2-CD2 3.78Å; L224-L265 HydrophobicContact CG-CD2 3.96Å
225	L	71.6	Confident	79.4	Confident	59 Å²	59	54.3 Å²	54.3	31%	0.309	29%	0.291	S	S	.	.	H	α-helix	trans	-90	-34.2	-171.8	-67.5	172.6	0	0	0	113.6	I44 N221 N222 K230	I44-L225 HydrophobicContact CB-CD1 4.18Å; I44-L225 HydrophobicContact CG2-CD1 4.26Å; I44-L225 HydrophobicContact CG2-CD2 4.47Å; N221-L225 WeakPolarHBondContact O-CB 3.14Å; N221-L225 VanDerWaalsContact O-CG 3.28Å; N221-L225 WeakPolarHBondContact O-CG 3.24Å; N221-L225 PolarHBondContact O-N 3.17Å; N222-L225 PolarHBondContact O-N 3.46Å; L225-K230 WeakPolarHBondContact O-CD 3.47Å; L225-K230 WeakPolarHBondContact O-CE 3.31Å; L225-K230 PolarHBondContact O-NZ 2.85Å
226	N	78.7	Confident	78.7	Confident	119 Å²	119	50.7 Å²	50.7	64%	0.636	28%	0.275	S	S	*	.	H	α-helix	trans	-130.8	-3.7	-169	-56.3	-42.8	0	0	0	113.2	N222	N222-N226 WeakPolarHBondContact O-CA 3.31Å; N222-N226 WeakPolarHBondContact O-CB 3.44Å; N222-N226 PolarHBondContact O-N 2.75Å; N222-N226 PolarHBondContact OD1-ND2 3.21Å
227	G	75.9	Confident	77.7	Confident	7 Å²	7	54.8 Å²	54.8	7%	0.072	30%	0.301	C	S	.	.	S	Bend	trans	-71.9	160.7	179.8	0	0	0	0	0	113.2	N222 E223 F229 K230	N222-G227 PolarHBondContact O-N 3.32Å; E223-G227 WeakPolarHBondContact O-CA 3.25Å; E223-G227 PolarHBondContact O-N 3.05Å; G227-F229 PolarHBondContact O-N 3.39Å; G227-K230 WeakPolarHBondContact O-CB 3.27Å; G227-K230 PolarHBondContact O-N 2.86Å
228	S	79	Confident	76.7	Confident	115 Å²	115	56.4 Å²	56.4	80%	0.804	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-16.9	-177.4	-51.5	0	0	0	0	114.1
229	F	83.1	Confident	76	Confident	66 Å²	66	55.6 Å²	55.6	29%	0.289	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	9.5	179.4	-65	-84.1	0	0	0	113.9	G227 G231 Y232 L233 M266 G267	G227-F229 PolarHBondContact O-N 3.39Å; F229-G231 VanDerWaalsContact C-N 3.29Å; F229-G231 PolarHBondContact O-N 2.85Å; F229-G231 VanDerWaalsContact O-N 3.12Å; F229-Y232 HydrophobicContact CD1-CD2 4.27Å; F229-Y232 PolarHBondContact O-N 2.89Å; F229-L233 HydrophobicContact CB-CD1 3.95Å; F229-L233 HydrophobicContact CB-CG 4.07Å; F229-L233 WeakPolarHBondContact O-CG 3.42Å; F229-L233 PolarHBondContact O-N 3.34Å; F229-M266 HydrophobicContact CD2-CB 4.41Å; F229-M266 HydrophobicContact CD2-CG 4.19Å; F229-M266 HydrophobicContact CE1-CE 4.06Å; F229-M266 HydrophobicContact CE2-CB 4.41Å; F229-M266 HydrophobicContact CE2-CE 4.21Å; F229-M266 HydrophobicContact CE2-CG 3.83Å; F229-M266 HydrophobicContact CZ-CE 3.61Å; F229-M266 HydrophobicContact CZ-CG 4.18Å; F229-G267 WeakPolarHBondContact CD1-O 3.48Å
230	K	79.4	Confident	75.5	Confident	82 Å²	82	54.5 Å²	54.5	36%	0.357	30%	0.299	S	S	.	.	H	α-helix	trans	-38.5	-54.6	-179.8	177.8	-172.5	-172.9	153.6	0	113.1	L225 G227 Y232 L233 E234	L225-K230 WeakPolarHBondContact O-CD 3.47Å; L225-K230 WeakPolarHBondContact O-CE 3.31Å; L225-K230 PolarHBondContact O-NZ 2.85Å; G227-K230 WeakPolarHBondContact O-CB 3.27Å; G227-K230 PolarHBondContact O-N 2.86Å; K230-Y232 VanDerWaalsContact C-N 3.28Å; K230-Y232 PolarHBondContact O-N 3.5Å; K230-L233 PolarHBondContact O-N 3.1Å; K230-L233 VanDerWaalsContact O-N 3.1Å; K230-E234 WeakPolarHBondContact CE-OE1 3.14Å; K230-E234 HydrophobicContact CG-CG 4.1Å; K230-E234 WeakPolarHBondContact CG-OE1 3.37Å; K230-E234 WeakPolarHBondContact O-CB 3.35Å; K230-E234 VanDerWaalsContact O-CG 3.29Å; K230-E234 WeakPolarHBondContact O-CG 3.24Å; K230-E234 PolarHBondContact O-N 2.79Å
231	G	76.3	Confident	74.9	Confident	39 Å²	39	54.5 Å²	54.5	40%	0.402	30%	0.299	S	S	.	.	H	α-helix	trans	-65.6	-22.3	-176.2	0	0	0	0	0	115.8	F229	F229-G231 VanDerWaalsContact C-N 3.29Å; F229-G231 PolarHBondContact O-N 2.85Å; F229-G231 VanDerWaalsContact O-N 3.12Å
232	Y	83	Confident	74.7	Confident	104 Å²	104	56 Å²	56	41%	0.408	31%	0.305	S	S	.	.	H	α-helix	trans	-84.4	-44	170	-68.2	-88.1	0	0	0	110.8	F229 K230 E234 K235 A236 Y280	F229-Y232 HydrophobicContact CD1-CD2 4.27Å; F229-Y232 PolarHBondContact O-N 2.89Å; K230-Y232 VanDerWaalsContact C-N 3.28Å; K230-Y232 PolarHBondContact O-N 3.5Å; Y232-E234 VanDerWaalsContact C-N 3.34Å; Y232-E234 PolarHBondContact O-N 2.83Å; Y232-K235 PolarHBondContact O-N 2.79Å; Y232-A236 PolarHBondContact O-N 2.92Å; Y232-Y280 AromaticContact CD1-CD1 3.95Å; Y232-Y280 HydrophobicContact CD1-CD1 3.95Å; Y232-Y280 HydrophobicContact CD1-CE1 4.02Å
233	L	80.9	Confident	74.1	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-61.9	-44.4	-179	-66	170.5	0	0	0	110	K47 L224 F229 K230 K235 A236 L265 A282	K47-L233 PolarHBondContact NZ-O 2.76Å; L224-L233 HydrophobicContact CD2-CB 4.06Å; L224-L233 HydrophobicContact CD2-CD1 4.26Å; F229-L233 HydrophobicContact CB-CD1 3.95Å; F229-L233 HydrophobicContact CB-CG 4.07Å; F229-L233 WeakPolarHBondContact O-CG 3.42Å; F229-L233 PolarHBondContact O-N 3.34Å; K230-L233 PolarHBondContact O-N 3.1Å; K230-L233 VanDerWaalsContact O-N 3.1Å; L233-K235 PolarHBondContact O-N 3.13Å; L233-K235 VanDerWaalsContact O-N 3.11Å; L233-A236 WeakPolarHBondContact O-CB 3.38Å; L233-A236 PolarHBondContact O-N 2.91Å; L233-L265 HydrophobicContact CD1-CD2 3.94Å; L233-L265 HydrophobicContact CD1-CG 3.96Å; L233-L265 HydrophobicContact CD2-CD1 4.19Å; L233-L265 HydrophobicContact CD2-CD2 4.39Å; L233-L265 HydrophobicContact CD2-CG 4Å; L233-A282 HydrophobicContact CD2-CB 3.53Å
234	E	75.6	Confident	74	Confident	68 Å²	68	53 Å²	53	32%	0.318	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-29.7	176.7	-79.5	174.9	166.6	0	0	113.5	V50 K230 Y232	V50-E234 WeakPolarHBondContact CG1-O 3.26Å; K230-E234 WeakPolarHBondContact CE-OE1 3.14Å; K230-E234 HydrophobicContact CG-CG 4.1Å; K230-E234 WeakPolarHBondContact CG-OE1 3.37Å; K230-E234 WeakPolarHBondContact O-CB 3.35Å; K230-E234 VanDerWaalsContact O-CG 3.29Å; K230-E234 WeakPolarHBondContact O-CG 3.24Å; K230-E234 PolarHBondContact O-N 2.79Å; Y232-E234 VanDerWaalsContact C-N 3.34Å; Y232-E234 PolarHBondContact O-N 2.83Å
235	K	79.3	Confident	74.4	Confident	123 Å²	123	53.1 Å²	53.1	54%	0.535	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-10.3	-179.9	-61	178.2	-177.9	179.8	0	113.7	Y232 L233 Y280	Y232-K235 PolarHBondContact O-N 2.79Å; L233-K235 PolarHBondContact O-N 3.13Å; L233-K235 VanDerWaalsContact O-N 3.11Å; K235-Y280 HydrophobicContact CB-CD1 3.89Å; K235-Y280 HydrophobicContact CB-CD2 3.52Å; K235-Y280 HydrophobicContact CB-CE1 4.35Å; K235-Y280 HydrophobicContact CB-CE2 4Å; K235-Y280 HydrophobicContact CB-CG 3.46Å; K235-Y280 VanDerWaalsContact CB-CG 3.46Å; K235-Y280 HydrophobicContact CD-CD1 4.04Å; K235-Y280 HydrophobicContact CD-CD2 4.05Å; K235-Y280 HydrophobicContact CD-CE1 3.64Å; K235-Y280 HydrophobicContact CD-CE2 3.63Å; K235-Y280 HydrophobicContact CD-CG 4.24Å; K235-Y280 VanDerWaalsContact CD-CZ 3.41Å; K235-Y280 HydrophobicContact CG-CD2 4.42Å; K235-Y280 HydrophobicContact CG-CE2 4.44Å
236	A	68.7	Low	74.7	Confident	8 Å²	8	50.4 Å²	50.4	7%	0.066	28%	0.276	C	S	.	.	S	Bend	trans	-71.2	147.2	175.4	0	0	0	0	0	110.3	Y232 L233 I241 Y280 A282	Y232-A236 PolarHBondContact O-N 2.92Å; L233-A236 WeakPolarHBondContact O-CB 3.38Å; L233-A236 PolarHBondContact O-N 2.91Å; A236-I241 HydrophobicContact CB-CD1 4.33Å; A236-I241 HydrophobicContact CB-CG1 4.07Å; A236-Y280 WeakPolarHBondContact CA-O 3.28Å; A236-A282 HydrophobicContact CB-CB 4.41Å
237	T	67.8	Low	75	Confident	87 Å²	87	44.8 Å²	44.8	53%	0.534	25%	0.246	S	C	.	.			trans	-64.2	148.4	178.8	59.6	0	0	0	0	110.6	L239 N240 I241	T237-L239 PolarHBondContact O-N 3.45Å; T237-N240 PolarHBondContact O-N 3.41Å; T237-N240 VanDerWaalsContact O-N 3.14Å; T237-N240 WeakPolarHBondContact OG1-CB 3.33Å; T237-N240 PolarHBondContact OG1-N 3.4Å; T237-I241 WeakPolarHBondContact O-CG1 3.44Å; T237-I241 PolarHBondContact O-N 2.76Å
238	S	57.1	Low	75.5	Confident	81 Å²	81	44.5 Å²	44.5	57%	0.566	24%	0.243	S	C	*	.	H	α-helix	trans	-51.2	-39.6	174.5	48.6	0	0	0	0	111.3	I241 H242	S238-I241 WeakPolarHBondContact O-CB 3.23Å; S238-I241 PolarHBondContact O-N 2.99Å; S238-H242 WeakPolarHBondContact O-CB 3.41Å; S238-H242 PolarHBondContact O-N 2.9Å
239	L	56.8	Low	75.8	Confident	45 Å²	45	39 Å²	39	24%	0.236	20%	0.204	C	C	.	.	H	α-helix	trans	-64.3	-49	178	-177.3	65.7	0	0	0	113.4	S93 E97 T237 I241 H242 D243	S93-L239 WeakPolarHBondContact OG-CD2 3.47Å; E97-L239 HydrophobicContact CG-CD1 3.55Å; E97-L239 HydrophobicContact CG-CD2 3.87Å; E97-L239 HydrophobicContact CG-CG 4.14Å; E97-L239 WeakPolarHBondContact OE1-CD1 3.35Å; E97-L239 WeakPolarHBondContact OE1-CD2 3.3Å; E97-L239 WeakPolarHBondContact OE2-CD1 3.46Å; T237-L239 PolarHBondContact O-N 3.45Å; L239-I241 PolarHBondContact O-N 3.48Å; L239-H242 CarbonylContact O-C 3.46Å; L239-H242 WeakPolarHBondContact O-CA 3.3Å; L239-H242 WeakPolarHBondContact O-CB 3.42Å; L239-H242 PolarHBondContact O-N 3.11Å; L239-D243 PolarHBondContact O-N 3.47Å
240	N	75.9	Confident	75.9	Confident	23 Å²	23	37.9 Å²	37.9	12%	0.123	20%	0.201	C	C	.	.	H	α-helix	trans	-65.7	-29.9	179.3	164	-100.3	0	0	0	111.9	T237 A244 T281 A282	T237-N240 PolarHBondContact O-N 3.41Å; T237-N240 VanDerWaalsContact O-N 3.14Å; T237-N240 WeakPolarHBondContact OG1-CB 3.33Å; T237-N240 PolarHBondContact OG1-N 3.4Å; N240-A244 PolarHBondContact O-N 3.16Å; N240-A244 VanDerWaalsContact O-N 3.1Å; N240-T281 VanDerWaalsContact OD1-CA 3.23Å; N240-T281 WeakPolarHBondContact OD1-CA 3.46Å; N240-A282 PolarHBondContact ND2-O 3.26Å; N240-A282 WeakPolarHBondContact OD1-CA 3.36Å; N240-A282 WeakPolarHBondContact OD1-CB 3.38Å; N240-A282 PolarHBondContact OD1-N 2.9Å; N240-A282 PolarHBondContact OD1-O 2.94Å
241	I	73.1	Confident	76.2	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-66.7	-43.1	170.4	-66.7	169	0	0	0	110.5	I46 K47 F220 L224 A236 T237 S238 L239 A244 F245 A282	I46-I241 HydrophobicContact CG2-CG2 3.91Å; K47-I241 HydrophobicContact CD-CD1 3.67Å; F220-I241 HydrophobicContact CE1-CG2 3.62Å; F220-I241 HydrophobicContact CZ-CG2 4.02Å; F220-I241 WeakPolarHBondContact CZ-O 3.27Å; L224-I241 HydrophobicContact CD1-CG2 4.05Å; L224-I241 HydrophobicContact CD2-CD1 4.47Å; L224-I241 HydrophobicContact CD2-CG2 4.07Å; A236-I241 HydrophobicContact CB-CD1 4.33Å; A236-I241 HydrophobicContact CB-CG1 4.07Å; T237-I241 WeakPolarHBondContact O-CG1 3.44Å; T237-I241 PolarHBondContact O-N 2.76Å; S238-I241 WeakPolarHBondContact O-CB 3.23Å; S238-I241 PolarHBondContact O-N 2.99Å; L239-I241 PolarHBondContact O-N 3.48Å; I241-A244 PolarHBondContact O-N 2.97Å; I241-F245 PolarHBondContact O-N 3.33Å; I241-A282 HydrophobicContact CG1-CB 4.22Å
242	H	71.7	Confident	76.8	Confident	50 Å²	50	32.8 Å²	32.8	23%	0.231	17%	0.17	C	C	.	.	H	α-helix	trans	-60.7	-44.6	175	179.3	72	0	0	0	111.8	A193 S238 L239 A244 F245 M246	A193-H242 VanDerWaalsContact CB-CE1 3.47Å; A193-H242 WeakPolarHBondContact CB-CE1 3.43Å; S238-H242 WeakPolarHBondContact O-CB 3.41Å; S238-H242 PolarHBondContact O-N 2.9Å; L239-H242 CarbonylContact O-C 3.46Å; L239-H242 WeakPolarHBondContact O-CA 3.3Å; L239-H242 WeakPolarHBondContact O-CB 3.42Å; L239-H242 PolarHBondContact O-N 3.11Å; H242-A244 PolarHBondContact O-N 3.23Å; H242-F245 WeakPolarHBondContact O-CB 3.34Å; H242-F245 PolarHBondContact O-N 3.3Å; H242-F245 VanDerWaalsContact O-N 3.09Å; H242-M246 WeakPolarHBondContact NE2-CG 3.5Å; H242-M246 WeakPolarHBondContact O-CG 3.27Å; H242-M246 PolarHBondContact O-N 2.97Å
243	D	67.4	Low	77.1	Confident	33 Å²	33	27.9 Å²	27.9	18%	0.176	15%	0.151	C	C	.	.	H	α-helix	trans	-59.1	-45.3	175.2	-72.5	-19.3	0	0	0	111.9	L239 F245 M246 N247	L239-D243 PolarHBondContact O-N 3.47Å; D243-F245 VanDerWaalsContact C-N 3.28Å; D243-F245 PolarHBondContact O-N 3.11Å; D243-M246 PolarHBondContact O-N 3.31Å; D243-N247 WeakPolarHBondContact O-CB 3.43Å; D243-N247 PolarHBondContact O-N 3.11Å
244	A	77.9	Confident	77.6	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.9	-39	175.6	0	0	0	0	0	111.2	F220 N240 I241 H242 N247 L265 A282 I284	F220-A244 HydrophobicContact CE2-CB 4.23Å; F220-A244 HydrophobicContact CZ-CB 4.12Å; N240-A244 PolarHBondContact O-N 3.16Å; N240-A244 VanDerWaalsContact O-N 3.1Å; I241-A244 PolarHBondContact O-N 2.97Å; H242-A244 PolarHBondContact O-N 3.23Å; A244-N247 WeakPolarHBondContact O-CB 3.19Å; A244-L265 HydrophobicContact CB-CD1 4.09Å; A244-A282 HydrophobicContact CB-CB 4.06Å; A244-I284 HydrophobicContact CB-CD1 4.4Å; A244-I284 HydrophobicContact CB-CG1 4.26Å; A244-I284 WeakPolarHBondContact O-CD1 3.46Å; A244-I284 WeakPolarHBondContact O-CG1 3.34Å
245	F	82.9	Confident	78.2	Confident	5 Å²	5	25.7 Å²	25.7	2%	0.022	14%	0.142	C	C	.	.	H	α-helix	trans	-68.3	-49.1	176.5	-172.3	-113.2	0	0	0	112.3	F197 F213 Q216 K217 F220 I241 H242 D243 N247 L248	F197-F245 AromaticContact CD2-CD1 3.73Å; F197-F245 HydrophobicContact CD2-CD1 3.73Å; F197-F245 AromaticContact CD2-CE1 3.43Å; F197-F245 HydrophobicContact CD2-CE1 3.43Å; F197-F245 VanDerWaalsContact CD2-CE1 3.43Å; F197-F245 HydrophobicContact CD2-CZ 4.03Å; F197-F245 AromaticContact CE2-CD1 3.92Å; F197-F245 HydrophobicContact CE2-CD1 3.92Å; F197-F245 HydrophobicContact CE2-CD2 4.42Å; F197-F245 AromaticContact CE2-CE1 3.58Å; F197-F245 HydrophobicContact CE2-CE1 3.58Å; F197-F245 HydrophobicContact CE2-CE2 4.14Å; F197-F245 HydrophobicContact CE2-CG 4.33Å; F197-F245 AromaticContact CE2-CZ 3.71Å; F197-F245 HydrophobicContact CE2-CZ 3.71Å; F197-F245 WeakPolarHBondContact CE2-O 3.22Å; F197-F245 HydrophobicContact CG-CE1 4.21Å; F197-F245 HydrophobicContact CZ-CE1 4.45Å; F197-F245 HydrophobicContact CZ-CZ 4.24Å; F213-F245 AromaticContact CD2-CE1 3.87Å; F213-F245 HydrophobicContact CD2-CE1 3.87Å; F213-F245 HydrophobicContact CD2-CZ 4.01Å; F213-F245 AromaticContact CE2-CE1 3.62Å; F213-F245 HydrophobicContact CE2-CE1 3.62Å; F213-F245 HydrophobicContact CE2-CZ 4.01Å; Q216-F245 HydrophobicContact CB-CE2 4.26Å; K217-F245 HydrophobicContact CB-CE2 4.49Å; K217-F245 HydrophobicContact CB-CZ 4.08Å; F220-F245 HydrophobicContact CB-CD2 3.78Å; F220-F245 HydrophobicContact CB-CE2 3.87Å; F220-F245 HydrophobicContact CD1-CB 4.45Å; F220-F245 AromaticContact CD1-CD2 3.84Å; F220-F245 HydrophobicContact CD1-CD2 3.84Å; F220-F245 HydrophobicContact CD1-CG 4.46Å; F220-F245 HydrophobicContact CD2-CB 4.34Å; F220-F245 AromaticContact CD2-CD2 3.62Å; F220-F245 HydrophobicContact CD2-CD2 3.62Å; F220-F245 HydrophobicContact CD2-CE2 4.48Å; F220-F245 HydrophobicContact CD2-CG 4.47Å; F220-F245 HydrophobicContact CE1-CB 4.02Å; F220-F245 HydrophobicContact CE1-CD2 4.25Å; F220-F245 HydrophobicContact CE1-CG 4.49Å; F220-F245 HydrophobicContact CE2-CB 3.93Å; F220-F245 HydrophobicContact CE2-CD2 4.09Å; F220-F245 AromaticContact CG-CD2 3.5Å; F220-F245 HydrophobicContact CG-CD2 3.5Å; F220-F245 VanDerWaalsContact CG-CD2 3.5Å; F220-F245 HydrophobicContact CG-CE2 4.12Å; F220-F245 HydrophobicContact CG-CG 4.46Å; F220-F245 HydrophobicContact CZ-CB 3.77Å; F220-F245 HydrophobicContact CZ-CD2 4.4Å; I241-F245 PolarHBondContact O-N 3.33Å; H242-F245 WeakPolarHBondContact O-CB 3.34Å; H242-F245 PolarHBondContact O-N 3.3Å; H242-F245 VanDerWaalsContact O-N 3.09Å; D243-F245 VanDerWaalsContact C-N 3.28Å; D243-F245 PolarHBondContact O-N 3.11Å; F245-N247 PolarHBondContact O-N 3.46Å; F245-L248 HydrophobicContact CD2-CD1 4.07Å; F245-L248 HydrophobicContact CE2-CD1 4.34Å; F245-L248 VanDerWaalsContact O-CB 3.24Å; F245-L248 WeakPolarHBondContact O-CB 3.46Å; F245-L248 PolarHBondContact O-N 3.23Å
246	M	78.4	Confident	78.6	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-59.3	-30.6	176.8	-73.1	-59.7	-68.9	0	0	112.6	Y101 K196 F197 V200 H242 D243 L248 A249 I250	Y101-M246 HydrophobicContact CE1-CE 4.02Å; K196-M246 HydrophobicContact CB-CE 4.22Å; K196-M246 HydrophobicContact CG-CE 3.92Å; F197-M246 HydrophobicContact CB-CE 4.46Å; F197-M246 HydrophobicContact CB-SD 3.76Å; F197-M246 HydrophobicContact CD2-SD 3.95Å; F197-M246 HydrophobicContact CG-SD 4.31Å; V200-M246 HydrophobicContact CB-CE 4.48Å; V200-M246 HydrophobicContact CG2-CE 4.09Å; H242-M246 WeakPolarHBondContact NE2-CG 3.5Å; H242-M246 WeakPolarHBondContact O-CG 3.27Å; H242-M246 PolarHBondContact O-N 2.97Å; D243-M246 PolarHBondContact O-N 3.31Å; M246-L248 PolarHBondContact O-N 3.47Å; M246-A249 WeakPolarHBondContact O-CB 3.43Å; M246-A249 PolarHBondContact O-N 3.13Å; M246-I250 WeakPolarHBondContact O-CG1 3.48Å; M246-I250 PolarHBondContact O-N 3.24Å
247	N	84.1	Confident	79.2	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-60.8	-27.1	175.2	-159.2	-76.2	0	0	0	112.9	D243 A244 F245 N251 I284 Y286 G425 L426 G428	D243-N247 WeakPolarHBondContact O-CB 3.43Å; D243-N247 PolarHBondContact O-N 3.11Å; A244-N247 WeakPolarHBondContact O-CB 3.19Å; F245-N247 PolarHBondContact O-N 3.46Å; N247-N251 WeakPolarHBondContact O-CB 3.38Å; N247-N251 PolarHBondContact O-N 2.99Å; N247-N251 PolarHBondContact O-ND2 3.28Å; N247-N251 PolarHBondContact OD1-ND2 2.5Å; N247-I284 HydrophobicContact CB-CG1 4.15Å; N247-Y286 PolarHBondContact OD1-OH 3.25Å; N247-G425 PolarHBondContact ND2-O 3.22Å; N247-L426 PolarHBondContact ND2-O 3.3Å; N247-G428 PolarHBondContact ND2-N 3.06Å
248	L	88	Confident	79.5	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-65.8	-44.5	170.8	-59.3	177.6	0	0	0	111.5	F197 Q216 F220 F245 M246 G252 L253 L255 I284	F197-L248 HydrophobicContact CE2-CB 4.21Å; F197-L248 HydrophobicContact CZ-CB 4.32Å; Q216-L248 HydrophobicContact CB-CD1 4.1Å; Q216-L248 HydrophobicContact CG-CD1 4.42Å; F220-L248 HydrophobicContact CD2-CD1 3.89Å; F245-L248 HydrophobicContact CD2-CD1 4.07Å; F245-L248 HydrophobicContact CE2-CD1 4.34Å; F245-L248 VanDerWaalsContact O-CB 3.24Å; F245-L248 WeakPolarHBondContact O-CB 3.46Å; F245-L248 PolarHBondContact O-N 3.23Å; M246-L248 PolarHBondContact O-N 3.47Å; L248-G252 VanDerWaalsContact O-CA 3.27Å; L248-G252 WeakPolarHBondContact O-CA 3.44Å; L248-G252 PolarHBondContact O-N 2.99Å; L248-L253 WeakPolarHBondContact CD2-O 3.32Å; L248-L253 PolarHBondContact O-N 3.48Å; L248-L255 HydrophobicContact CD1-CD1 3.85Å; L248-L255 HydrophobicContact CD1-CG 4.02Å; L248-L255 HydrophobicContact CD2-CG 4.06Å; L248-I284 HydrophobicContact CD2-CD1 3.81Å; L248-I284 HydrophobicContact CD2-CG1 4.11Å; L248-I284 HydrophobicContact CD2-CG2 4.2Å; L248-I284 HydrophobicContact CG-CD1 4.19Å; L248-I284 HydrophobicContact CG-CG1 4.45Å
249	A	84.9	Confident	80.1	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.5	-45.4	174.5	0	0	0	0	0	112	F197 V200 F205 M246 N251 G252	F197-A249 HydrophobicContact CB-CB 4.43Å; F197-A249 HydrophobicContact CD1-CB 3.75Å; F197-A249 HydrophobicContact CD2-CB 3.52Å; F197-A249 HydrophobicContact CE1-CB 3.82Å; F197-A249 HydrophobicContact CE2-CB 3.58Å; F197-A249 HydrophobicContact CG-CB 3.6Å; F197-A249 HydrophobicContact CZ-CB 3.73Å; V200-A249 HydrophobicContact CB-CB 4.49Å; V200-A249 HydrophobicContact CG1-CB 4.24Å; F205-A249 WeakPolarHBondContact CE2-O 3.44Å; M246-A249 WeakPolarHBondContact O-CB 3.43Å; M246-A249 PolarHBondContact O-N 3.13Å; A249-N251 VanDerWaalsContact C-N 3.27Å; A249-N251 PolarHBondContact O-N 2.74Å; A249-G252 PolarHBondContact O-N 3Å
250	I	84.6	Confident	80.9	Confident	42 Å²	42	33.8 Å²	33.8	22%	0.215	19%	0.191	C	C	.	.	H	α-helix	trans	-60.7	-38.3	-179.5	-67.2	167.7	0	0	0	111	V200 K204 M246	V200-I250 HydrophobicContact CG1-CB 4.46Å; V200-I250 HydrophobicContact CG1-CG1 3.69Å; K204-I250 WeakPolarHBondContact CD-O 3.39Å; K204-I250 VanDerWaalsContact CE-O 3.3Å; K204-I250 WeakPolarHBondContact CE-O 3.3Å; K204-I250 PolarHBondContact NZ-O 2.91Å; M246-I250 WeakPolarHBondContact O-CG1 3.48Å; M246-I250 PolarHBondContact O-N 3.24Å
251	N	86.9	Confident	81.3	Confident	9 Å²	9	33.1 Å²	33.1	5%	0.048	19%	0.187	C	C	.	.	H	α-helix	trans	-100.8	-11	-175.1	-69.3	-66.2	0	0	0	113.7	F205 N247 A249 L253 Y286 L294 R297	F205-N251 VanDerWaalsContact CZ-C 3.41Å; F205-N251 WeakPolarHBondContact CZ-O 3.47Å; N247-N251 WeakPolarHBondContact O-CB 3.38Å; N247-N251 PolarHBondContact O-N 2.99Å; N247-N251 PolarHBondContact O-ND2 3.28Å; N247-N251 PolarHBondContact OD1-ND2 2.5Å; A249-N251 VanDerWaalsContact C-N 3.27Å; A249-N251 PolarHBondContact O-N 2.74Å; N251-L253 VanDerWaalsContact C-N 3.31Å; N251-L253 HydrophobicContact CB-CD1 4Å; N251-L253 HydrophobicContact CB-CG 3.95Å; N251-L253 PolarHBondContact O-N 3.17Å; N251-Y286 HydrophobicContact CB-CE1 4.45Å; N251-Y286 PolarHBondContact ND2-OH 3.17Å; N251-Y286 VanDerWaalsContact ND2-OH 3.09Å; N251-L294 HydrophobicContact CB-CD2 4.01Å; N251-R297 PolarHBondContact O-NH1 3.41Å
252	G	87.5	Confident	82.2	Confident	6 Å²	6	35.1 Å²	35.1	6%	0.062	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	43.2	-178.1	0	0	0	0	0	111.9	F205 L248 A249 R297	F205-G252 VanDerWaalsContact CE2-CA 3.5Å; F205-G252 VanDerWaalsContact CE2-N 3.33Å; L248-G252 VanDerWaalsContact O-CA 3.27Å; L248-G252 WeakPolarHBondContact O-CA 3.44Å; L248-G252 PolarHBondContact O-N 2.99Å; A249-G252 PolarHBondContact O-N 3Å; G252-R297 PolarHBondContact O-NH1 2.73Å; G252-R297 PolarHBondContact O-NH2 2.85Å
253	L	89.8	Confident	83.1	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.005	19%	0.187	C	C	.	.			trans	-114.5	137.7	-178	-61	179.1	0	0	0	110.1	F212 L248 N251 L262 Y286 L293 L294	F212-L253 WeakPolarHBondContact CZ-O 3.46Å; L248-L253 WeakPolarHBondContact CD2-O 3.32Å; L248-L253 PolarHBondContact O-N 3.48Å; N251-L253 VanDerWaalsContact C-N 3.31Å; N251-L253 HydrophobicContact CB-CD1 4Å; N251-L253 HydrophobicContact CB-CG 3.95Å; N251-L253 PolarHBondContact O-N 3.17Å; L253-L262 HydrophobicContact CB-CB 4.36Å; L253-L262 HydrophobicContact CD2-CB 4.33Å; L253-L262 HydrophobicContact CD2-CD1 4.11Å; L253-Y286 HydrophobicContact CD1-CD1 3.23Å; L253-Y286 HydrophobicContact CD1-CE1 3.52Å; L253-Y286 HydrophobicContact CD1-CG 4.29Å; L253-L293 HydrophobicContact CD2-CB 4.44Å; L253-L293 HydrophobicContact CD2-CD2 3.58Å; L253-L293 HydrophobicContact CD2-CG 4.16Å; L253-L294 HydrophobicContact CD1-CD1 4.06Å; L253-L294 HydrophobicContact CD1-CD2 4.1Å; L253-L294 HydrophobicContact CD1-CG 4.01Å
254	S	90.8	Very high	84.2	Confident	16 Å²	16	35.3 Å²	35.3	11%	0.112	20%	0.195	C	C	.	.			trans	-90.6	145.7	-179.7	-178.5	0	0	0	0	112.2	Q216 E256 C263	Q216-S254 PolarHBondContact NE2-OG 2.72Å; Q216-S254 VanDerWaalsContact OE1-CA 3.3Å; S254-E256 VanDerWaalsContact C-N 3.26Å; S254-E256 VanDerWaalsContact OG-CB 3.27Å; S254-E256 WeakPolarHBondContact OG-CB 3.19Å; S254-E256 PolarHBondContact OG-N 3.23Å; S254-C263 PolarHBondContact O-SG 3.42Å
255	L	88.8	Confident	84.7	Confident	6 Å²	6	35.4 Å²	35.4	3%	0.031	20%	0.195	C	C	.	.			trans	-81.9	1.2	167.7	-80.7	178.1	0	0	0	113.5	L219 F220 L248 K257 L265 I284	L219-L255 HydrophobicContact CB-CB 4Å; L219-L255 HydrophobicContact CD1-CB 4.5Å; F220-L255 HydrophobicContact CB-CD1 3.79Å; F220-L255 HydrophobicContact CD2-CD1 3.5Å; F220-L255 HydrophobicContact CG-CD1 4.05Å; L248-L255 HydrophobicContact CD1-CD1 3.85Å; L248-L255 HydrophobicContact CD1-CG 4.02Å; L248-L255 HydrophobicContact CD2-CG 4.06Å; L255-K257 PolarHBondContact O-N 3.1Å; L255-L265 HydrophobicContact CD1-CB 4.4Å; L255-L265 HydrophobicContact CD2-CB 4.14Å; L255-I284 HydrophobicContact CD2-CD1 4.44Å
256	E	87.7	Confident	85	Confident	120 Å²	120	36.7 Å²	36.7	56%	0.561	20%	0.201	S	C	*	.			trans	-55.8	128.8	-178.9	-171.9	-175.7	-171.6	0	0	111.2	L219 S254 T261	L219-E256 HydrophobicContact CD1-CB 4.08Å; S254-E256 VanDerWaalsContact C-N 3.26Å; S254-E256 VanDerWaalsContact OG-CB 3.27Å; S254-E256 WeakPolarHBondContact OG-CB 3.19Å; S254-E256 PolarHBondContact OG-N 3.23Å; E256-T261 WeakPolarHBondContact O-CG2 3.41Å
257	K	81.7	Confident	85.2	Confident	129 Å²	129	36.8 Å²	36.8	56%	0.561	20%	0.203	S	C	*	.			trans	-82.4	130.6	-179.2	-67.5	-176.1	179.6	169.1	0	110.5	E223 L255	E223-K257 WeakPolarHBondContact OE1-CE 3.48Å; E223-K257 IonicContact OE1-NZ 3.71Å; E223-K257 PolarHBondContact OE1-NZ 2.94Å; E223-K257 IonicContact OE2-NZ 3.85Å; L255-K257 PolarHBondContact O-N 3.1Å
258	G	74.7	Confident	85.1	Confident	48 Å²	48	38.8 Å²	38.8	50%	0.495	21%	0.211	S	C	.	.	S	Bend	trans	-177.6	-175.9	175.2	0	0	0	0	0	112.4	T260 T261	G258-T260 PolarHBondContact O-N 2.68Å; G258-T261 PolarHBondContact N-OG1 3.12Å; G258-T261 PolarHBondContact O-N 3Å; G258-T261 PolarHBondContact O-OG1 3.38Å
259	T	67.8	Low	84.9	Confident	135 Å²	135	41.3 Å²	41.3	83%	0.828	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-22.7	176.5	51.4	0	0	0	0	113	Y289	T259-Y289 VanDerWaalsContact O-CE2 3.3Å; T259-Y289 WeakPolarHBondContact O-CE2 3.38Å
260	T	75	Confident	84.4	Confident	83 Å²	83	45.2 Å²	45.2	51%	0.509	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.7	24.9	178.6	55.3	0	0	0	0	113.1	G258 L262 Y289	G258-T260 PolarHBondContact O-N 2.68Å; T260-L262 PolarHBondContact O-N 3.03Å; T260-Y289 HydrophobicContact CG2-CD1 4.37Å; T260-Y289 HydrophobicContact CG2-CE1 4.19Å; T260-Y289 HydrophobicContact CG2-CE2 4.32Å
261	T	84.2	Confident	84	Confident	9 Å²	9	49.2 Å²	49.2	6%	0.055	26%	0.263	C	S	.	.			trans	-43.5	126.8	176.4	-56.3	0	0	0	0	110.1	E256 G258 C263 Y264 T287	E256-T261 WeakPolarHBondContact O-CG2 3.41Å; G258-T261 PolarHBondContact N-OG1 3.12Å; G258-T261 PolarHBondContact O-N 3Å; G258-T261 PolarHBondContact O-OG1 3.38Å; T261-C263 VanDerWaalsContact CG2-O 3.29Å; T261-C263 WeakPolarHBondContact CG2-O 3.44Å; T261-Y264 HydrophobicContact CG2-CD1 3.97Å; T261-Y264 HydrophobicContact CG2-CE1 3.52Å; T261-T287 HydrophobicContact CG2-CG2 4.34Å; T261-T287 VanDerWaalsContact O-CB 3.31Å; T261-T287 WeakPolarHBondContact O-CB 3.11Å; T261-T287 WeakPolarHBondContact O-CG2 3.3Å; T261-T287 PolarHBondContact O-OG1 2.77Å
262	L	90.6	Very high	83.3	Confident	42 Å²	42	51.7 Å²	51.7	22%	0.22	28%	0.276	C	S	.	.			trans	-85.9	-35.7	-173.9	-63.5	175.9	0	0	0	112.5	L253 T260 T287 G290 L293	L253-L262 HydrophobicContact CB-CB 4.36Å; L253-L262 HydrophobicContact CD2-CB 4.33Å; L253-L262 HydrophobicContact CD2-CD1 4.11Å; T260-L262 PolarHBondContact O-N 3.03Å; L262-T287 PolarHBondContact O-N 3.33Å; L262-T287 PolarHBondContact O-OG1 3.03Å; L262-G290 VanDerWaalsContact O-CA 3.23Å; L262-G290 WeakPolarHBondContact O-CA 3.32Å; L262-L293 HydrophobicContact CD1-CD2 3.84Å; L262-L293 HydrophobicContact CD2-CD2 4.19Å
263	C	90.9	Very high	82.4	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	162	177.3	64	0	0	0	0	112	S254 T261 I284 T285 Y286	S254-C263 PolarHBondContact O-SG 3.42Å; T261-C263 VanDerWaalsContact CG2-O 3.29Å; T261-C263 WeakPolarHBondContact CG2-O 3.44Å; C263-I284 HydrophobicContact CB-CG2 3.59Å; C263-T285 CarbonylContact C-O 3.58Å; C263-T285 VanDerWaalsContact CA-O 3.26Å; C263-T285 WeakPolarHBondContact CA-O 2.79Å; C263-Y286 HydrophobicContact CB-CD1 4.14Å
264	Y	90.2	Very high	81.4	Confident	88 Å²	88	64.9 Å²	64.9	35%	0.345	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	145.6	173.6	-59.5	-69.4	0	0	0	110	T261 T285 T287	T261-Y264 HydrophobicContact CG2-CD1 3.97Å; T261-Y264 HydrophobicContact CG2-CE1 3.52Å; Y264-T285 PolarHBondContact N-O 2.88Å; Y264-T285 PolarHBondContact O-N 3.48Å; Y264-T287 HydrophobicContact CD2-CG2 3.68Å; Y264-T287 HydrophobicContact CE2-CG2 3.27Å
265	L	89.5	Confident	80.7	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.005	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	111.5	164.7	-179	60.8	0	0	0	108.7	F220 E223 L224 L233 A244 L255 A282 I284	F220-L265 HydrophobicContact CD1-CD2 4.28Å; F220-L265 HydrophobicContact CD2-CD1 4.45Å; F220-L265 HydrophobicContact CD2-CD2 3.93Å; F220-L265 HydrophobicContact CE1-CD2 4.09Å; F220-L265 HydrophobicContact CE2-CD1 3.61Å; F220-L265 HydrophobicContact CE2-CD2 3.71Å; F220-L265 HydrophobicContact CE2-CG 4.2Å; F220-L265 HydrophobicContact CG-CD2 4.2Å; F220-L265 HydrophobicContact CZ-CD1 3.85Å; F220-L265 HydrophobicContact CZ-CD2 3.78Å; F220-L265 HydrophobicContact CZ-CG 4.48Å; E223-L265 HydrophobicContact CB-CB 4.09Å; E223-L265 HydrophobicContact CB-CD2 3.92Å; E223-L265 HydrophobicContact CG-CB 4.44Å; L224-L265 HydrophobicContact CD2-CD2 3.78Å; L224-L265 HydrophobicContact CG-CD2 3.96Å; L233-L265 HydrophobicContact CD1-CD2 3.94Å; L233-L265 HydrophobicContact CD1-CG 3.96Å; L233-L265 HydrophobicContact CD2-CD1 4.19Å; L233-L265 HydrophobicContact CD2-CD2 4.39Å; L233-L265 HydrophobicContact CD2-CG 4Å; A244-L265 HydrophobicContact CB-CD1 4.09Å; L255-L265 HydrophobicContact CD1-CB 4.4Å; L255-L265 HydrophobicContact CD2-CB 4.14Å; L265-A282 HydrophobicContact CD1-CB 4.15Å; L265-I284 HydrophobicContact CD1-CD1 3.99Å
266	M	88.7	Confident	80	Confident	32 Å²	32	77.1 Å²	77.1	16%	0.158	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	138.2	-179.5	-69.1	-175.5	62.3	0	0	110.8	F229 Y268 A282 K283 T285	F229-M266 HydrophobicContact CD2-CB 4.41Å; F229-M266 HydrophobicContact CD2-CG 4.19Å; F229-M266 HydrophobicContact CE1-CE 4.06Å; F229-M266 HydrophobicContact CE2-CB 4.41Å; F229-M266 HydrophobicContact CE2-CE 4.21Å; F229-M266 HydrophobicContact CE2-CG 3.83Å; F229-M266 HydrophobicContact CZ-CE 3.61Å; F229-M266 HydrophobicContact CZ-CG 4.18Å; M266-Y268 HydrophobicContact CB-CD2 4.4Å; M266-Y268 HydrophobicContact CB-CE2 3.56Å; M266-Y268 HydrophobicContact CE-CE1 4.07Å; M266-Y268 WeakPolarHBondContact CE-OH 3.24Å; M266-Y268 PolarHBondContact SD-OH 2.96Å; M266-A282 CarbonylContact O-C 3.59Å; M266-A282 WeakPolarHBondContact O-CA 3.28Å; M266-K283 PolarHBondContact N-O 2.92Å; M266-K283 PolarHBondContact O-N 3.04Å; M266-T285 HydrophobicContact SD-CG2 3.93Å; M266-T285 PolarHBondContact SD-OG1 2.79Å; M266-T285 VanDerWaalsContact SD-OG1 3.39Å
267	G	83.1	Confident	79.1	Confident	4 Å²	4	77.8 Å²	77.8	4%	0.041	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	134.3	170.8	0	0	0	0	0	110.9	F229	F229-G267 WeakPolarHBondContact CD1-O 3.48Å
268	Y	82.4	Confident	78.8	Confident	42 Å²	42	74.1 Å²	74.1	17%	0.165	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	149.4	177.7	-60.6	-92.1	0	0	0	110.1	M266 Y280 T281 K283 T285 M429 V434	M266-Y268 HydrophobicContact CB-CD2 4.4Å; M266-Y268 HydrophobicContact CB-CE2 3.56Å; M266-Y268 HydrophobicContact CE-CE1 4.07Å; M266-Y268 WeakPolarHBondContact CE-OH 3.24Å; M266-Y268 PolarHBondContact SD-OH 2.96Å; Y268-Y280 CarbonylContact O-C 3.54Å; Y268-Y280 VanDerWaalsContact O-CA 3.28Å; Y268-Y280 WeakPolarHBondContact O-CA 3.42Å; Y268-T281 PolarHBondContact N-O 3.41Å; Y268-T281 PolarHBondContact O-N 2.83Å; Y268-K283 HydrophobicContact CD2-CB 4.26Å; Y268-K283 HydrophobicContact CD2-CD 4.2Å; Y268-K283 HydrophobicContact CD2-CG 4.21Å; Y268-K283 HydrophobicContact CE2-CB 3.93Å; Y268-K283 HydrophobicContact CE2-CD 4.22Å; Y268-K283 HydrophobicContact CE2-CG 4.31Å; Y268-T285 PolarHBondContact OH-OG1 2.94Å; Y268-T285 VanDerWaalsContact OH-OG1 3.09Å; Y268-M429 HydrophobicContact CE1-CE 3.97Å; Y268-M429 HydrophobicContact CE2-CE 3.77Å; Y268-M429 WeakPolarHBondContact OH-CE 3.33Å; Y268-V434 HydrophobicContact CE1-CG1 4.04Å
269	S	82.1	Confident	79	Confident	54 Å²	54	75.7 Å²	75.7	38%	0.378	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	121.4	166	61.4	0	0	0	0	109.4
270	N	75.7	Confident	79.6	Confident	82 Å²	82	72.1 Å²	72.1	44%	0.439	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	114.9	169.6	-61.2	-56.1	0	0	0	108.2	S278 T279	N270-S278 CarbonylContact O-C 3.44Å; N270-S278 WeakPolarHBondContact O-CA 3.47Å; N270-T279 PolarHBondContact N-O 2.95Å; N270-T279 PolarHBondContact O-N 3.02Å; N270-T279 PolarHBondContact O-OG1 3.42Å
271	Y	75	Confident	79.9	Confident	127 Å²	127	69.5 Å²	69.5	50%	0.498	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	114.1	175.1	-179.1	-102	0	0	0	109.5	K273	Y271-K273 HydrophobicContact CD1-CG 4.02Å; Y271-K273 HydrophobicContact CE1-CB 4.49Å; Y271-K273 HydrophobicContact CE1-CG 4.01Å; Y271-K273 PolarHBondContact O-N 3.28Å
272	D	73.5	Confident	79.8	Confident	60 Å²	60	69 Å²	69	32%	0.321	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	114.5	170.8	176	11.3	0	0	0	109.5	N274 T275 R276 Q277	D272-N274 PolarHBondContact O-N 3.09Å; D272-N274 WeakPolarHBondContact OD1-CB 3.48Å; D272-N274 PolarHBondContact OD1-N 3.16Å; D272-T275 VanDerWaalsContact CB-OG1 3.31Å; D272-T275 WeakPolarHBondContact CB-OG1 3.27Å; D272-T275 VanDerWaalsContact CG-OG1 3.22Å; D272-T275 VanDerWaalsContact OD2-CG2 3.24Å; D272-T275 WeakPolarHBondContact OD2-CG2 3.49Å; D272-T275 PolarHBondContact OD2-OG1 3.5Å; D272-R276 VanDerWaalsContact O-CA 3.29Å; D272-R276 WeakPolarHBondContact O-CA 3.42Å; D272-R276 PolarHBondContact O-N 3.48Å; D272-Q277 PolarHBondContact N-O 2.89Å
273	K	69	Low	79.6	Confident	134 Å²	134	70 Å²	70	58%	0.583	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-25.5	179.8	-66.8	179.2	-178.8	170.2	0	112.6	Y271	Y271-K273 HydrophobicContact CD1-CG 4.02Å; Y271-K273 HydrophobicContact CE1-CB 4.49Å; Y271-K273 HydrophobicContact CE1-CG 4.01Å; Y271-K273 PolarHBondContact O-N 3.28Å
274	N	68.4	Low	79.5	Confident	151 Å²	151	70 Å²	70	81%	0.807	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-47.6	-177	-61.8	-40.8	0	0	0	111.4	D272	D272-N274 PolarHBondContact O-N 3.09Å; D272-N274 WeakPolarHBondContact OD1-CB 3.48Å; D272-N274 PolarHBondContact OD1-N 3.16Å
275	T	76.7	Confident	79.5	Confident	78 Å²	78	65.8 Å²	65.8	48%	0.479	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-13.5	179.7	56	0	0	0	0	113.1	D272 Q277	D272-T275 VanDerWaalsContact CB-OG1 3.31Å; D272-T275 WeakPolarHBondContact CB-OG1 3.27Å; D272-T275 VanDerWaalsContact CG-OG1 3.22Å; D272-T275 VanDerWaalsContact OD2-CG2 3.24Å; D272-T275 WeakPolarHBondContact OD2-CG2 3.49Å; D272-T275 PolarHBondContact OD2-OG1 3.5Å; T275-Q277 PolarHBondContact O-N 3.19Å
276	R	72.1	Confident	79.4	Confident	200 Å²	200	65.8 Å²	65.8	76%	0.755	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	24.2	-171.7	-58.7	-179.1	176.8	175.8	-1.4	113.2	D272	D272-R276 VanDerWaalsContact O-CA 3.29Å; D272-R276 WeakPolarHBondContact O-CA 3.42Å; D272-R276 PolarHBondContact O-N 3.48Å
277	Q	69.9	Low	79.4	Confident	135 Å²	135	64.4 Å²	64.4	63%	0.631	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.9	146.6	178.8	-69.5	-179.1	-5.9	0	0	110.2	D272 T275	D272-Q277 PolarHBondContact N-O 2.89Å; T275-Q277 PolarHBondContact O-N 3.19Å
278	S	76.2	Confident	79.5	Confident	51 Å²	51	64.2 Å²	64.2	36%	0.357	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	122.2	172.2	-59.4	0	0	0	0	108.9	N270	N270-S278 CarbonylContact O-C 3.44Å; N270-S278 WeakPolarHBondContact O-CA 3.47Å
279	T	77.3	Confident	79.7	Confident	81 Å²	81	65 Å²	65	50%	0.497	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	126.8	168.5	52.7	0	0	0	0	108.9	N270	N270-T279 PolarHBondContact N-O 2.95Å; N270-T279 PolarHBondContact O-N 3.02Å; N270-T279 PolarHBondContact O-OG1 3.42Å
280	Y	82	Confident	80.1	Confident	61 Å²	61	62.4 Å²	62.4	24%	0.239	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	131.6	178.4	-63.8	-91.4	0	0	0	109.8	Y232 K235 A236 Y268	Y232-Y280 AromaticContact CD1-CD1 3.95Å; Y232-Y280 HydrophobicContact CD1-CD1 3.95Å; Y232-Y280 HydrophobicContact CD1-CE1 4.02Å; K235-Y280 HydrophobicContact CB-CD1 3.89Å; K235-Y280 HydrophobicContact CB-CD2 3.52Å; K235-Y280 HydrophobicContact CB-CE1 4.35Å; K235-Y280 HydrophobicContact CB-CE2 4Å; K235-Y280 HydrophobicContact CB-CG 3.46Å; K235-Y280 VanDerWaalsContact CB-CG 3.46Å; K235-Y280 HydrophobicContact CD-CD1 4.04Å; K235-Y280 HydrophobicContact CD-CD2 4.05Å; K235-Y280 HydrophobicContact CD-CE1 3.64Å; K235-Y280 HydrophobicContact CD-CE2 3.63Å; K235-Y280 HydrophobicContact CD-CG 4.24Å; K235-Y280 VanDerWaalsContact CD-CZ 3.41Å; K235-Y280 HydrophobicContact CG-CD2 4.42Å; K235-Y280 HydrophobicContact CG-CE2 4.44Å; A236-Y280 WeakPolarHBondContact CA-O 3.28Å; Y268-Y280 CarbonylContact O-C 3.54Å; Y268-Y280 VanDerWaalsContact O-CA 3.28Å; Y268-Y280 WeakPolarHBondContact O-CA 3.42Å
281	T	81	Confident	80.7	Confident	27 Å²	27	58.8 Å²	58.8	17%	0.166	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	123.6	-177.9	58.6	0	0	0	0	111.2	N240 Y268	N240-T281 VanDerWaalsContact OD1-CA 3.23Å; N240-T281 WeakPolarHBondContact OD1-CA 3.46Å; Y268-T281 PolarHBondContact N-O 3.41Å; Y268-T281 PolarHBondContact O-N 2.83Å
282	A	81	Confident	81.5	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	136.3	157.6	0	0	0	0	0	110.8	L233 A236 N240 I241 A244 L265 M266	L233-A282 HydrophobicContact CD2-CB 3.53Å; A236-A282 HydrophobicContact CB-CB 4.41Å; N240-A282 PolarHBondContact ND2-O 3.26Å; N240-A282 WeakPolarHBondContact OD1-CA 3.36Å; N240-A282 WeakPolarHBondContact OD1-CB 3.38Å; N240-A282 PolarHBondContact OD1-N 2.9Å; N240-A282 PolarHBondContact OD1-O 2.94Å; I241-A282 HydrophobicContact CG1-CB 4.22Å; A244-A282 HydrophobicContact CB-CB 4.06Å; L265-A282 HydrophobicContact CD1-CB 4.15Å; M266-A282 CarbonylContact O-C 3.59Å; M266-A282 WeakPolarHBondContact O-CA 3.28Å
283	K	87.1	Confident	82.2	Confident	61 Å²	61	52.6 Å²	52.6	27%	0.265	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	146.7	171.4	-63.7	-174.1	174.3	-172.8	0	110.5	M266 Y268 G427 M429	M266-K283 PolarHBondContact N-O 2.92Å; M266-K283 PolarHBondContact O-N 3.04Å; Y268-K283 HydrophobicContact CD2-CB 4.26Å; Y268-K283 HydrophobicContact CD2-CD 4.2Å; Y268-K283 HydrophobicContact CD2-CG 4.21Å; Y268-K283 HydrophobicContact CE2-CB 3.93Å; Y268-K283 HydrophobicContact CE2-CD 4.22Å; Y268-K283 HydrophobicContact CE2-CG 4.31Å; K283-G427 CarbonylContact C-O 3.5Å; K283-G427 VanDerWaalsContact CA-O 3.22Å; K283-G427 WeakPolarHBondContact CA-O 3Å; K283-G427 WeakPolarHBondContact CB-O 3.17Å; K283-M429 HydrophobicContact CD-CE 3.97Å
284	I	89.8	Confident	83.2	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	112.5	166.7	-61.5	-55.1	0	0	0	108.3	F220 A244 N247 L248 L255 C263 L265 Y286 G427 G428 M429	F220-I284 HydrophobicContact CE2-CD1 4.12Å; A244-I284 HydrophobicContact CB-CD1 4.4Å; A244-I284 HydrophobicContact CB-CG1 4.26Å; A244-I284 WeakPolarHBondContact O-CD1 3.46Å; A244-I284 WeakPolarHBondContact O-CG1 3.34Å; N247-I284 HydrophobicContact CB-CG1 4.15Å; L248-I284 HydrophobicContact CD2-CD1 3.81Å; L248-I284 HydrophobicContact CD2-CG1 4.11Å; L248-I284 HydrophobicContact CD2-CG2 4.2Å; L248-I284 HydrophobicContact CG-CD1 4.19Å; L248-I284 HydrophobicContact CG-CG1 4.45Å; L255-I284 HydrophobicContact CD2-CD1 4.44Å; C263-I284 HydrophobicContact CB-CG2 3.59Å; L265-I284 HydrophobicContact CD1-CD1 3.99Å; I284-Y286 HydrophobicContact CG2-CD1 3.99Å; I284-Y286 HydrophobicContact CG2-CE1 3.69Å; I284-G427 PolarHBondContact N-O 3.09Å; I284-G428 CarbonylContact O-C 3.54Å; I284-G428 WeakPolarHBondContact O-CA 3.12Å; I284-M429 PolarHBondContact O-N 2.93Å
285	T	88.4	Confident	84.3	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	111.4	176.7	-60.3	0	0	0	0	109.5	C263 Y264 M266 Y268 M429 Q431 V434	C263-T285 CarbonylContact C-O 3.58Å; C263-T285 VanDerWaalsContact CA-O 3.26Å; C263-T285 WeakPolarHBondContact CA-O 2.79Å; Y264-T285 PolarHBondContact N-O 2.88Å; Y264-T285 PolarHBondContact O-N 3.48Å; M266-T285 HydrophobicContact SD-CG2 3.93Å; M266-T285 PolarHBondContact SD-OG1 2.79Å; M266-T285 VanDerWaalsContact SD-OG1 3.39Å; Y268-T285 PolarHBondContact OH-OG1 2.94Å; Y268-T285 VanDerWaalsContact OH-OG1 3.09Å; T285-M429 CarbonylContact C-O 3.54Å; T285-M429 VanDerWaalsContact CA-O 3.27Å; T285-M429 WeakPolarHBondContact CA-O 3.18Å; T285-Q431 HydrophobicContact CG2-CB 4.07Å; T285-Q431 HydrophobicContact CG2-CG 3.84Å; T285-V434 HydrophobicContact CG2-CG2 3.99Å
286	Y	88.5	Confident	84.9	Confident	1 Å²	1	39.7 Å²	39.7	0%	0.004	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	130.3	-179.8	-42.9	-70.7	0	0	0	110.5	N247 N251 L253 C263 I284 L294 V424 G428 M429 L430 Q431	N247-Y286 PolarHBondContact OD1-OH 3.25Å; N251-Y286 HydrophobicContact CB-CE1 4.45Å; N251-Y286 PolarHBondContact ND2-OH 3.17Å; N251-Y286 VanDerWaalsContact ND2-OH 3.09Å; L253-Y286 HydrophobicContact CD1-CD1 3.23Å; L253-Y286 HydrophobicContact CD1-CE1 3.52Å; L253-Y286 HydrophobicContact CD1-CG 4.29Å; C263-Y286 HydrophobicContact CB-CD1 4.14Å; I284-Y286 HydrophobicContact CG2-CD1 3.99Å; I284-Y286 HydrophobicContact CG2-CE1 3.69Å; Y286-L294 HydrophobicContact CD1-CD1 3.93Å; Y286-L294 HydrophobicContact CD2-CD1 4Å; Y286-L294 HydrophobicContact CE1-CD1 4.16Å; Y286-L294 HydrophobicContact CE2-CD1 4.25Å; Y286-L294 HydrophobicContact CG-CD1 3.8Å; Y286-V424 HydrophobicContact CD2-CG1 3.9Å; Y286-V424 HydrophobicContact CE2-CB 3.68Å; Y286-V424 HydrophobicContact CE2-CG1 3.33Å; Y286-G428 WeakPolarHBondContact OH-CA 3.2Å; Y286-M429 WeakPolarHBondContact CD2-O 3.32Å; Y286-M429 PolarHBondContact N-O 3.44Å; Y286-L430 HydrophobicContact CD2-CD2 4Å; Y286-Q431 VanDerWaalsContact O-CB 3.32Å; Y286-Q431 WeakPolarHBondContact O-CB 3.29Å; Y286-Q431 PolarHBondContact O-N 3.23Å; Y286-Q431 VanDerWaalsContact O-N 3.07Å
287	T	87.7	Confident	85.6	Confident	4 Å²	4	35.5 Å²	35.5	3%	0.025	17%	0.171	C	C	.	.			trans	-73.8	176	177.3	73.8	0	0	0	0	111.3	T261 L262 Y264 Y289 G290 E291	T261-T287 HydrophobicContact CG2-CG2 4.34Å; T261-T287 VanDerWaalsContact O-CB 3.31Å; T261-T287 WeakPolarHBondContact O-CB 3.11Å; T261-T287 WeakPolarHBondContact O-CG2 3.3Å; T261-T287 PolarHBondContact O-OG1 2.77Å; L262-T287 PolarHBondContact O-N 3.33Å; L262-T287 PolarHBondContact O-OG1 3.03Å; Y264-T287 HydrophobicContact CD2-CG2 3.68Å; Y264-T287 HydrophobicContact CE2-CG2 3.27Å; T287-Y289 PolarHBondContact O-N 3.43Å; T287-Y289 PolarHBondContact OG1-N 3.43Å; T287-G290 PolarHBondContact O-N 2.81Å; T287-G290 VanDerWaalsContact O-N 3.15Å; T287-G290 PolarHBondContact OG1-N 3.22Å; T287-G290 VanDerWaalsContact OG1-N 3.1Å; T287-E291 PolarHBondContact O-N 2.74Å
288	G	85	Confident	86.3	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-54.9	-35.6	169.9	0	0	0	0	0	113.4	I292	G288-I292 VanDerWaalsContact O-CG1 3.29Å; G288-I292 WeakPolarHBondContact O-CG1 3.25Å; G288-I292 PolarHBondContact O-N 3.19Å
289	Y	87.8	Confident	86.7	Confident	58 Å²	58	31.5 Å²	31.5	23%	0.227	17%	0.168	C	C	.	.	H	α-helix	trans	-74.9	-38.5	175.4	-71.5	-73.6	0	0	0	112.4	T259 T260 T287 E291 I292 L293	T259-Y289 VanDerWaalsContact O-CE2 3.3Å; T259-Y289 WeakPolarHBondContact O-CE2 3.38Å; T260-Y289 HydrophobicContact CG2-CD1 4.37Å; T260-Y289 HydrophobicContact CG2-CE1 4.19Å; T260-Y289 HydrophobicContact CG2-CE2 4.32Å; T287-Y289 PolarHBondContact O-N 3.43Å; T287-Y289 PolarHBondContact OG1-N 3.43Å; Y289-E291 VanDerWaalsContact C-N 3.34Å; Y289-E291 PolarHBondContact O-N 3.47Å; Y289-I292 HydrophobicContact CD1-CD1 4.41Å; Y289-I292 PolarHBondContact O-N 3.48Å; Y289-L293 PolarHBondContact O-N 3.45Å; Y289-L293 VanDerWaalsContact O-N 3.1Å
290	G	89.7	Confident	87.2	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.8	-42.3	172.4	0	0	0	0	0	112.6	L262 T287 L293 L294	L262-G290 VanDerWaalsContact O-CA 3.23Å; L262-G290 WeakPolarHBondContact O-CA 3.32Å; T287-G290 PolarHBondContact O-N 2.81Å; T287-G290 VanDerWaalsContact O-N 3.15Å; T287-G290 PolarHBondContact OG1-N 3.22Å; T287-G290 VanDerWaalsContact OG1-N 3.1Å; G290-L293 PolarHBondContact O-N 2.87Å; G290-L294 WeakPolarHBondContact O-CG 3.27Å; G290-L294 PolarHBondContact O-N 3.45Å
291	E	89.5	Confident	87.7	Confident	5 Å²	5	27.2 Å²	27.2	2%	0.023	15%	0.145	C	C	.	.	H	α-helix	trans	-64.1	-40.8	175.9	-173.9	171.9	175.4	0	0	112	T287 Y289 L293 L294 R295 F416 L422 L430	T287-E291 PolarHBondContact O-N 2.74Å; Y289-E291 VanDerWaalsContact C-N 3.34Å; Y289-E291 PolarHBondContact O-N 3.47Å; E291-L293 VanDerWaalsContact C-N 3.35Å; E291-L293 PolarHBondContact O-N 2.83Å; E291-L294 PolarHBondContact O-N 2.68Å; E291-R295 HydrophobicContact CG-CG 4.32Å; E291-R295 WeakPolarHBondContact O-CB 3.41Å; E291-R295 VanDerWaalsContact O-CG 3.3Å; E291-R295 WeakPolarHBondContact O-CG 3.15Å; E291-R295 PolarHBondContact O-N 3.26Å; E291-R295 IonicContact OE1-CZ 3.13Å; E291-R295 IonicContact OE1-NE 3.85Å; E291-R295 PolarHBondContact OE1-NE 2.9Å; E291-R295 IonicContact OE1-NH2 2.91Å; E291-R295 PolarHBondContact OE1-NH2 3.15Å; E291-F416 HydrophobicContact CG-CD2 4.27Å; E291-F416 WeakPolarHBondContact OE1-CB 3.26Å; E291-L422 HydrophobicContact CG-CD1 4.35Å; E291-L430 HydrophobicContact CB-CD2 4.05Å; E291-L430 HydrophobicContact CG-CD2 3.76Å
292	I	90.5	Very high	88	Confident	16 Å²	16	30 Å²	30	8%	0.082	16%	0.159	C	C	.	.	H	α-helix	trans	-55.7	-50.3	173	-71.3	165.6	0	0	0	110.3	G288 Y289 L294 R295 Q296 I301 C304 C412 F416	G288-I292 VanDerWaalsContact O-CG1 3.29Å; G288-I292 WeakPolarHBondContact O-CG1 3.25Å; G288-I292 PolarHBondContact O-N 3.19Å; Y289-I292 HydrophobicContact CD1-CD1 4.41Å; Y289-I292 PolarHBondContact O-N 3.48Å; I292-L294 PolarHBondContact O-N 3.25Å; I292-R295 PolarHBondContact O-N 3.43Å; I292-Q296 HydrophobicContact CG2-CG 4.48Å; I292-Q296 WeakPolarHBondContact O-CG 3.34Å; I292-Q296 PolarHBondContact O-N 2.93Å; I292-I301 HydrophobicContact CG2-CD1 4.29Å; I292-C304 HydrophobicContact CD1-CB 3.97Å; I292-C304 HydrophobicContact CG1-CB 4.05Å; I292-C304 HydrophobicContact CG2-CB 3.64Å; I292-C412 HydrophobicContact CD1-CB 4.27Å; I292-F416 HydrophobicContact CD1-CE2 4.46Å; I292-F416 HydrophobicContact CG1-CE2 3.53Å; I292-F416 HydrophobicContact CG1-CZ 3.87Å
293	L	89.8	Confident	88.5	Confident	42 Å²	42	37.2 Å²	37.2	22%	0.22	19%	0.185	C	C	.	.	H	α-helix	trans	-64	-41.7	-178.7	-177.7	57.8	0	0	0	112.1	L253 L262 Y289 G290 E291 Q296 R297	L253-L293 HydrophobicContact CD2-CB 4.44Å; L253-L293 HydrophobicContact CD2-CD2 3.58Å; L253-L293 HydrophobicContact CD2-CG 4.16Å; L262-L293 HydrophobicContact CD1-CD2 3.84Å; L262-L293 HydrophobicContact CD2-CD2 4.19Å; Y289-L293 PolarHBondContact O-N 3.45Å; Y289-L293 VanDerWaalsContact O-N 3.1Å; G290-L293 PolarHBondContact O-N 2.87Å; E291-L293 VanDerWaalsContact C-N 3.35Å; E291-L293 PolarHBondContact O-N 2.83Å; L293-Q296 PolarHBondContact O-N 2.96Å; L293-R297 WeakPolarHBondContact O-CB 3.38Å; L293-R297 WeakPolarHBondContact O-CG 3.39Å; L293-R297 PolarHBondContact O-N 3.3Å
294	L	89.8	Confident	88.6	Confident	16 Å²	16	35.4 Å²	35.4	8%	0.084	18%	0.18	C	C	.	.	H	α-helix	trans	-61.8	-42.8	174.4	-73.3	174.8	0	0	0	112	N251 L253 Y286 G290 E291 I292 R297 A298 L422	N251-L294 HydrophobicContact CB-CD2 4.01Å; L253-L294 HydrophobicContact CD1-CD1 4.06Å; L253-L294 HydrophobicContact CD1-CD2 4.1Å; L253-L294 HydrophobicContact CD1-CG 4.01Å; Y286-L294 HydrophobicContact CD1-CD1 3.93Å; Y286-L294 HydrophobicContact CD2-CD1 4Å; Y286-L294 HydrophobicContact CE1-CD1 4.16Å; Y286-L294 HydrophobicContact CE2-CD1 4.25Å; Y286-L294 HydrophobicContact CG-CD1 3.8Å; G290-L294 WeakPolarHBondContact O-CG 3.27Å; G290-L294 PolarHBondContact O-N 3.45Å; E291-L294 PolarHBondContact O-N 2.68Å; I292-L294 PolarHBondContact O-N 3.25Å; L294-R297 PolarHBondContact O-N 2.92Å; L294-A298 WeakPolarHBondContact O-CB 3.24Å; L294-A298 PolarHBondContact O-N 3.01Å; L294-L422 HydrophobicContact CB-CD1 3.65Å
295	R	90.1	Very high	88.5	Confident	4 Å²	4	36.8 Å²	36.8	2%	0.015	19%	0.194	C	C	.	.	H	α-helix	trans	-69.1	-34.2	178.5	-69.8	-173.4	-177.6	-93	10.2	112.6	E291 I292 G299 Q300 I301 F416 P420 L422	E291-R295 HydrophobicContact CG-CG 4.32Å; E291-R295 WeakPolarHBondContact O-CB 3.41Å; E291-R295 VanDerWaalsContact O-CG 3.3Å; E291-R295 WeakPolarHBondContact O-CG 3.15Å; E291-R295 PolarHBondContact O-N 3.26Å; E291-R295 IonicContact OE1-CZ 3.13Å; E291-R295 IonicContact OE1-NE 3.85Å; E291-R295 PolarHBondContact OE1-NE 2.9Å; E291-R295 IonicContact OE1-NH2 2.91Å; E291-R295 PolarHBondContact OE1-NH2 3.15Å; I292-R295 PolarHBondContact O-N 3.43Å; R295-G299 PolarHBondContact O-N 3.48Å; R295-Q300 HydrophobicContact CB-CB 4.38Å; R295-Q300 PolarHBondContact O-N 2.96Å; R295-I301 HydrophobicContact CB-CD1 3.84Å; R295-I301 HydrophobicContact CB-CG1 3.81Å; R295-I301 PolarHBondContact O-N 2.96Å; R295-F416 VanDerWaalsContact CD-CG 3.47Å; R295-F416 VanDerWaalsContact CZ-CB 3.44Å; R295-F416 PolarHBondContact NH2-O 3.09Å; R295-P420 PolarHBondContact NH1-O 3.3Å; R295-L422 HydrophobicContact CB-CD1 4.44Å; R295-L422 HydrophobicContact CG-CD1 3.37Å; R295-L422 HydrophobicContact CG-CD2 4.21Å; R295-L422 HydrophobicContact CG-CG 3.95Å
296	Q	89.8	Confident	88.5	Confident	71 Å²	71	43.4 Å²	43.4	33%	0.332	23%	0.23	S	C	.	.	H	α-helix	trans	-62.7	-47.8	170.8	-73.4	178.3	-56.8	0	0	111.1	I292 L293 A298 G299 I301 L302	I292-Q296 HydrophobicContact CG2-CG 4.48Å; I292-Q296 WeakPolarHBondContact O-CG 3.34Å; I292-Q296 PolarHBondContact O-N 2.93Å; L293-Q296 PolarHBondContact O-N 2.96Å; Q296-A298 VanDerWaalsContact C-N 3.35Å; Q296-A298 PolarHBondContact O-N 3.04Å; Q296-G299 PolarHBondContact O-N 3.39Å; Q296-G299 VanDerWaalsContact O-N 3.09Å; Q296-I301 WeakPolarHBondContact CA-O 3.21Å; Q296-I301 HydrophobicContact CG-CD1 4.05Å; Q296-I301 HydrophobicContact CG-CG1 3.79Å; Q296-L302 PolarHBondContact NE2-O 3.44Å
297	R	86.2	Confident	88.6	Confident	113 Å²	113	44 Å²	44	43%	0.426	23%	0.234	S	C	.	.	H	α-helix	trans	-65	-35.4	177.9	-73.6	174.7	169.6	165.9	1.1	112.9	N251 G252 L293 L294 G299	N251-R297 PolarHBondContact O-NH1 3.41Å; G252-R297 PolarHBondContact O-NH1 2.73Å; G252-R297 PolarHBondContact O-NH2 2.85Å; L293-R297 WeakPolarHBondContact O-CB 3.38Å; L293-R297 WeakPolarHBondContact O-CG 3.39Å; L293-R297 PolarHBondContact O-N 3.3Å; L294-R297 PolarHBondContact O-N 2.92Å; R297-G299 PolarHBondContact O-N 3.48Å
298	A	85.3	Confident	88.9	Confident	59 Å²	59	45.8 Å²	45.8	49%	0.488	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-4.7	174.6	0	0	0	0	0	113.7	L294 Q296 Q300 L422	L294-A298 WeakPolarHBondContact O-CB 3.24Å; L294-A298 PolarHBondContact O-N 3.01Å; Q296-A298 VanDerWaalsContact C-N 3.35Å; Q296-A298 PolarHBondContact O-N 3.04Å; A298-Q300 HydrophobicContact CB-CG 4.46Å; A298-Q300 PolarHBondContact O-N 3.17Å; A298-L422 HydrophobicContact CB-CD2 3.56Å
299	G	84.4	Confident	89.3	Confident	43 Å²	43	46.6 Å²	46.6	44%	0.443	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	17.1	-178.4	0	0	0	0	0	114.6	R295 Q296 R297 P351	R295-G299 PolarHBondContact O-N 3.48Å; Q296-G299 PolarHBondContact O-N 3.39Å; Q296-G299 VanDerWaalsContact O-N 3.09Å; R297-G299 PolarHBondContact O-N 3.48Å; G299-P351 WeakPolarHBondContact O-CG 3.19Å
300	Q	87.9	Confident	89.5	Confident	49 Å²	49	43.9 Å²	43.9	23%	0.229	24%	0.239	C	C	.	.	S	Bend	trans	-76.1	-30.7	174.7	-73.3	-175.5	-21	0	0	112	R295 A298 P351 P420	R295-Q300 HydrophobicContact CB-CB 4.38Å; R295-Q300 PolarHBondContact O-N 2.96Å; A298-Q300 HydrophobicContact CB-CG 4.46Å; A298-Q300 PolarHBondContact O-N 3.17Å; Q300-P351 WeakPolarHBondContact O-CD 3.33Å; Q300-P420 PolarHBondContact NE2-O 3.28Å
301	I	91.8	Very high	89.7	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	25%	0.249	C	C	.	.			trans	-131.7	151.4	173.3	66.9	179.4	0	0	0	108.8	I292 R295 Q296 C304 I348 L350 F416 Y419	I292-I301 HydrophobicContact CG2-CD1 4.29Å; R295-I301 HydrophobicContact CB-CD1 3.84Å; R295-I301 HydrophobicContact CB-CG1 3.81Å; R295-I301 PolarHBondContact O-N 2.96Å; Q296-I301 WeakPolarHBondContact CA-O 3.21Å; Q296-I301 HydrophobicContact CG-CD1 4.05Å; Q296-I301 HydrophobicContact CG-CG1 3.79Å; I301-C304 HydrophobicContact CD1-CB 4.37Å; I301-I348 HydrophobicContact CB-CG2 4.17Å; I301-I348 HydrophobicContact CG2-CG2 3.61Å; I301-L350 HydrophobicContact CG2-CD2 4.37Å; I301-F416 HydrophobicContact CD1-CE1 3.93Å; I301-F416 HydrophobicContact CD1-CZ 3.82Å; I301-F416 HydrophobicContact CG2-CE1 4.02Å; I301-Y419 HydrophobicContact CG2-CE1 3.89Å
302	L	88.2	Confident	89.7	Confident	87 Å²	87	50 Å²	50	46%	0.455	27%	0.269	S	S	.	.	S	Bend	trans	-81.9	-50.2	172	-174.3	65.5	0	0	0	110.3	Q296 I349 L350 N353	Q296-L302 PolarHBondContact NE2-O 3.44Å; L302-I349 WeakPolarHBondContact CA-O 3.45Å; L302-I349 HydrophobicContact CB-CG2 4.22Å; L302-I349 WeakPolarHBondContact CB-O 3.39Å; L302-I349 HydrophobicContact CD2-CG2 4.05Å; L302-I349 PolarHBondContact N-O 2.63Å; L302-L350 WeakPolarHBondContact CB-O 3.23Å; L302-N353 WeakPolarHBondContact CD2-OD1 3.21Å
303	R	90.4	Very high	89.6	Confident	150 Å²	150	50.9 Å²	50.9	57%	0.566	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-157.7	156.6	175.2	65.1	-179.2	-165	-176.9	4.3	111.8	I349	R303-I349 HydrophobicContact CG-CB 3.81Å; R303-I349 HydrophobicContact CG-CD1 3.71Å; R303-I349 HydrophobicContact CG-CG1 4.23Å; R303-I349 HydrophobicContact CG-CG2 4.32Å; R303-I349 PolarHBondContact N-O 2.79Å; R303-I349 WeakPolarHBondContact O-CB 3.43Å; R303-I349 PolarHBondContact O-N 2.88Å
304	C	90.5	Very high	89.8	Confident	23 Å²	23	49.6 Å²	49.6	16%	0.155	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	131.5	171.2	-158.2	0	0	0	0	108.1	I292 I301 V346	I292-C304 HydrophobicContact CD1-CB 3.97Å; I292-C304 HydrophobicContact CG1-CB 4.05Å; I292-C304 HydrophobicContact CG2-CB 3.64Å; I301-C304 HydrophobicContact CD1-CB 4.37Å; C304-V346 WeakPolarHBondContact SG-CG2 3.19Å
305	G	88.1	Confident	89.8	Confident	29 Å²	29	52.9 Å²	52.9	30%	0.299	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-72	168.1	173.4	0	0	0	0	0	111.8	V346 K347	G305-V346 VanDerWaalsContact O-CG2 3.25Å; G305-V346 WeakPolarHBondContact O-CG2 3.48Å; G305-K347 PolarHBondContact N-O 3.26Å
306	N	87.7	Confident	90	Very high	140 Å²	140	54.4 Å²	54.4	75%	0.749	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-66.3	133.5	171.4	-68.6	-17.7	0	0	0	109.5	V308	N306-V308 PolarHBondContact O-N 3.42Å
307	P	91.1	Very high	90.2	Very high	14 Å²	14	58.6 Å²	58.6	9%	0.091	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-61	138.5	173.9	-22.5	33.6	0	0	0	111.1	Y345 V346 I408 T411 C412	P307-Y345 CarbonylContact C-O 3.51Å; P307-Y345 VanDerWaalsContact CA-O 3.24Å; P307-Y345 WeakPolarHBondContact CA-O 3.45Å; P307-V346 HydrophobicContact CB-CB 4.3Å; P307-V346 HydrophobicContact CG-CB 4.2Å; P307-V346 HydrophobicContact CG-CG2 4.03Å; P307-I408 HydrophobicContact CB-CB 4.41Å; P307-I408 HydrophobicContact CB-CG1 4.25Å; P307-I408 HydrophobicContact CB-CG2 4.01Å; P307-I408 HydrophobicContact CG-CG2 3.79Å; P307-T411 HydrophobicContact CB-CG2 4.46Å; P307-C412 WeakPolarHBondContact CG-SG 3.33Å
308	V	93.2	Very high	90.5	Very high	40 Å²	40	57.7 Å²	57.7	24%	0.242	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.5	-177.8	178.8	0	0	0	0	108.3	N306 Y329 C344 Y345	N306-V308 PolarHBondContact O-N 3.42Å; V308-Y329 HydrophobicContact CG1-CD1 4.13Å; V308-Y329 HydrophobicContact CG1-CE1 3.63Å; V308-Y329 HydrophobicContact CG1-CE2 4.45Å; V308-C344 CarbonylContact O-C 3.52Å; V308-C344 VanDerWaalsContact O-CA 3.25Å; V308-C344 WeakPolarHBondContact O-CA 3.17Å; V308-C344 PolarHBondContact O-SG 3.09Å; V308-C344 VanDerWaalsContact O-SG 3.41Å; V308-Y345 HydrophobicContact CB-CD1 4.01Å; V308-Y345 HydrophobicContact CB-CE1 3.52Å; V308-Y345 HydrophobicContact CB-CE2 4.26Å; V308-Y345 HydrophobicContact CG1-CD1 4.43Å; V308-Y345 HydrophobicContact CG1-CE1 3.66Å; V308-Y345 HydrophobicContact CG2-CE1 4.22Å; V308-Y345 HydrophobicContact CG2-CE2 4.21Å; V308-Y345 PolarHBondContact N-O 3.45Å; V308-Y345 PolarHBondContact O-N 3.3Å
309	V	92.9	Very high	90.7	Very high	18 Å²	18	56.1 Å²	56.1	11%	0.109	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	125.2	173	-177.6	0	0	0	0	108.5	Y311 I341 T404 L407 I408	V309-Y311 HydrophobicContact CB-CE2 4.18Å; V309-Y311 HydrophobicContact CG1-CD2 4.35Å; V309-Y311 HydrophobicContact CG1-CE2 3.76Å; V309-I341 HydrophobicContact CG1-CB 4.47Å; V309-I341 HydrophobicContact CG1-CD1 3.99Å; V309-I341 HydrophobicContact CG1-CG1 3.92Å; V309-I341 HydrophobicContact CG1-CG2 3.82Å; V309-T404 HydrophobicContact CG1-CG2 4.45Å; V309-T404 HydrophobicContact CG2-CG2 4.46Å; V309-L407 HydrophobicContact CG1-CD2 4.19Å; V309-L407 HydrophobicContact CG2-CD2 4.38Å; V309-I408 HydrophobicContact CG2-CD1 4.18Å; V309-I408 HydrophobicContact CG2-CG1 3.97Å
310	V	93.3	Very high	90.8	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133	-178.3	-176.4	0	0	0	0	108.8	D314 F316 Y329 V342 A343 Y345	V310-D314 HydrophobicContact CG1-CB 4.18Å; V310-F316 HydrophobicContact CB-CD1 4.49Å; V310-F316 HydrophobicContact CB-CG 4.35Å; V310-F316 HydrophobicContact CG1-CB 3.45Å; V310-F316 VanDerWaalsContact CG1-CB 3.45Å; V310-F316 HydrophobicContact CG1-CD1 3.81Å; V310-F316 HydrophobicContact CG1-CD2 4.06Å; V310-F316 HydrophobicContact CG1-CG 3.52Å; V310-F316 HydrophobicContact CG2-CD1 4.36Å; V310-F316 HydrophobicContact CG2-CD2 3.76Å; V310-F316 HydrophobicContact CG2-CE1 4.42Å; V310-F316 HydrophobicContact CG2-CE2 3.81Å; V310-F316 HydrophobicContact CG2-CG 4.03Å; V310-F316 HydrophobicContact CG2-CZ 4.17Å; V310-Y329 HydrophobicContact CB-CE2 4.42Å; V310-Y329 HydrophobicContact CG1-CD2 4.38Å; V310-Y329 HydrophobicContact CG1-CE2 4.14Å; V310-Y329 HydrophobicContact CG2-CD2 4.11Å; V310-Y329 HydrophobicContact CG2-CE2 4.04Å; V310-V342 HydrophobicContact CB-CG2 4.16Å; V310-V342 HydrophobicContact CG1-CG2 3.67Å; V310-V342 PolarHBondContact O-N 2.88Å; V310-A343 HydrophobicContact CB-CB 4.05Å; V310-A343 WeakPolarHBondContact CB-O 3.35Å; V310-A343 HydrophobicContact CG2-CB 4.25Å; V310-A343 PolarHBondContact N-O 3.34Å; V310-A343 PolarHBondContact O-N 3.45Å; V310-Y345 HydrophobicContact CG2-CD1 3.74Å; V310-Y345 HydrophobicContact CG2-CE1 4Å
311	Y	92.2	Very high	90.3	Very high	53 Å²	53	65.7 Å²	65.7	21%	0.208	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	157.9	176.1	-59.4	-107.6	0	0	0	111	V309 C313 D314 R335 R340 I341	V309-Y311 HydrophobicContact CB-CE2 4.18Å; V309-Y311 HydrophobicContact CG1-CD2 4.35Å; V309-Y311 HydrophobicContact CG1-CE2 3.76Å; Y311-C313 PolarHBondContact O-N 2.77Å; Y311-C313 VanDerWaalsContact O-N 3.11Å; Y311-D314 PolarHBondContact N-OD2 3.06Å; Y311-D314 VanDerWaalsContact N-OD2 3.17Å; Y311-D314 WeakPolarHBondContact O-CB 3.32Å; Y311-D314 PolarHBondContact O-N 3.29Å; Y311-R335 VanDerWaalsContact CD2-NE 3.3Å; Y311-R340 CarbonylContact C-O 3.59Å; Y311-R340 WeakPolarHBondContact CA-O 3.31Å; Y311-R340 WeakPolarHBondContact CB-O 3.5Å; Y311-I341 HydrophobicContact CD1-CG1 4.08Å; Y311-I341 HydrophobicContact CE1-CG1 3.73Å
312	D	90.1	Very high	89.6	Confident	82 Å²	82	72.8 Å²	72.8	44%	0.439	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-28.3	-179.9	58	-8.2	0	0	0	115	S339 R340 V342	D312-S339 VanDerWaalsContact OD1-CA 3.26Å; D312-S339 WeakPolarHBondContact OD1-CA 3.44Å; D312-S339 WeakPolarHBondContact OD1-CB 3.23Å; D312-R340 VanDerWaalsContact CG-N 3.26Å; D312-R340 PolarHBondContact N-O 3.24Å; D312-R340 PolarHBondContact OD1-N 2.94Å; D312-R340 PolarHBondContact OD2-N 3.42Å; D312-V342 HydrophobicContact CB-CG1 3.71Å
313	C	89.5	Confident	88.9	Confident	34 Å²	34	71.4 Å²	71.4	23%	0.23	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-8.2	176	73.7	0	0	0	0	114.4	Y311 T332 R335 P336 S339	Y311-C313 PolarHBondContact O-N 2.77Å; Y311-C313 VanDerWaalsContact O-N 3.11Å; C313-T332 HydrophobicContact CB-CG2 4.48Å; C313-T332 WeakPolarHBondContact O-CB 3.27Å; C313-T332 PolarHBondContact O-OG1 2.83Å; C313-R335 PolarHBondContact SG-NH1 2.81Å; C313-P336 HydrophobicContact CB-CG 4.44Å; C313-S339 PolarHBondContact SG-OG 3.23Å
314	D	92.4	Very high	88.2	Confident	15 Å²	15	69.9 Å²	69.9	8%	0.08	37%	0.366	C	S	.	.	S	Bend	trans	-79.4	149.5	175.8	-66.2	-25.8	0	0	0	111	V310 Y311 F316 Y329 T332 R335	V310-D314 HydrophobicContact CG1-CB 4.18Å; Y311-D314 PolarHBondContact N-OD2 3.06Å; Y311-D314 VanDerWaalsContact N-OD2 3.17Å; Y311-D314 WeakPolarHBondContact O-CB 3.32Å; Y311-D314 PolarHBondContact O-N 3.29Å; D314-F316 PolarHBondContact O-N 2.97Å; D314-Y329 HydrophobicContact CB-CD2 4.4Å; D314-Y329 HydrophobicContact CB-CE2 3.68Å; D314-Y329 VanDerWaalsContact OD2-CE2 3.31Å; D314-Y329 WeakPolarHBondContact OD2-CE2 3.46Å; D314-Y329 PolarHBondContact OD2-OH 2.94Å; D314-T332 PolarHBondContact OD1-N 3.06Å; D314-R335 VanDerWaalsContact CG-NH1 3.25Å; D314-R335 VanDerWaalsContact CG-NH2 3.32Å; D314-R335 IonicContact OD1-CZ 2.61Å; D314-R335 VanDerWaalsContact OD1-CZ 3.32Å; D314-R335 IonicContact OD1-NH1 3.17Å; D314-R335 PolarHBondContact OD1-NH1 3.45Å; D314-R335 IonicContact OD1-NH2 2.73Å; D314-R335 PolarHBondContact OD1-NH2 3.2Å; D314-R335 IonicContact OD2-CZ 3.74Å; D314-R335 IonicContact OD2-NH1 3.43Å; D314-R335 PolarHBondContact OD2-NH1 3.33Å; D314-R335 IonicContact OD2-NH2 3.78Å; D314-R335 PolarHBondContact OD2-NH2 3.25Å
315	D	91.4	Very high	88	Confident	84 Å²	84	72.6 Å²	72.6	45%	0.449	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	108.6	167.6	-171.5	4	0	0	0	108.1	R317 Y329 V330	D315-R317 IonicContact OD1-NE 3.2Å; D315-Y329 CarbonylContact O-C 3.58Å; D315-Y329 WeakPolarHBondContact O-CA 3.28Å; D315-V330 HydrophobicContact CB-CB 4.12Å; D315-V330 PolarHBondContact N-O 2.88Å; D315-V330 PolarHBondContact O-N 3.23Å
316	F	94.5	Very high	88.1	Confident	37 Å²	37	73.8 Å²	73.8	16%	0.162	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	125.4	-174.8	176.6	-110.9	0	0	0	111.3	V310 D314 F318 V327 D328 Y329 A343 Y345 V359	V310-F316 HydrophobicContact CB-CD1 4.49Å; V310-F316 HydrophobicContact CB-CG 4.35Å; V310-F316 HydrophobicContact CG1-CB 3.45Å; V310-F316 VanDerWaalsContact CG1-CB 3.45Å; V310-F316 HydrophobicContact CG1-CD1 3.81Å; V310-F316 HydrophobicContact CG1-CD2 4.06Å; V310-F316 HydrophobicContact CG1-CG 3.52Å; V310-F316 HydrophobicContact CG2-CD1 4.36Å; V310-F316 HydrophobicContact CG2-CD2 3.76Å; V310-F316 HydrophobicContact CG2-CE1 4.42Å; V310-F316 HydrophobicContact CG2-CE2 3.81Å; V310-F316 HydrophobicContact CG2-CG 4.03Å; V310-F316 HydrophobicContact CG2-CZ 4.17Å; D314-F316 PolarHBondContact O-N 2.97Å; F316-F318 HydrophobicContact CD1-CD1 4.22Å; F316-F318 AromaticContact CE1-CD1 3.39Å; F316-F318 HydrophobicContact CE1-CD1 3.39Å; F316-F318 AromaticContact CE1-CE1 3.89Å; F316-F318 HydrophobicContact CE1-CE1 3.89Å; F316-F318 HydrophobicContact CE1-CG 4.29Å; F316-F318 HydrophobicContact CZ-CB 4.16Å; F316-F318 AromaticContact CZ-CD1 3.74Å; F316-F318 HydrophobicContact CZ-CD1 3.74Å; F316-F318 HydrophobicContact CZ-CG 4.2Å; F316-V327 HydrophobicContact CD2-CG1 4.12Å; F316-V327 HydrophobicContact CE2-CG1 3.54Å; F316-D328 CarbonylContact C-O 3.57Å; F316-D328 WeakPolarHBondContact CA-O 3.41Å; F316-Y329 HydrophobicContact CB-CD2 4.31Å; F316-Y329 AromaticContact CD2-CD2 3.96Å; F316-Y329 HydrophobicContact CD2-CD2 3.96Å; F316-A343 HydrophobicContact CD1-CB 4.29Å; F316-A343 HydrophobicContact CE1-CB 3.62Å; F316-A343 HydrophobicContact CZ-CB 4.1Å; F316-Y345 HydrophobicContact CD2-CD1 4.39Å; F316-Y345 HydrophobicContact CD2-CE1 4.45Å; F316-Y345 AromaticContact CE2-CD1 3.57Å; F316-Y345 HydrophobicContact CE2-CD1 3.57Å; F316-Y345 HydrophobicContact CE2-CE1 4.01Å; F316-Y345 HydrophobicContact CE2-CG 4.3Å; F316-Y345 HydrophobicContact CZ-CD1 4.24Å; F316-V359 HydrophobicContact CE1-CG1 4.2Å; F316-V359 HydrophobicContact CZ-CG1 3.8Å; F316-V359 HydrophobicContact CZ-CG2 4.4Å
317	R	92.6	Very high	88.4	Confident	158 Å²	158	67.8 Å²	67.8	60%	0.596	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.5	141.3	174.4	-55.2	179.5	-168.6	-179.6	0.5	109.2	D315 V327 D328	D315-R317 IonicContact OD1-NE 3.2Å; R317-V327 CarbonylContact O-C 3.58Å; R317-V327 WeakPolarHBondContact O-CA 3.36Å; R317-D328 HydrophobicContact CB-CB 4.34Å; R317-D328 PolarHBondContact N-O 3.42Å; R317-D328 PolarHBondContact O-N 2.96Å
318	F	93.1	Very high	88.3	Confident	94 Å²	94	71 Å²	71	41%	0.412	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	160	174.5	71.5	-79.2	0	0	0	110	F316 F326 V327 V359 D361	F316-F318 HydrophobicContact CD1-CD1 4.22Å; F316-F318 AromaticContact CE1-CD1 3.39Å; F316-F318 HydrophobicContact CE1-CD1 3.39Å; F316-F318 AromaticContact CE1-CE1 3.89Å; F316-F318 HydrophobicContact CE1-CE1 3.89Å; F316-F318 HydrophobicContact CE1-CG 4.29Å; F316-F318 HydrophobicContact CZ-CB 4.16Å; F316-F318 AromaticContact CZ-CD1 3.74Å; F316-F318 HydrophobicContact CZ-CD1 3.74Å; F316-F318 HydrophobicContact CZ-CG 4.2Å; F318-F326 VanDerWaalsContact CA-O 3.25Å; F318-F326 WeakPolarHBondContact CA-O 3.32Å; F318-F326 WeakPolarHBondContact CB-O 3.49Å; F318-V327 HydrophobicContact CB-CG2 3.95Å; F318-V359 HydrophobicContact CB-CG2 3.93Å; F318-V359 HydrophobicContact CD1-CG1 4.08Å; F318-V359 HydrophobicContact CD2-CB 3.94Å; F318-V359 HydrophobicContact CD2-CG1 4Å; F318-V359 HydrophobicContact CD2-CG2 3.86Å; F318-V359 HydrophobicContact CE1-CG1 4.12Å; F318-V359 HydrophobicContact CE2-CB 4.18Å; F318-V359 HydrophobicContact CE2-CG1 4.04Å; F318-V359 HydrophobicContact CG-CB 4.28Å; F318-V359 HydrophobicContact CG-CG1 4.01Å; F318-V359 HydrophobicContact CG-CG2 3.93Å; F318-V359 HydrophobicContact CZ-CG1 4.1Å; F318-D361 HydrophobicContact CE1-CB 4.38Å; F318-D361 HydrophobicContact CZ-CB 3.93Å
319	G	89	Confident	88.3	Confident	27 Å²	27	71.8 Å²	71.8	28%	0.278	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	169.4	-160.9	178.6	0	0	0	0	0	111.4	K325 F326	G319-K325 CarbonylContact O-C 3.59Å; G319-K325 VanDerWaalsContact O-CA 3.27Å; G319-K325 WeakPolarHBondContact O-CA 3.49Å; G319-F326 VanDerWaalsContact C-CE1 3.47Å; G319-F326 PolarHBondContact N-O 3.01Å; G319-F326 WeakPolarHBondContact O-CD1 3.41Å; G319-F326 PolarHBondContact O-N 2.87Å
320	E	85.9	Confident	88.2	Confident	141 Å²	141	75.3 Å²	75.3	66%	0.659	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119	130.2	175.4	-164.7	175.5	158.2	0	0	109	G323 H324	E320-G323 WeakPolarHBondContact OE1-CA 3.44Å; E320-H324 CarbonylContact C-O 3.48Å; E320-H324 WeakPolarHBondContact CA-O 3.43Å
321	R	78.4	Confident	88.1	Confident	152 Å²	152	81.4 Å²	81.4	57%	0.574	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.1	121.7	176.4	-170.9	-177.3	-65.5	173.6	5	107.5	G323 H324 F326	R321-G323 VanDerWaalsContact C-N 3.26Å; R321-G323 PolarHBondContact O-N 3.45Å; R321-H324 PolarHBondContact N-O 2.61Å; R321-H324 WeakPolarHBondContact O-CB 3.11Å; R321-H324 PolarHBondContact O-N 3Å; R321-H324 VanDerWaalsContact O-O 3.07Å; R321-F326 HydrophobicContact CB-CD1 3.85Å; R321-F326 HydrophobicContact CB-CE1 4.2Å
322	D	76.5	Confident	87.8	Confident	150 Å²	150	81.4 Å²	81.4	80%	0.802	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	35.8	179.3	-52.8	-41.7	0	0	0	114.6	H324	D322-H324 VanDerWaalsContact C-N 3.26Å; D322-H324 PolarHBondContact O-CD2 3.19Å; D322-H324 VanDerWaalsContact O-CD2 3.32Å; D322-H324 PolarHBondContact O-N 3.15Å
323	G	73.9	Confident	87.4	Confident	58 Å²	58	86.8 Å²	86.8	60%	0.598	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	3.7	-177.3	0	0	0	0	0	114.7	E320 R321	E320-G323 WeakPolarHBondContact OE1-CA 3.44Å; R321-G323 VanDerWaalsContact C-N 3.26Å; R321-G323 PolarHBondContact O-N 3.45Å
324	H	75.4	Confident	87	Confident	118 Å²	118	90.1 Å²	90.1	55%	0.546	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.3	178.6	-63.1	-74.4	0	0	0	110.6	E320 R321 D322	E320-H324 CarbonylContact C-O 3.48Å; E320-H324 WeakPolarHBondContact CA-O 3.43Å; R321-H324 PolarHBondContact N-O 2.61Å; R321-H324 WeakPolarHBondContact O-CB 3.11Å; R321-H324 PolarHBondContact O-N 3Å; R321-H324 VanDerWaalsContact O-O 3.07Å; D322-H324 VanDerWaalsContact C-N 3.26Å; D322-H324 PolarHBondContact O-CD2 3.19Å; D322-H324 VanDerWaalsContact O-CD2 3.32Å; D322-H324 PolarHBondContact O-N 3.15Å
325	K	86.7	Confident	86.5	Confident	81 Å²	81	92.4 Å²	92.4	35%	0.352	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	140	173	-62.7	-177.9	-161.7	146.6	0	110.2	G319 D356 Y357	G319-K325 CarbonylContact O-C 3.59Å; G319-K325 VanDerWaalsContact O-CA 3.27Å; G319-K325 WeakPolarHBondContact O-CA 3.49Å; K325-D356 WeakPolarHBondContact CD-OD1 3.1Å; K325-D356 IonicContact NZ-OD1 2.89Å; K325-D356 PolarHBondContact NZ-OD1 2.96Å; K325-D356 IonicContact NZ-OD2 3.17Å; K325-Y357 WeakPolarHBondContact CD-O 3.17Å; K325-Y357 PolarHBondContact NZ-O 3.43Å; K325-Y357 WeakPolarHBondContact O-CD2 3.28Å
326	F	90.3	Very high	86.1	Confident	53 Å²	53	92 Å²	92	23%	0.232	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	153.4	174.3	75.5	-86	0	0	0	110.8	F318 G319 R321	F318-F326 VanDerWaalsContact CA-O 3.25Å; F318-F326 WeakPolarHBondContact CA-O 3.32Å; F318-F326 WeakPolarHBondContact CB-O 3.49Å; G319-F326 VanDerWaalsContact C-CE1 3.47Å; G319-F326 PolarHBondContact N-O 3.01Å; G319-F326 WeakPolarHBondContact O-CD1 3.41Å; G319-F326 PolarHBondContact O-N 2.87Å; R321-F326 HydrophobicContact CB-CD1 3.85Å; R321-F326 HydrophobicContact CB-CE1 4.2Å
327	V	92.9	Very high	85.1	Confident	14 Å²	14	95.3 Å²	95.3	9%	0.085	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	119.7	169.8	168.9	0	0	0	0	107.5	F316 R317 F318 Y345 Y357 V359	F316-V327 HydrophobicContact CD2-CG1 4.12Å; F316-V327 HydrophobicContact CE2-CG1 3.54Å; R317-V327 CarbonylContact O-C 3.58Å; R317-V327 WeakPolarHBondContact O-CA 3.36Å; F318-V327 HydrophobicContact CB-CG2 3.95Å; V327-Y345 HydrophobicContact CB-CD2 4.49Å; V327-Y345 HydrophobicContact CG1-CD1 4.05Å; V327-Y345 HydrophobicContact CG1-CD2 4Å; V327-Y345 HydrophobicContact CG1-CE1 3.92Å; V327-Y345 HydrophobicContact CG1-CE2 3.9Å; V327-Y345 HydrophobicContact CG1-CG 4.09Å; V327-Y345 HydrophobicContact CG2-CD2 4.32Å; V327-Y345 HydrophobicContact CG2-CG 4.41Å; V327-Y357 HydrophobicContact CB-CD1 3.69Å; V327-Y357 HydrophobicContact CB-CE1 3.78Å; V327-Y357 HydrophobicContact CB-CG 4.18Å; V327-Y357 HydrophobicContact CG2-CD1 3.48Å; V327-Y357 VanDerWaalsContact CG2-CD1 3.48Å; V327-Y357 HydrophobicContact CG2-CE1 4.13Å; V327-Y357 HydrophobicContact CG2-CG 3.7Å; V327-V359 HydrophobicContact CG2-CG2 3.73Å
328	D	90.9	Very high	84.3	Confident	83 Å²	83	94.8 Å²	94.8	44%	0.444	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	117.4	168.4	-61.6	-33.7	0	0	0	107.1	F316 R317	F316-D328 CarbonylContact C-O 3.57Å; F316-D328 WeakPolarHBondContact CA-O 3.41Å; R317-D328 HydrophobicContact CB-CB 4.34Å; R317-D328 PolarHBondContact N-O 3.42Å; R317-D328 PolarHBondContact O-N 2.96Å
329	Y	93	Very high	83.7	Confident	55 Å²	55	91.3 Å²	91.3	22%	0.216	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	123.8	-176	174	-108.6	0	0	0	110.7	V308 V310 D314 D315 F316 K331 Y345	V308-Y329 HydrophobicContact CG1-CD1 4.13Å; V308-Y329 HydrophobicContact CG1-CE1 3.63Å; V308-Y329 HydrophobicContact CG1-CE2 4.45Å; V310-Y329 HydrophobicContact CB-CE2 4.42Å; V310-Y329 HydrophobicContact CG1-CD2 4.38Å; V310-Y329 HydrophobicContact CG1-CE2 4.14Å; V310-Y329 HydrophobicContact CG2-CD2 4.11Å; V310-Y329 HydrophobicContact CG2-CE2 4.04Å; D314-Y329 HydrophobicContact CB-CD2 4.4Å; D314-Y329 HydrophobicContact CB-CE2 3.68Å; D314-Y329 VanDerWaalsContact OD2-CE2 3.31Å; D314-Y329 WeakPolarHBondContact OD2-CE2 3.46Å; D314-Y329 PolarHBondContact OD2-OH 2.94Å; D315-Y329 CarbonylContact O-C 3.58Å; D315-Y329 WeakPolarHBondContact O-CA 3.28Å; F316-Y329 HydrophobicContact CB-CD2 4.31Å; F316-Y329 AromaticContact CD2-CD2 3.96Å; F316-Y329 HydrophobicContact CD2-CD2 3.96Å; Y329-K331 HydrophobicContact CE1-CB 3.98Å; Y329-Y345 HydrophobicContact CD1-CE1 4.21Å; Y329-Y345 WeakPolarHBondContact CD1-OH 3.4Å; Y329-Y345 HydrophobicContact CD2-CE1 4.21Å; Y329-Y345 AromaticContact CG-CE1 3.85Å; Y329-Y345 HydrophobicContact CG-CE1 3.85Å
330	V	90.1	Very high	83.6	Confident	92 Å²	92	97 Å²	97	56%	0.558	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.8	116.9	170.7	-172.8	0	0	0	0	108.4	D315	D315-V330 HydrophobicContact CB-CB 4.12Å; D315-V330 PolarHBondContact N-O 2.88Å; D315-V330 PolarHBondContact O-N 3.23Å
331	K	90.4	Very high	83.7	Confident	129 Å²	129	90.5 Å²	90.5	56%	0.561	47%	0.469	S	S	*	.			trans	-71	130.8	177.7	-179.1	-179.5	176.1	-176.4	0	110.3	Y329	Y329-K331 HydrophobicContact CE1-CB 3.98Å
332	T	87.2	Confident	84.3	Confident	52 Å²	52	85.4 Å²	85.4	32%	0.319	46%	0.455	S	S	.	.			trans	-83.7	129.2	170.9	-68.6	0	0	0	0	110.6	C313 D314	C313-T332 HydrophobicContact CB-CG2 4.48Å; C313-T332 WeakPolarHBondContact O-CB 3.27Å; C313-T332 PolarHBondContact O-OG1 2.83Å; D314-T332 PolarHBondContact OD1-N 3.06Å
333	Y	81	Confident	85.1	Confident	196 Å²	196	78.4 Å²	78.4	77%	0.769	42%	0.417	S	S	*	.	S	Bend	trans	-138.3	133.1	178.7	-173.6	-96.1	0	0	0	111.8
334	P	80.8	Confident	86.1	Confident	103 Å²	103	75.6 Å²	75.6	67%	0.669	39%	0.389	S	S	*	.	S	Bend	cis	-68.3	146.2	-7.5	29.5	-34.1	0	0	0	111.8
335	R	82.2	Confident	87.1	Confident	64 Å²	64	71.3 Å²	71.3	24%	0.242	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-75.4	126.5	177.6	-176.6	175.8	-55.4	-62.4	9.8	109.3	Y311 C313 D314 S339	Y311-R335 VanDerWaalsContact CD2-NE 3.3Å; C313-R335 PolarHBondContact SG-NH1 2.81Å; D314-R335 VanDerWaalsContact CG-NH1 3.25Å; D314-R335 VanDerWaalsContact CG-NH2 3.32Å; D314-R335 IonicContact OD1-CZ 2.61Å; D314-R335 VanDerWaalsContact OD1-CZ 3.32Å; D314-R335 IonicContact OD1-NH1 3.17Å; D314-R335 PolarHBondContact OD1-NH1 3.45Å; D314-R335 IonicContact OD1-NH2 2.73Å; D314-R335 PolarHBondContact OD1-NH2 3.2Å; D314-R335 IonicContact OD2-CZ 3.74Å; D314-R335 IonicContact OD2-NH1 3.43Å; D314-R335 PolarHBondContact OD2-NH1 3.33Å; D314-R335 IonicContact OD2-NH2 3.78Å; D314-R335 PolarHBondContact OD2-NH2 3.25Å; R335-S339 WeakPolarHBondContact CG-OG 2.89Å
336	P	83.6	Confident	87.4	Confident	75 Å²	75	67.5 Å²	67.5	49%	0.487	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-55.8	143.3	175	-25.3	33.5	0	0	0	112.3	C313 N338 S339	C313-P336 HydrophobicContact CB-CG 4.44Å; P336-N338 PolarHBondContact O-N 3.39Å; P336-S339 WeakPolarHBondContact CD-OG 3.46Å; P336-S339 WeakPolarHBondContact O-CB 3.43Å; P336-S339 PolarHBondContact O-N 2.99Å; P336-S339 VanDerWaalsContact O-N 3.11Å; P336-S339 PolarHBondContact O-OG 2.83Å
337	A	72.2	Confident	87.6	Confident	107 Å²	107	67.9 Å²	67.9	88%	0.884	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-23.2	-175.2	0	0	0	0	0	114.7
338	N	76.2	Confident	87.6	Confident	146 Å²	146	67.2 Å²	67.2	78%	0.781	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	19.2	-177	-63.2	-22.6	0	0	0	113.8	P336	P336-N338 PolarHBondContact O-N 3.39Å
339	S	81.6	Confident	87.6	Confident	21 Å²	21	63.8 Å²	63.8	15%	0.147	33%	0.33	C	S	.	.			trans	-66.8	135.8	-178.8	-52.1	0	0	0	0	111.3	D312 C313 R335 P336	D312-S339 VanDerWaalsContact OD1-CA 3.26Å; D312-S339 WeakPolarHBondContact OD1-CA 3.44Å; D312-S339 WeakPolarHBondContact OD1-CB 3.23Å; C313-S339 PolarHBondContact SG-OG 3.23Å; R335-S339 WeakPolarHBondContact CG-OG 2.89Å; P336-S339 WeakPolarHBondContact CD-OG 3.46Å; P336-S339 WeakPolarHBondContact O-CB 3.43Å; P336-S339 PolarHBondContact O-N 2.99Å; P336-S339 VanDerWaalsContact O-N 3.11Å; P336-S339 PolarHBondContact O-OG 2.83Å
340	R	85.6	Confident	87.5	Confident	146 Å²	146	62.8 Å²	62.8	55%	0.551	33%	0.328	S	S	*	.			trans	-105	146.8	-175.1	-63.1	-178.9	179.8	-176.5	-0.1	112.3	Y311 D312 V342 D401	Y311-R340 CarbonylContact C-O 3.59Å; Y311-R340 WeakPolarHBondContact CA-O 3.31Å; Y311-R340 WeakPolarHBondContact CB-O 3.5Å; D312-R340 VanDerWaalsContact CG-N 3.26Å; D312-R340 PolarHBondContact N-O 3.24Å; D312-R340 PolarHBondContact OD1-N 2.94Å; D312-R340 PolarHBondContact OD2-N 3.42Å; R340-V342 PolarHBondContact O-N 3.06Å; R340-D401 WeakPolarHBondContact CA-OD2 3.29Å; R340-D401 WeakPolarHBondContact CB-OD2 3.09Å
341	I	89.1	Confident	87.3	Confident	5 Å²	5	60.9 Å²	60.9	3%	0.026	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	124.4	177	-59.9	176	0	0	0	109.9	V309 Y311 R362 I365 D401 I402 T404 L407	V309-I341 HydrophobicContact CG1-CB 4.47Å; V309-I341 HydrophobicContact CG1-CD1 3.99Å; V309-I341 HydrophobicContact CG1-CG1 3.92Å; V309-I341 HydrophobicContact CG1-CG2 3.82Å; Y311-I341 HydrophobicContact CD1-CG1 4.08Å; Y311-I341 HydrophobicContact CE1-CG1 3.73Å; I341-R362 PolarHBondContact O-NH1 2.89Å; I341-I365 HydrophobicContact CG2-CD1 4.21Å; I341-D401 HydrophobicContact CB-CB 4.49Å; I341-D401 HydrophobicContact CD1-CB 4.11Å; I341-D401 HydrophobicContact CG1-CB 4.22Å; I341-D401 PolarHBondContact N-OD2 3.35Å; I341-I402 HydrophobicContact CD1-CG2 3.96Å; I341-I402 WeakPolarHBondContact CD1-O 3.28Å; I341-I402 HydrophobicContact CG2-CG2 4.37Å; I341-T404 HydrophobicContact CD1-CG2 3.87Å; I341-L407 HydrophobicContact CD1-CD2 4.46Å; I341-L407 HydrophobicContact CG2-CD2 3.59Å
342	V	90.7	Very high	86.9	Confident	46 Å²	46	56.1 Å²	56.1	28%	0.279	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	-25.5	-179.3	-64.1	0	0	0	0	113.7	V310 D312 R340 R362	V310-V342 HydrophobicContact CB-CG2 4.16Å; V310-V342 HydrophobicContact CG1-CG2 3.67Å; V310-V342 PolarHBondContact O-N 2.88Å; D312-V342 HydrophobicContact CB-CG1 3.71Å; R340-V342 PolarHBondContact O-N 3.06Å; V342-R362 WeakPolarHBondContact O-CA 3.46Å; V342-R362 PolarHBondContact O-N 3.04Å
343	A	93.7	Very high	86.6	Confident	2 Å²	2	57.8 Å²	57.8	2%	0.017	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	167.4	175.4	0	0	0	0	0	111.2	V310 F316 V359 L360	V310-A343 HydrophobicContact CB-CB 4.05Å; V310-A343 WeakPolarHBondContact CB-O 3.35Å; V310-A343 HydrophobicContact CG2-CB 4.25Å; V310-A343 PolarHBondContact N-O 3.34Å; V310-A343 PolarHBondContact O-N 3.45Å; F316-A343 HydrophobicContact CD1-CB 4.29Å; F316-A343 HydrophobicContact CE1-CB 3.62Å; F316-A343 HydrophobicContact CZ-CB 4.1Å; A343-V359 HydrophobicContact CB-CG1 4.34Å; A343-L360 CarbonylContact C-O 3.49Å; A343-L360 VanDerWaalsContact CA-O 3.29Å; A343-L360 WeakPolarHBondContact CA-O 3.49Å
344	C	94.6	Very high	86.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	131.7	161.1	-179.6	0	0	0	0	108.8	V308 L360 L407 T411	V308-C344 CarbonylContact O-C 3.52Å; V308-C344 VanDerWaalsContact O-CA 3.25Å; V308-C344 WeakPolarHBondContact O-CA 3.17Å; V308-C344 PolarHBondContact O-SG 3.09Å; V308-C344 VanDerWaalsContact O-SG 3.41Å; C344-L360 PolarHBondContact N-O 3.34Å; C344-L360 PolarHBondContact O-N 2.93Å; C344-L407 HydrophobicContact CB-CD1 3.97Å; C344-L407 HydrophobicContact CB-CD2 3.67Å; C344-L407 HydrophobicContact CB-CG 3.61Å; C344-T411 WeakPolarHBondContact CB-OG1 3.5Å; C344-T411 PolarHBondContact SG-OG1 2.74Å
345	Y	95.3	Very high	87.2	Confident	28 Å²	28	50.8 Å²	50.8	11%	0.11	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	156.3	179.1	77	-91.5	0	0	0	112	P307 V308 V310 F316 V327 Y329 Y357 F358	P307-Y345 CarbonylContact C-O 3.51Å; P307-Y345 VanDerWaalsContact CA-O 3.24Å; P307-Y345 WeakPolarHBondContact CA-O 3.45Å; V308-Y345 HydrophobicContact CB-CD1 4.01Å; V308-Y345 HydrophobicContact CB-CE1 3.52Å; V308-Y345 HydrophobicContact CB-CE2 4.26Å; V308-Y345 HydrophobicContact CG1-CD1 4.43Å; V308-Y345 HydrophobicContact CG1-CE1 3.66Å; V308-Y345 HydrophobicContact CG2-CE1 4.22Å; V308-Y345 HydrophobicContact CG2-CE2 4.21Å; V308-Y345 PolarHBondContact N-O 3.45Å; V308-Y345 PolarHBondContact O-N 3.3Å; V310-Y345 HydrophobicContact CG2-CD1 3.74Å; V310-Y345 HydrophobicContact CG2-CE1 4Å; F316-Y345 HydrophobicContact CD2-CD1 4.39Å; F316-Y345 HydrophobicContact CD2-CE1 4.45Å; F316-Y345 AromaticContact CE2-CD1 3.57Å; F316-Y345 HydrophobicContact CE2-CD1 3.57Å; F316-Y345 HydrophobicContact CE2-CE1 4.01Å; F316-Y345 HydrophobicContact CE2-CG 4.3Å; F316-Y345 HydrophobicContact CZ-CD1 4.24Å; V327-Y345 HydrophobicContact CB-CD2 4.49Å; V327-Y345 HydrophobicContact CG1-CD1 4.05Å; V327-Y345 HydrophobicContact CG1-CD2 4Å; V327-Y345 HydrophobicContact CG1-CE1 3.92Å; V327-Y345 HydrophobicContact CG1-CE2 3.9Å; V327-Y345 HydrophobicContact CG1-CG 4.09Å; V327-Y345 HydrophobicContact CG2-CD2 4.32Å; V327-Y345 HydrophobicContact CG2-CG 4.41Å; Y329-Y345 HydrophobicContact CD1-CE1 4.21Å; Y329-Y345 WeakPolarHBondContact CD1-OH 3.4Å; Y329-Y345 HydrophobicContact CD2-CE1 4.21Å; Y329-Y345 AromaticContact CG-CE1 3.85Å; Y329-Y345 HydrophobicContact CG-CE1 3.85Å; Y345-Y357 HydrophobicContact CD2-CD1 4.14Å; Y345-Y357 HydrophobicContact CE2-CD1 4.48Å; Y345-Y357 HydrophobicContact CE2-CE1 4.41Å; Y345-F358 CarbonylContact C-O 3.57Å; Y345-F358 WeakPolarHBondContact CA-O 3.46Å; Y345-F358 WeakPolarHBondContact CB-O 3.42Å
346	V	94.1	Very high	87.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	134.9	171.4	66.6	0	0	0	0	110.1	C304 G305 P307 Y357 F358 T411 A415	C304-V346 WeakPolarHBondContact SG-CG2 3.19Å; G305-V346 VanDerWaalsContact O-CG2 3.25Å; G305-V346 WeakPolarHBondContact O-CG2 3.48Å; P307-V346 HydrophobicContact CB-CB 4.3Å; P307-V346 HydrophobicContact CG-CB 4.2Å; P307-V346 HydrophobicContact CG-CG2 4.03Å; V346-Y357 WeakPolarHBondContact O-CA 3.47Å; V346-F358 HydrophobicContact CG1-CB 3.92Å; V346-F358 PolarHBondContact N-O 2.77Å; V346-F358 PolarHBondContact O-N 2.85Å; V346-T411 HydrophobicContact CB-CG2 4.23Å; V346-T411 HydrophobicContact CG1-CG2 4.1Å; V346-A415 HydrophobicContact CG1-CB 3.76Å
347	K	94.3	Very high	88.1	Confident	62 Å²	62	46.7 Å²	46.7	27%	0.27	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	119.1	177.5	-178.6	174.2	-178.9	173	0	109.5	G305 Y355 Y357	G305-K347 PolarHBondContact N-O 3.26Å; K347-Y355 HydrophobicContact CD-CD1 4.3Å; K347-Y355 HydrophobicContact CG-CD1 4.4Å; K347-Y357 HydrophobicContact CB-CD1 4.04Å; K347-Y357 HydrophobicContact CB-CE1 3.71Å; K347-Y357 HydrophobicContact CD-CE1 3.92Å; K347-Y357 WeakPolarHBondContact CE-OH 3.32Å; K347-Y357 HydrophobicContact CG-CD1 4.25Å; K347-Y357 HydrophobicContact CG-CE1 3.62Å
348	I	93.8	Very high	89.1	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	127	178.7	-56.5	164.8	0	0	0	107.9	I301 L350 Y355 D356 A415 F416 Y419	I301-I348 HydrophobicContact CB-CG2 4.17Å; I301-I348 HydrophobicContact CG2-CG2 3.61Å; I348-L350 HydrophobicContact CG2-CD2 4.19Å; I348-Y355 WeakPolarHBondContact O-CA 3.09Å; I348-D356 HydrophobicContact CB-CB 4.27Å; I348-D356 PolarHBondContact N-O 2.95Å; I348-D356 PolarHBondContact O-N 2.86Å; I348-A415 HydrophobicContact CD1-CB 4.36Å; I348-F416 HydrophobicContact CD1-CD1 4.25Å; I348-F416 HydrophobicContact CD1-CE1 3.74Å; I348-F416 HydrophobicContact CD1-CZ 4.37Å; I348-F416 HydrophobicContact CG1-CE1 4.12Å; I348-F416 HydrophobicContact CG1-CZ 4.44Å; I348-F416 HydrophobicContact CG2-CE1 4.21Å; I348-Y419 HydrophobicContact CD1-CE2 4.34Å
349	I	91.1	Very high	89.9	Confident	10 Å²	10	38.1 Å²	38.1	5%	0.051	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	113.6	177.3	-63.4	166.9	0	0	0	106.6	L302 R303 Y355	L302-I349 WeakPolarHBondContact CA-O 3.45Å; L302-I349 HydrophobicContact CB-CG2 4.22Å; L302-I349 WeakPolarHBondContact CB-O 3.39Å; L302-I349 HydrophobicContact CD2-CG2 4.05Å; L302-I349 PolarHBondContact N-O 2.63Å; R303-I349 HydrophobicContact CG-CB 3.81Å; R303-I349 HydrophobicContact CG-CD1 3.71Å; R303-I349 HydrophobicContact CG-CG1 4.23Å; R303-I349 HydrophobicContact CG-CG2 4.32Å; R303-I349 PolarHBondContact N-O 2.79Å; R303-I349 WeakPolarHBondContact O-CB 3.43Å; R303-I349 PolarHBondContact O-N 2.88Å; I349-Y355 HydrophobicContact CD1-CE1 4.18Å; I349-Y355 HydrophobicContact CG1-CD1 3.76Å; I349-Y355 HydrophobicContact CG1-CE1 3.85Å
350	L	90.2	Very high	90.4	Very high	34 Å²	34	37.6 Å²	37.6	18%	0.178	18%	0.182	C	C	.	.			trans	-73.7	166.3	-179.4	-61.8	178.8	0	0	0	109.9	I301 L302 I348 N352 N353 S354 D356 Y419	I301-L350 HydrophobicContact CG2-CD2 4.37Å; L302-L350 WeakPolarHBondContact CB-O 3.23Å; I348-L350 HydrophobicContact CG2-CD2 4.19Å; L350-N352 HydrophobicContact CB-CB 3.9Å; L350-N352 WeakPolarHBondContact CB-ND2 3.18Å; L350-N352 PolarHBondContact O-N 2.87Å; L350-N353 PolarHBondContact O-N 3.45Å; L350-S354 PolarHBondContact N-O 3.02Å; L350-S354 VanDerWaalsContact N-O 3.12Å; L350-D356 HydrophobicContact CD1-CB 4.43Å; L350-Y419 HydrophobicContact CD2-CE1 4.21Å
351	P	85	Confident	90.7	Very high	53 Å²	53	32.5 Å²	32.5	34%	0.344	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	4.5	178.2	-27.3	36.7	0	0	0	116.4	G299 Q300 T1190	G299-P351 WeakPolarHBondContact O-CG 3.19Å; Q300-P351 WeakPolarHBondContact O-CD 3.33Å; P351-T1190 WeakPolarHBondContact O-CG2 3.16Å
352	N	83.4	Confident	90.6	Very high	29 Å²	29	36.1 Å²	36.1	16%	0.155	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.8	-10.1	-140.1	117.8	5.3	0	0	0	107.3	L350 S354 T1190 S1192 V1193	L350-N352 HydrophobicContact CB-CB 3.9Å; L350-N352 WeakPolarHBondContact CB-ND2 3.18Å; L350-N352 PolarHBondContact O-N 2.87Å; N352-S354 PolarHBondContact ND2-OG 3.46Å; N352-S354 PolarHBondContact O-N 2.91Å; N352-S354 VanDerWaalsContact OD1-CA 3.3Å; N352-S354 WeakPolarHBondContact OD1-CA 3.33Å; N352-S354 WeakPolarHBondContact OD1-CB 2.98Å; N352-S354 PolarHBondContact OD1-N 2.91Å; N352-S354 PolarHBondContact OD1-OG 2.97Å; N352-T1190 WeakPolarHBondContact CA-OG1 3.39Å; N352-S1192 WeakPolarHBondContact CA-OG 3.19Å; N352-S1192 WeakPolarHBondContact CB-OG 3.44Å; N352-S1192 WeakPolarHBondContact ND2-CB 3.41Å; N352-S1192 PolarHBondContact O-OG 2.92Å; N352-S1192 WeakPolarHBondContact OD1-CB 3.38Å; N352-S1192 PolarHBondContact OD1-OG 3.49Å; N352-S1192 VanDerWaalsContact OD1-OG 3.13Å; N352-V1193 WeakPolarHBondContact O-CG1 3.28Å
353	N	81.1	Confident	90.3	Very high	86 Å²	86	39.9 Å²	39.9	46%	0.46	19%	0.193	S	C	.	.	S	Bend	trans	63.6	-0.9	-172.1	-67.3	-28	0	0	0	116.6	L302 L350	L302-N353 WeakPolarHBondContact CD2-OD1 3.21Å; L350-N353 PolarHBondContact O-N 3.45Å
354	S	85.8	Confident	89.9	Confident	38 Å²	38	39.9 Å²	39.9	27%	0.266	19%	0.194	S	C	.	.			trans	-73.3	160.9	165.2	87.1	0	0	0	0	111.6	L350 N352	L350-S354 PolarHBondContact N-O 3.02Å; L350-S354 VanDerWaalsContact N-O 3.12Å; N352-S354 PolarHBondContact ND2-OG 3.46Å; N352-S354 PolarHBondContact O-N 2.91Å; N352-S354 VanDerWaalsContact OD1-CA 3.3Å; N352-S354 WeakPolarHBondContact OD1-CA 3.33Å; N352-S354 WeakPolarHBondContact OD1-CB 2.98Å; N352-S354 PolarHBondContact OD1-N 2.91Å; N352-S354 PolarHBondContact OD1-OG 2.97Å
355	Y	87.6	Confident	89.4	Confident	114 Å²	114	40.1 Å²	40.1	45%	0.447	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	139.3	179.6	-51.1	-55	0	0	0	110.3	K347 I348 I349	K347-Y355 HydrophobicContact CD-CD1 4.3Å; K347-Y355 HydrophobicContact CG-CD1 4.4Å; I348-Y355 WeakPolarHBondContact O-CA 3.09Å; I349-Y355 HydrophobicContact CD1-CE1 4.18Å; I349-Y355 HydrophobicContact CG1-CD1 3.76Å; I349-Y355 HydrophobicContact CG1-CE1 3.85Å
356	D	90.7	Very high	88.7	Confident	25 Å²	25	41.2 Å²	41.2	13%	0.134	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	158.8	158.4	-174.9	21.3	0	0	0	107.2	K325 I348 L350 Y419	K325-D356 WeakPolarHBondContact CD-OD1 3.1Å; K325-D356 IonicContact NZ-OD1 2.89Å; K325-D356 PolarHBondContact NZ-OD1 2.96Å; K325-D356 IonicContact NZ-OD2 3.17Å; I348-D356 HydrophobicContact CB-CB 4.27Å; I348-D356 PolarHBondContact N-O 2.95Å; I348-D356 PolarHBondContact O-N 2.86Å; L350-D356 HydrophobicContact CD1-CB 4.43Å; D356-Y419 PolarHBondContact OD2-OH 3.44Å
357	Y	93.3	Very high	88.1	Confident	29 Å²	29	47.6 Å²	47.6	11%	0.114	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	139	-178.6	-68.3	-93.6	0	0	0	109.6	K325 V327 Y345 V346 K347	K325-Y357 WeakPolarHBondContact CD-O 3.17Å; K325-Y357 PolarHBondContact NZ-O 3.43Å; K325-Y357 WeakPolarHBondContact O-CD2 3.28Å; V327-Y357 HydrophobicContact CB-CD1 3.69Å; V327-Y357 HydrophobicContact CB-CE1 3.78Å; V327-Y357 HydrophobicContact CB-CG 4.18Å; V327-Y357 HydrophobicContact CG2-CD1 3.48Å; V327-Y357 VanDerWaalsContact CG2-CD1 3.48Å; V327-Y357 HydrophobicContact CG2-CE1 4.13Å; V327-Y357 HydrophobicContact CG2-CG 3.7Å; Y345-Y357 HydrophobicContact CD2-CD1 4.14Å; Y345-Y357 HydrophobicContact CE2-CD1 4.48Å; Y345-Y357 HydrophobicContact CE2-CE1 4.41Å; V346-Y357 WeakPolarHBondContact O-CA 3.47Å; K347-Y357 HydrophobicContact CB-CD1 4.04Å; K347-Y357 HydrophobicContact CB-CE1 3.71Å; K347-Y357 HydrophobicContact CD-CE1 3.92Å; K347-Y357 WeakPolarHBondContact CE-OH 3.32Å; K347-Y357 HydrophobicContact CG-CD1 4.25Å; K347-Y357 HydrophobicContact CG-CE1 3.62Å
358	F	93.4	Very high	87.3	Confident	43 Å²	43	45.5 Å²	45.5	19%	0.189	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	125.4	163.8	179.7	-98.1	0	0	0	108.4	Y345 V346 L360 T411 H414 A415	Y345-F358 CarbonylContact C-O 3.57Å; Y345-F358 WeakPolarHBondContact CA-O 3.46Å; Y345-F358 WeakPolarHBondContact CB-O 3.42Å; V346-F358 HydrophobicContact CG1-CB 3.92Å; V346-F358 PolarHBondContact N-O 2.77Å; V346-F358 PolarHBondContact O-N 2.85Å; F358-L360 HydrophobicContact CE1-CB 4.09Å; F358-T411 HydrophobicContact CD1-CG2 3.95Å; F358-T411 HydrophobicContact CE1-CG2 4.34Å; F358-H414 HydrophobicContact CE1-CB 3.66Å; F358-H414 HydrophobicContact CE2-CB 4.24Å; F358-H414 WeakPolarHBondContact CE2-O 3.48Å; F358-H414 HydrophobicContact CZ-CB 3.39Å; F358-A415 HydrophobicContact CB-CB 3.86Å; F358-A415 HydrophobicContact CD1-CB 4.09Å; F358-A415 VanDerWaalsContact CG-CA 3.43Å; F358-A415 HydrophobicContact CG-CB 4.01Å
359	V	93.3	Very high	86.3	Confident	29 Å²	29	48.7 Å²	48.7	18%	0.176	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	123	178.6	-177.2	0	0	0	0	107.6	F316 F318 V327 A343 D361	F316-V359 HydrophobicContact CE1-CG1 4.2Å; F316-V359 HydrophobicContact CZ-CG1 3.8Å; F316-V359 HydrophobicContact CZ-CG2 4.4Å; F318-V359 HydrophobicContact CB-CG2 3.93Å; F318-V359 HydrophobicContact CD1-CG1 4.08Å; F318-V359 HydrophobicContact CD2-CB 3.94Å; F318-V359 HydrophobicContact CD2-CG1 4Å; F318-V359 HydrophobicContact CD2-CG2 3.86Å; F318-V359 HydrophobicContact CE1-CG1 4.12Å; F318-V359 HydrophobicContact CE2-CB 4.18Å; F318-V359 HydrophobicContact CE2-CG1 4.04Å; F318-V359 HydrophobicContact CG-CB 4.28Å; F318-V359 HydrophobicContact CG-CG1 4.01Å; F318-V359 HydrophobicContact CG-CG2 3.93Å; F318-V359 HydrophobicContact CZ-CG1 4.1Å; V327-V359 HydrophobicContact CG2-CG2 3.73Å; A343-V359 HydrophobicContact CB-CG1 4.34Å; V359-D361 HydrophobicContact CG1-CB 4.45Å
360	L	92.8	Very high	85.4	Confident	10 Å²	10	53.9 Å²	53.9	5%	0.052	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	93.1	166.7	-169.9	69	0	0	0	107.1	A343 C344 F358 I365 L368 L407 K410	A343-L360 CarbonylContact C-O 3.49Å; A343-L360 VanDerWaalsContact CA-O 3.29Å; A343-L360 WeakPolarHBondContact CA-O 3.49Å; C344-L360 PolarHBondContact N-O 3.34Å; C344-L360 PolarHBondContact O-N 2.93Å; F358-L360 HydrophobicContact CE1-CB 4.09Å; L360-I365 HydrophobicContact CD2-CG1 4.33Å; L360-I365 HydrophobicContact CG-CG1 4.18Å; L360-L368 HydrophobicContact CD1-CD1 4.21Å; L360-L368 HydrophobicContact CD2-CD1 3.69Å; L360-L368 HydrophobicContact CG-CD1 4.48Å; L360-L407 HydrophobicContact CD2-CD1 3.7Å; L360-K410 HydrophobicContact CD2-CB 4.5Å
361	D	91.8	Very high	84.4	Confident	40 Å²	40	57.3 Å²	57.3	21%	0.214	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-179.2	-178.5	66.5	-6.7	0	0	0	112.4	F318 V359 E363 G364 I365 R367	F318-D361 HydrophobicContact CE1-CB 4.38Å; F318-D361 HydrophobicContact CZ-CB 3.93Å; V359-D361 HydrophobicContact CG1-CB 4.45Å; D361-E363 VanDerWaalsContact C-N 3.29Å; D361-E363 PolarHBondContact O-N 3.28Å; D361-G364 WeakPolarHBondContact O-CA 3.3Å; D361-G364 PolarHBondContact O-N 3.44Å; D361-G364 PolarHBondContact OD1-N 3.45Å; D361-I365 WeakPolarHBondContact O-CG1 3.33Å; D361-I365 PolarHBondContact O-N 3.05Å; D361-R367 IonicContact OD1-NH2 2.74Å
362	R	86.1	Confident	83.4	Confident	81 Å²	81	55.8 Å²	55.8	31%	0.306	26%	0.257	S	S	.	.	H	α-helix	trans	-58.1	-42	-177.9	-170.5	68.7	-156	-170.9	3.7	112.2	I341 V342 G364 I365 D366 D401	I341-R362 PolarHBondContact O-NH1 2.89Å; V342-R362 WeakPolarHBondContact O-CA 3.46Å; V342-R362 PolarHBondContact O-N 3.04Å; R362-G364 VanDerWaalsContact C-N 3.34Å; R362-G364 PolarHBondContact O-N 3.02Å; R362-I365 PolarHBondContact O-N 2.9Å; R362-D366 IonicContact CZ-OD1 3.11Å; R362-D366 IonicContact NE-OD1 3.86Å; R362-D366 PolarHBondContact NE-OD1 3.49Å; R362-D366 IonicContact NE-OD2 2.93Å; R362-D366 PolarHBondContact NE-OD2 3.44Å; R362-D366 IonicContact NH2-OD1 2.66Å; R362-D366 PolarHBondContact NH2-OD1 3.02Å; R362-D366 WeakPolarHBondContact O-CB 3.41Å; R362-D366 VanDerWaalsContact O-CG 3.31Å; R362-D366 PolarHBondContact O-N 3.27Å; R362-D401 IonicContact NH1-OD1 3.41Å; R362-D401 PolarHBondContact NH1-OD1 3.4Å
363	E	84.7	Confident	82.6	Confident	124 Å²	124	56 Å²	56	58%	0.579	26%	0.263	S	S	*	.	H	α-helix	trans	-63.1	-40.6	175.3	-60.6	-171.3	172.7	0	0	112	D361 D366 R367	D361-E363 VanDerWaalsContact C-N 3.29Å; D361-E363 PolarHBondContact O-N 3.28Å; E363-D366 PolarHBondContact O-N 3.5Å; E363-R367 WeakPolarHBondContact O-CB 3.27Å; E363-R367 VanDerWaalsContact O-CG 3.27Å; E363-R367 WeakPolarHBondContact O-CG 3.36Å; E363-R367 PolarHBondContact O-N 3Å; E363-R367 IonicContact OE2-NH1 3.75Å; E363-R367 PolarHBondContact OE2-NH1 3.39Å
364	G	85.8	Confident	81.7	Confident	3 Å²	3	59.5 Å²	59.5	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-61	-42.3	174.3	0	0	0	0	0	113	D361 R362 L368	D361-G364 WeakPolarHBondContact O-CA 3.3Å; D361-G364 PolarHBondContact O-N 3.44Å; D361-G364 PolarHBondContact OD1-N 3.45Å; R362-G364 VanDerWaalsContact C-N 3.34Å; R362-G364 PolarHBondContact O-N 3.02Å; G364-L368 WeakPolarHBondContact O-CG 3.33Å; G364-L368 PolarHBondContact O-N 2.81Å; G364-L368 VanDerWaalsContact O-N 3.11Å
365	I	84.5	Confident	80.3	Confident	5 Å²	5	64.1 Å²	64.1	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-65.1	-45.7	176.1	-65.1	169.2	0	0	0	110.6	I341 L360 D361 R362 L368 R369 I402 L407	I341-I365 HydrophobicContact CG2-CD1 4.21Å; L360-I365 HydrophobicContact CD2-CG1 4.33Å; L360-I365 HydrophobicContact CG-CG1 4.18Å; D361-I365 WeakPolarHBondContact O-CG1 3.33Å; D361-I365 PolarHBondContact O-N 3.05Å; R362-I365 PolarHBondContact O-N 2.9Å; I365-L368 WeakPolarHBondContact O-CB 3.39Å; I365-L368 PolarHBondContact O-N 2.84Å; I365-R369 PolarHBondContact O-N 2.84Å; I365-I402 HydrophobicContact CG2-CD1 4.11Å; I365-I402 HydrophobicContact CG2-CG2 4.24Å; I365-L407 HydrophobicContact CD1-CD1 3.9Å; I365-L407 HydrophobicContact CD1-CD2 4.23Å; I365-L407 HydrophobicContact CG1-CD1 3.79Å
366	D	80.6	Confident	78.4	Confident	51 Å²	51	60 Å²	60	27%	0.273	28%	0.282	S	S	.	.	H	α-helix	trans	-66.9	-38.5	179.8	-68.7	-30.4	0	0	0	111.1	R362 E363 L368 R369 E370	R362-D366 IonicContact CZ-OD1 3.11Å; R362-D366 IonicContact NE-OD1 3.86Å; R362-D366 PolarHBondContact NE-OD1 3.49Å; R362-D366 IonicContact NE-OD2 2.93Å; R362-D366 PolarHBondContact NE-OD2 3.44Å; R362-D366 IonicContact NH2-OD1 2.66Å; R362-D366 PolarHBondContact NH2-OD1 3.02Å; R362-D366 WeakPolarHBondContact O-CB 3.41Å; R362-D366 VanDerWaalsContact O-CG 3.31Å; R362-D366 PolarHBondContact O-N 3.27Å; E363-D366 PolarHBondContact O-N 3.5Å; D366-L368 VanDerWaalsContact C-N 3.33Å; D366-L368 PolarHBondContact O-N 3.39Å; D366-R369 WeakPolarHBondContact O-CB 3.15Å; D366-R369 PolarHBondContact O-N 3.3Å; D366-R369 VanDerWaalsContact O-N 3.16Å; D366-E370 WeakPolarHBondContact O-CG 3.37Å; D366-E370 PolarHBondContact O-N 3.36Å
367	R	81.2	Confident	76.2	Confident	134 Å²	134	61.8 Å²	61.8	51%	0.506	31%	0.306	S	S	.	.	H	α-helix	trans	-59.3	-39	170.8	-77.3	-173.8	-64.6	-99.6	0.5	112.8	D361 E363 Y371	D361-R367 IonicContact OD1-NH2 2.74Å; E363-R367 WeakPolarHBondContact O-CB 3.27Å; E363-R367 VanDerWaalsContact O-CG 3.27Å; E363-R367 WeakPolarHBondContact O-CG 3.36Å; E363-R367 PolarHBondContact O-N 3Å; E363-R367 IonicContact OE2-NH1 3.75Å; E363-R367 PolarHBondContact OE2-NH1 3.39Å; R367-Y371 WeakPolarHBondContact O-CB 3.39Å; R367-Y371 PolarHBondContact O-N 3.31Å
368	L	76.3	Confident	73.9	Confident	18 Å²	18	69.9 Å²	69.9	9%	0.094	35%	0.345	C	S	.	.	H	α-helix	trans	-67.8	-38.6	175.7	-72	171.3	0	0	0	111.9	L360 G364 I365 D366 Y371 S372 Y386 K410	L360-L368 HydrophobicContact CD1-CD1 4.21Å; L360-L368 HydrophobicContact CD2-CD1 3.69Å; L360-L368 HydrophobicContact CG-CD1 4.48Å; G364-L368 WeakPolarHBondContact O-CG 3.33Å; G364-L368 PolarHBondContact O-N 2.81Å; G364-L368 VanDerWaalsContact O-N 3.11Å; I365-L368 WeakPolarHBondContact O-CB 3.39Å; I365-L368 PolarHBondContact O-N 2.84Å; D366-L368 VanDerWaalsContact C-N 3.33Å; D366-L368 PolarHBondContact O-N 3.39Å; L368-Y371 PolarHBondContact O-N 3.02Å; L368-S372 PolarHBondContact O-N 2.88Å; L368-Y386 HydrophobicContact CB-CE1 3.67Å; L368-K410 HydrophobicContact CD1-CB 4.1Å; L368-K410 HydrophobicContact CD1-CG 4.35Å
369	R	74.6	Confident	71.5	Confident	66 Å²	66	74.3 Å²	74.3	25%	0.249	37%	0.371	C	S	.	.	H	α-helix	trans	-63.7	-46.4	174.7	-179.2	-173.7	-97.9	-175.6	-7.3	111	I365 D366 S372 A373 A382 Y386 G387	I365-R369 PolarHBondContact O-N 2.84Å; D366-R369 WeakPolarHBondContact O-CB 3.15Å; D366-R369 PolarHBondContact O-N 3.3Å; D366-R369 VanDerWaalsContact O-N 3.16Å; R369-S372 PolarHBondContact O-N 2.82Å; R369-A373 PolarHBondContact O-N 2.72Å; R369-A382 HydrophobicContact CG-CB 4.32Å; R369-Y386 HydrophobicContact CB-CD1 4.15Å; R369-Y386 HydrophobicContact CB-CG 4.33Å; R369-Y386 VanDerWaalsContact CZ-O 3.28Å; R369-Y386 PolarHBondContact NE-O 3.35Å; R369-Y386 VanDerWaalsContact NE-O 3.08Å; R369-Y386 PolarHBondContact NH2-O 3Å; R369-G387 PolarHBondContact NH2-O 3.11Å; R369-G387 VanDerWaalsContact NH2-O 3.12Å
370	E	71.8	Confident	69.4	Low	119 Å²	119	80.6 Å²	80.6	56%	0.556	40%	0.398	S	S	*	.	H	α-helix	trans	-61	-43.8	175.7	-74.4	-179.5	-172.1	0	0	112.3	D366 A373 K374	D366-E370 WeakPolarHBondContact O-CG 3.37Å; D366-E370 PolarHBondContact O-N 3.36Å; E370-A373 PolarHBondContact O-N 3.24Å; E370-K374 WeakPolarHBondContact O-CG 3.33Å; E370-K374 PolarHBondContact O-N 2.93Å; E370-K374 VanDerWaalsContact O-N 3.15Å
371	Y	67.8	Low	67.2	Low	106 Å²	106	88.1 Å²	88.1	42%	0.416	43%	0.43	S	S	.	.	H	α-helix	trans	-58.3	-51.1	174.3	-174.5	-84.8	0	0	0	109.5	R367 L368 A373 K374 F375 D435	R367-Y371 WeakPolarHBondContact O-CB 3.39Å; R367-Y371 PolarHBondContact O-N 3.31Å; L368-Y371 PolarHBondContact O-N 3.02Å; Y371-A373 VanDerWaalsContact C-N 3.28Å; Y371-A373 PolarHBondContact O-N 2.99Å; Y371-K374 PolarHBondContact O-N 3.47Å; Y371-K374 VanDerWaalsContact O-N 3.11Å; Y371-F375 AromaticContact CD1-CD2 3.71Å; Y371-F375 HydrophobicContact CD1-CD2 3.71Å; Y371-F375 AromaticContact CD1-CE2 3.86Å; Y371-F375 HydrophobicContact CD1-CE2 3.86Å; Y371-F375 HydrophobicContact CD2-CD2 4.3Å; Y371-F375 AromaticContact CD2-CE2 3.61Å; Y371-F375 HydrophobicContact CD2-CE2 3.61Å; Y371-F375 AromaticContact CE1-CD2 3.5Å; Y371-F375 HydrophobicContact CE1-CD2 3.5Å; Y371-F375 AromaticContact CE1-CE2 3.58Å; Y371-F375 HydrophobicContact CE1-CE2 3.58Å; Y371-F375 HydrophobicContact CE2-CD2 4.15Å; Y371-F375 AromaticContact CE2-CE2 3.33Å; Y371-F375 HydrophobicContact CE2-CE2 3.33Å; Y371-F375 HydrophobicContact CE2-CZ 4.01Å; Y371-F375 HydrophobicContact CG-CD2 4.09Å; Y371-F375 AromaticContact CG-CE2 3.86Å; Y371-F375 HydrophobicContact CG-CE2 3.86Å; Y371-F375 AromaticContact CZ-CD2 3.73Å; Y371-F375 AromaticContact CZ-CE2 3.29Å; Y371-F375 AromaticContact CZ-CZ 4Å; Y371-F375 WeakPolarHBondContact O-CD2 3.39Å; Y371-F375 PolarHBondContact O-N 2.93Å; Y371-D435 PolarHBondContact OH-O 3.01Å
372	S	64.9	Low	65.3	Low	21 Å²	21	87.8 Å²	87.8	15%	0.147	43%	0.433	C	S	.	.	H	α-helix	trans	-60.1	-34.6	178.1	-171.8	0	0	0	0	113.9	L368 R369 K374 F375 G376 Y386	L368-S372 PolarHBondContact O-N 2.88Å; R369-S372 PolarHBondContact O-N 2.82Å; S372-K374 VanDerWaalsContact C-N 3.32Å; S372-F375 PolarHBondContact O-N 3.27Å; S372-G376 PolarHBondContact O-N 3.02Å; S372-G376 VanDerWaalsContact O-N 3.12Å; S372-Y386 VanDerWaalsContact OG-CE2 3.27Å; S372-Y386 WeakPolarHBondContact OG-CE2 3.44Å
373	A	65.7	Low	64.1	Low	35 Å²	35	87.7 Å²	87.7	29%	0.289	44%	0.438	S	S	.	.	H	α-helix	trans	-68.1	-32	178	0	0	0	0	0	112.4	R369 E370 Y371 F375	R369-A373 PolarHBondContact O-N 2.72Å; E370-A373 PolarHBondContact O-N 3.24Å; Y371-A373 VanDerWaalsContact C-N 3.28Å; Y371-A373 PolarHBondContact O-N 2.99Å; A373-F375 VanDerWaalsContact C-N 3.33Å
374	K	63.9	Low	63	Low	159 Å²	159	86 Å²	86	69%	0.691	45%	0.445	S	S	*	.	H	α-helix	trans	-71.5	-24.2	177	-71.5	174.9	-176.9	174.3	0	113.6	E370 Y371 S372	E370-K374 WeakPolarHBondContact O-CG 3.33Å; E370-K374 PolarHBondContact O-N 2.93Å; E370-K374 VanDerWaalsContact O-N 3.15Å; Y371-K374 PolarHBondContact O-N 3.47Å; Y371-K374 VanDerWaalsContact O-N 3.11Å; S372-K374 VanDerWaalsContact C-N 3.32Å
375	F	54.7	Low	62	Low	134 Å²	134	88.9 Å²	88.9	59%	0.588	46%	0.46	S	S	*	.	H	α-helix	trans	-112.8	-2.9	-174.4	-61	-74	0	0	0	114.8	Y371 S372 A373	Y371-F375 AromaticContact CD1-CD2 3.71Å; Y371-F375 HydrophobicContact CD1-CD2 3.71Å; Y371-F375 AromaticContact CD1-CE2 3.86Å; Y371-F375 HydrophobicContact CD1-CE2 3.86Å; Y371-F375 HydrophobicContact CD2-CD2 4.3Å; Y371-F375 AromaticContact CD2-CE2 3.61Å; Y371-F375 HydrophobicContact CD2-CE2 3.61Å; Y371-F375 AromaticContact CE1-CD2 3.5Å; Y371-F375 HydrophobicContact CE1-CD2 3.5Å; Y371-F375 AromaticContact CE1-CE2 3.58Å; Y371-F375 HydrophobicContact CE1-CE2 3.58Å; Y371-F375 HydrophobicContact CE2-CD2 4.15Å; Y371-F375 AromaticContact CE2-CE2 3.33Å; Y371-F375 HydrophobicContact CE2-CE2 3.33Å; Y371-F375 HydrophobicContact CE2-CZ 4.01Å; Y371-F375 HydrophobicContact CG-CD2 4.09Å; Y371-F375 AromaticContact CG-CE2 3.86Å; Y371-F375 HydrophobicContact CG-CE2 3.86Å; Y371-F375 AromaticContact CZ-CD2 3.73Å; Y371-F375 AromaticContact CZ-CE2 3.29Å; Y371-F375 AromaticContact CZ-CZ 4Å; Y371-F375 WeakPolarHBondContact O-CD2 3.39Å; Y371-F375 PolarHBondContact O-N 2.93Å; S372-F375 PolarHBondContact O-N 3.27Å; A373-F375 VanDerWaalsContact C-N 3.33Å
376	G	49.5	Very low	61.2	Low	29 Å²	29	89.2 Å²	89.2	30%	0.299	46%	0.461	S	S	.	.	S	Bend	trans	-65.5	134.9	168.4	0	0	0	0	0	109.9	S372	S372-G376 PolarHBondContact O-N 3.02Å; S372-G376 VanDerWaalsContact O-N 3.12Å
377	G	44.5	Very low	60.3	Low	62 Å²	62	87.2 Å²	87.2	64%	0.639	45%	0.452	S	S	*	.			trans	-59.9	-159.9	179.3	0	0	0	0	0	114.3	D379 H380	G377-D379 PolarHBondContact O-N 3.14Å; G377-H380 PolarHBondContact O-N 3.19Å; G377-H380 VanDerWaalsContact O-N 3.1Å
378	Q	43.8	Very low	59.2	Low	199 Å²	199	82.6 Å²	82.6	93%	0.93	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.2	-7.4	-168.4	-79.1	-178.1	-30.9	0	0	117.9
379	D	43.7	Very low	58.3	Low	135 Å²	135	85.5 Å²	85.5	72%	0.722	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	3.7	179.2	-77.1	-23.1	0	0	0	116.3	G377 K381	G377-D379 PolarHBondContact O-N 3.14Å; D379-K381 WeakPolarHBondContact O-CG 3.41Å; D379-K381 PolarHBondContact O-N 2.62Å
380	H	47.9	Very low	57.3	Low	161 Å²	161	88.3 Å²	88.3	75%	0.745	48%	0.48	S	S	*	.			trans	41.8	19.2	174	-73.6	-55.4	0	0	0	117.5	G377	G377-H380 PolarHBondContact O-N 3.19Å; G377-H380 VanDerWaalsContact O-N 3.1Å
381	K	48.4	Very low	56.4	Low	169 Å²	169	87.4 Å²	87.4	74%	0.735	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-91.4	124.9	177.9	-77.5	170.9	-175.5	174.3	0	107.4	D379 N383	D379-K381 WeakPolarHBondContact O-CG 3.41Å; D379-K381 PolarHBondContact O-N 2.62Å; K381-N383 PolarHBondContact O-N 3.35Å
382	A	51.5	Low	55.7	Low	33 Å²	33	83.1 Å²	83.1	27%	0.273	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-50.6	142	166	0	0	0	0	0	108.8	R369 A384	R369-A382 HydrophobicContact CG-CB 4.32Å; A382-A384 PolarHBondContact O-N 3.49Å
383	N	59.4	Low	55.2	Low	78 Å²	78	91 Å²	91	42%	0.417	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-49.2	132.7	178	-171.2	-7.7	0	0	0	108.7	K381 L385 Y386	K381-N383 PolarHBondContact O-N 3.35Å; N383-L385 PolarHBondContact O-N 2.88Å; N383-Y386 HydrophobicContact CB-CD2 3.77Å; N383-Y386 HydrophobicContact CB-CE2 4.02Å; N383-Y386 PolarHBondContact O-N 2.97Å
384	A	62.1	Low	55.7	Low	88 Å²	88	93.1 Å²	93.1	73%	0.727	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-53.9	-24.4	-173.4	0	0	0	0	0	112.7	A382 Y386 G387	A382-A384 PolarHBondContact O-N 3.49Å; A384-Y386 VanDerWaalsContact C-N 3.32Å; A384-Y386 PolarHBondContact O-N 3.29Å; A384-G387 PolarHBondContact O-N 2.8Å
385	L	65.6	Low	55.3	Low	65 Å²	65	88.4 Å²	88.4	34%	0.34	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-64.5	-25.2	173.7	-60.8	174.9	0	0	0	114.3	N383 G387 I402 D403 F406	N383-L385 PolarHBondContact O-N 2.88Å; L385-G387 PolarHBondContact O-N 3.3Å; L385-I402 CarbonylContact O-C 3.59Å; L385-I402 WeakPolarHBondContact O-CA 3.47Å; L385-I402 WeakPolarHBondContact O-CG1 3.19Å; L385-D403 HydrophobicContact CB-CB 4.33Å; L385-D403 HydrophobicContact CD2-CB 3.89Å; L385-D403 PolarHBondContact O-N 3.34Å; L385-F406 HydrophobicContact CB-CB 4.22Å; L385-F406 HydrophobicContact CB-CD1 4.19Å; L385-F406 HydrophobicContact CB-CD2 4.28Å; L385-F406 HydrophobicContact CB-CG 3.96Å; L385-F406 HydrophobicContact CD1-CB 4.41Å; L385-F406 HydrophobicContact CD1-CD2 3.58Å; L385-F406 HydrophobicContact CD1-CE2 4.03Å; L385-F406 HydrophobicContact CD1-CG 4.05Å
386	Y	67	Low	54.9	Low	12 Å²	12	88.5 Å²	88.5	5%	0.047	51%	0.514	C	S	.	.	G	3₁₀ helix	trans	-79.3	2.8	174.9	-70.9	-76.4	0	0	0	113.3	L368 R369 S372 N383 A384 I402 F406	L368-Y386 HydrophobicContact CB-CE1 3.67Å; R369-Y386 HydrophobicContact CB-CD1 4.15Å; R369-Y386 HydrophobicContact CB-CG 4.33Å; R369-Y386 VanDerWaalsContact CZ-O 3.28Å; R369-Y386 PolarHBondContact NE-O 3.35Å; R369-Y386 VanDerWaalsContact NE-O 3.08Å; R369-Y386 PolarHBondContact NH2-O 3Å; S372-Y386 VanDerWaalsContact OG-CE2 3.27Å; S372-Y386 WeakPolarHBondContact OG-CE2 3.44Å; N383-Y386 HydrophobicContact CB-CD2 3.77Å; N383-Y386 HydrophobicContact CB-CE2 4.02Å; N383-Y386 PolarHBondContact O-N 2.97Å; A384-Y386 VanDerWaalsContact C-N 3.32Å; A384-Y386 PolarHBondContact O-N 3.29Å; Y386-I402 HydrophobicContact CD1-CD1 3.71Å; Y386-I402 HydrophobicContact CD1-CG1 4.4Å; Y386-I402 HydrophobicContact CE1-CD1 4.1Å; Y386-F406 HydrophobicContact CD1-CE1 4.19Å; Y386-F406 HydrophobicContact CD2-CE1 4.48Å; Y386-F406 HydrophobicContact CE1-CD1 4.36Å; Y386-F406 AromaticContact CE1-CE1 3.51Å; Y386-F406 HydrophobicContact CE1-CE1 3.51Å; Y386-F406 HydrophobicContact CE1-CZ 4.34Å; Y386-F406 AromaticContact CE2-CE1 3.83Å; Y386-F406 HydrophobicContact CE2-CE1 3.83Å; Y386-F406 AromaticContact CE2-CZ 3.99Å; Y386-F406 HydrophobicContact CE2-CZ 3.99Å; Y386-F406 AromaticContact CZ-CE1 3.31Å; Y386-F406 AromaticContact CZ-CZ 3.68Å; Y386-F406 WeakPolarHBondContact OH-CE1 3.27Å; Y386-F406 WeakPolarHBondContact OH-CZ 3.2Å
387	G	62	Low	54.6	Low	8 Å²	8	92.6 Å²	92.6	8%	0.082	53%	0.527	C	S	.	.			trans	82.4	151.4	-176.1	0	0	0	0	0	112.8	R369 A384 L385 K400 D401	R369-G387 PolarHBondContact NH2-O 3.11Å; R369-G387 VanDerWaalsContact NH2-O 3.12Å; A384-G387 PolarHBondContact O-N 2.8Å; L385-G387 PolarHBondContact O-N 3.3Å; G387-K400 CarbonylContact C-O 2.94Å; G387-K400 WeakPolarHBondContact CA-O 3.24Å; G387-D401 WeakPolarHBondContact CA-O 3.37Å
388	G	57.7	Low	54.7	Low	38 Å²	38	94 Å²	94	39%	0.392	51%	0.514	S	S	.	.			trans	-147.3	163.7	-178.5	0	0	0	0	0	110.9	K400	G388-K400 PolarHBondContact N-O 3.4Å; G388-K400 PolarHBondContact O-N 3.19Å
389	S	57.3	Low	55.2	Low	78 Å²	78	90.9 Å²	90.9	55%	0.545	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	136	169.5	30.8	0	0	0	0	110.4	M397 Y398	S389-M397 VanDerWaalsContact CB-CE 3.48Å; S389-Y398 WeakPolarHBondContact CA-O 3.28Å
390	Y	55.2	Low	56.2	Low	126 Å²	126	89.8 Å²	89.8	49%	0.494	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	147.4	164.5	70.4	-88.2	0	0	0	110.2	Y398	Y390-Y398 HydrophobicContact CD2-CD2 4.28Å; Y390-Y398 VanDerWaalsContact CE1-CB 3.45Å; Y390-Y398 HydrophobicContact CE1-CG 4.37Å; Y390-Y398 AromaticContact CE2-CD2 3.77Å; Y390-Y398 HydrophobicContact CE2-CD2 3.77Å; Y390-Y398 AromaticContact CE2-CG 3.79Å; Y390-Y398 HydrophobicContact CE2-CG 3.79Å; Y390-Y398 AromaticContact CZ-CG 3.72Å; Y390-Y398 PolarHBondContact N-O 2.87Å; Y390-Y398 PolarHBondContact O-N 3.48Å
391	T	51.5	Low	57.4	Low	99 Å²	99	84 Å²	84	61%	0.607	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	122.7	175.7	-25.2	0	0	0	0	108.1	K396	T391-K396 WeakPolarHBondContact CA-O 3.38Å
392	G	53.7	Low	58.8	Low	16 Å²	16	76.2 Å²	76.2	17%	0.165	43%	0.427	C	S	.	.			trans	-73.4	169.7	174.5	0	0	0	0	0	111.9	D394 G395 K396	G392-D394 PolarHBondContact O-N 2.94Å; G392-G395 PolarHBondContact O-N 3.1Å; G392-K396 PolarHBondContact N-O 2.78Å
393	N	55.4	Low	60.3	Low	187 Å²	187	78.1 Å²	78.1	100%	1	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-12.7	174.8	-73.7	-12.7	0	0	0	113.5
394	D	74.2	Confident	61.5	Low	79 Å²	79	77.1 Å²	77.1	42%	0.422	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	4.1	175.4	65.4	-12.1	0	0	0	113.6	G392 K396 Y398	G392-D394 PolarHBondContact O-N 2.94Å; D394-K396 PolarHBondContact O-N 3.2Å; D394-K396 WeakPolarHBondContact OD1-CB 3.15Å; D394-K396 PolarHBondContact OD1-N 3.05Å; D394-K396 WeakPolarHBondContact OD2-CD 3.38Å; D394-Y398 WeakPolarHBondContact OD1-CE2 3.5Å; D394-Y398 PolarHBondContact OD2-OH 3.1Å
395	G	57.5	Low	62.1	Low	60 Å²	60	74.9 Å²	74.9	62%	0.619	42%	0.415	S	S	*	.	S	Bend	trans	74.2	2.2	-177.5	0	0	0	0	0	114.5	G392	G392-G395 PolarHBondContact O-N 3.1Å
396	K	45	Very low	62.8	Low	136 Å²	136	73.8 Å²	73.8	59%	0.591	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-84	140.6	177	-64.2	-175.6	-173.1	166.7	0	110.4	T391 G392 D394 Y398	T391-K396 WeakPolarHBondContact CA-O 3.38Å; G392-K396 PolarHBondContact N-O 2.78Å; D394-K396 PolarHBondContact O-N 3.2Å; D394-K396 WeakPolarHBondContact OD1-CB 3.15Å; D394-K396 PolarHBondContact OD1-N 3.05Å; D394-K396 WeakPolarHBondContact OD2-CD 3.38Å; K396-Y398 HydrophobicContact CB-CE2 4Å; K396-Y398 VanDerWaalsContact O-CD2 3.23Å; K396-Y398 WeakPolarHBondContact O-CD2 3.4Å; K396-Y398 WeakPolarHBondContact O-CE2 3.31Å
397	M	43.4	Very low	63.7	Low	116 Å²	116	73.2 Å²	73.2	57%	0.571	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.8	123.1	170	-82.1	-175.8	59.3	0	0	110.3	S389 F399	S389-M397 VanDerWaalsContact CB-CE 3.48Å; M397-F399 HydrophobicContact CE-CE2 4.47Å; M397-F399 HydrophobicContact CE-CZ 4.27Å
398	Y	46.1	Very low	64.9	Low	92 Å²	92	74.7 Å²	74.7	36%	0.361	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	132.9	171.3	-64.9	-94.3	0	0	0	108.9	S389 Y390 D394 K396	S389-Y398 WeakPolarHBondContact CA-O 3.28Å; Y390-Y398 HydrophobicContact CD2-CD2 4.28Å; Y390-Y398 VanDerWaalsContact CE1-CB 3.45Å; Y390-Y398 HydrophobicContact CE1-CG 4.37Å; Y390-Y398 AromaticContact CE2-CD2 3.77Å; Y390-Y398 HydrophobicContact CE2-CD2 3.77Å; Y390-Y398 AromaticContact CE2-CG 3.79Å; Y390-Y398 HydrophobicContact CE2-CG 3.79Å; Y390-Y398 AromaticContact CZ-CG 3.72Å; Y390-Y398 PolarHBondContact N-O 2.87Å; Y390-Y398 PolarHBondContact O-N 3.48Å; D394-Y398 WeakPolarHBondContact OD1-CE2 3.5Å; D394-Y398 PolarHBondContact OD2-OH 3.1Å; K396-Y398 HydrophobicContact CB-CE2 4Å; K396-Y398 VanDerWaalsContact O-CD2 3.23Å; K396-Y398 WeakPolarHBondContact O-CD2 3.4Å; K396-Y398 WeakPolarHBondContact O-CE2 3.31Å
399	F	54.8	Low	65.9	Low	132 Å²	132	74.8 Å²	74.8	58%	0.579	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	118	172.7	-78.7	-90	0	0	0	108.8	M397	M397-F399 HydrophobicContact CE-CE2 4.47Å; M397-F399 HydrophobicContact CE-CZ 4.27Å
400	K	65	Low	67.2	Low	113 Å²	113	72.3 Å²	72.3	49%	0.491	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-81.6	119.5	164.4	-163.4	169.3	-177.8	173.3	0	106.6	E11 G387 G388	E11-K400 IonicContact OE1-NZ 3.32Å; G387-K400 CarbonylContact C-O 2.94Å; G387-K400 WeakPolarHBondContact CA-O 3.24Å; G388-K400 PolarHBondContact N-O 3.4Å; G388-K400 PolarHBondContact O-N 3.19Å
401	D	72.9	Confident	68.9	Low	39 Å²	39	66.3 Å²	66.3	21%	0.209	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-68.4	172.1	172.7	-101.1	-38.8	0	0	0	110.8	R340 I341 R362 G387	R340-D401 WeakPolarHBondContact CA-OD2 3.29Å; R340-D401 WeakPolarHBondContact CB-OD2 3.09Å; I341-D401 HydrophobicContact CB-CB 4.49Å; I341-D401 HydrophobicContact CD1-CB 4.11Å; I341-D401 HydrophobicContact CG1-CB 4.22Å; I341-D401 PolarHBondContact N-OD2 3.35Å; R362-D401 IonicContact NH1-OD1 3.41Å; R362-D401 PolarHBondContact NH1-OD1 3.4Å; G387-D401 WeakPolarHBondContact CA-O 3.37Å
402	I	78.6	Confident	70.6	Confident	6 Å²	6	61.6 Å²	61.6	3%	0.031	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-56.1	139.5	174.5	-173.8	165.3	0	0	0	111	I341 I365 L385 Y386 T404 F406 L407	I341-I402 HydrophobicContact CD1-CG2 3.96Å; I341-I402 WeakPolarHBondContact CD1-O 3.28Å; I341-I402 HydrophobicContact CG2-CG2 4.37Å; I365-I402 HydrophobicContact CG2-CD1 4.11Å; I365-I402 HydrophobicContact CG2-CG2 4.24Å; L385-I402 CarbonylContact O-C 3.59Å; L385-I402 WeakPolarHBondContact O-CA 3.47Å; L385-I402 WeakPolarHBondContact O-CG1 3.19Å; Y386-I402 HydrophobicContact CD1-CD1 3.71Å; Y386-I402 HydrophobicContact CD1-CG1 4.4Å; Y386-I402 HydrophobicContact CE1-CD1 4.1Å; I402-T404 PolarHBondContact O-N 2.76Å; I402-F406 HydrophobicContact CD1-CD1 4.15Å; I402-F406 HydrophobicContact CG1-CD1 4.3Å; I402-L407 HydrophobicContact CD1-CB 4.2Å; I402-L407 HydrophobicContact CD1-CD1 4.19Å; I402-L407 HydrophobicContact CG1-CB 4.25Å; I402-L407 HydrophobicContact CG2-CB 4.21Å; I402-L407 HydrophobicContact CG2-CD2 3.89Å; I402-L407 HydrophobicContact CG2-CG 4.45Å
403	D	81.7	Confident	71.9	Confident	73 Å²	73	61 Å²	61	39%	0.39	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-57.1	128.5	173.1	176.9	-96.2	0	0	0	110.1	L385 G405 F406 L407	L385-D403 HydrophobicContact CB-CB 4.33Å; L385-D403 HydrophobicContact CD2-CB 3.89Å; L385-D403 PolarHBondContact O-N 3.34Å; D403-G405 PolarHBondContact O-N 3.25Å; D403-G405 WeakPolarHBondContact OD1-CA 3.24Å; D403-G405 PolarHBondContact OD1-N 3.27Å; D403-G405 VanDerWaalsContact OD1-N 3.13Å; D403-F406 HydrophobicContact CB-CB 3.99Å; D403-F406 PolarHBondContact O-N 2.89Å; D403-F406 WeakPolarHBondContact OD1-CB 3.36Å; D403-F406 PolarHBondContact OD1-N 3.29Å; D403-L407 WeakPolarHBondContact O-CB 3.45Å; D403-L407 PolarHBondContact O-N 3.08Å
404	T	85	Confident	73.4	Confident	57 Å²	57	53.4 Å²	53.4	35%	0.35	28%	0.284	S	S	.	.	H	α-helix	trans	-67.6	-38.6	-172.5	52.1	0	0	0	0	111.8	V309 I341 I402 F406 L407 I408	V309-T404 HydrophobicContact CG1-CG2 4.45Å; V309-T404 HydrophobicContact CG2-CG2 4.46Å; I341-T404 HydrophobicContact CD1-CG2 3.87Å; I402-T404 PolarHBondContact O-N 2.76Å; T404-F406 VanDerWaalsContact C-N 3.35Å; T404-L407 PolarHBondContact O-N 2.96Å; T404-I408 WeakPolarHBondContact O-CB 3.39Å; T404-I408 WeakPolarHBondContact O-CD1 3.44Å; T404-I408 WeakPolarHBondContact O-CG1 3.18Å; T404-I408 PolarHBondContact O-N 3.39Å
405	G	74.5	Confident	74.2	Confident	41 Å²	41	49.8 Å²	49.8	42%	0.423	27%	0.265	S	S	.	.	H	α-helix	trans	-63.3	-42.9	176.3	0	0	0	0	0	111.7	D403 S409	D403-G405 PolarHBondContact O-N 3.25Å; D403-G405 WeakPolarHBondContact OD1-CA 3.24Å; D403-G405 PolarHBondContact OD1-N 3.27Å; D403-G405 VanDerWaalsContact OD1-N 3.13Å; G405-S409 PolarHBondContact O-N 2.93Å; G405-S409 VanDerWaalsContact O-N 3.09Å
406	F	79.7	Confident	75.6	Confident	42 Å²	42	47 Å²	47	18%	0.184	24%	0.236	C	C	.	.	H	α-helix	trans	-65.2	-43.3	175.5	-173.1	-98.1	0	0	0	112.5	L385 Y386 I402 D403 T404 S409 K410	L385-F406 HydrophobicContact CB-CB 4.22Å; L385-F406 HydrophobicContact CB-CD1 4.19Å; L385-F406 HydrophobicContact CB-CD2 4.28Å; L385-F406 HydrophobicContact CB-CG 3.96Å; L385-F406 HydrophobicContact CD1-CB 4.41Å; L385-F406 HydrophobicContact CD1-CD2 3.58Å; L385-F406 HydrophobicContact CD1-CE2 4.03Å; L385-F406 HydrophobicContact CD1-CG 4.05Å; Y386-F406 HydrophobicContact CD1-CE1 4.19Å; Y386-F406 HydrophobicContact CD2-CE1 4.48Å; Y386-F406 HydrophobicContact CE1-CD1 4.36Å; Y386-F406 AromaticContact CE1-CE1 3.51Å; Y386-F406 HydrophobicContact CE1-CE1 3.51Å; Y386-F406 HydrophobicContact CE1-CZ 4.34Å; Y386-F406 AromaticContact CE2-CE1 3.83Å; Y386-F406 HydrophobicContact CE2-CE1 3.83Å; Y386-F406 AromaticContact CE2-CZ 3.99Å; Y386-F406 HydrophobicContact CE2-CZ 3.99Å; Y386-F406 AromaticContact CZ-CE1 3.31Å; Y386-F406 AromaticContact CZ-CZ 3.68Å; Y386-F406 WeakPolarHBondContact OH-CE1 3.27Å; Y386-F406 WeakPolarHBondContact OH-CZ 3.2Å; I402-F406 HydrophobicContact CD1-CD1 4.15Å; I402-F406 HydrophobicContact CG1-CD1 4.3Å; D403-F406 HydrophobicContact CB-CB 3.99Å; D403-F406 PolarHBondContact O-N 2.89Å; D403-F406 WeakPolarHBondContact OD1-CB 3.36Å; D403-F406 PolarHBondContact OD1-N 3.29Å; T404-F406 VanDerWaalsContact C-N 3.35Å; F406-S409 PolarHBondContact O-N 3.19Å; F406-K410 HydrophobicContact CD1-CG 4.26Å; F406-K410 HydrophobicContact CE1-CG 3.79Å; F406-K410 HydrophobicContact CZ-CD 4.33Å; F406-K410 HydrophobicContact CZ-CG 4.03Å; F406-K410 PolarHBondContact O-N 3.38Å
407	L	86.5	Confident	77.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.2	-47.9	175.6	177.4	61.2	0	0	0	111.7	V309 I341 C344 L360 I365 I402 D403 T404 S409 K410 T411	V309-L407 HydrophobicContact CG1-CD2 4.19Å; V309-L407 HydrophobicContact CG2-CD2 4.38Å; I341-L407 HydrophobicContact CD1-CD2 4.46Å; I341-L407 HydrophobicContact CG2-CD2 3.59Å; C344-L407 HydrophobicContact CB-CD1 3.97Å; C344-L407 HydrophobicContact CB-CD2 3.67Å; C344-L407 HydrophobicContact CB-CG 3.61Å; L360-L407 HydrophobicContact CD2-CD1 3.7Å; I365-L407 HydrophobicContact CD1-CD1 3.9Å; I365-L407 HydrophobicContact CD1-CD2 4.23Å; I365-L407 HydrophobicContact CG1-CD1 3.79Å; I402-L407 HydrophobicContact CD1-CB 4.2Å; I402-L407 HydrophobicContact CD1-CD1 4.19Å; I402-L407 HydrophobicContact CG1-CB 4.25Å; I402-L407 HydrophobicContact CG2-CB 4.21Å; I402-L407 HydrophobicContact CG2-CD2 3.89Å; I402-L407 HydrophobicContact CG2-CG 4.45Å; D403-L407 WeakPolarHBondContact O-CB 3.45Å; D403-L407 PolarHBondContact O-N 3.08Å; T404-L407 PolarHBondContact O-N 2.96Å; L407-S409 VanDerWaalsContact C-N 3.31Å; L407-S409 PolarHBondContact O-N 3.33Å; L407-K410 PolarHBondContact O-N 2.82Å; L407-T411 PolarHBondContact O-N 3.08Å; L407-T411 PolarHBondContact O-OG1 3.37Å
408	I	87.2	Confident	79.1	Confident	39 Å²	39	45.8 Å²	45.8	20%	0.2	24%	0.237	C	C	.	.	H	α-helix	trans	-55.6	-46.5	176.6	-73.6	169.1	0	0	0	110.7	P307 V309 T404 K410 T411 C412	P307-I408 HydrophobicContact CB-CB 4.41Å; P307-I408 HydrophobicContact CB-CG1 4.25Å; P307-I408 HydrophobicContact CB-CG2 4.01Å; P307-I408 HydrophobicContact CG-CG2 3.79Å; V309-I408 HydrophobicContact CG2-CD1 4.18Å; V309-I408 HydrophobicContact CG2-CG1 3.97Å; T404-I408 WeakPolarHBondContact O-CB 3.39Å; T404-I408 WeakPolarHBondContact O-CD1 3.44Å; T404-I408 WeakPolarHBondContact O-CG1 3.18Å; T404-I408 PolarHBondContact O-N 3.39Å; I408-K410 PolarHBondContact O-N 3.3Å; I408-T411 PolarHBondContact O-N 3.18Å; I408-C412 PolarHBondContact O-N 3.49Å
409	S	78.6	Confident	80.9	Confident	40 Å²	40	43 Å²	43	28%	0.28	23%	0.226	S	C	.	.	H	α-helix	trans	-61.6	-44.5	178.2	-173.3	0	0	0	0	112.3	G405 F406 L407 C412 K413	G405-S409 PolarHBondContact O-N 2.93Å; G405-S409 VanDerWaalsContact O-N 3.09Å; F406-S409 PolarHBondContact O-N 3.19Å; L407-S409 VanDerWaalsContact C-N 3.31Å; L407-S409 PolarHBondContact O-N 3.33Å; S409-C412 PolarHBondContact O-N 2.85Å; S409-K413 WeakPolarHBondContact O-CB 3.44Å; S409-K413 PolarHBondContact O-N 3.42Å
410	K	84.5	Confident	82.1	Confident	25 Å²	25	41.2 Å²	41.2	11%	0.109	23%	0.228	C	C	.	.	H	α-helix	trans	-65.4	-38.5	176.5	-73.1	-66.1	-174.7	179	0	112.4	L360 L368 F406 L407 I408 K413 H414 D435	L360-K410 HydrophobicContact CD2-CB 4.5Å; L368-K410 HydrophobicContact CD1-CB 4.1Å; L368-K410 HydrophobicContact CD1-CG 4.35Å; F406-K410 HydrophobicContact CD1-CG 4.26Å; F406-K410 HydrophobicContact CE1-CG 3.79Å; F406-K410 HydrophobicContact CZ-CD 4.33Å; F406-K410 HydrophobicContact CZ-CG 4.03Å; F406-K410 PolarHBondContact O-N 3.38Å; L407-K410 PolarHBondContact O-N 2.82Å; I408-K410 PolarHBondContact O-N 3.3Å; K410-K413 HydrophobicContact CD-CD 4.49Å; K410-K413 PolarHBondContact O-N 3.09Å; K410-H414 PolarHBondContact O-CD2 2.74Å; K410-H414 PolarHBondContact O-N 3.26Å; K410-D435 IonicContact NZ-OD2 3.49Å; K410-D435 PolarHBondContact NZ-OD2 3.46Å
411	T	90.1	Very high	82.7	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60.6	-50	174.3	-58.5	0	0	0	0	111	P307 C344 V346 F358 L407 I408 K413 H414 A415	P307-T411 HydrophobicContact CB-CG2 4.46Å; C344-T411 WeakPolarHBondContact CB-OG1 3.5Å; C344-T411 PolarHBondContact SG-OG1 2.74Å; V346-T411 HydrophobicContact CB-CG2 4.23Å; V346-T411 HydrophobicContact CG1-CG2 4.1Å; F358-T411 HydrophobicContact CD1-CG2 3.95Å; F358-T411 HydrophobicContact CE1-CG2 4.34Å; L407-T411 PolarHBondContact O-N 3.08Å; L407-T411 PolarHBondContact O-OG1 3.37Å; I408-T411 PolarHBondContact O-N 3.18Å; T411-K413 PolarHBondContact O-N 3Å; T411-H414 PolarHBondContact O-N 3.3Å; T411-A415 WeakPolarHBondContact O-CB 3.22Å; T411-A415 PolarHBondContact O-N 2.95Å
412	C	87.2	Confident	82.9	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.007	23%	0.232	C	C	.	.	H	α-helix	trans	-57.6	-45.6	175.4	-74.2	0	0	0	0	112.5	I292 P307 I408 S409 H414 A415	I292-C412 HydrophobicContact CD1-CB 4.27Å; P307-C412 WeakPolarHBondContact CG-SG 3.33Å; I408-C412 PolarHBondContact O-N 3.49Å; S409-C412 PolarHBondContact O-N 2.85Å; C412-H414 VanDerWaalsContact C-N 3.31Å; C412-H414 PolarHBondContact O-N 2.81Å; C412-A415 WeakPolarHBondContact O-CB 3.32Å; C412-A415 PolarHBondContact O-N 2.87Å
413	K	82.5	Confident	82.4	Confident	3 Å²	3	47.9 Å²	47.9	1%	0.013	27%	0.268	C	S	.	.	H	α-helix	trans	-62	-35.1	-179.5	175.6	177.8	179.5	158.3	0	113.3	S409 K410 T411 Q431 A432 D435	S409-K413 WeakPolarHBondContact O-CB 3.44Å; S409-K413 PolarHBondContact O-N 3.42Å; K410-K413 HydrophobicContact CD-CD 4.49Å; K410-K413 PolarHBondContact O-N 3.09Å; T411-K413 PolarHBondContact O-N 3Å; K413-Q431 HydrophobicContact CD-CB 4.17Å; K413-Q431 HydrophobicContact CD-CG 4.39Å; K413-Q431 WeakPolarHBondContact CE-O 3.14Å; K413-Q431 VanDerWaalsContact NZ-CG 3.32Å; K413-Q431 PolarHBondContact NZ-O 3.15Å; K413-A432 HydrophobicContact CG-CB 4.24Å; K413-D435 VanDerWaalsContact CE-OD2 3.28Å; K413-D435 WeakPolarHBondContact CE-OD2 3.4Å; K413-D435 IonicContact NZ-OD1 3.23Å; K413-D435 PolarHBondContact NZ-OD1 3.39Å; K413-D435 IonicContact NZ-OD2 2.72Å; K413-D435 PolarHBondContact NZ-OD2 3.49Å
414	H	87.2	Confident	81.7	Confident	27 Å²	27	46.5 Å²	46.5	13%	0.125	26%	0.261	C	S	.	.	H	α-helix	trans	-90.8	-15.6	-177.6	-75.1	-123.4	0	0	0	113.2	F358 K410 T411 C412 F416 K417	F358-H414 HydrophobicContact CE1-CB 3.66Å; F358-H414 HydrophobicContact CE2-CB 4.24Å; F358-H414 WeakPolarHBondContact CE2-O 3.48Å; F358-H414 HydrophobicContact CZ-CB 3.39Å; K410-H414 PolarHBondContact O-CD2 2.74Å; K410-H414 PolarHBondContact O-N 3.26Å; T411-H414 PolarHBondContact O-N 3.3Å; C412-H414 VanDerWaalsContact C-N 3.31Å; C412-H414 PolarHBondContact O-N 2.81Å; H414-F416 PolarHBondContact O-N 3.33Å; H414-F416 VanDerWaalsContact O-N 3.1Å; H414-K417 HydrophobicContact CB-CD 4.45Å; H414-K417 PolarHBondContact CE1-NZ 3.45Å; H414-K417 WeakPolarHBondContact ND1-CE 3.1Å; H414-K417 PolarHBondContact ND1-NZ 3.31Å; H414-K417 VanDerWaalsContact ND1-NZ 3.17Å; H414-K417 PolarHBondContact O-N 3.34Å
415	A	89.5	Confident	80.4	Confident	3 Å²	3	45 Å²	45	3%	0.025	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-32.2	-174.8	0	0	0	0	0	114.6	V346 I348 F358 T411 C412	V346-A415 HydrophobicContact CG1-CB 3.76Å; I348-A415 HydrophobicContact CD1-CB 4.36Å; F358-A415 HydrophobicContact CB-CB 3.86Å; F358-A415 HydrophobicContact CD1-CB 4.09Å; F358-A415 VanDerWaalsContact CG-CA 3.43Å; F358-A415 HydrophobicContact CG-CB 4.01Å; T411-A415 WeakPolarHBondContact O-CB 3.22Å; T411-A415 PolarHBondContact O-N 2.95Å; C412-A415 WeakPolarHBondContact O-CB 3.32Å; C412-A415 PolarHBondContact O-N 2.87Å
416	F	87.6	Confident	79.5	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.009	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	13.7	-172.4	-51.7	-72.9	0	0	0	114.9	E291 I292 R295 I301 I348 H414 T418 Y419	E291-F416 HydrophobicContact CG-CD2 4.27Å; E291-F416 WeakPolarHBondContact OE1-CB 3.26Å; I292-F416 HydrophobicContact CD1-CE2 4.46Å; I292-F416 HydrophobicContact CG1-CE2 3.53Å; I292-F416 HydrophobicContact CG1-CZ 3.87Å; R295-F416 VanDerWaalsContact CD-CG 3.47Å; R295-F416 VanDerWaalsContact CZ-CB 3.44Å; R295-F416 PolarHBondContact NH2-O 3.09Å; I301-F416 HydrophobicContact CD1-CE1 3.93Å; I301-F416 HydrophobicContact CD1-CZ 3.82Å; I301-F416 HydrophobicContact CG2-CE1 4.02Å; I348-F416 HydrophobicContact CD1-CD1 4.25Å; I348-F416 HydrophobicContact CD1-CE1 3.74Å; I348-F416 HydrophobicContact CD1-CZ 4.37Å; I348-F416 HydrophobicContact CG1-CE1 4.12Å; I348-F416 HydrophobicContact CG1-CZ 4.44Å; I348-F416 HydrophobicContact CG2-CE1 4.21Å; H414-F416 PolarHBondContact O-N 3.33Å; H414-F416 VanDerWaalsContact O-N 3.1Å; F416-T418 PolarHBondContact O-N 3.01Å; F416-T418 VanDerWaalsContact O-N 3.16Å; F416-Y419 HydrophobicContact CB-CD2 4.25Å; F416-Y419 HydrophobicContact CB-CG 4.28Å; F416-Y419 HydrophobicContact CD1-CD1 4.1Å; F416-Y419 HydrophobicContact CD1-CD2 4.07Å; F416-Y419 HydrophobicContact CD1-CE1 4.13Å; F416-Y419 HydrophobicContact CD1-CE2 4.12Å; F416-Y419 HydrophobicContact CD1-CG 4.09Å; F416-Y419 WeakPolarHBondContact O-CB 3.49Å; F416-Y419 PolarHBondContact O-N 2.88Å
417	K	81.6	Confident	78.5	Confident	108 Å²	108	47.1 Å²	47.1	47%	0.47	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-29.4	-179.7	-77.5	-173.2	175.1	-166.9	0	114	H414	H414-K417 HydrophobicContact CB-CD 4.45Å; H414-K417 PolarHBondContact CE1-NZ 3.45Å; H414-K417 WeakPolarHBondContact ND1-CE 3.1Å; H414-K417 PolarHBondContact ND1-NZ 3.31Å; H414-K417 VanDerWaalsContact ND1-NZ 3.17Å; H414-K417 PolarHBondContact O-N 3.34Å
418	T	79.2	Confident	77.2	Confident	119 Å²	119	47.7 Å²	47.7	73%	0.73	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-2.1	179.1	57.9	0	0	0	0	113.4	F416	F416-T418 PolarHBondContact O-N 3.01Å; F416-T418 VanDerWaalsContact O-N 3.16Å
419	Y	84.2	Confident	76.7	Confident	34 Å²	34	46.8 Å²	46.8	13%	0.133	27%	0.266	C	S	.	.	S	Bend	trans	-83.7	154.8	-179.9	-77.1	-123.2	0	0	0	110.4	I301 I348 L350 D356 F416 K421	I301-Y419 HydrophobicContact CG2-CE1 3.89Å; I348-Y419 HydrophobicContact CD1-CE2 4.34Å; L350-Y419 HydrophobicContact CD2-CE1 4.21Å; D356-Y419 PolarHBondContact OD2-OH 3.44Å; F416-Y419 HydrophobicContact CB-CD2 4.25Å; F416-Y419 HydrophobicContact CB-CG 4.28Å; F416-Y419 HydrophobicContact CD1-CD1 4.1Å; F416-Y419 HydrophobicContact CD1-CD2 4.07Å; F416-Y419 HydrophobicContact CD1-CE1 4.13Å; F416-Y419 HydrophobicContact CD1-CE2 4.12Å; F416-Y419 HydrophobicContact CD1-CG 4.09Å; F416-Y419 WeakPolarHBondContact O-CB 3.49Å; F416-Y419 PolarHBondContact O-N 2.88Å; Y419-K421 PolarHBondContact O-N 2.81Å
420	P	81.1	Confident	76.6	Confident	93 Å²	93	45.2 Å²	45.2	60%	0.604	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-52.5	137.5	172.2	-23.9	33.3	0	0	0	111.2	R295 Q300 L422	R295-P420 PolarHBondContact NH1-O 3.3Å; Q300-P420 PolarHBondContact NE2-O 3.28Å; P420-L422 PolarHBondContact O-N 3.48Å
421	K	78	Confident	76	Confident	165 Å²	165	46.1 Å²	46.1	72%	0.717	26%	0.259	S	S	*	.	P	Polyproline II helix	trans	-60.2	133.9	-179	-70.6	-166.3	173.7	-160.6	0	110.6	Y419	Y419-K421 PolarHBondContact O-N 2.81Å
422	L	75.4	Confident	74.8	Confident	15 Å²	15	46.5 Å²	46.5	8%	0.079	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-73.8	139.8	171.5	-79.5	170.3	0	0	0	109.9	E291 L294 R295 A298 P420 V424	E291-L422 HydrophobicContact CG-CD1 4.35Å; L294-L422 HydrophobicContact CB-CD1 3.65Å; R295-L422 HydrophobicContact CB-CD1 4.44Å; R295-L422 HydrophobicContact CG-CD1 3.37Å; R295-L422 HydrophobicContact CG-CD2 4.21Å; R295-L422 HydrophobicContact CG-CG 3.95Å; A298-L422 HydrophobicContact CB-CD2 3.56Å; P420-L422 PolarHBondContact O-N 3.48Å; L422-V424 HydrophobicContact CB-CG1 4.5Å; L422-V424 PolarHBondContact O-N 2.72Å
423	P	69.3	Low	73.9	Confident	119 Å²	119	48.9 Å²	48.9	77%	0.773	28%	0.275	S	S	*	.			trans	-68.7	101.2	166.4	28.8	-30.8	0	0	0	108.3
424	V	66.3	Low	73	Confident	43 Å²	43	50.4 Å²	50.4	26%	0.261	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-93.8	123.2	169.2	-67.5	0	0	0	0	107	Y286 L422 L430	Y286-V424 HydrophobicContact CD2-CG1 3.9Å; Y286-V424 HydrophobicContact CE2-CB 3.68Å; Y286-V424 HydrophobicContact CE2-CG1 3.33Å; L422-V424 HydrophobicContact CB-CG1 4.5Å; L422-V424 PolarHBondContact O-N 2.72Å; V424-L430 HydrophobicContact CG1-CD2 4.28Å; V424-L430 HydrophobicContact CG1-CG 4.23Å
425	G	59.3	Low	71.5	Confident	27 Å²	27	51.4 Å²	51.4	28%	0.278	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-58.4	166.6	-177.2	0	0	0	0	0	112.7	N247 G427 G428	N247-G425 PolarHBondContact ND2-O 3.22Å; G425-G427 PolarHBondContact O-N 2.86Å; G425-G428 PolarHBondContact O-N 3.11Å
426	L	55.1	Low	69.7	Low	110 Å²	110	54.5 Å²	54.5	58%	0.576	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.8	134	171.8	-100.3	99.7	0	0	0	109.7	N247	N247-L426 PolarHBondContact ND2-O 3.3Å
427	G	57.7	Low	67.4	Low	16 Å²	16	60.9 Å²	60.9	17%	0.165	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.3	-10.2	-173.3	0	0	0	0	0	115.9	K283 I284 G425	K283-G427 CarbonylContact C-O 3.5Å; K283-G427 VanDerWaalsContact CA-O 3.22Å; K283-G427 WeakPolarHBondContact CA-O 3Å; K283-G427 WeakPolarHBondContact CB-O 3.17Å; I284-G427 PolarHBondContact N-O 3.09Å; G425-G427 PolarHBondContact O-N 2.86Å
428	G	60	Low	65.2	Low	13 Å²	13	61.1 Å²	61.1	13%	0.134	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	144.6	176.3	0	0	0	0	0	113.6	N247 I284 Y286 G425	N247-G428 PolarHBondContact ND2-N 3.06Å; I284-G428 CarbonylContact O-C 3.54Å; I284-G428 WeakPolarHBondContact O-CA 3.12Å; Y286-G428 WeakPolarHBondContact OH-CA 3.2Å; G425-G428 PolarHBondContact O-N 3.11Å
429	M	76.8	Confident	63	Low	19 Å²	19	64.8 Å²	64.8	9%	0.094	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	135.7	174.4	-169	162.2	51.4	0	0	111.8	Y268 K283 I284 T285 Y286 D433 V434	Y268-M429 HydrophobicContact CE1-CE 3.97Å; Y268-M429 HydrophobicContact CE2-CE 3.77Å; Y268-M429 WeakPolarHBondContact OH-CE 3.33Å; K283-M429 HydrophobicContact CD-CE 3.97Å; I284-M429 PolarHBondContact O-N 2.93Å; T285-M429 CarbonylContact C-O 3.54Å; T285-M429 VanDerWaalsContact CA-O 3.27Å; T285-M429 WeakPolarHBondContact CA-O 3.18Å; Y286-M429 WeakPolarHBondContact CD2-O 3.32Å; Y286-M429 PolarHBondContact N-O 3.44Å; M429-D433 HydrophobicContact CG-CB 4.39Å; M429-V434 HydrophobicContact CE-CB 4.36Å; M429-V434 HydrophobicContact CE-CG1 4.33Å; M429-V434 HydrophobicContact CE-CG2 3.35Å; M429-V434 HydrophobicContact CG-CG2 3.82Å; M429-V434 HydrophobicContact SD-CG2 3.8Å
430	L	76.8	Confident	60.2	Low	8 Å²	8	70.8 Å²	70.8	4%	0.042	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	136.6	172.3	-65.7	173.4	0	0	0	109.5	Y286 E291 V424 A432 D433 V434	Y286-L430 HydrophobicContact CD2-CD2 4Å; E291-L430 HydrophobicContact CB-CD2 4.05Å; E291-L430 HydrophobicContact CG-CD2 3.76Å; V424-L430 HydrophobicContact CG1-CD2 4.28Å; V424-L430 HydrophobicContact CG1-CG 4.23Å; L430-A432 PolarHBondContact O-N 3.06Å; L430-D433 PolarHBondContact O-N 3.2Å; L430-V434 WeakPolarHBondContact O-CG2 3.15Å; L430-V434 PolarHBondContact O-N 3.36Å
431	Q	71.3	Confident	57.6	Low	43 Å²	43	74.8 Å²	74.8	20%	0.201	40%	0.403	C	S	.	.	H	α-helix	trans	-56.1	-30.9	179.2	-142.4	-176.3	-11.3	0	0	112.6	T285 Y286 K413 D433 V434 D435	T285-Q431 HydrophobicContact CG2-CB 4.07Å; T285-Q431 HydrophobicContact CG2-CG 3.84Å; Y286-Q431 VanDerWaalsContact O-CB 3.32Å; Y286-Q431 WeakPolarHBondContact O-CB 3.29Å; Y286-Q431 PolarHBondContact O-N 3.23Å; Y286-Q431 VanDerWaalsContact O-N 3.07Å; K413-Q431 HydrophobicContact CD-CB 4.17Å; K413-Q431 HydrophobicContact CD-CG 4.39Å; K413-Q431 WeakPolarHBondContact CE-O 3.14Å; K413-Q431 VanDerWaalsContact NZ-CG 3.32Å; K413-Q431 PolarHBondContact NZ-O 3.15Å; Q431-D433 VanDerWaalsContact C-N 3.34Å; Q431-V434 PolarHBondContact O-N 2.97Å; Q431-D435 PolarHBondContact O-N 2.8Å
432	A	64.9	Low	55.1	Low	9 Å²	9	75.2 Å²	75.2	7%	0.074	41%	0.408	C	S	.	.	H	α-helix	trans	-67.5	-32.2	179.2	0	0	0	0	0	113	K413 L430 S436	K413-A432 HydrophobicContact CG-CB 4.24Å; L430-A432 PolarHBondContact O-N 3.06Å; A432-S436 PolarHBondContact O-N 2.87Å; A432-S436 PolarHBondContact O-OG 3.11Å
433	D	69	Low	52.9	Low	51 Å²	51	83.9 Å²	83.9	27%	0.273	45%	0.448	S	S	.	.	H	α-helix	trans	-73.1	-32.3	176.7	-70.5	-31.4	0	0	0	111.2	M429 L430 Q431 S436 Q437	M429-D433 HydrophobicContact CG-CB 4.39Å; L430-D433 PolarHBondContact O-N 3.2Å; Q431-D433 VanDerWaalsContact C-N 3.34Å; D433-S436 WeakPolarHBondContact CA-OG 3.19Å; D433-S436 PolarHBondContact O-N 3.45Å; D433-S436 PolarHBondContact O-OG 2.8Å; D433-Q437 PolarHBondContact O-N 3.2Å
434	V	61.9	Low	50.8	Low	34 Å²	34	87.1 Å²	87.1	21%	0.206	45%	0.453	C	S	.	.	H	α-helix	trans	-63.2	-47.4	175.7	-165.8	0	0	0	0	111.6	Y268 T285 M429 L430 Q431 S436	Y268-V434 HydrophobicContact CE1-CG1 4.04Å; T285-V434 HydrophobicContact CG2-CG2 3.99Å; M429-V434 HydrophobicContact CE-CB 4.36Å; M429-V434 HydrophobicContact CE-CG1 4.33Å; M429-V434 HydrophobicContact CE-CG2 3.35Å; M429-V434 HydrophobicContact CG-CG2 3.82Å; M429-V434 HydrophobicContact SD-CG2 3.8Å; L430-V434 WeakPolarHBondContact O-CG2 3.15Å; L430-V434 PolarHBondContact O-N 3.36Å; Q431-V434 PolarHBondContact O-N 2.97Å; V434-S436 PolarHBondContact O-N 2.93Å
435	D	56.7	Low	49	Very low	48 Å²	48	94 Å²	94	26%	0.257	48%	0.482	S	S	.	.	H	α-helix	trans	-71.4	-17.1	-178.4	-71.3	25.1	0	0	0	112.6	Y371 K410 K413 Q431	Y371-D435 PolarHBondContact OH-O 3.01Å; K410-D435 IonicContact NZ-OD2 3.49Å; K410-D435 PolarHBondContact NZ-OD2 3.46Å; K413-D435 VanDerWaalsContact CE-OD2 3.28Å; K413-D435 WeakPolarHBondContact CE-OD2 3.4Å; K413-D435 IonicContact NZ-OD1 3.23Å; K413-D435 PolarHBondContact NZ-OD1 3.39Å; K413-D435 IonicContact NZ-OD2 2.72Å; K413-D435 PolarHBondContact NZ-OD2 3.49Å; Q431-D435 PolarHBondContact O-N 2.8Å
436	S	51.1	Low	47.7	Very low	69 Å²	69	96.3 Å²	96.3	48%	0.483	50%	0.498	S	S	.	.	H	α-helix	trans	-96.9	-5.4	-176.7	47.3	0	0	0	0	114.4	A432 D433 V434 P438	A432-S436 PolarHBondContact O-N 2.87Å; A432-S436 PolarHBondContact O-OG 3.11Å; D433-S436 WeakPolarHBondContact CA-OG 3.19Å; D433-S436 PolarHBondContact O-N 3.45Å; D433-S436 PolarHBondContact O-OG 2.8Å; V434-S436 PolarHBondContact O-N 2.93Å; S436-P438 WeakPolarHBondContact O-CD 3.42Å
437	Q	40.2	Very low	46.3	Very low	135 Å²	135	101.3 Å²	101.3	63%	0.631	52%	0.516	S	S	*	.			trans	-76.3	113.6	171.2	-72.1	-168	-0.9	0	0	110.9	D433 Q439	D433-Q437 PolarHBondContact O-N 3.2Å; Q437-Q439 PolarHBondContact O-N 2.78Å
438	P	34.8	Very low	45	Very low	114 Å²	114	104 Å²	104	74%	0.74	54%	0.543	S	S	*	.			trans	-75.5	122	170.5	2.6	15.4	0	0	0	108.5	S436 Q440	S436-P438 WeakPolarHBondContact O-CD 3.42Å; P438-Q440 PolarHBondContact O-N 3.4Å; P438-Q440 VanDerWaalsContact O-N 3.1Å
439	Q	32.4	Very low	43.7	Very low	195 Å²	195	108.2 Å²	108.2	91%	0.911	58%	0.578	S	S	*	*			trans	-58.4	115.4	166.9	-73.3	178.5	-10.4	0	0	108.9	Q437 Q441	Q437-Q439 PolarHBondContact O-N 2.78Å; Q439-Q441 PolarHBondContact O-N 3.43Å
440	Q	25.4	Very low	41.6	Very low	161 Å²	161	111.9 Å²	111.9	75%	0.752	61%	0.605	S	S	*	*			trans	-59.2	115.5	-169.7	-67.4	172.9	-3.8	0	0	114.3	P438	P438-Q440 PolarHBondContact O-N 3.4Å; P438-Q440 VanDerWaalsContact O-N 3.1Å
441	Q	27.6	Very low	39.5	Very low	176 Å²	176	120.5 Å²	120.5	82%	0.822	65%	0.645	S	S	*	*			trans	-141	115.2	154	-76.3	-173.3	-3.7	0	0	112.3	Q439	Q439-Q441 PolarHBondContact O-N 3.43Å
442	Q	25.5	Very low	37.5	Very low	174 Å²	174	122.4 Å²	122.4	81%	0.813	67%	0.668	S	S	*	*			trans	52.7	109.1	144.4	-61.9	175.4	-1.5	0	0	120.9
443	Q	29	Very low	35.9	Very low	198 Å²	198	131.3 Å²	131.3	93%	0.925	71%	0.708	S	S	*	*				174.2	136.2	113.7	-91.5	169.3	17.2	0	0	112.2
444	Q	25.4	Very low	34.1	Very low	186 Å²	186	135.2 Å²	135.2	87%	0.869	73%	0.734	S	S	*	*			trans	-121.8	171.3	-179.4	-138	175	18.2	0	0	108.4
445	E	28.6	Very low	32.7	Very low	188 Å²	188	142.7 Å²	142.7	88%	0.879	77%	0.767	S	S	*	*			trans	95.9	140.1	173.9	-53.7	-176.6	175.7	0	0	114.8
446	A	30.9	Very low	31.9	Very low	75 Å²	75	150.2 Å²	150.2	62%	0.62	80%	0.797	S	S	*	*			cis	-176.3	152.1	19.7	0	0	0	0	0	112.7
447	F	27.2	Very low	31.3	Very low	215 Å²	215	154.4 Å²	154.4	94%	0.943	81%	0.814	S	S	*	*			trans	64.3	149.2	148.4	-75.8	-105.4	0	0	0	121.8
448	G	30.6	Very low	31.2	Very low	72 Å²	72	151 Å²	151	74%	0.742	82%	0.815	S	S	*	*			cis	177.9	173.9	12.1	0	0	0	0	0	112.3
449	A	32.3	Very low	31.8	Very low	103 Å²	103	152 Å²	152	85%	0.851	82%	0.819	S	S	*	*			trans	-66.2	179.3	-167.1	0	0	0	0	0	117.3
450	S	31.9	Very low	32.5	Very low	95 Å²	95	151 Å²	151	66%	0.664	81%	0.811	S	S	*	*			cis	179	161.4	37.4	59.6	0	0	0	0	114
451	Q	31.9	Very low	33.3	Very low	189 Å²	189	146.4 Å²	146.4	88%	0.883	80%	0.801	S	S	*	*			trans	63.9	149.6	145.1	-71.9	176	24.2	0	0	121
452	A	31.1	Very low	34.5	Very low	84 Å²	84	146.2 Å²	146.2	69%	0.694	80%	0.798	S	S	*	*			cis	-171.2	154.7	-9.6	0	0	0	0	0	108.5
453	E	30.9	Very low	35.9	Very low	196 Å²	196	143.4 Å²	143.4	92%	0.916	79%	0.788	S	S	*	*			trans	161.8	130.8	131.7	-90.4	-176.2	167	0	0	114.1
454	T	30	Very low	37	Very low	132 Å²	132	137.3 Å²	137.3	81%	0.81	76%	0.764	S	S	*	*			trans	-133.2	129.7	-173.4	-54.4	0	0	0	0	108
455	Q	34	Very low	38.6	Very low	191 Å²	191	134.2 Å²	134.2	89%	0.893	75%	0.749	S	S	*	*			trans	-177.6	100	157.1	-105.9	168.2	40.2	0	0	110.8
456	K	40.1	Very low	40.4	Very low	207 Å²	207	131.8 Å²	131.8	90%	0.9	74%	0.738	S	S	*	*	S	Bend	trans	-172.2	-0.1	157.6	-110.7	169.1	-175.5	179.2	0	118.4
457	N	38.5	Very low	41.9	Very low	157 Å²	157	133.3 Å²	133.3	84%	0.84	73%	0.732	S	S	*	*			trans	-106.6	16	-166.8	-75.4	-15	0	0	0	118.3	V459	N457-V459 PolarHBondContact O-N 3.17Å
458	G	38.3	Very low	43.2	Very low	63 Å²	63	124.8 Å²	124.8	65%	0.649	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-9.8	-166.9	0	0	0	0	0	119.5
459	V	46.2	Very low	45.2	Very low	135 Å²	135	125.4 Å²	125.4	82%	0.818	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-28	-167.7	-176.9	0	0	0	0	114.1	N457	N457-V459 PolarHBondContact O-N 3.17Å
460	K	47.7	Very low	47	Very low	173 Å²	173	125 Å²	125	75%	0.752	67%	0.672	S	S	*	*	S	Bend	trans	-78.2	-21	-179.8	-79.2	-175.2	175.9	-177.8	0	114.4	K462	K460-K462 PolarHBondContact O-N 3.12Å
461	A	42	Very low	48.5	Very low	66 Å²	66	122.2 Å²	122.2	55%	0.545	65%	0.649	S	S	.	*	H	α-helix	trans	-68.8	-31.3	-177.5	0	0	0	0	0	113.8	L463 Q465	A461-L463 PolarHBondContact O-N 3.14Å; A461-Q465 PolarHBondContact O-N 3.28Å
462	K	52.4	Low	50	Low	171 Å²	171	117.6 Å²	117.6	74%	0.743	63%	0.633	S	S	*	*	H	α-helix	trans	-68.7	-32.3	-177.5	-84.3	-175.5	175.1	179.8	0	114	K460 Q466	K460-K462 PolarHBondContact O-N 3.12Å; K462-Q466 PolarHBondContact O-N 3.15Å
463	L	54.7	Low	51.8	Low	116 Å²	116	122.2 Å²	122.2	61%	0.607	63%	0.633	S	S	*	*	H	α-helix	trans	-72.9	-36.9	-177.8	-161.6	74.5	0	0	0	111.8	A461 Q465 Q466 Q467	A461-L463 PolarHBondContact O-N 3.14Å; L463-Q465 VanDerWaalsContact C-N 3.34Å; L463-Q466 PolarHBondContact O-N 3.44Å; L463-Q467 PolarHBondContact O-N 2.79Å
464	V	52.9	Low	53.5	Low	69 Å²	69	118.1 Å²	118.1	42%	0.418	61%	0.614	S	S	.	*	H	α-helix	trans	-65.9	-38.2	176.5	179.5	0	0	0	0	111	Q466 Q467 A468 L558	V464-Q466 VanDerWaalsContact C-N 3.33Å; V464-Q466 PolarHBondContact O-N 3.47Å; V464-Q467 PolarHBondContact O-N 3.31Å; V464-A468 PolarHBondContact O-N 2.95Å; V464-A468 VanDerWaalsContact O-N 3.08Å; V464-L558 HydrophobicContact CG1-CD1 4.34Å
465	Q	58.6	Low	55.1	Low	122 Å²	122	115.3 Å²	115.3	57%	0.57	59%	0.593	S	S	*	*	H	α-helix	trans	-62.1	-38.5	176.2	-160.9	75	38.3	0	0	112.6	A461 L463 N469	A461-Q465 PolarHBondContact O-N 3.28Å; L463-Q465 VanDerWaalsContact C-N 3.34Å; Q465-N469 PolarHBondContact O-N 3.12Å
466	Q	67.5	Low	56.6	Low	137 Å²	137	109.5 Å²	109.5	64%	0.64	58%	0.578	S	S	*	*	H	α-helix	trans	-67.1	-39.4	177.2	-88.2	-175.8	-20.2	0	0	112.6	K462 L463 V464 N469 N470	K462-Q466 PolarHBondContact O-N 3.15Å; L463-Q466 PolarHBondContact O-N 3.44Å; V464-Q466 VanDerWaalsContact C-N 3.33Å; V464-Q466 PolarHBondContact O-N 3.47Å; Q466-N469 PolarHBondContact O-N 2.84Å; Q466-N470 PolarHBondContact O-N 3.31Å
467	Q	61	Low	57.9	Low	106 Å²	106	104.1 Å²	104.1	50%	0.495	56%	0.562	S	S	.	*	H	α-helix	trans	-67	-41.2	177.2	-74.7	-178.4	-25.8	0	0	112.1	L463 V464 N469 N470 I471	L463-Q467 PolarHBondContact O-N 2.79Å; V464-Q467 PolarHBondContact O-N 3.31Å; Q467-N469 VanDerWaalsContact C-N 3.34Å; Q467-N469 PolarHBondContact O-N 2.84Å; Q467-N470 PolarHBondContact O-N 3.01Å; Q467-I471 PolarHBondContact O-N 3.49Å
468	A	55.8	Low	59.1	Low	36 Å²	36	98.9 Å²	98.9	30%	0.298	53%	0.534	S	S	.	.	H	α-helix	trans	-59.4	-43.8	175.4	0	0	0	0	0	112.1	V464 N470 I471 T472	V464-A468 PolarHBondContact O-N 2.95Å; V464-A468 VanDerWaalsContact O-N 3.08Å; A468-N470 VanDerWaalsContact C-N 3.3Å; A468-N470 PolarHBondContact O-N 2.8Å; A468-I471 PolarHBondContact O-N 3.3Å; A468-T472 PolarHBondContact O-N 3.49Å; A468-T472 VanDerWaalsContact O-N 3.14Å; A468-T472 PolarHBondContact O-OG1 3.45Å; A468-T472 VanDerWaalsContact O-OG1 3.08Å
469	N	71	Confident	60.4	Low	85 Å²	85	102.9 Å²	102.9	46%	0.455	53%	0.533	S	S	.	.	H	α-helix	trans	-63.6	-32	178.8	-72.6	-13.9	0	0	0	113.5	Q465 Q466 Q467 R473	Q465-N469 PolarHBondContact O-N 3.12Å; Q466-N469 PolarHBondContact O-N 2.84Å; Q467-N469 VanDerWaalsContact C-N 3.34Å; Q467-N469 PolarHBondContact O-N 2.84Å; N469-R473 PolarHBondContact O-N 2.94Å
470	N	71.5	Confident	61.5	Low	96 Å²	96	99.5 Å²	99.5	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-71.4	-39.4	176.2	-105.2	-11.6	0	0	0	112.3	Q466 Q467 A468 T472 R473 Q474	Q466-N470 PolarHBondContact O-N 3.31Å; Q467-N470 PolarHBondContact O-N 3.01Å; A468-N470 VanDerWaalsContact C-N 3.3Å; A468-N470 PolarHBondContact O-N 2.8Å; N470-T472 VanDerWaalsContact C-N 3.33Å; N470-T472 PolarHBondContact O-N 3.41Å; N470-R473 PolarHBondContact O-N 3.05Å; N470-Q474 PolarHBondContact O-N 3.38Å
471	I	61.7	Low	62.6	Low	35 Å²	35	95.7 Å²	95.7	18%	0.179	50%	0.504	C	S	.	.	H	α-helix	trans	-62.4	-43	176	-68.2	172	0	0	0	110.2	Q467 A468 R473 Q474 I475 M554	Q467-I471 PolarHBondContact O-N 3.49Å; A468-I471 PolarHBondContact O-N 3.3Å; I471-R473 VanDerWaalsContact C-N 3.33Å; I471-R473 PolarHBondContact O-N 3.08Å; I471-Q474 PolarHBondContact O-N 3.37Å; I471-I475 HydrophobicContact CG2-CD1 3.75Å; I471-I475 HydrophobicContact CG2-CG1 4.35Å; I471-I475 WeakPolarHBondContact O-CG1 3.19Å; I471-I475 PolarHBondContact O-N 2.99Å; I471-M554 HydrophobicContact CD1-CE 3.52Å
472	T	64	Low	63.9	Low	92 Å²	92	94.1 Å²	94.1	56%	0.564	49%	0.488	S	S	*	.	H	α-helix	trans	-59.3	-40	178.2	-51.5	0	0	0	0	112.7	A468 N470 I475 A476	A468-T472 PolarHBondContact O-N 3.49Å; A468-T472 VanDerWaalsContact O-N 3.14Å; A468-T472 PolarHBondContact O-OG1 3.45Å; A468-T472 VanDerWaalsContact O-OG1 3.08Å; N470-T472 VanDerWaalsContact C-N 3.33Å; N470-T472 PolarHBondContact O-N 3.41Å; T472-I475 PolarHBondContact O-N 3.06Å; T472-A476 PolarHBondContact O-N 3.47Å
473	R	69.5	Low	65	Low	181 Å²	181	92 Å²	92	68%	0.683	48%	0.48	S	S	*	.	H	α-helix	trans	-67.9	-38.3	176.3	-73.9	-176.2	-168.7	158.2	1.8	112.9	N469 N470 I471 A476 T477	N469-R473 PolarHBondContact O-N 2.94Å; N470-R473 PolarHBondContact O-N 3.05Å; I471-R473 VanDerWaalsContact C-N 3.33Å; I471-R473 PolarHBondContact O-N 3.08Å; R473-A476 PolarHBondContact O-N 2.92Å; R473-T477 PolarHBondContact O-N 3.14Å; R473-T477 PolarHBondContact O-OG1 3.38Å; R473-T477 VanDerWaalsContact O-OG1 3.06Å
474	Q	66.6	Low	66.1	Low	111 Å²	111	91.5 Å²	91.5	52%	0.519	48%	0.478	S	S	.	.	H	α-helix	trans	-65.2	-41	176.7	-72.6	-179.9	-11.5	0	0	111.4	N470 I471 A476 T477 L478	N470-Q474 PolarHBondContact O-N 3.38Å; I471-Q474 PolarHBondContact O-N 3.37Å; Q474-A476 PolarHBondContact O-N 3.38Å; Q474-T477 PolarHBondContact O-N 3.03Å; Q474-L478 WeakPolarHBondContact O-CD1 3.24Å; Q474-L478 VanDerWaalsContact O-CG 3.28Å; Q474-L478 WeakPolarHBondContact O-CG 3.46Å; Q474-L478 PolarHBondContact O-N 3.46Å
475	I	62.6	Low	67.3	Low	73 Å²	73	89.2 Å²	89.2	37%	0.374	47%	0.466	S	S	.	.	H	α-helix	trans	-61	-42.4	177.2	-68.3	169.4	0	0	0	111.8	I471 T472 T477 L478 K479 V548	I471-I475 HydrophobicContact CG2-CD1 3.75Å; I471-I475 HydrophobicContact CG2-CG1 4.35Å; I471-I475 WeakPolarHBondContact O-CG1 3.19Å; I471-I475 PolarHBondContact O-N 2.99Å; T472-I475 PolarHBondContact O-N 3.06Å; I475-T477 PolarHBondContact O-N 3.4Å; I475-L478 PolarHBondContact O-N 3.38Å; I475-K479 PolarHBondContact O-N 2.82Å; I475-V548 HydrophobicContact CG1-CG2 4.48Å
476	A	66.2	Low	68.1	Low	69 Å²	69	87.3 Å²	87.3	57%	0.57	46%	0.463	S	S	*	.	H	α-helix	trans	-62.8	-40.8	-179.3	0	0	0	0	0	112.8	T472 R473 Q474	T472-A476 PolarHBondContact O-N 3.47Å; R473-A476 PolarHBondContact O-N 2.92Å; Q474-A476 PolarHBondContact O-N 3.38Å
477	T	66.9	Low	68.7	Low	94 Å²	94	85.8 Å²	85.8	58%	0.577	46%	0.456	S	S	*	.	H	α-helix	trans	-68.9	-41.8	-179.8	-42.9	0	0	0	0	111.1	R473 Q474 I475 K479	R473-T477 PolarHBondContact O-N 3.14Å; R473-T477 PolarHBondContact O-OG1 3.38Å; R473-T477 VanDerWaalsContact O-OG1 3.06Å; Q474-T477 PolarHBondContact O-N 3.03Å; I475-T477 PolarHBondContact O-N 3.4Å; T477-K479 VanDerWaalsContact C-N 3.32Å; T477-K479 PolarHBondContact O-N 2.89Å
478	L	63.5	Low	69.8	Low	46 Å²	46	82.4 Å²	82.4	24%	0.241	45%	0.446	C	S	.	.	H	α-helix	trans	-69.9	-23.9	-177.6	-70.3	168.4	0	0	0	114.2	Q474 I475 D481 T482 V544	Q474-L478 WeakPolarHBondContact O-CD1 3.24Å; Q474-L478 VanDerWaalsContact O-CG 3.28Å; Q474-L478 WeakPolarHBondContact O-CG 3.46Å; Q474-L478 PolarHBondContact O-N 3.46Å; I475-L478 PolarHBondContact O-N 3.38Å; L478-D481 PolarHBondContact O-N 3.49Å; L478-T482 PolarHBondContact O-N 2.8Å; L478-T482 VanDerWaalsContact O-N 3.15Å; L478-T482 PolarHBondContact O-OG1 3.2Å; L478-V544 HydrophobicContact CB-CG1 4.09Å; L478-V544 HydrophobicContact CB-CG2 3.99Å; L478-V544 HydrophobicContact CD1-CG1 4.26Å; L478-V544 HydrophobicContact CD1-CG2 4.15Å; L478-V544 HydrophobicContact CD2-CG2 3.88Å; L478-V544 HydrophobicContact CG-CG2 4.22Å
479	K	65.6	Low	71.1	Confident	147 Å²	147	81.9 Å²	81.9	64%	0.639	44%	0.438	S	S	*	.	H	α-helix	trans	-65	-42.9	179.2	-160.9	-179.7	-179.4	-172.9	0	111.9	I475 T477 T482 E483	I475-K479 PolarHBondContact O-N 2.82Å; T477-K479 VanDerWaalsContact C-N 3.32Å; T477-K479 PolarHBondContact O-N 2.89Å; K479-T482 PolarHBondContact O-N 2.96Å; K479-E483 PolarHBondContact O-N 3.33Å
480	S	70.4	Confident	71.7	Confident	64 Å²	64	84.5 Å²	84.5	45%	0.448	44%	0.442	S	S	.	.	H	α-helix	trans	-59.6	-45.6	175.6	163.9	0	0	0	0	111.9	T482 E483 N484	S480-T482 VanDerWaalsContact C-N 3.31Å; S480-T482 PolarHBondContact O-N 3.12Å; S480-E483 PolarHBondContact O-N 3.24Å; S480-N484 PolarHBondContact O-N 2.78Å; S480-N484 PolarHBondContact O-ND2 2.8Å
481	D	70.8	Confident	72.4	Confident	93 Å²	93	87.1 Å²	87.1	50%	0.497	45%	0.448	S	S	.	.	H	α-helix	trans	-69.1	-32.6	-176.8	-65.4	-17.9	0	0	0	112.4	L478 A485	L478-D481 PolarHBondContact O-N 3.49Å; D481-A485 WeakPolarHBondContact O-CB 3.44Å; D481-A485 PolarHBondContact O-N 3.41Å
482	T	70	Confident	73.5	Confident	34 Å²	34	87.3 Å²	87.3	21%	0.209	45%	0.453	C	S	.	.	H	α-helix	trans	-66.8	-44.7	178	-57.8	0	0	0	0	111.9	L478 K479 S480 N484 A485 V486 V541	L478-T482 PolarHBondContact O-N 2.8Å; L478-T482 VanDerWaalsContact O-N 3.15Å; L478-T482 PolarHBondContact O-OG1 3.2Å; K479-T482 PolarHBondContact O-N 2.96Å; S480-T482 VanDerWaalsContact C-N 3.31Å; S480-T482 PolarHBondContact O-N 3.12Å; T482-N484 VanDerWaalsContact C-N 3.34Å; T482-N484 PolarHBondContact O-N 3.48Å; T482-A485 PolarHBondContact O-N 3.39Å; T482-V486 WeakPolarHBondContact O-CG2 3.5Å; T482-V486 PolarHBondContact O-N 2.91Å; T482-V541 HydrophobicContact CG2-CB 4.41Å; T482-V541 HydrophobicContact CG2-CG1 3.67Å; T482-V541 HydrophobicContact CG2-CG2 3.94Å
483	E	73.8	Confident	74.3	Confident	127 Å²	127	89.4 Å²	89.4	59%	0.593	45%	0.451	S	S	*	.	H	α-helix	trans	-60.6	-43.5	177.3	-101.5	167.5	178.3	0	0	111.8	K479 S480 A485 V486 Q487	K479-E483 PolarHBondContact O-N 3.33Å; S480-E483 PolarHBondContact O-N 3.24Å; E483-A485 PolarHBondContact O-N 3.14Å; E483-V486 PolarHBondContact O-N 2.99Å; E483-Q487 WeakPolarHBondContact O-CG 3.1Å; E483-Q487 PolarHBondContact O-N 3.49Å
484	N	79.4	Confident	75	Confident	105 Å²	105	84.5 Å²	84.5	56%	0.561	44%	0.436	S	S	*	.	H	α-helix	trans	-63.3	-41.7	177.3	-70.2	-31.1	0	0	0	112.2	S480 T482 A488	S480-N484 PolarHBondContact O-N 2.78Å; S480-N484 PolarHBondContact O-ND2 2.8Å; T482-N484 VanDerWaalsContact C-N 3.34Å; T482-N484 PolarHBondContact O-N 3.48Å; N484-A488 WeakPolarHBondContact O-CB 3.35Å; N484-A488 PolarHBondContact O-N 3.07Å
485	A	77	Confident	75.9	Confident	20 Å²	20	81.9 Å²	81.9	17%	0.165	43%	0.434	C	S	.	.	H	α-helix	trans	-65.1	-42.4	178.4	0	0	0	0	0	112.5	D481 T482 E483 A488 N489 V541	D481-A485 WeakPolarHBondContact O-CB 3.44Å; D481-A485 PolarHBondContact O-N 3.41Å; T482-A485 PolarHBondContact O-N 3.39Å; E483-A485 PolarHBondContact O-N 3.14Å; A485-A488 PolarHBondContact O-N 3.48Å; A485-N489 WeakPolarHBondContact O-CB 3.43Å; A485-N489 PolarHBondContact O-N 3.04Å; A485-V541 HydrophobicContact CB-CG2 4.15Å
486	V	76.2	Confident	76.8	Confident	83 Å²	83	80 Å²	80	50%	0.503	43%	0.426	S	S	.	.	H	α-helix	trans	-65	-45.7	177.9	172.8	0	0	0	0	111.1	T482 E483 A488 N489 R490	T482-V486 WeakPolarHBondContact O-CG2 3.5Å; T482-V486 PolarHBondContact O-N 2.91Å; E483-V486 PolarHBondContact O-N 2.99Å; V486-A488 VanDerWaalsContact C-N 3.34Å; V486-A488 PolarHBondContact O-N 3.29Å; V486-N489 PolarHBondContact O-N 3.42Å; V486-R490 WeakPolarHBondContact O-CB 3.34Å; V486-R490 PolarHBondContact O-N 2.7Å
487	Q	80.3	Confident	77.4	Confident	105 Å²	105	79 Å²	79	49%	0.491	41%	0.413	S	S	.	.	H	α-helix	trans	-62.9	-40	177.8	-71.4	-65.9	-14.5	0	0	112.2	E483 R490 K491	E483-Q487 WeakPolarHBondContact O-CG 3.1Å; E483-Q487 PolarHBondContact O-N 3.49Å; Q487-R490 PolarHBondContact O-N 3.43Å; Q487-K491 PolarHBondContact O-N 2.82Å
488	A	82.5	Confident	78.1	Confident	34 Å²	34	80.9 Å²	80.9	28%	0.281	42%	0.415	S	S	.	.	H	α-helix	trans	-64.8	-42.7	175.9	0	0	0	0	0	112	N484 A485 V486 K491 S492	N484-A488 WeakPolarHBondContact O-CB 3.35Å; N484-A488 PolarHBondContact O-N 3.07Å; A485-A488 PolarHBondContact O-N 3.48Å; V486-A488 VanDerWaalsContact C-N 3.34Å; V486-A488 PolarHBondContact O-N 3.29Å; A488-K491 PolarHBondContact O-N 3.44Å; A488-S492 PolarHBondContact O-N 3.34Å; A488-S492 VanDerWaalsContact O-N 3.17Å; A488-S492 PolarHBondContact O-OG 3.41Å
489	N	84.5	Confident	79	Confident	25 Å²	25	81 Å²	81	13%	0.134	42%	0.423	C	S	.	.	H	α-helix	trans	-66.4	-38.2	177	-84.1	4.7	0	0	0	112.2	A485 V486 K491 S492 Y493 M534 K537	A485-N489 WeakPolarHBondContact O-CB 3.43Å; A485-N489 PolarHBondContact O-N 3.04Å; V486-N489 PolarHBondContact O-N 3.42Å; N489-K491 PolarHBondContact O-N 2.85Å; N489-S492 PolarHBondContact O-N 3.1Å; N489-Y493 WeakPolarHBondContact O-CB 3.3Å; N489-Y493 PolarHBondContact O-N 3.09Å; N489-M534 HydrophobicContact CB-CE 3.97Å; N489-M534 HydrophobicContact CB-CG 4.31Å; N489-M534 PolarHBondContact ND2-O 3.05Å; N489-M534 WeakPolarHBondContact OD1-CA 3.49Å; N489-K537 WeakPolarHBondContact OD1-CD 3.4Å
490	R	83.7	Confident	79.4	Confident	141 Å²	141	74.9 Å²	74.9	53%	0.532	40%	0.401	S	S	.	.	H	α-helix	trans	-58.6	-47.5	175.4	-177.5	179.4	173.2	-169.9	-0.4	111.8	V486 Q487 S492 Y493 E494	V486-R490 WeakPolarHBondContact O-CB 3.34Å; V486-R490 PolarHBondContact O-N 2.7Å; Q487-R490 PolarHBondContact O-N 3.43Å; R490-S492 VanDerWaalsContact C-N 3.33Å; R490-S492 PolarHBondContact O-N 2.96Å; R490-Y493 WeakPolarHBondContact O-CB 3.17Å; R490-Y493 PolarHBondContact O-N 2.97Å; R490-E494 HydrophobicContact CG-CG 4.46Å; R490-E494 IonicContact CZ-OE1 3.21Å; R490-E494 IonicContact NE-OE1 3.21Å; R490-E494 PolarHBondContact NE-OE1 3.24Å; R490-E494 IonicContact NH2-OE1 3.31Å; R490-E494 PolarHBondContact NH2-OE1 2.96Å; R490-E494 VanDerWaalsContact NH2-OE1 3.13Å; R490-E494 WeakPolarHBondContact O-CG 3.37Å; R490-E494 PolarHBondContact O-N 2.89Å
491	K	86	Confident	79.8	Confident	151 Å²	151	77.8 Å²	77.8	66%	0.657	41%	0.408	S	S	*	.	H	α-helix	trans	-60.7	-41.6	176.3	-72.5	-177.2	178.5	-177.4	0	112.3	Q487 A488 N489 A495	Q487-K491 PolarHBondContact O-N 2.82Å; A488-K491 PolarHBondContact O-N 3.44Å; N489-K491 PolarHBondContact O-N 2.85Å; K491-A495 WeakPolarHBondContact O-CB 3.34Å; K491-A495 PolarHBondContact O-N 3.34Å; K491-A495 VanDerWaalsContact O-N 3.1Å
492	S	83.4	Confident	80.4	Confident	39 Å²	39	76.7 Å²	76.7	27%	0.273	41%	0.408	S	S	.	.	H	α-helix	trans	-64.5	-39.4	176.5	-69.7	0	0	0	0	112.6	A488 N489 R490 C496	A488-S492 PolarHBondContact O-N 3.34Å; A488-S492 VanDerWaalsContact O-N 3.17Å; A488-S492 PolarHBondContact O-OG 3.41Å; N489-S492 PolarHBondContact O-N 3.1Å; R490-S492 VanDerWaalsContact C-N 3.33Å; R490-S492 PolarHBondContact O-N 2.96Å; S492-C496 WeakPolarHBondContact O-CB 3.49Å; S492-C496 PolarHBondContact O-N 3.31Å; S492-C496 VanDerWaalsContact O-N 3.16Å
493	Y	82.1	Confident	80.8	Confident	136 Å²	136	75.9 Å²	75.9	53%	0.533	40%	0.402	S	S	.	.	H	α-helix	trans	-64	-52.3	174.2	166.4	-100	0	0	0	111.8	N489 R490 A495 C496 V497	N489-Y493 WeakPolarHBondContact O-CB 3.3Å; N489-Y493 PolarHBondContact O-N 3.09Å; R490-Y493 WeakPolarHBondContact O-CB 3.17Å; R490-Y493 PolarHBondContact O-N 2.97Å; Y493-A495 VanDerWaalsContact C-N 3.31Å; Y493-A495 PolarHBondContact O-N 3.46Å; Y493-C496 PolarHBondContact O-N 3.46Å; Y493-C496 VanDerWaalsContact O-N 3.09Å; Y493-V497 HydrophobicContact CD2-CG2 3.98Å; Y493-V497 HydrophobicContact CE1-CG2 4.14Å; Y493-V497 HydrophobicContact CE2-CG2 3.53Å; Y493-V497 HydrophobicContact CG-CG2 4.47Å; Y493-V497 WeakPolarHBondContact O-CG2 3.39Å; Y493-V497 PolarHBondContact O-N 3.34Å
494	E	83.5	Confident	80.8	Confident	77 Å²	77	75.1 Å²	75.1	36%	0.36	40%	0.402	S	S	.	.	H	α-helix	trans	-58.1	-43.4	-178.6	-73	170.7	174	0	0	111.5	R490 C496 V497 Q498	R490-E494 HydrophobicContact CG-CG 4.46Å; R490-E494 IonicContact CZ-OE1 3.21Å; R490-E494 IonicContact NE-OE1 3.21Å; R490-E494 PolarHBondContact NE-OE1 3.24Å; R490-E494 IonicContact NH2-OE1 3.31Å; R490-E494 PolarHBondContact NH2-OE1 2.96Å; R490-E494 VanDerWaalsContact NH2-OE1 3.13Å; R490-E494 WeakPolarHBondContact O-CG 3.37Å; R490-E494 PolarHBondContact O-N 2.89Å; E494-C496 PolarHBondContact O-N 3.04Å; E494-V497 PolarHBondContact O-N 3Å; E494-Q498 WeakPolarHBondContact O-CG 3.29Å; E494-Q498 PolarHBondContact O-N 2.61Å
495	A	85.6	Confident	80.8	Confident	57 Å²	57	73.7 Å²	73.7	47%	0.471	40%	0.4	S	S	.	.	H	α-helix	trans	-65.4	-37.7	176.4	0	0	0	0	0	113.1	K491 Y493 A499	K491-A495 WeakPolarHBondContact O-CB 3.34Å; K491-A495 PolarHBondContact O-N 3.34Å; K491-A495 VanDerWaalsContact O-N 3.1Å; Y493-A495 VanDerWaalsContact C-N 3.31Å; Y493-A495 PolarHBondContact O-N 3.46Å; A495-A499 WeakPolarHBondContact O-CB 3.45Å; A495-A499 PolarHBondContact O-N 2.63Å
496	C	81.2	Confident	81	Confident	32 Å²	32	75.9 Å²	75.9	22%	0.216	41%	0.409	C	S	.	.	H	α-helix	trans	-68.4	-40.7	177.5	-169.6	0	0	0	0	111.7	S492 Y493 E494 G500 F523	S492-C496 WeakPolarHBondContact O-CB 3.49Å; S492-C496 PolarHBondContact O-N 3.31Å; S492-C496 VanDerWaalsContact O-N 3.16Å; Y493-C496 PolarHBondContact O-N 3.46Å; Y493-C496 VanDerWaalsContact O-N 3.09Å; E494-C496 PolarHBondContact O-N 3.04Å; C496-G500 PolarHBondContact O-N 2.86Å; C496-F523 WeakPolarHBondContact O-CE2 3.46Å
497	V	78.1	Confident	81	Confident	48 Å²	48	74 Å²	74	29%	0.291	40%	0.395	S	S	.	.	H	α-helix	trans	-65.6	-48.6	178.1	172.6	0	0	0	0	110.8	Y493 E494 A499 G500 E501	Y493-V497 HydrophobicContact CD2-CG2 3.98Å; Y493-V497 HydrophobicContact CE1-CG2 4.14Å; Y493-V497 HydrophobicContact CE2-CG2 3.53Å; Y493-V497 HydrophobicContact CG-CG2 4.47Å; Y493-V497 WeakPolarHBondContact O-CG2 3.39Å; Y493-V497 PolarHBondContact O-N 3.34Å; E494-V497 PolarHBondContact O-N 3Å; V497-A499 VanDerWaalsContact C-N 3.31Å; V497-A499 PolarHBondContact O-N 2.83Å; V497-G500 CarbonylContact O-C 3.57Å; V497-G500 WeakPolarHBondContact O-CA 3.26Å; V497-G500 PolarHBondContact O-N 2.87Å; V497-E501 HydrophobicContact CG1-CG 4.15Å; V497-E501 WeakPolarHBondContact O-CG 3.2Å; V497-E501 PolarHBondContact O-N 3.12Å
498	Q	82.4	Confident	80.6	Confident	134 Å²	134	73.6 Å²	73.6	63%	0.626	40%	0.404	S	S	*	.	H	α-helix	trans	-57.8	-42.3	178.2	-76	178.8	-11.1	0	0	112.6	E494 G500 S502	E494-Q498 WeakPolarHBondContact O-CG 3.29Å; E494-Q498 PolarHBondContact O-N 2.61Å; Q498-G500 VanDerWaalsContact C-N 3.35Å; Q498-S502 WeakPolarHBondContact O-CB 3.48Å; Q498-S502 PolarHBondContact O-N 2.92Å
499	A	81.6	Confident	80.6	Confident	49 Å²	49	76 Å²	76	41%	0.405	42%	0.424	S	S	.	.	H	α-helix	trans	-65.4	-38.2	175.9	0	0	0	0	0	112.3	A495 V497 L503 F523	A495-A499 WeakPolarHBondContact O-CB 3.45Å; A495-A499 PolarHBondContact O-N 2.63Å; V497-A499 VanDerWaalsContact C-N 3.31Å; V497-A499 PolarHBondContact O-N 2.83Å; A499-L503 PolarHBondContact O-N 3.01Å; A499-L503 VanDerWaalsContact O-N 3.13Å; A499-F523 HydrophobicContact CB-CD2 4.3Å; A499-F523 HydrophobicContact CB-CE2 3.94Å
500	G	74.1	Confident	80.5	Confident	18 Å²	18	78.6 Å²	78.6	19%	0.186	44%	0.444	C	S	.	.	H	α-helix	trans	-68.4	-42.6	176.3	0	0	0	0	0	113.2	C496 V497 Q498 L503 L504	C496-G500 PolarHBondContact O-N 2.86Å; V497-G500 CarbonylContact O-C 3.57Å; V497-G500 WeakPolarHBondContact O-CA 3.26Å; V497-G500 PolarHBondContact O-N 2.87Å; Q498-G500 VanDerWaalsContact C-N 3.35Å; G500-L503 PolarHBondContact O-N 3.23Å; G500-L504 WeakPolarHBondContact O-CB 3.16Å; G500-L504 PolarHBondContact O-N 2.86Å
501	E	80.4	Confident	79.5	Confident	125 Å²	125	73.6 Å²	73.6	58%	0.584	44%	0.437	S	S	*	.	H	α-helix	trans	-63.6	-41.8	175.9	-73.5	177.6	163	0	0	111.6	V497 L503 L504 S505	V497-E501 HydrophobicContact CG1-CG 4.15Å; V497-E501 WeakPolarHBondContact O-CG 3.2Å; V497-E501 PolarHBondContact O-N 3.12Å; E501-L503 VanDerWaalsContact C-N 3.35Å; E501-L503 PolarHBondContact O-N 2.84Å; E501-L504 PolarHBondContact O-N 3.49Å; E501-S505 WeakPolarHBondContact O-CB 3.45Å; E501-S505 PolarHBondContact O-N 3.24Å
502	S	83.5	Confident	78.9	Confident	70 Å²	70	71.3 Å²	71.3	49%	0.49	43%	0.43	S	S	.	.	H	α-helix	trans	-58.6	-45.9	173.2	-175.8	0	0	0	0	111.5	Q498 S505 D506	Q498-S502 WeakPolarHBondContact O-CB 3.48Å; Q498-S502 PolarHBondContact O-N 2.92Å; S502-S505 WeakPolarHBondContact O-CB 3.45Å; S502-S505 PolarHBondContact O-N 3.35Å; S502-D506 PolarHBondContact O-N 2.93Å; S502-D506 VanDerWaalsContact O-N 3.09Å
503	L	77.4	Confident	78.9	Confident	18 Å²	18	72.6 Å²	72.6	9%	0.094	43%	0.434	C	S	.	.	H	α-helix	trans	-68.6	-38.1	178.3	-175.9	64.9	0	0	0	112.2	A499 G500 E501 S505 D506 I507 L516 K519 A520 F523	A499-L503 PolarHBondContact O-N 3.01Å; A499-L503 VanDerWaalsContact O-N 3.13Å; G500-L503 PolarHBondContact O-N 3.23Å; E501-L503 VanDerWaalsContact C-N 3.35Å; E501-L503 PolarHBondContact O-N 2.84Å; L503-S505 VanDerWaalsContact C-N 3.31Å; L503-S505 PolarHBondContact O-N 3.35Å; L503-D506 PolarHBondContact O-N 3.32Å; L503-I507 HydrophobicContact CG-CD1 4.1Å; L503-I507 VanDerWaalsContact O-CG1 3.3Å; L503-I507 WeakPolarHBondContact O-CG1 3.43Å; L503-I507 PolarHBondContact O-N 2.66Å; L503-L516 HydrophobicContact CD1-CD2 4Å; L503-K519 HydrophobicContact CD1-CB 3.78Å; L503-K519 HydrophobicContact CD1-CD 4.3Å; L503-A520 HydrophobicContact CD2-CB 4.02Å; L503-F523 HydrophobicContact CD2-CB 3.92Å; L503-F523 HydrophobicContact CD2-CD1 4.44Å; L503-F523 HydrophobicContact CD2-CG 4.22Å
504	L	73.4	Confident	78.6	Confident	111 Å²	111	73.3 Å²	73.3	58%	0.581	45%	0.447	S	S	*	.	H	α-helix	trans	-65.3	-36.5	176.1	-163.5	79.7	0	0	0	111.4	G500 E501 I507 S508	G500-L504 WeakPolarHBondContact O-CB 3.16Å; G500-L504 PolarHBondContact O-N 2.86Å; E501-L504 PolarHBondContact O-N 3.49Å; L504-I507 PolarHBondContact O-N 3.17Å; L504-S508 VanDerWaalsContact O-CB 3.31Å; L504-S508 WeakPolarHBondContact O-CB 3.12Å; L504-S508 PolarHBondContact O-N 2.96Å; L504-S508 PolarHBondContact O-OG 2.73Å
505	S	80.2	Confident	78.6	Confident	75 Å²	75	72.5 Å²	72.5	52%	0.524	45%	0.453	S	S	.	.	H	α-helix	trans	-63.1	-44.1	172.6	-177.8	0	0	0	0	111.2	E501 S502 L503 S508 A509	E501-S505 WeakPolarHBondContact O-CB 3.45Å; E501-S505 PolarHBondContact O-N 3.24Å; S502-S505 WeakPolarHBondContact O-CB 3.45Å; S502-S505 PolarHBondContact O-N 3.35Å; L503-S505 VanDerWaalsContact C-N 3.31Å; L503-S505 PolarHBondContact O-N 3.35Å; S505-S508 PolarHBondContact O-N 3.42Å; S505-A509 WeakPolarHBondContact O-CB 3.44Å; S505-A509 PolarHBondContact O-N 2.74Å
506	D	80.4	Confident	78.3	Confident	66 Å²	66	70.2 Å²	70.2	35%	0.353	43%	0.433	S	S	.	.	H	α-helix	trans	-62.8	-42.1	176.2	-69.9	-12.9	0	0	0	112	S502 L503 A509 S510 L516	S502-D506 PolarHBondContact O-N 2.93Å; S502-D506 VanDerWaalsContact O-N 3.09Å; L503-D506 PolarHBondContact O-N 3.32Å; D506-A509 PolarHBondContact O-N 3.4Å; D506-S510 PolarHBondContact O-N 3.49Å; D506-S510 VanDerWaalsContact O-N 3.14Å; D506-S510 PolarHBondContact O-OG 3.42Å; D506-L516 HydrophobicContact CB-CD2 3.85Å
507	I	76.2	Confident	77.7	Confident	43 Å²	43	73.2 Å²	73.2	22%	0.221	45%	0.447	C	S	.	.	H	α-helix	trans	-64.9	-42.1	175.5	-67.8	166.4	0	0	0	111	L503 L504 A509 G511 M512 L516	L503-I507 HydrophobicContact CG-CD1 4.1Å; L503-I507 VanDerWaalsContact O-CG1 3.3Å; L503-I507 WeakPolarHBondContact O-CG1 3.43Å; L503-I507 PolarHBondContact O-N 2.66Å; L504-I507 PolarHBondContact O-N 3.17Å; I507-A509 VanDerWaalsContact C-N 3.29Å; I507-A509 PolarHBondContact O-N 2.98Å; I507-G511 VanDerWaalsContact O-CA 3.28Å; I507-G511 WeakPolarHBondContact O-CA 3.09Å; I507-G511 PolarHBondContact O-N 3.39Å; I507-M512 HydrophobicContact CD1-SD 3.99Å; I507-M512 HydrophobicContact CG1-SD 4Å; I507-M512 HydrophobicContact CG2-SD 4.36Å; I507-L516 HydrophobicContact CG1-CB 4.32Å; I507-L516 HydrophobicContact CG1-CD1 4.05Å; I507-L516 HydrophobicContact CG1-CD2 4.48Å
508	S	73.1	Confident	77.9	Confident	96 Å²	96	77.9 Å²	77.9	67%	0.671	47%	0.465	S	S	*	.	H	α-helix	trans	-66.9	-32	178.7	-58.5	0	0	0	0	112.2	L504 S505	L504-S508 VanDerWaalsContact O-CB 3.31Å; L504-S508 WeakPolarHBondContact O-CB 3.12Å; L504-S508 PolarHBondContact O-N 2.96Å; L504-S508 PolarHBondContact O-OG 2.73Å; S505-S508 PolarHBondContact O-N 3.42Å
509	A	81.2	Confident	77.9	Confident	86 Å²	86	76.8 Å²	76.8	71%	0.711	46%	0.459	S	S	*	.	H	α-helix	trans	-80.6	-33.3	-178.1	0	0	0	0	0	114	S505 D506 I507	S505-A509 WeakPolarHBondContact O-CB 3.44Å; S505-A509 PolarHBondContact O-N 2.74Å; D506-A509 PolarHBondContact O-N 3.4Å; I507-A509 VanDerWaalsContact C-N 3.29Å; I507-A509 PolarHBondContact O-N 2.98Å
510	S	82.3	Confident	77.4	Confident	78 Å²	78	75.1 Å²	75.1	55%	0.545	45%	0.445	S	S	.	.	H	α-helix	trans	-121.3	-5	-171.5	60.7	0	0	0	0	115.3	D506 L516	D506-S510 PolarHBondContact O-N 3.49Å; D506-S510 VanDerWaalsContact O-N 3.14Å; D506-S510 PolarHBondContact O-OG 3.42Å; S510-L516 VanDerWaalsContact OG-CD1 3.29Å; S510-L516 WeakPolarHBondContact OG-CD1 3.37Å
511	G	63.2	Low	77.4	Confident	37 Å²	37	76.9 Å²	76.9	38%	0.381	46%	0.458	S	S	.	.			trans	71.5	163	-168.3	0	0	0	0	0	111.7	I507 N513 L516	I507-G511 VanDerWaalsContact O-CA 3.28Å; I507-G511 WeakPolarHBondContact O-CA 3.09Å; I507-G511 PolarHBondContact O-N 3.39Å; G511-N513 PolarHBondContact O-N 2.88Å; G511-L516 VanDerWaalsContact O-CD1 3.31Å; G511-L516 WeakPolarHBondContact O-CD1 3.11Å
512	M	73.6	Confident	77.6	Confident	103 Å²	103	75.9 Å²	75.9	51%	0.507	45%	0.453	S	S	.	.			trans	-68.1	133.1	178.2	-159.7	65.5	167.7	0	0	110.4	I507 L516 D517 A520	I507-M512 HydrophobicContact CD1-SD 3.99Å; I507-M512 HydrophobicContact CG1-SD 4Å; I507-M512 HydrophobicContact CG2-SD 4.36Å; M512-L516 HydrophobicContact SD-CB 4.1Å; M512-D517 HydrophobicContact CE-CB 3.75Å; M512-D517 WeakPolarHBondContact CE-OD1 3.08Å; M512-A520 HydrophobicContact CE-CB 3.98Å
513	N	82.4	Confident	77.7	Confident	66 Å²	66	75.3 Å²	75.3	35%	0.353	44%	0.442	S	S	.	.			trans	-142.6	168.3	175.1	60.6	59.1	0	0	0	109.4	G511 A515 L516 D517	G511-N513 PolarHBondContact O-N 2.88Å; N513-A515 PolarHBondContact O-N 3.46Å; N513-A515 VanDerWaalsContact O-N 3.14Å; N513-A515 WeakPolarHBondContact OD1-CB 3.06Å; N513-A515 PolarHBondContact OD1-N 3.34Å; N513-L516 CarbonylContact O-C 3.41Å; N513-L516 WeakPolarHBondContact O-CA 3.37Å; N513-L516 PolarHBondContact O-N 3.48Å; N513-L516 PolarHBondContact OD1-N 3.29Å; N513-D517 PolarHBondContact O-N 2.74Å
514	D	77.1	Confident	77.6	Confident	151 Å²	151	78.5 Å²	78.5	81%	0.807	46%	0.458	S	S	*	.	H	α-helix	trans	-54.6	-37.9	-174.4	-61.1	-12.2	0	0	0	113.1	D517 E518	D514-D517 PolarHBondContact O-N 2.99Å; D514-E518 PolarHBondContact O-N 2.92Å
515	A	82.4	Confident	78	Confident	60 Å²	60	80.2 Å²	80.2	50%	0.496	46%	0.461	S	S	.	.	H	α-helix	trans	-70.8	-34.1	178.6	0	0	0	0	0	112.7	N513 K519	N513-A515 PolarHBondContact O-N 3.46Å; N513-A515 VanDerWaalsContact O-N 3.14Å; N513-A515 WeakPolarHBondContact OD1-CB 3.06Å; N513-A515 PolarHBondContact OD1-N 3.34Å; A515-K519 WeakPolarHBondContact O-CG 3.47Å; A515-K519 PolarHBondContact O-N 3.19Å
516	L	79.4	Confident	78.2	Confident	9 Å²	9	82 Å²	82	5%	0.047	46%	0.459	C	S	.	.	H	α-helix	trans	-77.1	-32.3	173.9	-72	176.4	0	0	0	112.5	L503 D506 I507 S510 G511 M512 N513 K519 A520	L503-L516 HydrophobicContact CD1-CD2 4Å; D506-L516 HydrophobicContact CB-CD2 3.85Å; I507-L516 HydrophobicContact CG1-CB 4.32Å; I507-L516 HydrophobicContact CG1-CD1 4.05Å; I507-L516 HydrophobicContact CG1-CD2 4.48Å; S510-L516 VanDerWaalsContact OG-CD1 3.29Å; S510-L516 WeakPolarHBondContact OG-CD1 3.37Å; G511-L516 VanDerWaalsContact O-CD1 3.31Å; G511-L516 WeakPolarHBondContact O-CD1 3.11Å; M512-L516 HydrophobicContact SD-CB 4.1Å; N513-L516 CarbonylContact O-C 3.41Å; N513-L516 WeakPolarHBondContact O-CA 3.37Å; N513-L516 PolarHBondContact O-N 3.48Å; N513-L516 PolarHBondContact OD1-N 3.29Å; L516-K519 HydrophobicContact CD2-CD 4.33Å; L516-K519 PolarHBondContact O-N 3.4Å; L516-A520 VanDerWaalsContact O-CB 3.23Å; L516-A520 WeakPolarHBondContact O-CB 3.24Å; L516-A520 PolarHBondContact O-N 3.45Å
517	D	69.9	Low	78	Confident	95 Å²	95	80.1 Å²	80.1	51%	0.508	45%	0.453	S	S	.	.	H	α-helix	trans	-63.9	-44.4	172.2	-168.9	60.2	0	0	0	111.6	M512 N513 D514 K519 A520 A521	M512-D517 HydrophobicContact CE-CB 3.75Å; M512-D517 WeakPolarHBondContact CE-OD1 3.08Å; N513-D517 PolarHBondContact O-N 2.74Å; D514-D517 PolarHBondContact O-N 2.99Å; D517-K519 PolarHBondContact O-N 3.29Å; D517-A520 PolarHBondContact O-N 3.45Å; D517-A521 WeakPolarHBondContact O-CB 3.38Å; D517-A521 PolarHBondContact O-N 3.24Å
518	E	81.6	Confident	78	Confident	145 Å²	145	84.7 Å²	84.7	68%	0.678	47%	0.471	S	S	*	.	H	α-helix	trans	-60.8	-45.9	174.2	-171.3	173.9	-165.5	0	0	111.6	D514 A520 A521 E522	D514-E518 PolarHBondContact O-N 2.92Å; E518-A520 VanDerWaalsContact C-N 3.34Å; E518-A520 PolarHBondContact O-N 2.92Å; E518-A521 PolarHBondContact O-N 2.83Å; E518-E522 WeakPolarHBondContact O-CB 3.46Å; E518-E522 PolarHBondContact O-N 2.82Å
519	K	83	Confident	78.5	Confident	112 Å²	112	85.4 Å²	85.4	49%	0.487	47%	0.467	S	S	.	.	H	α-helix	trans	-62.3	-39.1	174.6	-76.5	178.3	177.2	-179.1	0	112.5	L503 A515 L516 D517 E522 F523	L503-K519 HydrophobicContact CD1-CB 3.78Å; L503-K519 HydrophobicContact CD1-CD 4.3Å; A515-K519 WeakPolarHBondContact O-CG 3.47Å; A515-K519 PolarHBondContact O-N 3.19Å; L516-K519 HydrophobicContact CD2-CD 4.33Å; L516-K519 PolarHBondContact O-N 3.4Å; D517-K519 PolarHBondContact O-N 3.29Å; K519-E522 PolarHBondContact O-N 2.82Å; K519-F523 VanDerWaalsContact O-CB 3.28Å; K519-F523 WeakPolarHBondContact O-CB 3.33Å; K519-F523 PolarHBondContact O-N 3.35Å
520	A	71.4	Confident	78.7	Confident	14 Å²	14	83.3 Å²	83.3	12%	0.116	45%	0.445	C	S	.	.	H	α-helix	trans	-67.5	-43.8	177.4	0	0	0	0	0	111.8	L503 M512 L516 D517 E518 E522 F523 I524	L503-A520 HydrophobicContact CD2-CB 4.02Å; M512-A520 HydrophobicContact CE-CB 3.98Å; L516-A520 VanDerWaalsContact O-CB 3.23Å; L516-A520 WeakPolarHBondContact O-CB 3.24Å; L516-A520 PolarHBondContact O-N 3.45Å; D517-A520 PolarHBondContact O-N 3.45Å; E518-A520 VanDerWaalsContact C-N 3.34Å; E518-A520 PolarHBondContact O-N 2.92Å; A520-E522 VanDerWaalsContact C-N 3.35Å; A520-E522 PolarHBondContact O-N 3.48Å; A520-F523 PolarHBondContact O-N 2.89Å; A520-I524 WeakPolarHBondContact O-CB 3.38Å; A520-I524 WeakPolarHBondContact O-CG1 3.48Å; A520-I524 PolarHBondContact O-N 3.47Å
521	A	73	Confident	78.5	Confident	55 Å²	55	85.5 Å²	85.5	46%	0.455	45%	0.447	S	S	.	.	H	α-helix	trans	-61.1	-43.8	174.4	0	0	0	0	0	111.4	D517 E518 I524 K525	D517-A521 WeakPolarHBondContact O-CB 3.38Å; D517-A521 PolarHBondContact O-N 3.24Å; E518-A521 PolarHBondContact O-N 2.83Å; A521-I524 PolarHBondContact O-N 3.28Å; A521-K525 WeakPolarHBondContact O-CB 3.34Å; A521-K525 PolarHBondContact O-N 3.23Å
522	E	84.6	Confident	79.4	Confident	103 Å²	103	90.8 Å²	90.8	48%	0.481	46%	0.459	S	S	.	.	H	α-helix	trans	-65.6	-42.1	176.9	-158.4	-168.9	166.6	0	0	111.9	E518 K519 A520 K525 K526	E518-E522 WeakPolarHBondContact O-CB 3.46Å; E518-E522 PolarHBondContact O-N 2.82Å; K519-E522 PolarHBondContact O-N 2.82Å; A520-E522 VanDerWaalsContact C-N 3.35Å; A520-E522 PolarHBondContact O-N 3.48Å; E522-K525 PolarHBondContact O-N 3.14Å; E522-K526 WeakPolarHBondContact O-CG 3.17Å; E522-K526 PolarHBondContact O-N 2.64Å; E522-K526 WeakPolarHBondContact OE1-CE 3.33Å; E522-K526 IonicContact OE1-NZ 3.9Å; E522-K526 PolarHBondContact OE1-NZ 3.44Å
523	F	86.8	Confident	80	Confident	58 Å²	58	88.2 Å²	88.2	25%	0.254	45%	0.454	S	S	.	.	H	α-helix	trans	-60.6	-49.4	174.6	173.2	-99.4	0	0	0	111.7	C496 A499 L503 K519 A520 K525 K526 A527	C496-F523 WeakPolarHBondContact O-CE2 3.46Å; A499-F523 HydrophobicContact CB-CD2 4.3Å; A499-F523 HydrophobicContact CB-CE2 3.94Å; L503-F523 HydrophobicContact CD2-CB 3.92Å; L503-F523 HydrophobicContact CD2-CD1 4.44Å; L503-F523 HydrophobicContact CD2-CG 4.22Å; K519-F523 VanDerWaalsContact O-CB 3.28Å; K519-F523 WeakPolarHBondContact O-CB 3.33Å; K519-F523 PolarHBondContact O-N 3.35Å; A520-F523 PolarHBondContact O-N 2.89Å; F523-K525 VanDerWaalsContact C-N 3.28Å; F523-K525 PolarHBondContact O-N 3Å; F523-K526 PolarHBondContact O-N 2.86Å; F523-K526 VanDerWaalsContact O-N 3.12Å; F523-A527 WeakPolarHBondContact O-CB 3.41Å; F523-A527 PolarHBondContact O-N 3.1Å
524	I	74.5	Confident	80	Confident	86 Å²	86	87.3 Å²	87.3	44%	0.441	45%	0.448	S	S	.	.	H	α-helix	trans	-59.3	-41.2	178.6	-69.5	165.2	0	0	0	110.7	A520 A521 A527 K528	A520-I524 WeakPolarHBondContact O-CB 3.38Å; A520-I524 WeakPolarHBondContact O-CG1 3.48Å; A520-I524 PolarHBondContact O-N 3.47Å; A521-I524 PolarHBondContact O-N 3.28Å; I524-A527 PolarHBondContact O-N 3.28Å; I524-K528 HydrophobicContact CG2-CD 4.38Å; I524-K528 WeakPolarHBondContact O-CG 3.42Å; I524-K528 PolarHBondContact O-N 3.4Å
525	K	81	Confident	80.1	Confident	146 Å²	146	82.3 Å²	82.3	64%	0.635	42%	0.423	S	S	*	.	H	α-helix	trans	-61.9	-45.5	175.9	-174.5	179.9	177.6	-178.3	0	111.6	A521 E522 F523 L529	A521-K525 WeakPolarHBondContact O-CB 3.34Å; A521-K525 PolarHBondContact O-N 3.23Å; E522-K525 PolarHBondContact O-N 3.14Å; F523-K525 VanDerWaalsContact C-N 3.28Å; F523-K525 PolarHBondContact O-N 3Å; K525-L529 WeakPolarHBondContact O-CG 3.43Å; K525-L529 PolarHBondContact O-N 3.19Å
526	K	85.1	Confident	80	Confident	113 Å²	113	84.3 Å²	84.3	49%	0.491	42%	0.422	S	S	.	.	H	α-helix	trans	-66.6	-40.1	176.7	-73.3	176.3	-175.3	163.8	0	112	E522 F523 L529 T530	E522-K526 WeakPolarHBondContact O-CG 3.17Å; E522-K526 PolarHBondContact O-N 2.64Å; E522-K526 WeakPolarHBondContact OE1-CE 3.33Å; E522-K526 IonicContact OE1-NZ 3.9Å; E522-K526 PolarHBondContact OE1-NZ 3.44Å; F523-K526 PolarHBondContact O-N 2.86Å; F523-K526 VanDerWaalsContact O-N 3.12Å; K526-L529 PolarHBondContact O-N 2.8Å; K526-T530 PolarHBondContact O-N 3.49Å; K526-T530 PolarHBondContact O-OG1 2.92Å; K526-T530 VanDerWaalsContact O-OG1 3.06Å
527	A	77.3	Confident	79.9	Confident	27 Å²	27	88.1 Å²	88.1	22%	0.223	44%	0.439	C	S	.	.	H	α-helix	trans	-60.8	-45.5	177.4	0	0	0	0	0	111.8	F523 I524 L529 T530 E531	F523-A527 WeakPolarHBondContact O-CB 3.41Å; F523-A527 PolarHBondContact O-N 3.1Å; I524-A527 PolarHBondContact O-N 3.28Å; A527-L529 VanDerWaalsContact C-N 3.34Å; A527-L529 PolarHBondContact O-N 3.16Å; A527-T530 PolarHBondContact O-N 3.03Å; A527-E531 PolarHBondContact O-N 2.95Å
528	K	76	Confident	80	Confident	139 Å²	139	90.7 Å²	90.7	60%	0.604	44%	0.441	S	S	*	.	H	α-helix	trans	-61.5	-38.6	175	-73.6	178.3	178.8	178.5	0	113	I524 K532	I524-K528 HydrophobicContact CG2-CD 4.38Å; I524-K528 WeakPolarHBondContact O-CG 3.42Å; I524-K528 PolarHBondContact O-N 3.4Å; K528-K532 WeakPolarHBondContact O-CB 3.19Å; K528-K532 PolarHBondContact O-N 3.41Å
529	L	83.8	Confident	79.6	Confident	111 Å²	111	88.6 Å²	88.6	58%	0.581	43%	0.43	S	S	*	.	H	α-helix	trans	-66.4	-42.1	175.4	-73.9	169.7	0	0	0	111.7	K525 K526 A527 K532 A533	K525-L529 WeakPolarHBondContact O-CG 3.43Å; K525-L529 PolarHBondContact O-N 3.19Å; K526-L529 PolarHBondContact O-N 2.8Å; A527-L529 VanDerWaalsContact C-N 3.34Å; A527-L529 PolarHBondContact O-N 3.16Å; L529-K532 PolarHBondContact O-N 2.88Å; L529-A533 PolarHBondContact O-N 3.23Å
530	T	84.2	Confident	79.1	Confident	41 Å²	41	85 Å²	85	25%	0.252	43%	0.425	S	S	.	.	H	α-helix	trans	-62.5	-44.5	175	-59.1	0	0	0	0	111.3	K526 A527 K532 A533 M534	K526-T530 PolarHBondContact O-N 3.49Å; K526-T530 PolarHBondContact O-OG1 2.92Å; K526-T530 VanDerWaalsContact O-OG1 3.06Å; A527-T530 PolarHBondContact O-N 3.03Å; T530-K532 PolarHBondContact O-N 2.89Å; T530-A533 PolarHBondContact O-N 3.29Å; T530-M534 HydrophobicContact CG2-CG 4.4Å; T530-M534 HydrophobicContact CG2-SD 4.01Å; T530-M534 WeakPolarHBondContact O-CB 2.82Å; T530-M534 VanDerWaalsContact O-CG 3.28Å; T530-M534 WeakPolarHBondContact O-CG 3.43Å; T530-M534 PolarHBondContact O-N 3.01Å
531	E	78.5	Confident	78.9	Confident	124 Å²	124	85.6 Å²	85.6	58%	0.579	43%	0.427	S	S	*	.	H	α-helix	trans	-59.3	-45.2	175.5	-174.9	-170.1	-172.7	0	0	111.9	A527 A533 M534 T535	A527-E531 PolarHBondContact O-N 2.95Å; E531-A533 PolarHBondContact O-N 2.77Å; E531-M534 PolarHBondContact O-N 2.97Å; E531-T535 WeakPolarHBondContact O-CB 3.23Å; E531-T535 PolarHBondContact O-N 3.29Å; E531-T535 PolarHBondContact O-OG1 3.06Å
532	K	82	Confident	78.7	Confident	148 Å²	148	85.8 Å²	85.8	64%	0.643	42%	0.423	S	S	*	.	H	α-helix	trans	-61.6	-43.2	176.9	-170.2	176.6	179.8	179.6	0	111.6	K528 L529 T530 T535 E536	K528-K532 WeakPolarHBondContact O-CB 3.19Å; K528-K532 PolarHBondContact O-N 3.41Å; L529-K532 PolarHBondContact O-N 2.88Å; T530-K532 PolarHBondContact O-N 2.89Å; K532-T535 PolarHBondContact O-N 2.95Å; K532-E536 PolarHBondContact O-N 2.87Å
533	A	84.9	Confident	77.9	Confident	49 Å²	49	86.8 Å²	86.8	41%	0.405	43%	0.427	S	S	.	.	H	α-helix	trans	-65.7	-39.8	176.1	0	0	0	0	0	112.5	L529 T530 E531 T535 E536 K537	L529-A533 PolarHBondContact O-N 3.23Å; T530-A533 PolarHBondContact O-N 3.29Å; E531-A533 PolarHBondContact O-N 2.77Å; A533-T535 VanDerWaalsContact C-N 3.32Å; A533-E536 PolarHBondContact O-N 3.32Å; A533-K537 WeakPolarHBondContact O-CG 3.38Å; A533-K537 PolarHBondContact O-N 3.24Å; A533-K537 VanDerWaalsContact O-N 3.15Å
534	M	82.8	Confident	76.8	Confident	47 Å²	47	85 Å²	85	23%	0.232	42%	0.422	C	S	.	.	H	α-helix	trans	-64.4	-37.7	174.1	-72.4	174.7	67.9	0	0	111.8	N489 T530 E531 K537 R538	N489-M534 HydrophobicContact CB-CE 3.97Å; N489-M534 HydrophobicContact CB-CG 4.31Å; N489-M534 PolarHBondContact ND2-O 3.05Å; N489-M534 WeakPolarHBondContact OD1-CA 3.49Å; T530-M534 HydrophobicContact CG2-CG 4.4Å; T530-M534 HydrophobicContact CG2-SD 4.01Å; T530-M534 WeakPolarHBondContact O-CB 2.82Å; T530-M534 VanDerWaalsContact O-CG 3.28Å; T530-M534 WeakPolarHBondContact O-CG 3.43Å; T530-M534 PolarHBondContact O-N 3.01Å; E531-M534 PolarHBondContact O-N 2.97Å; M534-K537 PolarHBondContact O-N 2.78Å; M534-R538 PolarHBondContact O-N 3.37Å
535	T	79	Confident	76.3	Confident	46 Å²	46	87.8 Å²	87.8	28%	0.282	43%	0.43	S	S	.	.	H	α-helix	trans	-67.4	-40.7	177.3	-57.6	0	0	0	0	111.8	E531 K532 A533 R538 K539	E531-T535 WeakPolarHBondContact O-CB 3.23Å; E531-T535 PolarHBondContact O-N 3.29Å; E531-T535 PolarHBondContact O-OG1 3.06Å; K532-T535 PolarHBondContact O-N 2.95Å; A533-T535 VanDerWaalsContact C-N 3.32Å; T535-R538 WeakPolarHBondContact O-CB 3.4Å; T535-R538 PolarHBondContact O-N 3.29Å; T535-R538 VanDerWaalsContact O-N 3.14Å; T535-K539 PolarHBondContact O-N 2.77Å
536	E	80.9	Confident	75.8	Confident	102 Å²	102	83.5 Å²	83.5	48%	0.477	42%	0.415	S	S	.	.	H	α-helix	trans	-62.4	-42.6	173.6	-79.2	-56.5	152.7	0	0	112	K532 A533 R538 K539	K532-E536 PolarHBondContact O-N 2.87Å; A533-E536 PolarHBondContact O-N 3.32Å; E536-R538 VanDerWaalsContact C-N 3.27Å; E536-R538 PolarHBondContact O-N 2.84Å; E536-K539 WeakPolarHBondContact O-CB 3.49Å; E536-K539 PolarHBondContact O-N 3.3Å; E536-K539 WeakPolarHBondContact OE1-CE 3.24Å; E536-K539 IonicContact OE1-NZ 3.88Å; E536-K539 PolarHBondContact OE1-NZ 2.83Å; E536-K539 WeakPolarHBondContact OE2-CD 3.44Å; E536-K539 IonicContact OE2-NZ 2.64Å
537	K	77.8	Confident	74.9	Confident	90 Å²	90	81.9 Å²	81.9	39%	0.391	41%	0.411	S	S	.	.	H	α-helix	trans	-62.4	-35.6	172.6	-70.1	170.2	178.7	176.9	0	112	N489 A533 M534	N489-K537 WeakPolarHBondContact OD1-CD 3.4Å; A533-K537 WeakPolarHBondContact O-CG 3.38Å; A533-K537 PolarHBondContact O-N 3.24Å; A533-K537 VanDerWaalsContact O-N 3.15Å; M534-K537 PolarHBondContact O-N 2.78Å
538	R	72.1	Confident	74.2	Confident	149 Å²	149	82.5 Å²	82.5	56%	0.562	41%	0.412	S	S	*	.	H	α-helix	trans	-66.2	-36.2	175.2	-168	-172	78.9	-165.7	2.2	112.4	M534 T535 E536 G540 V541 T542	M534-R538 PolarHBondContact O-N 3.37Å; T535-R538 WeakPolarHBondContact O-CB 3.4Å; T535-R538 PolarHBondContact O-N 3.29Å; T535-R538 VanDerWaalsContact O-N 3.14Å; E536-R538 VanDerWaalsContact C-N 3.27Å; E536-R538 PolarHBondContact O-N 2.84Å; R538-G540 VanDerWaalsContact C-N 3.25Å; R538-G540 PolarHBondContact O-N 2.67Å; R538-V541 CarbonylContact O-C 3.48Å; R538-V541 WeakPolarHBondContact O-CA 3.37Å; R538-V541 WeakPolarHBondContact O-CB 3.42Å; R538-V541 PolarHBondContact O-N 3.48Å; R538-T542 PolarHBondContact O-N 3.48Å; R538-T542 PolarHBondContact O-OG1 3.37Å; R538-T542 VanDerWaalsContact O-OG1 3.14Å
539	K	73.6	Confident	73.9	Confident	100 Å²	100	83 Å²	83	44%	0.435	41%	0.41	S	S	.	.	H	α-helix	trans	-55.3	-41.1	-178.9	-77	-174.2	-172.6	165.4	0	112.3	T535 E536 V541 T542 Q543	T535-K539 PolarHBondContact O-N 2.77Å; E536-K539 WeakPolarHBondContact O-CB 3.49Å; E536-K539 PolarHBondContact O-N 3.3Å; E536-K539 WeakPolarHBondContact OE1-CE 3.24Å; E536-K539 IonicContact OE1-NZ 3.88Å; E536-K539 PolarHBondContact OE1-NZ 2.83Å; E536-K539 WeakPolarHBondContact OE2-CD 3.44Å; E536-K539 IonicContact OE2-NZ 2.64Å; K539-V541 VanDerWaalsContact C-N 3.34Å; K539-V541 PolarHBondContact O-N 3.04Å; K539-T542 PolarHBondContact O-N 3.01Å; K539-Q543 WeakPolarHBondContact O-CB 3.45Å; K539-Q543 VanDerWaalsContact O-CG 3.29Å; K539-Q543 WeakPolarHBondContact O-CG 3.42Å; K539-Q543 PolarHBondContact O-N 3.17Å
540	G	71.4	Confident	73.2	Confident	38 Å²	38	85 Å²	85	39%	0.392	41%	0.413	S	S	.	.	H	α-helix	trans	-57.2	-47.4	173.7	0	0	0	0	0	111.7	R538 Q543 V544	R538-G540 VanDerWaalsContact C-N 3.25Å; R538-G540 PolarHBondContact O-N 2.67Å; G540-Q543 WeakPolarHBondContact O-CB 3.43Å; G540-Q543 PolarHBondContact O-N 2.99Å; G540-V544 WeakPolarHBondContact O-CG2 3.12Å; G540-V544 PolarHBondContact O-N 2.95Å; G540-V544 VanDerWaalsContact O-N 3.1Å
541	V	67.1	Low	72.2	Confident	25 Å²	25	83.4 Å²	83.4	15%	0.152	41%	0.405	C	S	.	.	H	α-helix	trans	-65.3	-41.4	177.9	-176.6	0	0	0	0	112.4	T482 A485 R538 K539 Q543 V544 F545	T482-V541 HydrophobicContact CG2-CB 4.41Å; T482-V541 HydrophobicContact CG2-CG1 3.67Å; T482-V541 HydrophobicContact CG2-CG2 3.94Å; A485-V541 HydrophobicContact CB-CG2 4.15Å; R538-V541 CarbonylContact O-C 3.48Å; R538-V541 WeakPolarHBondContact O-CA 3.37Å; R538-V541 WeakPolarHBondContact O-CB 3.42Å; R538-V541 PolarHBondContact O-N 3.48Å; K539-V541 VanDerWaalsContact C-N 3.34Å; K539-V541 PolarHBondContact O-N 3.04Å; V541-Q543 VanDerWaalsContact C-N 3.32Å; V541-Q543 PolarHBondContact O-N 3.5Å; V541-V544 WeakPolarHBondContact O-CB 3.49Å; V541-V544 PolarHBondContact O-N 2.92Å; V541-V544 VanDerWaalsContact O-N 3.13Å; V541-F545 HydrophobicContact CG1-CD2 4.27Å; V541-F545 HydrophobicContact CG1-CE2 4.21Å; V541-F545 PolarHBondContact O-N 3.14Å; V541-F545 VanDerWaalsContact O-N 3.12Å
542	T	69.9	Low	71.5	Confident	60 Å²	60	83.1 Å²	83.1	37%	0.368	40%	0.402	S	S	.	.	H	α-helix	trans	-63.9	-38.3	176.1	-49.6	0	0	0	0	111.4	R538 K539 V544 F545 D546	R538-T542 PolarHBondContact O-N 3.48Å; R538-T542 PolarHBondContact O-OG1 3.37Å; R538-T542 VanDerWaalsContact O-OG1 3.14Å; K539-T542 PolarHBondContact O-N 3.01Å; T542-V544 VanDerWaalsContact C-N 3.3Å; T542-V544 PolarHBondContact O-N 3.21Å; T542-F545 PolarHBondContact O-N 2.96Å; T542-D546 PolarHBondContact O-N 3.3Å
543	Q	67.5	Low	70.8	Confident	123 Å²	123	79.6 Å²	79.6	58%	0.575	39%	0.394	S	S	*	.	H	α-helix	trans	-62.9	-35.6	172.8	-73	173.2	-0.1	0	0	111.8	K539 G540 V541 D546 I547	K539-Q543 WeakPolarHBondContact O-CB 3.45Å; K539-Q543 VanDerWaalsContact O-CG 3.29Å; K539-Q543 WeakPolarHBondContact O-CG 3.42Å; K539-Q543 PolarHBondContact O-N 3.17Å; G540-Q543 WeakPolarHBondContact O-CB 3.43Å; G540-Q543 PolarHBondContact O-N 2.99Å; V541-Q543 VanDerWaalsContact C-N 3.32Å; V541-Q543 PolarHBondContact O-N 3.5Å; Q543-D546 PolarHBondContact O-N 3.26Å; Q543-I547 WeakPolarHBondContact O-CB 3.45Å; Q543-I547 WeakPolarHBondContact O-CD1 3.19Å; Q543-I547 WeakPolarHBondContact O-CG1 3.05Å; Q543-I547 PolarHBondContact O-N 3.32Å
544	V	62.6	Low	69.7	Low	22 Å²	22	80.8 Å²	80.8	13%	0.133	39%	0.392	C	S	.	.	H	α-helix	trans	-61.5	-48.1	172.8	-177.6	0	0	0	0	111	L478 G540 V541 T542 D546 I547 V548	L478-V544 HydrophobicContact CB-CG1 4.09Å; L478-V544 HydrophobicContact CB-CG2 3.99Å; L478-V544 HydrophobicContact CD1-CG1 4.26Å; L478-V544 HydrophobicContact CD1-CG2 4.15Å; L478-V544 HydrophobicContact CD2-CG2 3.88Å; L478-V544 HydrophobicContact CG-CG2 4.22Å; G540-V544 WeakPolarHBondContact O-CG2 3.12Å; G540-V544 PolarHBondContact O-N 2.95Å; G540-V544 VanDerWaalsContact O-N 3.1Å; V541-V544 WeakPolarHBondContact O-CB 3.49Å; V541-V544 PolarHBondContact O-N 2.92Å; V541-V544 VanDerWaalsContact O-N 3.13Å; T542-V544 VanDerWaalsContact C-N 3.3Å; T542-V544 PolarHBondContact O-N 3.21Å; V544-D546 VanDerWaalsContact C-N 3.27Å; V544-D546 PolarHBondContact O-N 2.84Å; V544-I547 PolarHBondContact O-N 3.45Å; V544-V548 HydrophobicContact CG1-CG2 4.18Å; V544-V548 WeakPolarHBondContact O-CB 3.36Å; V544-V548 VanDerWaalsContact O-CG2 3.24Å; V544-V548 WeakPolarHBondContact O-CG2 3.41Å; V544-V548 PolarHBondContact O-N 2.96Å
545	F	65.2	Low	68.7	Low	143 Å²	143	82.3 Å²	82.3	63%	0.627	40%	0.399	S	S	*	.	H	α-helix	trans	-61.3	-36.6	176.7	-86.2	-77.5	0	0	0	112.4	V541 T542 V548 R549	V541-F545 HydrophobicContact CG1-CD2 4.27Å; V541-F545 HydrophobicContact CG1-CE2 4.21Å; V541-F545 PolarHBondContact O-N 3.14Å; V541-F545 VanDerWaalsContact O-N 3.12Å; T542-F545 PolarHBondContact O-N 2.96Å; F545-V548 PolarHBondContact O-N 3.23Å; F545-R549 WeakPolarHBondContact O-CB 3.11Å; F545-R549 PolarHBondContact O-N 2.9Å
546	D	69.3	Low	68	Low	57 Å²	57	85.6 Å²	85.6	31%	0.305	41%	0.411	S	S	.	.	H	α-helix	trans	-69.1	-38.7	175	-79.7	-12.9	0	0	0	112.9	T542 Q543 V544 R549 K550	T542-D546 PolarHBondContact O-N 3.3Å; Q543-D546 PolarHBondContact O-N 3.26Å; V544-D546 VanDerWaalsContact C-N 3.27Å; V544-D546 PolarHBondContact O-N 2.84Å; D546-R549 IonicContact OD1-CZ 2.71Å; D546-R549 IonicContact OD1-NE 2.68Å; D546-R549 PolarHBondContact OD1-NE 2.93Å; D546-R549 IonicContact OD1-NH2 2.99Å; D546-R549 PolarHBondContact OD1-NH2 2.93Å; D546-R549 IonicContact OD2-NH2 3.42Å; D546-K550 VanDerWaalsContact O-CB 3.23Å; D546-K550 WeakPolarHBondContact O-CB 3.29Å; D546-K550 VanDerWaalsContact O-CG 3.23Å; D546-K550 WeakPolarHBondContact O-CG 3.33Å; D546-K550 PolarHBondContact O-N 3.14Å
547	I	66.1	Low	67.1	Low	79 Å²	79	82.8 Å²	82.8	41%	0.405	40%	0.403	S	S	.	.	H	α-helix	trans	-65.9	-43.8	174.5	-70.2	164.3	0	0	0	110	Q543 V544 K550 G551	Q543-I547 WeakPolarHBondContact O-CB 3.45Å; Q543-I547 WeakPolarHBondContact O-CD1 3.19Å; Q543-I547 WeakPolarHBondContact O-CG1 3.05Å; Q543-I547 PolarHBondContact O-N 3.32Å; V544-I547 PolarHBondContact O-N 3.45Å; I547-K550 PolarHBondContact O-N 2.95Å; I547-G551 PolarHBondContact O-N 2.98Å
548	V	64	Low	66.1	Low	40 Å²	40	81.6 Å²	81.6	24%	0.242	40%	0.4	C	S	.	.	H	α-helix	trans	-64.2	-48	177.3	171.5	0	0	0	0	110.3	I475 V544 F545 K550 G551 F552	I475-V548 HydrophobicContact CG1-CG2 4.48Å; V544-V548 HydrophobicContact CG1-CG2 4.18Å; V544-V548 WeakPolarHBondContact O-CB 3.36Å; V544-V548 VanDerWaalsContact O-CG2 3.24Å; V544-V548 WeakPolarHBondContact O-CG2 3.41Å; V544-V548 PolarHBondContact O-N 2.96Å; F545-V548 PolarHBondContact O-N 3.23Å; V548-K550 PolarHBondContact O-N 3.03Å; V548-G551 CarbonylContact O-C 3.56Å; V548-G551 WeakPolarHBondContact O-CA 3.38Å; V548-G551 PolarHBondContact O-N 3.38Å; V548-G551 VanDerWaalsContact O-N 3.12Å; V548-F552 HydrophobicContact CG1-CD2 3.59Å; V548-F552 HydrophobicContact CG1-CE2 3.44Å; V548-F552 VanDerWaalsContact CG1-CE2 3.44Å; V548-F552 WeakPolarHBondContact O-CD2 3.25Å; V548-F552 PolarHBondContact O-N 2.78Å
549	R	68.5	Low	65.2	Low	150 Å²	150	80.1 Å²	80.1	57%	0.566	40%	0.403	S	S	*	.	H	α-helix	trans	-58.3	-48.6	174.9	179.6	172.5	58.6	136.3	-1.9	111.3	F545 D546 G551 F552 T553	F545-R549 WeakPolarHBondContact O-CB 3.11Å; F545-R549 PolarHBondContact O-N 2.9Å; D546-R549 IonicContact OD1-CZ 2.71Å; D546-R549 IonicContact OD1-NE 2.68Å; D546-R549 PolarHBondContact OD1-NE 2.93Å; D546-R549 IonicContact OD1-NH2 2.99Å; D546-R549 PolarHBondContact OD1-NH2 2.93Å; D546-R549 IonicContact OD2-NH2 3.42Å; R549-G551 VanDerWaalsContact C-N 3.28Å; R549-G551 PolarHBondContact O-N 3.43Å; R549-F552 PolarHBondContact O-N 3.06Å; R549-T553 WeakPolarHBondContact O-CB 3.43Å; R549-T553 PolarHBondContact O-N 3.12Å; R549-T553 PolarHBondContact O-OG1 3.46Å
550	K	68.8	Low	64.3	Low	151 Å²	151	77.2 Å²	77.2	66%	0.657	40%	0.395	S	S	*	.	H	α-helix	trans	-60.5	-38.1	174.7	-78	176.2	-179.7	178.1	0	111.9	D546 I547 V548 M554	D546-K550 VanDerWaalsContact O-CB 3.23Å; D546-K550 WeakPolarHBondContact O-CB 3.29Å; D546-K550 VanDerWaalsContact O-CG 3.23Å; D546-K550 WeakPolarHBondContact O-CG 3.33Å; D546-K550 PolarHBondContact O-N 3.14Å; I547-K550 PolarHBondContact O-N 2.95Å; V548-K550 PolarHBondContact O-N 3.03Å; K550-M554 WeakPolarHBondContact O-CB 3.24Å; K550-M554 PolarHBondContact O-N 3.4Å
551	G	64.5	Low	63.8	Low	8 Å²	8	78.2 Å²	78.2	8%	0.082	40%	0.399	C	S	.	.	H	α-helix	trans	-61.2	-50.1	174.1	0	0	0	0	0	112.1	I547 V548 R549 M554 M555	I547-G551 PolarHBondContact O-N 2.98Å; V548-G551 CarbonylContact O-C 3.56Å; V548-G551 WeakPolarHBondContact O-CA 3.38Å; V548-G551 PolarHBondContact O-N 3.38Å; V548-G551 VanDerWaalsContact O-N 3.12Å; R549-G551 VanDerWaalsContact C-N 3.28Å; R549-G551 PolarHBondContact O-N 3.43Å; G551-M554 PolarHBondContact O-N 2.91Å; G551-M555 WeakPolarHBondContact O-CB 2.94Å; G551-M555 WeakPolarHBondContact O-CE 3.29Å; G551-M555 VanDerWaalsContact O-CG 3.29Å; G551-M555 WeakPolarHBondContact O-CG 3.34Å; G551-M555 PolarHBondContact O-N 3.25Å
552	F	64.2	Low	63.6	Low	118 Å²	118	86.2 Å²	86.2	52%	0.518	43%	0.432	S	S	.	.	H	α-helix	trans	-62.1	-50.3	175.4	-80.1	-71.7	0	0	0	111.9	V548 R549 M554 M555 E556	V548-F552 HydrophobicContact CG1-CD2 3.59Å; V548-F552 HydrophobicContact CG1-CE2 3.44Å; V548-F552 VanDerWaalsContact CG1-CE2 3.44Å; V548-F552 WeakPolarHBondContact O-CD2 3.25Å; V548-F552 PolarHBondContact O-N 2.78Å; R549-F552 PolarHBondContact O-N 3.06Å; F552-M554 VanDerWaalsContact C-N 3.27Å; F552-M554 PolarHBondContact O-N 3.35Å; F552-M555 HydrophobicContact CD1-CE 4.01Å; F552-M555 HydrophobicContact CE1-CE 4.33Å; F552-M555 HydrophobicContact CG-CE 4.33Å; F552-M555 CarbonylContact O-C 3.46Å; F552-M555 PolarHBondContact O-N 3.11Å; F552-M555 VanDerWaalsContact O-N 3.13Å; F552-E556 WeakPolarHBondContact O-CB 3.49Å; F552-E556 VanDerWaalsContact O-CG 3.26Å; F552-E556 WeakPolarHBondContact O-CG 3.45Å; F552-E556 PolarHBondContact O-N 3.27Å
553	T	67.2	Low	63.4	Low	75 Å²	75	85.4 Å²	85.4	46%	0.46	43%	0.425	S	S	.	.	H	α-helix	trans	-60.7	-36.8	177.7	-52.2	0	0	0	0	111.9	R549 S557	R549-T553 WeakPolarHBondContact O-CB 3.43Å; R549-T553 PolarHBondContact O-N 3.12Å; R549-T553 PolarHBondContact O-OG1 3.46Å; T553-S557 VanDerWaalsContact O-CB 3.29Å; T553-S557 WeakPolarHBondContact O-CB 3.48Å; T553-S557 PolarHBondContact O-N 3.13Å
554	M	62.1	Low	63.4	Low	74 Å²	74	83.5 Å²	83.5	37%	0.365	42%	0.422	S	S	.	.	H	α-helix	trans	-65	-49.9	174	-172.1	-175.5	77.3	0	0	110.6	I471 K550 G551 F552 E556 S557 L558	I471-M554 HydrophobicContact CD1-CE 3.52Å; K550-M554 WeakPolarHBondContact O-CB 3.24Å; K550-M554 PolarHBondContact O-N 3.4Å; G551-M554 PolarHBondContact O-N 2.91Å; F552-M554 VanDerWaalsContact C-N 3.27Å; F552-M554 PolarHBondContact O-N 3.35Å; M554-E556 VanDerWaalsContact C-N 3.35Å; M554-E556 PolarHBondContact O-N 3.45Å; M554-S557 PolarHBondContact O-N 3.35Å; M554-S557 PolarHBondContact O-OG 3.41Å; M554-L558 HydrophobicContact CG-CD1 4.4Å; M554-L558 VanDerWaalsContact O-CG 3.27Å; M554-L558 WeakPolarHBondContact O-CG 3.3Å; M554-L558 PolarHBondContact O-N 3.03Å
555	M	61.7	Low	63.3	Low	78 Å²	78	88 Å²	88	38%	0.384	45%	0.445	S	S	.	.	H	α-helix	trans	-59.2	-42.6	176.9	-72.8	-175.3	-72.8	0	0	112.3	G551 F552 L558	G551-M555 WeakPolarHBondContact O-CB 2.94Å; G551-M555 WeakPolarHBondContact O-CE 3.29Å; G551-M555 VanDerWaalsContact O-CG 3.29Å; G551-M555 WeakPolarHBondContact O-CG 3.34Å; G551-M555 PolarHBondContact O-N 3.25Å; F552-M555 HydrophobicContact CD1-CE 4.01Å; F552-M555 HydrophobicContact CE1-CE 4.33Å; F552-M555 HydrophobicContact CG-CE 4.33Å; F552-M555 CarbonylContact O-C 3.46Å; F552-M555 PolarHBondContact O-N 3.11Å; F552-M555 VanDerWaalsContact O-N 3.13Å; M555-L558 PolarHBondContact O-N 3.3Å
556	E	64	Low	63.1	Low	115 Å²	115	81.3 Å²	81.3	54%	0.537	42%	0.416	S	S	.	.	H	α-helix	trans	-64	-43.9	174.8	-72.9	168.6	-179.2	0	0	111.4	F552 M554 L558 I559 S560	F552-E556 WeakPolarHBondContact O-CB 3.49Å; F552-E556 VanDerWaalsContact O-CG 3.26Å; F552-E556 WeakPolarHBondContact O-CG 3.45Å; F552-E556 PolarHBondContact O-N 3.27Å; M554-E556 VanDerWaalsContact C-N 3.35Å; M554-E556 PolarHBondContact O-N 3.45Å; E556-L558 PolarHBondContact O-N 2.84Å; E556-I559 CarbonylContact O-C 3.55Å; E556-I559 WeakPolarHBondContact O-CG1 3.41Å; E556-I559 PolarHBondContact O-N 3.15Å; E556-S560 WeakPolarHBondContact O-CB 3.48Å; E556-S560 PolarHBondContact O-N 3.31Å
557	S	61.5	Low	62.3	Low	43 Å²	43	83.3 Å²	83.3	30%	0.301	43%	0.431	S	S	.	.	H	α-helix	trans	-63.1	-33.4	177.4	85.9	0	0	0	0	111.8	T553 M554 I559 S560 N563	T553-S557 VanDerWaalsContact O-CB 3.29Å; T553-S557 WeakPolarHBondContact O-CB 3.48Å; T553-S557 PolarHBondContact O-N 3.13Å; M554-S557 PolarHBondContact O-N 3.35Å; M554-S557 PolarHBondContact O-OG 3.41Å; S557-I559 PolarHBondContact O-N 3.41Å; S557-S560 PolarHBondContact O-N 2.88Å; S557-N563 WeakPolarHBondContact O-CB 3.27Å; S557-N563 PolarHBondContact O-ND2 3.09Å
558	L	55.9	Low	61.8	Low	65 Å²	65	82.4 Å²	82.4	34%	0.34	43%	0.429	S	S	.	.	H	α-helix	trans	-68.5	-18.8	180	-72.6	169.3	0	0	0	113.2	V464 M554 M555 E556 S566	V464-L558 HydrophobicContact CG1-CD1 4.34Å; M554-L558 HydrophobicContact CG-CD1 4.4Å; M554-L558 VanDerWaalsContact O-CG 3.27Å; M554-L558 WeakPolarHBondContact O-CG 3.3Å; M554-L558 PolarHBondContact O-N 3.03Å; M555-L558 PolarHBondContact O-N 3.3Å; E556-L558 PolarHBondContact O-N 2.84Å; L558-S566 WeakPolarHBondContact O-CA 3.3Å; L558-S566 WeakPolarHBondContact O-CB 3.35Å; L558-S566 PolarHBondContact O-OG 2.72Å; L558-S566 VanDerWaalsContact O-OG 3.14Å
559	I	53.9	Low	61.8	Low	119 Å²	119	84 Å²	84	61%	0.61	43%	0.431	S	S	*	.	H	α-helix	trans	-117.6	3.5	175.8	64	172.5	0	0	0	113.3	E556 S557 S566 V568	E556-I559 CarbonylContact O-C 3.55Å; E556-I559 WeakPolarHBondContact O-CG1 3.41Å; E556-I559 PolarHBondContact O-N 3.15Å; S557-I559 PolarHBondContact O-N 3.41Å; I559-S566 VanDerWaalsContact C-OG 3.25Å; I559-S566 WeakPolarHBondContact CA-OG 3.43Å; I559-V568 HydrophobicContact CB-CG2 4.31Å; I559-V568 VanDerWaalsContact O-CB 3.32Å; I559-V568 WeakPolarHBondContact O-CB 3.24Å; I559-V568 WeakPolarHBondContact O-CG2 3.5Å
560	S	55.9	Low	61.5	Low	39 Å²	39	80.3 Å²	80.3	27%	0.273	42%	0.419	S	S	.	.			trans	-69.6	136.1	-179.1	176.8	0	0	0	0	111.2	E556 S557 K562 N563 S566	E556-S560 WeakPolarHBondContact O-CB 3.48Å; E556-S560 PolarHBondContact O-N 3.31Å; S557-S560 PolarHBondContact O-N 2.88Å; S560-K562 PolarHBondContact O-N 2.86Å; S560-K562 PolarHBondContact OG-N 3.23Å; S560-K562 VanDerWaalsContact OG-N 3.1Å; S560-N563 PolarHBondContact O-N 3.36Å; S560-S566 PolarHBondContact N-OG 2.81Å; S560-S566 WeakPolarHBondContact O-CB 3.21Å; S560-S566 PolarHBondContact O-OG 2.95Å
561	A	59.8	Low	60.9	Low	58 Å²	58	77.8 Å²	77.8	48%	0.479	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-6.2	170.5	0	0	0	0	0	113.1	V568 Y569	A561-V568 HydrophobicContact CB-CG1 3.92Å; A561-Y569 WeakPolarHBondContact O-CD2 3.42Å
562	K	63.7	Low	60.4	Low	194 Å²	194	80.8 Å²	80.8	84%	0.843	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-14.2	176.8	-61	-177.2	178.5	-179.3	0	113.5	S560	S560-K562 PolarHBondContact O-N 2.86Å; S560-K562 PolarHBondContact OG-N 3.23Å; S560-K562 VanDerWaalsContact OG-N 3.1Å
563	N	65.2	Low	60.4	Low	42 Å²	42	78.9 Å²	78.9	23%	0.225	42%	0.416	C	S	.	.			trans	-92.3	114.1	-179.7	-179.1	-3.2	0	0	0	109.9	S557 S560 D565 S566 Y569	S557-N563 WeakPolarHBondContact O-CB 3.27Å; S557-N563 PolarHBondContact O-ND2 3.09Å; S560-N563 PolarHBondContact O-N 3.36Å; N563-D565 PolarHBondContact O-N 3.31Å; N563-D565 PolarHBondContact OD1-N 3.39Å; N563-D565 VanDerWaalsContact OD1-N 3.08Å; N563-S566 WeakPolarHBondContact O-CB 3.47Å; N563-S566 PolarHBondContact O-N 3.39Å; N563-Y569 WeakPolarHBondContact O-CB 3.5Å
564	T	67.2	Low	60.1	Low	84 Å²	84	81 Å²	81	52%	0.515	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-23.1	-177.9	52	0	0	0	0	113.8	Y569 K570	T564-Y569 VanDerWaalsContact CA-CD1 3.49Å; T564-Y569 HydrophobicContact CG2-CD1 4.44Å; T564-Y569 HydrophobicContact CG2-CE1 3.98Å; T564-Y569 HydrophobicContact CG2-CE2 4.05Å; T564-K570 VanDerWaalsContact O-CE 3.32Å; T564-K570 WeakPolarHBondContact O-CE 3.4Å
565	D	60.1	Low	59.9	Low	116 Å²	116	85.2 Å²	85.2	62%	0.62	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-19.1	177.5	-83.6	-42.3	0	0	0	115.3	N563 K570	N563-D565 PolarHBondContact O-N 3.31Å; N563-D565 PolarHBondContact OD1-N 3.39Å; N563-D565 VanDerWaalsContact OD1-N 3.08Å; D565-K570 PolarHBondContact O-NZ 2.56Å; D565-K570 IonicContact OD1-NZ 3.78Å; D565-K570 PolarHBondContact OD1-NZ 2.9Å
566	S	61.4	Low	59.9	Low	2 Å²	2	85.9 Å²	85.9	1%	0.014	44%	0.436	C	S	.	.	S	Bend	trans	-61.3	143.3	178.3	166.1	0	0	0	0	111.5	L558 I559 S560 N563 V568 Y569 K570	L558-S566 WeakPolarHBondContact O-CA 3.3Å; L558-S566 WeakPolarHBondContact O-CB 3.35Å; L558-S566 PolarHBondContact O-OG 2.72Å; L558-S566 VanDerWaalsContact O-OG 3.14Å; I559-S566 VanDerWaalsContact C-OG 3.25Å; I559-S566 WeakPolarHBondContact CA-OG 3.43Å; S560-S566 PolarHBondContact N-OG 2.81Å; S560-S566 WeakPolarHBondContact O-CB 3.21Å; S560-S566 PolarHBondContact O-OG 2.95Å; N563-S566 WeakPolarHBondContact O-CB 3.47Å; N563-S566 PolarHBondContact O-N 3.39Å; S566-V568 PolarHBondContact O-N 2.65Å; S566-V568 WeakPolarHBondContact OG-CB 3.35Å; S566-V568 PolarHBondContact OG-N 3.06Å; S566-Y569 PolarHBondContact O-N 2.9Å; S566-K570 PolarHBondContact O-N 3.19Å
567	V	52.4	Low	59.9	Low	100 Å²	100	84.8 Å²	84.8	61%	0.606	43%	0.431	S	S	*	.	H	α-helix	trans	-59.4	-34.2	171.2	172.7	0	0	0	0	110.5	K570 I571	V567-K570 PolarHBondContact O-N 3.02Å; V567-I571 HydrophobicContact CG1-CD1 3.63Å; V567-I571 HydrophobicContact CG1-CG1 4.2Å; V567-I571 WeakPolarHBondContact O-CB 3.22Å; V567-I571 WeakPolarHBondContact O-CG1 3.28Å; V567-I571 PolarHBondContact O-N 2.86Å
568	V	55.5	Low	59.5	Low	60 Å²	60	89.1 Å²	89.1	36%	0.364	44%	0.441	S	S	.	.	H	α-helix	trans	-66.9	-44.1	178.8	-179.6	0	0	0	0	111.3	I559 A561 S566 I571 Q572	I559-V568 HydrophobicContact CB-CG2 4.31Å; I559-V568 VanDerWaalsContact O-CB 3.32Å; I559-V568 WeakPolarHBondContact O-CB 3.24Å; I559-V568 WeakPolarHBondContact O-CG2 3.5Å; A561-V568 HydrophobicContact CB-CG1 3.92Å; S566-V568 PolarHBondContact O-N 2.65Å; S566-V568 WeakPolarHBondContact OG-CB 3.35Å; S566-V568 PolarHBondContact OG-N 3.06Å; V568-I571 PolarHBondContact O-N 3.34Å; V568-Q572 WeakPolarHBondContact O-CB 3.34Å; V568-Q572 PolarHBondContact O-N 2.79Å
569	Y	65.2	Low	59.4	Low	72 Å²	72	88.7 Å²	88.7	28%	0.282	45%	0.448	S	S	.	.	H	α-helix	trans	-62.6	-47.7	173.9	179.4	-82.9	0	0	0	111	A561 N563 T564 S566 I571 Q572 E573	A561-Y569 WeakPolarHBondContact O-CD2 3.42Å; N563-Y569 WeakPolarHBondContact O-CB 3.5Å; T564-Y569 VanDerWaalsContact CA-CD1 3.49Å; T564-Y569 HydrophobicContact CG2-CD1 4.44Å; T564-Y569 HydrophobicContact CG2-CE1 3.98Å; T564-Y569 HydrophobicContact CG2-CE2 4.05Å; S566-Y569 PolarHBondContact O-N 2.9Å; Y569-I571 VanDerWaalsContact C-N 3.29Å; Y569-I571 PolarHBondContact O-N 3.11Å; Y569-Q572 CarbonylContact O-C 3.48Å; Y569-Q572 WeakPolarHBondContact O-CA 3.27Å; Y569-Q572 PolarHBondContact O-N 2.93Å; Y569-E573 HydrophobicContact CD1-CB 4.43Å; Y569-E573 HydrophobicContact CE1-CB 4.16Å; Y569-E573 WeakPolarHBondContact O-CB 3.38Å; Y569-E573 PolarHBondContact O-N 2.69Å
570	K	60.5	Low	59.9	Low	74 Å²	74	85.7 Å²	85.7	32%	0.322	44%	0.44	S	S	.	.	H	α-helix	trans	-61.9	-36.5	180	-73	168.2	178	150.5	0	112.1	T564 D565 S566 V567 K574	T564-K570 VanDerWaalsContact O-CE 3.32Å; T564-K570 WeakPolarHBondContact O-CE 3.4Å; D565-K570 PolarHBondContact O-NZ 2.56Å; D565-K570 IonicContact OD1-NZ 3.78Å; D565-K570 PolarHBondContact OD1-NZ 2.9Å; S566-K570 PolarHBondContact O-N 3.19Å; V567-K570 PolarHBondContact O-N 3.02Å; K570-K574 WeakPolarHBondContact O-CB 3.44Å; K570-K574 WeakPolarHBondContact O-CG 3.49Å; K570-K574 PolarHBondContact O-N 3.36Å
571	I	56.6	Low	60.3	Low	97 Å²	97	90 Å²	90	50%	0.497	45%	0.452	S	S	.	.	H	α-helix	trans	-66.6	-44.8	171.5	-71.4	169	0	0	0	110.5	V567 V568 Y569 E573 K574 R575	V567-I571 HydrophobicContact CG1-CD1 3.63Å; V567-I571 HydrophobicContact CG1-CG1 4.2Å; V567-I571 WeakPolarHBondContact O-CB 3.22Å; V567-I571 WeakPolarHBondContact O-CG1 3.28Å; V567-I571 PolarHBondContact O-N 2.86Å; V568-I571 PolarHBondContact O-N 3.34Å; Y569-I571 VanDerWaalsContact C-N 3.29Å; Y569-I571 PolarHBondContact O-N 3.11Å; I571-E573 VanDerWaalsContact C-N 3.34Å; I571-E573 PolarHBondContact O-N 2.95Å; I571-K574 CarbonylContact O-C 3.58Å; I571-K574 PolarHBondContact O-N 3.16Å; I571-R575 HydrophobicContact CG2-CG 4.38Å; I571-R575 WeakPolarHBondContact O-CG 3.45Å; I571-R575 PolarHBondContact O-N 2.83Å
572	Q	54	Low	60.4	Low	71 Å²	71	92.5 Å²	92.5	33%	0.332	45%	0.452	S	S	.	.	H	α-helix	trans	-64.2	-39.5	179	-171.4	59.7	50.3	0	0	111.8	V568 Y569 R575 N576	V568-Q572 WeakPolarHBondContact O-CB 3.34Å; V568-Q572 PolarHBondContact O-N 2.79Å; Y569-Q572 CarbonylContact O-C 3.48Å; Y569-Q572 WeakPolarHBondContact O-CA 3.27Å; Y569-Q572 PolarHBondContact O-N 2.93Å; Q572-R575 CarbonylContact O-C 3.48Å; Q572-R575 WeakPolarHBondContact O-CB 3.47Å; Q572-R575 PolarHBondContact O-N 3.46Å; Q572-N576 PolarHBondContact NE2-OD1 3.38Å; Q572-N576 WeakPolarHBondContact O-CB 3.27Å; Q572-N576 PolarHBondContact O-N 3.2Å; Q572-N576 PolarHBondContact O-OD1 2.81Å
573	E	64.2	Low	60.4	Low	79 Å²	79	88.8 Å²	88.8	37%	0.369	44%	0.441	S	S	.	.	H	α-helix	trans	-61.8	-47.1	172.7	-173.1	178.1	-138	0	0	110.3	Y569 I571 R575 N576 E577	Y569-E573 HydrophobicContact CD1-CB 4.43Å; Y569-E573 HydrophobicContact CE1-CB 4.16Å; Y569-E573 WeakPolarHBondContact O-CB 3.38Å; Y569-E573 PolarHBondContact O-N 2.69Å; I571-E573 VanDerWaalsContact C-N 3.34Å; I571-E573 PolarHBondContact O-N 2.95Å; E573-R575 VanDerWaalsContact C-N 3.31Å; E573-R575 PolarHBondContact O-N 2.98Å; E573-N576 PolarHBondContact O-N 3.02Å; E573-N576 VanDerWaalsContact O-N 3.16Å; E573-E577 WeakPolarHBondContact O-CB 3.46Å; E573-E577 WeakPolarHBondContact O-CG 2.98Å; E573-E577 PolarHBondContact O-N 2.92Å
574	K	61.3	Low	60.3	Low	120 Å²	120	91.2 Å²	91.2	52%	0.522	45%	0.45	S	S	.	.	H	α-helix	trans	-63.4	-31.9	172.7	-69.6	-46.8	-176.9	-163.1	0	113.8	K570 I571 E577 Y578	K570-K574 WeakPolarHBondContact O-CB 3.44Å; K570-K574 WeakPolarHBondContact O-CG 3.49Å; K570-K574 PolarHBondContact O-N 3.36Å; I571-K574 CarbonylContact O-C 3.58Å; I571-K574 PolarHBondContact O-N 3.16Å; K574-E577 WeakPolarHBondContact CD-OE2 3.14Å; K574-E577 IonicContact NZ-OE1 3.72Å; K574-E577 PolarHBondContact NZ-OE1 3.35Å; K574-E577 IonicContact NZ-OE2 3.05Å; K574-E577 PolarHBondContact NZ-OE2 2.95Å; K574-Y578 VanDerWaalsContact O-CB 3.24Å; K574-Y578 WeakPolarHBondContact O-CB 3.42Å; K574-Y578 PolarHBondContact O-N 3.09Å
575	R	57.1	Low	60.2	Low	161 Å²	161	90.8 Å²	90.8	61%	0.608	44%	0.442	S	S	*	.	H	α-helix	trans	-69.5	-39.9	172.2	-75.3	-178.2	73.9	-177.6	4.9	111.6	I571 Q572 E573 Y578 A579	I571-R575 HydrophobicContact CG2-CG 4.38Å; I571-R575 WeakPolarHBondContact O-CG 3.45Å; I571-R575 PolarHBondContact O-N 2.83Å; Q572-R575 CarbonylContact O-C 3.48Å; Q572-R575 WeakPolarHBondContact O-CB 3.47Å; Q572-R575 PolarHBondContact O-N 3.46Å; E573-R575 VanDerWaalsContact C-N 3.31Å; E573-R575 PolarHBondContact O-N 2.98Å; R575-Y578 PolarHBondContact O-N 2.97Å; R575-A579 VanDerWaalsContact O-CB 3.25Å; R575-A579 WeakPolarHBondContact O-CB 3.22Å; R575-A579 PolarHBondContact O-N 3.47Å
576	N	63.5	Low	60.3	Low	93 Å²	93	90.9 Å²	90.9	50%	0.497	44%	0.439	S	S	.	.	H	α-helix	trans	-69	-43	176.7	-67.8	-5.7	0	0	0	110.5	Q572 E573 Y578 A579 A580	Q572-N576 PolarHBondContact NE2-OD1 3.38Å; Q572-N576 WeakPolarHBondContact O-CB 3.27Å; Q572-N576 PolarHBondContact O-N 3.2Å; Q572-N576 PolarHBondContact O-OD1 2.81Å; E573-N576 PolarHBondContact O-N 3.02Å; E573-N576 VanDerWaalsContact O-N 3.16Å; N576-Y578 VanDerWaalsContact C-N 3.34Å; N576-Y578 PolarHBondContact O-N 2.86Å; N576-A579 PolarHBondContact O-N 3.2Å; N576-A580 VanDerWaalsContact O-CB 3.29Å; N576-A580 WeakPolarHBondContact O-CB 3.34Å; N576-A580 PolarHBondContact O-N 2.74Å
577	E	63.2	Low	60.4	Low	92 Å²	92	97.7 Å²	97.7	43%	0.43	47%	0.465	S	S	.	.	H	α-helix	trans	-59.1	-43.7	170.7	-74.7	177.9	-158.6	0	0	111.1	E573 K574 A580 Y581	E573-E577 WeakPolarHBondContact O-CB 3.46Å; E573-E577 WeakPolarHBondContact O-CG 2.98Å; E573-E577 PolarHBondContact O-N 2.92Å; K574-E577 WeakPolarHBondContact CD-OE2 3.14Å; K574-E577 IonicContact NZ-OE1 3.72Å; K574-E577 PolarHBondContact NZ-OE1 3.35Å; K574-E577 IonicContact NZ-OE2 3.05Å; K574-E577 PolarHBondContact NZ-OE2 2.95Å; E577-A580 PolarHBondContact O-N 3.06Å; E577-Y581 WeakPolarHBondContact O-CB 3.21Å; E577-Y581 PolarHBondContact O-N 3.13Å
578	Y	53.5	Low	61.2	Low	133 Å²	133	97.9 Å²	97.9	52%	0.522	46%	0.457	S	S	.	.	H	α-helix	trans	-70.5	-35.7	177.6	-176.5	-104	0	0	0	112.4	K574 R575 N576 Y581 K582	K574-Y578 VanDerWaalsContact O-CB 3.24Å; K574-Y578 WeakPolarHBondContact O-CB 3.42Å; K574-Y578 PolarHBondContact O-N 3.09Å; R575-Y578 PolarHBondContact O-N 2.97Å; N576-Y578 VanDerWaalsContact C-N 3.34Å; N576-Y578 PolarHBondContact O-N 2.86Å; Y578-Y581 HydrophobicContact CD2-CD1 4.21Å; Y578-Y581 HydrophobicContact CE2-CD1 4.27Å; Y578-Y581 PolarHBondContact O-N 2.82Å; Y578-K582 HydrophobicContact CE1-CD 3.96Å; Y578-K582 HydrophobicContact CE1-CG 4.07Å; Y578-K582 WeakPolarHBondContact O-CB 3.45Å; Y578-K582 PolarHBondContact O-N 3.26Å; Y578-K582 WeakPolarHBondContact OH-CE 3.25Å
579	A	53.2	Low	61.6	Low	57 Å²	57	98 Å²	98	47%	0.471	47%	0.465	S	S	.	.	H	α-helix	trans	-66.6	-42	174	0	0	0	0	0	110.9	R575 N576 K582 L583	R575-A579 VanDerWaalsContact O-CB 3.25Å; R575-A579 WeakPolarHBondContact O-CB 3.22Å; R575-A579 PolarHBondContact O-N 3.47Å; N576-A579 PolarHBondContact O-N 3.2Å; A579-K582 PolarHBondContact O-N 2.92Å; A579-L583 VanDerWaalsContact O-CB 3.26Å; A579-L583 WeakPolarHBondContact O-CB 3.42Å; A579-L583 PolarHBondContact O-N 3.34Å
580	A	64.3	Low	61.6	Low	55 Å²	55	99.5 Å²	99.5	46%	0.455	47%	0.474	S	S	.	.	H	α-helix	trans	-64.8	-43.4	172.5	0	0	0	0	0	111.5	N576 E577 L583 E584	N576-A580 VanDerWaalsContact O-CB 3.29Å; N576-A580 WeakPolarHBondContact O-CB 3.34Å; N576-A580 PolarHBondContact O-N 2.74Å; E577-A580 PolarHBondContact O-N 3.06Å; A580-L583 PolarHBondContact O-N 2.71Å; A580-E584 VanDerWaalsContact O-CB 3.28Å; A580-E584 WeakPolarHBondContact O-CB 3.35Å; A580-E584 PolarHBondContact O-N 3.48Å
581	Y	64.4	Low	61.8	Low	130 Å²	130	100.8 Å²	100.8	51%	0.51	48%	0.481	S	S	.	.	H	α-helix	trans	-63.1	-42.1	173.2	173.5	-96.6	0	0	0	111.6	E577 Y578 E584 Q585	E577-Y581 WeakPolarHBondContact O-CB 3.21Å; E577-Y581 PolarHBondContact O-N 3.13Å; Y578-Y581 HydrophobicContact CD2-CD1 4.21Å; Y578-Y581 HydrophobicContact CE2-CD1 4.27Å; Y578-Y581 PolarHBondContact O-N 2.82Å; Y581-E584 CarbonylContact O-C 3.59Å; Y581-E584 PolarHBondContact O-N 2.69Å; Y581-Q585 HydrophobicContact CD1-CG 3.94Å; Y581-Q585 HydrophobicContact CD2-CG 4.2Å; Y581-Q585 HydrophobicContact CE1-CG 3.53Å; Y581-Q585 HydrophobicContact CE2-CG 3.83Å; Y581-Q585 HydrophobicContact CG-CG 4.26Å; Y581-Q585 VanDerWaalsContact CZ-CG 3.47Å; Y581-Q585 VanDerWaalsContact O-CB 3.31Å; Y581-Q585 WeakPolarHBondContact O-CB 3.11Å; Y581-Q585 WeakPolarHBondContact O-CG 3.48Å; Y581-Q585 PolarHBondContact O-N 3.38Å; Y581-Q585 PolarHBondContact OH-NE2 3.19Å; Y581-Q585 VanDerWaalsContact OH-NE2 3.07Å
582	K	61.7	Low	62.3	Low	110 Å²	110	100 Å²	100	48%	0.478	48%	0.475	S	S	.	.	H	α-helix	trans	-65.3	-40.8	175.4	-113.3	-161.5	176.5	-169.5	0	111.3	Y578 A579 E584 Q585 Q586	Y578-K582 HydrophobicContact CE1-CD 3.96Å; Y578-K582 HydrophobicContact CE1-CG 4.07Å; Y578-K582 WeakPolarHBondContact O-CB 3.45Å; Y578-K582 PolarHBondContact O-N 3.26Å; Y578-K582 WeakPolarHBondContact OH-CE 3.25Å; A579-K582 PolarHBondContact O-N 2.92Å; K582-E584 VanDerWaalsContact C-N 3.32Å; K582-Q585 PolarHBondContact O-N 3.07Å; K582-Q586 VanDerWaalsContact O-CB 3.28Å; K582-Q586 WeakPolarHBondContact O-CB 3.35Å; K582-Q586 VanDerWaalsContact O-CG 3.28Å; K582-Q586 WeakPolarHBondContact O-CG 3.5Å; K582-Q586 PolarHBondContact O-N 3.42Å
583	L	63.4	Low	63.2	Low	117 Å²	117	103.2 Å²	103.2	61%	0.613	48%	0.484	S	S	*	.	H	α-helix	trans	-65.2	-37.6	174.4	-168.7	74.2	0	0	0	110.6	A579 A580 R587	A579-L583 VanDerWaalsContact O-CB 3.26Å; A579-L583 WeakPolarHBondContact O-CB 3.42Å; A579-L583 PolarHBondContact O-N 3.34Å; A580-L583 PolarHBondContact O-N 2.71Å; L583-R587 VanDerWaalsContact O-CB 3.24Å; L583-R587 WeakPolarHBondContact O-CB 3.42Å; L583-R587 PolarHBondContact O-N 2.85Å
584	E	64.6	Low	63.7	Low	92 Å²	92	102.8 Å²	102.8	43%	0.43	48%	0.484	S	S	.	.	H	α-helix	trans	-74.6	-34.7	176.3	-172	162.9	171.4	0	0	112.6	A580 Y581 K582 R587 K588	A580-E584 VanDerWaalsContact O-CB 3.28Å; A580-E584 WeakPolarHBondContact O-CB 3.35Å; A580-E584 PolarHBondContact O-N 3.48Å; Y581-E584 CarbonylContact O-C 3.59Å; Y581-E584 PolarHBondContact O-N 2.69Å; K582-E584 VanDerWaalsContact C-N 3.32Å; E584-R587 PolarHBondContact O-N 3.2Å; E584-K588 WeakPolarHBondContact O-CB 3.28Å; E584-K588 VanDerWaalsContact O-CG 3.31Å; E584-K588 WeakPolarHBondContact O-CG 3.47Å; E584-K588 PolarHBondContact O-N 3.25Å; E584-K588 IonicContact OE1-NZ 3.39Å
585	Q	63.2	Low	64.4	Low	75 Å²	75	103.1 Å²	103.1	35%	0.35	48%	0.482	S	S	.	.	H	α-helix	trans	-68.6	-39.4	170.6	-73	-62.2	-23.4	0	0	111.1	Y581 K582 K588 A589	Y581-Q585 HydrophobicContact CD1-CG 3.94Å; Y581-Q585 HydrophobicContact CD2-CG 4.2Å; Y581-Q585 HydrophobicContact CE1-CG 3.53Å; Y581-Q585 HydrophobicContact CE2-CG 3.83Å; Y581-Q585 HydrophobicContact CG-CG 4.26Å; Y581-Q585 VanDerWaalsContact CZ-CG 3.47Å; Y581-Q585 VanDerWaalsContact O-CB 3.31Å; Y581-Q585 WeakPolarHBondContact O-CB 3.11Å; Y581-Q585 WeakPolarHBondContact O-CG 3.48Å; Y581-Q585 PolarHBondContact O-N 3.38Å; Y581-Q585 PolarHBondContact OH-NE2 3.19Å; Y581-Q585 VanDerWaalsContact OH-NE2 3.07Å; K582-Q585 PolarHBondContact O-N 3.07Å; Q585-K588 PolarHBondContact O-N 3.43Å; Q585-A589 WeakPolarHBondContact O-CB 3.05Å; Q585-A589 PolarHBondContact O-N 3.09Å
586	Q	62.7	Low	65.3	Low	118 Å²	118	101.1 Å²	101.1	55%	0.551	48%	0.48	S	S	*	.	H	α-helix	trans	-63.2	-43.5	170.4	-80	177	-21.4	0	0	110.7	K582 A589 E590	K582-Q586 VanDerWaalsContact O-CB 3.28Å; K582-Q586 WeakPolarHBondContact O-CB 3.35Å; K582-Q586 VanDerWaalsContact O-CG 3.28Å; K582-Q586 WeakPolarHBondContact O-CG 3.5Å; K582-Q586 PolarHBondContact O-N 3.42Å; Q586-A589 PolarHBondContact O-N 3.1Å; Q586-E590 WeakPolarHBondContact O-CB 3.1Å; Q586-E590 PolarHBondContact O-N 3.3Å
587	R	64.7	Low	66	Low	145 Å²	145	100.6 Å²	100.6	55%	0.547	48%	0.475	S	S	.	.	H	α-helix	trans	-65.6	-39.7	176.6	-160.6	-179.6	81.1	138.1	2.8	112.2	L583 E584 Q591	L583-R587 VanDerWaalsContact O-CB 3.24Å; L583-R587 WeakPolarHBondContact O-CB 3.42Å; L583-R587 PolarHBondContact O-N 2.85Å; E584-R587 PolarHBondContact O-N 3.2Å; R587-Q591 VanDerWaalsContact O-CB 3.23Å; R587-Q591 WeakPolarHBondContact O-CB 3.43Å; R587-Q591 WeakPolarHBondContact O-CG 3.39Å; R587-Q591 PolarHBondContact O-N 2.97Å
588	K	67.7	Low	66.9	Low	105 Å²	105	101.5 Å²	101.5	46%	0.457	47%	0.474	S	S	.	.	H	α-helix	trans	-68.6	-40.7	174.3	-76.9	179.7	-175.7	174.5	0	111.6	E584 Q585 E592	E584-K588 WeakPolarHBondContact O-CB 3.28Å; E584-K588 VanDerWaalsContact O-CG 3.31Å; E584-K588 WeakPolarHBondContact O-CG 3.47Å; E584-K588 PolarHBondContact O-N 3.25Å; E584-K588 IonicContact OE1-NZ 3.39Å; Q585-K588 PolarHBondContact O-N 3.43Å; K588-E592 WeakPolarHBondContact O-CB 3.26Å; K588-E592 PolarHBondContact O-N 3.49Å
589	A	64.7	Low	68.2	Low	62 Å²	62	97 Å²	97	51%	0.512	46%	0.458	S	S	.	.	H	α-helix	trans	-66.9	-38.1	174.9	0	0	0	0	0	112.2	Q585 Q586 R593	Q585-A589 WeakPolarHBondContact O-CB 3.05Å; Q585-A589 PolarHBondContact O-N 3.09Å; Q586-A589 PolarHBondContact O-N 3.1Å; A589-R593 WeakPolarHBondContact O-CB 3.49Å; A589-R593 PolarHBondContact O-N 3.32Å
590	E	64.5	Low	69.7	Low	104 Å²	104	101.1 Å²	101.1	49%	0.486	47%	0.466	S	S	.	.	H	α-helix	trans	-72.1	-39.9	175.5	-172.7	168.5	-156.3	0	0	111.6	Q586 R593 L594	Q586-E590 WeakPolarHBondContact O-CB 3.1Å; Q586-E590 PolarHBondContact O-N 3.3Å; E590-R593 PolarHBondContact O-N 3.36Å; E590-L594 HydrophobicContact CG-CD1 4.24Å; E590-L594 WeakPolarHBondContact O-CB 3.4Å; E590-L594 VanDerWaalsContact O-CG 3.28Å; E590-L594 WeakPolarHBondContact O-CG 3.3Å; E590-L594 PolarHBondContact O-N 3.23Å
591	Q	66.2	Low	70.6	Confident	100 Å²	100	104.8 Å²	104.8	47%	0.467	47%	0.474	S	S	.	.	H	α-helix	trans	-62.3	-41	171.4	-80.5	179.5	-15.2	0	0	112.2	R587 R595	R587-Q591 VanDerWaalsContact O-CB 3.23Å; R587-Q591 WeakPolarHBondContact O-CB 3.43Å; R587-Q591 WeakPolarHBondContact O-CG 3.39Å; R587-Q591 PolarHBondContact O-N 2.97Å; Q591-R595 WeakPolarHBondContact O-CB 3.12Å; Q591-R595 PolarHBondContact O-N 2.66Å
592	E	67.2	Low	71.7	Confident	81 Å²	81	99.4 Å²	99.4	38%	0.379	46%	0.456	S	S	.	.	H	α-helix	trans	-70.3	-37	175.3	-170.9	59.8	-155.7	0	0	111.5	K588 R595 Q596	K588-E592 WeakPolarHBondContact O-CB 3.26Å; K588-E592 PolarHBondContact O-N 3.49Å; E592-R595 PolarHBondContact O-N 2.75Å; E592-R595 IonicContact OE1-NH1 2.7Å; E592-R595 IonicContact OE2-NH1 2.78Å; E592-Q596 WeakPolarHBondContact O-CG 3.31Å; E592-Q596 PolarHBondContact O-N 2.83Å
593	R	72.6	Confident	73.1	Confident	138 Å²	138	97.3 Å²	97.3	52%	0.521	45%	0.447	S	S	.	.	H	α-helix	trans	-61.9	-48	172.9	-164.3	-173.4	87	-154.5	-4.7	111.5	A589 E590 R595 Q596 E597	A589-R593 WeakPolarHBondContact O-CB 3.49Å; A589-R593 PolarHBondContact O-N 3.32Å; E590-R593 PolarHBondContact O-N 3.36Å; R593-R595 VanDerWaalsContact C-N 3.3Å; R593-R595 PolarHBondContact O-N 3.09Å; R593-Q596 PolarHBondContact O-N 2.58Å; R593-E597 IonicContact NE-OE1 3.54Å; R593-E597 PolarHBondContact NE-OE1 3.29Å; R593-E597 PolarHBondContact O-N 2.83Å
594	L	73.2	Confident	74.2	Confident	70 Å²	70	96.6 Å²	96.6	37%	0.366	44%	0.443	S	S	.	.	H	α-helix	trans	-63.5	-34.9	176.2	-73.4	166.8	0	0	0	111.8	E590 E597 R598	E590-L594 HydrophobicContact CG-CD1 4.24Å; E590-L594 WeakPolarHBondContact O-CB 3.4Å; E590-L594 VanDerWaalsContact O-CG 3.28Å; E590-L594 WeakPolarHBondContact O-CG 3.3Å; E590-L594 PolarHBondContact O-N 3.23Å; L594-E597 PolarHBondContact O-N 2.79Å; L594-R598 WeakPolarHBondContact O-CG 3.15Å; L594-R598 PolarHBondContact O-N 2.84Å; L594-R598 PolarHBondContact O-NH1 2.89Å
595	R	77.7	Confident	75.5	Confident	127 Å²	127	98.5 Å²	98.5	48%	0.479	45%	0.449	S	S	.	.	H	α-helix	trans	-66	-43	173.3	-176.1	-178	175.2	-135.7	-1.5	111.4	Q591 E592 R593 R598 I599	Q591-R595 WeakPolarHBondContact O-CB 3.12Å; Q591-R595 PolarHBondContact O-N 2.66Å; E592-R595 PolarHBondContact O-N 2.75Å; E592-R595 IonicContact OE1-NH1 2.7Å; E592-R595 IonicContact OE2-NH1 2.78Å; R593-R595 VanDerWaalsContact C-N 3.3Å; R593-R595 PolarHBondContact O-N 3.09Å; R595-R598 PolarHBondContact O-N 3.49Å; R595-I599 HydrophobicContact CG-CD1 4.17Å; R595-I599 VanDerWaalsContact O-CG1 3.31Å; R595-I599 WeakPolarHBondContact O-CG1 3.08Å; R595-I599 PolarHBondContact O-N 3.26Å
596	Q	75.5	Confident	76.9	Confident	120 Å²	120	95.1 Å²	95.1	56%	0.561	43%	0.434	S	S	*	.	H	α-helix	trans	-65.9	-37.6	175.2	-71.9	-173.7	10.7	0	0	112.4	E592 R593 I599 K600	E592-Q596 WeakPolarHBondContact O-CG 3.31Å; E592-Q596 PolarHBondContact O-N 2.83Å; R593-Q596 PolarHBondContact O-N 2.58Å; Q596-I599 PolarHBondContact O-N 2.93Å; Q596-K600 WeakPolarHBondContact O-CB 3.49Å; Q596-K600 PolarHBondContact O-N 2.87Å
597	E	78.8	Confident	78.3	Confident	82 Å²	82	93.3 Å²	93.3	38%	0.383	42%	0.424	S	S	.	.	H	α-helix	trans	-62.7	-46.8	172.8	-77.7	168.9	-176.2	0	0	111.4	R593 L594 I599 K600 E601	R593-E597 IonicContact NE-OE1 3.54Å; R593-E597 PolarHBondContact NE-OE1 3.29Å; R593-E597 PolarHBondContact O-N 2.83Å; L594-E597 PolarHBondContact O-N 2.79Å; E597-I599 PolarHBondContact O-N 2.66Å; E597-K600 WeakPolarHBondContact O-CB 3.39Å; E597-K600 PolarHBondContact O-N 3.12Å; E597-K600 VanDerWaalsContact O-N 3.13Å; E597-E601 WeakPolarHBondContact O-CG 3.26Å; E597-E601 PolarHBondContact O-N 3.5Å
598	R	80.9	Confident	79.5	Confident	110 Å²	110	89.5 Å²	89.5	42%	0.415	42%	0.417	S	S	.	.	H	α-helix	trans	-59.7	-44.4	174.7	-76.1	-166.4	-58.6	-81.1	-0.3	113	L594 R595 K600 E601 A602 E671	L594-R598 WeakPolarHBondContact O-CG 3.15Å; L594-R598 PolarHBondContact O-N 2.84Å; L594-R598 PolarHBondContact O-NH1 2.89Å; R595-R598 PolarHBondContact O-N 3.49Å; R598-K600 VanDerWaalsContact C-N 3.3Å; R598-K600 PolarHBondContact O-N 2.87Å; R598-E601 PolarHBondContact O-N 3.38Å; R598-A602 VanDerWaalsContact O-CB 3.25Å; R598-A602 WeakPolarHBondContact O-CB 3.5Å; R598-A602 PolarHBondContact O-N 3.45Å; R598-E671 IonicContact NE-OE1 2.95Å; R598-E671 PolarHBondContact NE-OE1 2.9Å
599	I	80.8	Confident	80.7	Confident	38 Å²	38	86.9 Å²	86.9	20%	0.195	41%	0.408	C	S	.	.	H	α-helix	trans	-61	-42.1	175.6	-68.4	167.1	0	0	0	110.1	R595 Q596 E597 A602 K603 E671	R595-I599 HydrophobicContact CG-CD1 4.17Å; R595-I599 VanDerWaalsContact O-CG1 3.31Å; R595-I599 WeakPolarHBondContact O-CG1 3.08Å; R595-I599 PolarHBondContact O-N 3.26Å; Q596-I599 PolarHBondContact O-N 2.93Å; E597-I599 PolarHBondContact O-N 2.66Å; I599-A602 PolarHBondContact O-N 3.25Å; I599-K603 HydrophobicContact CG2-CD 4.26Å; I599-K603 HydrophobicContact CG2-CG 4.5Å; I599-K603 WeakPolarHBondContact O-CB 3.39Å; I599-K603 VanDerWaalsContact O-CG 3.26Å; I599-K603 WeakPolarHBondContact O-CG 3.34Å; I599-K603 PolarHBondContact O-N 3.1Å; I599-E671 HydrophobicContact CG1-CB 4.3Å
600	K	84.2	Confident	82	Confident	145 Å²	145	83.9 Å²	83.9	63%	0.63	38%	0.383	S	S	*	.	H	α-helix	trans	-64.2	-44.8	178.4	-171.6	-178.9	178.1	-174.1	0	112	Q596 E597 R598 K603 I604	Q596-K600 WeakPolarHBondContact O-CB 3.49Å; Q596-K600 PolarHBondContact O-N 2.87Å; E597-K600 WeakPolarHBondContact O-CB 3.39Å; E597-K600 PolarHBondContact O-N 3.12Å; E597-K600 VanDerWaalsContact O-N 3.13Å; R598-K600 VanDerWaalsContact C-N 3.3Å; R598-K600 PolarHBondContact O-N 2.87Å; K600-K603 PolarHBondContact O-N 3.4Å; K600-I604 HydrophobicContact CG-CD1 4.38Å; K600-I604 WeakPolarHBondContact O-CG1 3.48Å; K600-I604 PolarHBondContact O-N 3.44Å
601	E	84.7	Confident	83.3	Confident	132 Å²	132	80.9 Å²	80.9	62%	0.617	37%	0.37	S	S	*	.	H	α-helix	trans	-64.4	-43.3	175.7	-74	177.9	170.1	0	0	112	E597 R598 K603 I604 K605	E597-E601 WeakPolarHBondContact O-CG 3.26Å; E597-E601 PolarHBondContact O-N 3.5Å; R598-E601 PolarHBondContact O-N 3.38Å; E601-K603 VanDerWaalsContact C-N 3.31Å; E601-K603 PolarHBondContact O-N 3.42Å; E601-I604 PolarHBondContact O-N 3.17Å; E601-K605 WeakPolarHBondContact O-CB 2.97Å; E601-K605 PolarHBondContact O-N 3.44Å
602	A	87	Confident	84.5	Confident	17 Å²	17	80 Å²	80	14%	0.14	37%	0.368	C	S	.	.	H	α-helix	trans	-61	-39.9	176.4	0	0	0	0	0	111.5	R598 I599 K605 L606 I672	R598-A602 VanDerWaalsContact O-CB 3.25Å; R598-A602 WeakPolarHBondContact O-CB 3.5Å; R598-A602 PolarHBondContact O-N 3.45Å; I599-A602 PolarHBondContact O-N 3.25Å; A602-K605 PolarHBondContact O-N 3.31Å; A602-L606 WeakPolarHBondContact O-CB 3.11Å; A602-L606 PolarHBondContact O-N 3.43Å; A602-I672 HydrophobicContact CB-CD1 3.81Å; A602-I672 HydrophobicContact CB-CG1 3.9Å; A602-I672 WeakPolarHBondContact O-CD1 3.26Å
603	K	90.3	Very high	85.7	Confident	66 Å²	66	77.4 Å²	77.4	29%	0.287	36%	0.359	S	S	.	.	H	α-helix	trans	-65.1	-42	174.4	-72.7	-176.5	177.5	-166.7	0	112.6	I599 K600 E601 K607 I672 D676 I680	I599-K603 HydrophobicContact CG2-CD 4.26Å; I599-K603 HydrophobicContact CG2-CG 4.5Å; I599-K603 WeakPolarHBondContact O-CB 3.39Å; I599-K603 VanDerWaalsContact O-CG 3.26Å; I599-K603 WeakPolarHBondContact O-CG 3.34Å; I599-K603 PolarHBondContact O-N 3.1Å; K600-K603 PolarHBondContact O-N 3.4Å; E601-K603 VanDerWaalsContact C-N 3.31Å; E601-K603 PolarHBondContact O-N 3.42Å; K603-K607 PolarHBondContact O-N 3.12Å; K603-I672 HydrophobicContact CG-CD1 4.38Å; K603-I672 HydrophobicContact CG-CG1 4.44Å; K603-D676 WeakPolarHBondContact CE-OD2 3.49Å; K603-D676 VanDerWaalsContact NZ-CG 3.32Å; K603-D676 IonicContact NZ-OD1 2.74Å; K603-D676 IonicContact NZ-OD2 3.2Å; K603-D676 PolarHBondContact NZ-OD2 3.3Å; K603-I680 HydrophobicContact CB-CD1 3.72Å; K603-I680 HydrophobicContact CD-CD1 4.1Å; K603-I680 HydrophobicContact CG-CD1 3.57Å
604	I	87.8	Confident	86.6	Confident	101 Å²	101	70.9 Å²	70.9	52%	0.518	33%	0.334	S	S	.	.	H	α-helix	trans	-62.7	-47.7	175.5	-69.4	166.7	0	0	0	110	K600 E601 L606 K607 T608	K600-I604 HydrophobicContact CG-CD1 4.38Å; K600-I604 WeakPolarHBondContact O-CG1 3.48Å; K600-I604 PolarHBondContact O-N 3.44Å; E601-I604 PolarHBondContact O-N 3.17Å; I604-L606 PolarHBondContact O-N 3.24Å; I604-K607 WeakPolarHBondContact O-CB 3.42Å; I604-K607 PolarHBondContact O-N 3.32Å; I604-T608 PolarHBondContact O-N 3.12Å; I604-T608 PolarHBondContact O-OG1 3.02Å
605	K	90.1	Very high	87.6	Confident	132 Å²	132	70.4 Å²	70.4	57%	0.574	33%	0.332	S	S	*	.	H	α-helix	trans	-59.5	-46.4	178.8	-175	178.6	177	-178.3	0	112	E601 A602 K607 T608 D609	E601-K605 WeakPolarHBondContact O-CB 2.97Å; E601-K605 PolarHBondContact O-N 3.44Å; A602-K605 PolarHBondContact O-N 3.31Å; K605-K607 VanDerWaalsContact C-N 3.26Å; K605-K607 PolarHBondContact O-N 3.1Å; K605-T608 PolarHBondContact O-N 2.66Å; K605-T608 VanDerWaalsContact O-N 3.1Å; K605-D609 WeakPolarHBondContact O-CB 3.29Å; K605-D609 VanDerWaalsContact O-CG 3.28Å; K605-D609 PolarHBondContact O-N 2.67Å
606	L	93.7	Very high	88.2	Confident	4 Å²	4	69.4 Å²	69.4	2%	0.021	34%	0.336	C	S	.	.	H	α-helix	trans	-59	-38.5	177.1	-179.7	58.3	0	0	0	112.2	A602 I604 T610 P666 Y668 I672 A677 I680 M681	A602-L606 WeakPolarHBondContact O-CB 3.11Å; A602-L606 PolarHBondContact O-N 3.43Å; I604-L606 PolarHBondContact O-N 3.24Å; L606-T610 WeakPolarHBondContact O-CB 3.4Å; L606-T610 PolarHBondContact O-N 3.29Å; L606-T610 PolarHBondContact O-OG1 3Å; L606-P666 HydrophobicContact CD1-CG 4.09Å; L606-Y668 HydrophobicContact CD2-CG 4.41Å; L606-I672 HydrophobicContact CB-CD1 4.22Å; L606-I672 HydrophobicContact CD2-CD1 4.05Å; L606-A677 HydrophobicContact CD2-CB 3.82Å; L606-I680 HydrophobicContact CB-CG2 4.23Å; L606-I680 HydrophobicContact CD2-CB 4.19Å; L606-I680 HydrophobicContact CD2-CD1 4.34Å; L606-I680 HydrophobicContact CD2-CG2 4.13Å; L606-I680 HydrophobicContact CG-CG2 3.96Å; L606-M681 HydrophobicContact CD1-CG 4.16Å; L606-M681 HydrophobicContact CD1-SD 4.47Å; L606-M681 HydrophobicContact CG-CG 4.37Å
607	K	92.2	Very high	89	Confident	81 Å²	81	64 Å²	64	35%	0.352	31%	0.311	S	S	.	.	H	α-helix	trans	-62.5	-47.7	174.5	-170	-176.4	177	-176.9	0	110.8	K603 I604 K605 T610 I611 I680 A684 E687	K603-K607 PolarHBondContact O-N 3.12Å; I604-K607 WeakPolarHBondContact O-CB 3.42Å; I604-K607 PolarHBondContact O-N 3.32Å; K605-K607 VanDerWaalsContact C-N 3.26Å; K605-K607 PolarHBondContact O-N 3.1Å; K607-T610 WeakPolarHBondContact O-CB 3.44Å; K607-T610 PolarHBondContact O-N 2.87Å; K607-I611 HydrophobicContact CG-CD1 4.27Å; K607-I611 WeakPolarHBondContact O-CG1 3.37Å; K607-I611 PolarHBondContact O-N 2.78Å; K607-I611 VanDerWaalsContact O-N 3.1Å; K607-I680 HydrophobicContact CB-CG2 3.88Å; K607-A684 HydrophobicContact CG-CB 4.23Å; K607-E687 WeakPolarHBondContact CE-OE2 3.45Å; K607-E687 IonicContact NZ-OE1 2.66Å; K607-E687 PolarHBondContact NZ-OE1 3.02Å; K607-E687 IonicContact NZ-OE2 3.98Å; K607-E687 PolarHBondContact NZ-OE2 3.24Å
608	T	90.3	Very high	89.6	Confident	65 Å²	65	60.8 Å²	60.8	40%	0.399	30%	0.296	S	S	.	.	H	α-helix	trans	-61.9	-50.3	178.3	-54.7	0	0	0	0	111.8	I604 K605 T610 I611 D612	I604-T608 PolarHBondContact O-N 3.12Å; I604-T608 PolarHBondContact O-OG1 3.02Å; K605-T608 PolarHBondContact O-N 2.66Å; K605-T608 VanDerWaalsContact O-N 3.1Å; T608-T610 PolarHBondContact O-N 2.96Å; T608-I611 WeakPolarHBondContact O-CB 3.49Å; T608-I611 PolarHBondContact O-N 3.26Å; T608-D612 PolarHBondContact O-N 2.91Å
609	D	91.4	Very high	90	Very high	49 Å²	49	59.5 Å²	59.5	26%	0.262	30%	0.301	S	S	.	.	H	α-helix	trans	-58.5	-36.5	178.9	-67.1	-9.2	0	0	0	111	K605 T613 P666	K605-D609 WeakPolarHBondContact O-CB 3.29Å; K605-D609 VanDerWaalsContact O-CG 3.28Å; K605-D609 PolarHBondContact O-N 2.67Å; D609-T613 WeakPolarHBondContact O-CB 3.2Å; D609-T613 PolarHBondContact O-N 2.54Å; D609-T613 PolarHBondContact O-OG1 2.88Å; D609-T613 VanDerWaalsContact O-OG1 3.05Å; D609-P666 HydrophobicContact CB-CB 3.93Å; D609-P666 HydrophobicContact CB-CG 4.44Å
610	T	92	Very high	90.5	Very high	0 Å²	0	64 Å²	64	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-65.5	-43.3	175.1	-57.4	0	0	0	0	112.4	L606 K607 T608 L614 F661 A684	L606-T610 WeakPolarHBondContact O-CB 3.4Å; L606-T610 PolarHBondContact O-N 3.29Å; L606-T610 PolarHBondContact O-OG1 3Å; K607-T610 WeakPolarHBondContact O-CB 3.44Å; K607-T610 PolarHBondContact O-N 2.87Å; T608-T610 PolarHBondContact O-N 2.96Å; T610-L614 HydrophobicContact CG2-CD1 4.13Å; T610-L614 WeakPolarHBondContact O-CG 3.48Å; T610-L614 PolarHBondContact O-N 3.18Å; T610-L614 VanDerWaalsContact O-N 3.12Å; T610-F661 HydrophobicContact CG2-CE2 3.68Å; T610-F661 HydrophobicContact CG2-CZ 3.59Å; T610-A684 HydrophobicContact CG2-CB 3.58Å
611	I	92	Very high	90.9	Very high	41 Å²	41	59.8 Å²	59.8	21%	0.21	30%	0.303	C	S	.	.	H	α-helix	trans	-64.1	-44.3	177.4	-69.4	170.7	0	0	0	110.2	K607 T608 L614 N615 A684 I688	K607-I611 HydrophobicContact CG-CD1 4.27Å; K607-I611 WeakPolarHBondContact O-CG1 3.37Å; K607-I611 PolarHBondContact O-N 2.78Å; K607-I611 VanDerWaalsContact O-N 3.1Å; T608-I611 WeakPolarHBondContact O-CB 3.49Å; T608-I611 PolarHBondContact O-N 3.26Å; I611-L614 PolarHBondContact O-N 2.89Å; I611-N615 WeakPolarHBondContact CG2-ND2 3.46Å; I611-N615 PolarHBondContact O-N 2.97Å; I611-N615 PolarHBondContact O-ND2 2.89Å; I611-N615 VanDerWaalsContact O-ND2 3.14Å; I611-A684 HydrophobicContact CG1-CB 4.21Å; I611-I688 HydrophobicContact CB-CD1 4.11Å; I611-I688 HydrophobicContact CG1-CD1 4.05Å; I611-I688 HydrophobicContact CG2-CD1 3.9Å
612	D	91.6	Very high	91.2	Very high	80 Å²	80	54.1 Å²	54.1	43%	0.428	28%	0.278	S	S	.	.	H	α-helix	trans	-65.2	-43.9	179.7	-70.8	-15.3	0	0	0	111.8	T608 L614 N615 N616	T608-D612 PolarHBondContact O-N 2.91Å; D612-L614 VanDerWaalsContact C-N 3.31Å; D612-L614 PolarHBondContact O-N 2.96Å; D612-N615 PolarHBondContact O-N 2.91Å; D612-N616 WeakPolarHBondContact O-CB 3.24Å; D612-N616 PolarHBondContact O-N 3.32Å; D612-N616 PolarHBondContact O-ND2 3.01Å
613	T	91.9	Very high	91.4	Very high	28 Å²	28	56 Å²	56	17%	0.172	29%	0.29	C	S	.	.	H	α-helix	trans	-55.2	-46.4	172.3	-70.8	0	0	0	0	111.6	D609 N616 L617 F661 N664	D609-T613 WeakPolarHBondContact O-CB 3.2Å; D609-T613 PolarHBondContact O-N 2.54Å; D609-T613 PolarHBondContact O-OG1 2.88Å; D609-T613 VanDerWaalsContact O-OG1 3.05Å; T613-N616 PolarHBondContact O-N 2.85Å; T613-L617 HydrophobicContact CG2-CD1 4.08Å; T613-L617 WeakPolarHBondContact O-CB 3.45Å; T613-L617 VanDerWaalsContact O-CG 3.28Å; T613-L617 WeakPolarHBondContact O-CG 3.35Å; T613-L617 PolarHBondContact O-N 3.44Å; T613-F661 HydrophobicContact CG2-CD2 4.21Å; T613-F661 HydrophobicContact CG2-CE2 4.35Å; T613-N664 HydrophobicContact CG2-CB 4.17Å; T613-N664 WeakPolarHBondContact CG2-O 3.39Å
614	L	93.3	Very high	91.3	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-67.1	-39.7	-179.5	-75.3	166.4	0	0	0	112.5	T610 I611 D612 L618 L657 F661 Y685 I688 L692	T610-L614 HydrophobicContact CG2-CD1 4.13Å; T610-L614 WeakPolarHBondContact O-CG 3.48Å; T610-L614 PolarHBondContact O-N 3.18Å; T610-L614 VanDerWaalsContact O-N 3.12Å; I611-L614 PolarHBondContact O-N 2.89Å; D612-L614 VanDerWaalsContact C-N 3.31Å; D612-L614 PolarHBondContact O-N 2.96Å; L614-L618 PolarHBondContact O-N 3.35Å; L614-L657 HydrophobicContact CD2-CD1 4.08Å; L614-L657 HydrophobicContact CD2-CD2 4.11Å; L614-L657 HydrophobicContact CD2-CG 3.97Å; L614-F661 HydrophobicContact CD2-CB 4.05Å; L614-F661 HydrophobicContact CD2-CD2 3.73Å; L614-F661 HydrophobicContact CD2-CG 4.03Å; L614-F661 HydrophobicContact CG-CD2 3.97Å; L614-F661 HydrophobicContact CG-CE2 4.31Å; L614-Y685 HydrophobicContact CD1-CD2 4.23Å; L614-Y685 HydrophobicContact CD2-CD2 3.8Å; L614-Y685 HydrophobicContact CD2-CE2 4.13Å; L614-I688 HydrophobicContact CB-CD1 3.75Å; L614-I688 HydrophobicContact CB-CG1 4.43Å; L614-I688 HydrophobicContact CD1-CD1 3.75Å; L614-I688 HydrophobicContact CD1-CG1 3.85Å; L614-I688 HydrophobicContact CG-CD1 4.4Å; L614-L692 HydrophobicContact CB-CD1 3.74Å
615	N	92.3	Very high	91.5	Very high	60 Å²	60	51.2 Å²	51.2	32%	0.321	28%	0.278	S	S	.	.	H	α-helix	trans	-63.6	-45	173.8	-77	-44.5	0	0	0	111.7	I611 D612 L617 L618 T619 L692	I611-N615 WeakPolarHBondContact CG2-ND2 3.46Å; I611-N615 PolarHBondContact O-N 2.97Å; I611-N615 PolarHBondContact O-ND2 2.89Å; I611-N615 VanDerWaalsContact O-ND2 3.14Å; D612-N615 PolarHBondContact O-N 2.91Å; N615-L617 PolarHBondContact O-N 3.39Å; N615-L618 WeakPolarHBondContact O-CB 3.39Å; N615-L618 PolarHBondContact O-N 3.21Å; N615-L618 VanDerWaalsContact O-N 3.17Å; N615-T619 PolarHBondContact O-N 2.84Å; N615-T619 PolarHBondContact O-OG1 2.62Å; N615-T619 VanDerWaalsContact O-OG1 3.1Å; N615-L692 VanDerWaalsContact OD1-CD2 3.29Å; N615-L692 WeakPolarHBondContact OD1-CD2 3.28Å
616	N	92.2	Very high	91.6	Very high	106 Å²	106	46.9 Å²	46.9	57%	0.567	26%	0.261	S	S	*	.	H	α-helix	trans	-62.1	-44.7	178.7	-71.8	-25	0	0	0	111.7	D612 T613 L618 T619 E620	D612-N616 WeakPolarHBondContact O-CB 3.24Å; D612-N616 PolarHBondContact O-N 3.32Å; D612-N616 PolarHBondContact O-ND2 3.01Å; T613-N616 PolarHBondContact O-N 2.85Å; N616-L618 VanDerWaalsContact C-N 3.3Å; N616-L618 PolarHBondContact O-N 3.37Å; N616-T619 PolarHBondContact O-N 3.02Å; N616-E620 WeakPolarHBondContact O-CB 3.4Å; N616-E620 PolarHBondContact O-N 3.34Å
617	L	91.6	Very high	91.5	Very high	8 Å²	8	51.1 Å²	51.1	4%	0.042	28%	0.284	C	S	.	.	H	α-helix	trans	-58.7	-42.7	173.8	-73.4	171.2	0	0	0	111.5	T613 N615 H621 L657 L660 N664	T613-L617 HydrophobicContact CG2-CD1 4.08Å; T613-L617 WeakPolarHBondContact O-CB 3.45Å; T613-L617 VanDerWaalsContact O-CG 3.28Å; T613-L617 WeakPolarHBondContact O-CG 3.35Å; T613-L617 PolarHBondContact O-N 3.44Å; N615-L617 PolarHBondContact O-N 3.39Å; L617-H621 WeakPolarHBondContact O-CB 3.4Å; L617-H621 PolarHBondContact O-CD2 2.88Å; L617-H621 VanDerWaalsContact O-CD2 3.22Å; L617-H621 PolarHBondContact O-N 3.1Å; L617-H621 VanDerWaalsContact O-N 3.09Å; L617-L657 HydrophobicContact CB-CD1 4.31Å; L617-L660 HydrophobicContact CD1-CB 4.07Å; L617-L660 HydrophobicContact CD2-CB 4.26Å; L617-N664 HydrophobicContact CD1-CB 4.21Å; L617-N664 HydrophobicContact CD2-CB 4.3Å
618	L	91.4	Very high	91.4	Very high	14 Å²	14	50.4 Å²	50.4	7%	0.073	29%	0.289	C	S	.	.	H	α-helix	trans	-61.8	-48	175.6	177.3	69.2	0	0	0	111.3	L614 N615 N616 S622 L655 L692 Y696	L614-L618 PolarHBondContact O-N 3.35Å; N615-L618 WeakPolarHBondContact O-CB 3.39Å; N615-L618 PolarHBondContact O-N 3.21Å; N615-L618 VanDerWaalsContact O-N 3.17Å; N616-L618 VanDerWaalsContact C-N 3.3Å; N616-L618 PolarHBondContact O-N 3.37Å; L618-S622 WeakPolarHBondContact O-CB 3.12Å; L618-S622 PolarHBondContact O-N 3.15Å; L618-S622 PolarHBondContact O-OG 2.82Å; L618-L655 HydrophobicContact CD1-CD2 4.44Å; L618-L692 HydrophobicContact CB-CD2 4.39Å; L618-L692 HydrophobicContact CD1-CB 4.45Å; L618-L692 VanDerWaalsContact CD1-O 3.31Å; L618-L692 WeakPolarHBondContact CD1-O 3.45Å; L618-L692 HydrophobicContact CD2-CB 3.92Å; L618-L692 HydrophobicContact CD2-CD2 3.39Å; L618-L692 HydrophobicContact CD2-CG 4.2Å; L618-L692 HydrophobicContact CG-CD2 4.46Å; L618-Y696 HydrophobicContact CD1-CD2 4.22Å; L618-Y696 HydrophobicContact CD1-CG 4.36Å
619	T	89.3	Confident	91.5	Very high	83 Å²	83	47.4 Å²	47.4	51%	0.509	27%	0.27	S	S	.	.	H	α-helix	trans	-61.3	-48.7	-178.9	-58.1	0	0	0	0	111.2	N615 N616 H621 S622 S623	N615-T619 PolarHBondContact O-N 2.84Å; N615-T619 PolarHBondContact O-OG1 2.62Å; N615-T619 VanDerWaalsContact O-OG1 3.1Å; N616-T619 PolarHBondContact O-N 3.02Å; T619-H621 PolarHBondContact O-N 3.41Å; T619-S622 PolarHBondContact O-N 2.86Å; T619-S623 WeakPolarHBondContact O-CB 3.21Å; T619-S623 PolarHBondContact O-N 2.99Å; T619-S623 PolarHBondContact O-OG 3.4Å
620	E	90.8	Very high	91.5	Very high	131 Å²	131	48.3 Å²	48.3	61%	0.612	28%	0.275	S	S	*	.	H	α-helix	trans	-58.9	-49.4	-179.7	-173.2	179.2	174.7	0	0	111.6	N616 S623 A624	N616-E620 WeakPolarHBondContact O-CB 3.4Å; N616-E620 PolarHBondContact O-N 3.34Å; E620-S623 PolarHBondContact O-N 2.83Å; E620-A624 WeakPolarHBondContact O-CB 3.2Å; E620-A624 PolarHBondContact O-N 3.48Å
621	H	92.4	Very high	91.4	Very high	58 Å²	58	53 Å²	53	27%	0.269	30%	0.3	S	S	.	.	H	α-helix	trans	-72.8	-32.9	-179	-78.3	-84	0	0	0	113.1	L617 T619 A624 A625 L655 L660 Y696	L617-H621 WeakPolarHBondContact O-CB 3.4Å; L617-H621 PolarHBondContact O-CD2 2.88Å; L617-H621 VanDerWaalsContact O-CD2 3.22Å; L617-H621 PolarHBondContact O-N 3.1Å; L617-H621 VanDerWaalsContact O-N 3.09Å; T619-H621 PolarHBondContact O-N 3.41Å; H621-A624 PolarHBondContact O-N 2.82Å; H621-A625 WeakPolarHBondContact O-CB 3.27Å; H621-A625 PolarHBondContact O-N 2.86Å; H621-L655 HydrophobicContact CB-CD1 3.75Å; H621-L655 HydrophobicContact CB-CD2 4.26Å; H621-L660 WeakPolarHBondContact NE2-CD1 3.42Å; H621-L660 WeakPolarHBondContact NE2-CD2 3.32Å; H621-Y696 HydrophobicContact CB-CE2 4.41Å
622	S	91	Very high	91.4	Very high	13 Å²	13	52.2 Å²	52.2	9%	0.091	30%	0.297	C	S	.	.	H	α-helix	trans	-64.2	-47.6	172.4	-59.5	0	0	0	0	110.6	L618 T619 A624 A625 I626	L618-S622 WeakPolarHBondContact O-CB 3.12Å; L618-S622 PolarHBondContact O-N 3.15Å; L618-S622 PolarHBondContact O-OG 2.82Å; T619-S622 PolarHBondContact O-N 2.86Å; S622-A624 VanDerWaalsContact C-N 3.35Å; S622-A624 PolarHBondContact O-N 3.02Å; S622-A625 PolarHBondContact O-N 2.93Å; S622-I626 WeakPolarHBondContact O-CB 3.26Å; S622-I626 WeakPolarHBondContact O-CD1 3.29Å; S622-I626 WeakPolarHBondContact O-CG1 3.13Å; S622-I626 PolarHBondContact O-N 3.41Å
623	S	90.8	Very high	91.5	Very high	56 Å²	56	49.9 Å²	49.9	39%	0.392	28%	0.283	S	S	.	.	H	α-helix	trans	-61.8	-41.3	176.4	-68	0	0	0	0	112	T619 E620 I626 N627	T619-S623 WeakPolarHBondContact O-CB 3.21Å; T619-S623 PolarHBondContact O-N 2.99Å; T619-S623 PolarHBondContact O-OG 3.4Å; E620-S623 PolarHBondContact O-N 2.83Å; S623-I626 PolarHBondContact O-N 3.06Å; S623-N627 VanDerWaalsContact O-CB 3.26Å; S623-N627 WeakPolarHBondContact O-CB 3.44Å; S623-N627 PolarHBondContact O-N 3.22Å; S623-N627 PolarHBondContact O-ND2 3.11Å
624	A	89.9	Confident	91.3	Very high	55 Å²	55	52.6 Å²	52.6	46%	0.455	30%	0.304	S	S	.	.	H	α-helix	trans	-61.7	-44.1	175.9	0	0	0	0	0	112.2	E620 H621 S622 S628	E620-A624 WeakPolarHBondContact O-CB 3.2Å; E620-A624 PolarHBondContact O-N 3.48Å; H621-A624 PolarHBondContact O-N 2.82Å; S622-A624 VanDerWaalsContact C-N 3.35Å; S622-A624 PolarHBondContact O-N 3.02Å; A624-S628 WeakPolarHBondContact O-CB 3.35Å; A624-S628 PolarHBondContact O-N 3.5Å
625	A	91.3	Very high	91	Very high	11 Å²	11	57.7 Å²	57.7	9%	0.091	33%	0.33	C	S	.	.	H	α-helix	trans	-64.9	-45.5	176.9	0	0	0	0	0	112.1	H621 S622 S628 L629 Y696 V700	H621-A625 WeakPolarHBondContact O-CB 3.27Å; H621-A625 PolarHBondContact O-N 2.86Å; S622-A625 PolarHBondContact O-N 2.93Å; A625-S628 PolarHBondContact O-N 3.25Å; A625-L629 WeakPolarHBondContact O-CG 3.49Å; A625-L629 PolarHBondContact O-N 2.94Å; A625-Y696 HydrophobicContact CB-CE2 4.31Å; A625-V700 HydrophobicContact CB-CG2 3.79Å
626	I	92.2	Very high	91	Very high	42 Å²	42	55.4 Å²	55.4	22%	0.215	32%	0.318	C	S	.	.	H	α-helix	trans	-60.7	-46.3	176.4	-68	164.6	0	0	0	110.9	S622 S623 S628 L629 N630 T699 T703	S622-I626 WeakPolarHBondContact O-CB 3.26Å; S622-I626 WeakPolarHBondContact O-CD1 3.29Å; S622-I626 WeakPolarHBondContact O-CG1 3.13Å; S622-I626 PolarHBondContact O-N 3.41Å; S623-I626 PolarHBondContact O-N 3.06Å; I626-S628 VanDerWaalsContact C-N 3.35Å; I626-S628 PolarHBondContact O-N 3.3Å; I626-L629 PolarHBondContact O-N 3.1Å; I626-N630 WeakPolarHBondContact CG2-ND2 3.47Å; I626-N630 WeakPolarHBondContact O-CB 3.42Å; I626-N630 PolarHBondContact O-N 3.15Å; I626-N630 PolarHBondContact O-ND2 3.18Å; I626-T699 HydrophobicContact CD1-CG2 3.65Å; I626-T699 HydrophobicContact CG1-CG2 4.22Å; I626-T703 HydrophobicContact CG2-CG2 4.44Å
627	N	90.7	Very high	90.8	Very high	93 Å²	93	53.1 Å²	53.1	50%	0.497	31%	0.308	S	S	.	.	H	α-helix	trans	-64.1	-40.9	178.9	-73.7	-21.2	0	0	0	111.4	S623 N630 N631	S623-N627 VanDerWaalsContact O-CB 3.26Å; S623-N627 WeakPolarHBondContact O-CB 3.44Å; S623-N627 PolarHBondContact O-N 3.22Å; S623-N627 PolarHBondContact O-ND2 3.11Å; N627-N630 PolarHBondContact O-N 3.18Å; N627-N631 WeakPolarHBondContact O-CB 3.15Å; N627-N631 PolarHBondContact O-N 3.47Å; N627-N631 PolarHBondContact O-ND2 2.8Å
628	S	90.3	Very high	90.4	Very high	65 Å²	65	55.3 Å²	55.3	46%	0.455	32%	0.319	S	S	.	.	H	α-helix	trans	-60.4	-44.9	174.6	-176.8	0	0	0	0	112.1	A624 A625 I626 T632	A624-S628 WeakPolarHBondContact O-CB 3.35Å; A624-S628 PolarHBondContact O-N 3.5Å; A625-S628 PolarHBondContact O-N 3.25Å; I626-S628 VanDerWaalsContact C-N 3.35Å; I626-S628 PolarHBondContact O-N 3.3Å; S628-T632 WeakPolarHBondContact O-CB 3.42Å; S628-T632 PolarHBondContact O-N 3.26Å; S628-T632 PolarHBondContact O-OG1 3.17Å
629	L	92.9	Very high	90.2	Very high	3 Å²	3	62.2 Å²	62.2	2%	0.016	36%	0.356	C	S	.	.	H	α-helix	trans	-61.3	-49.7	175.7	-80.5	171.2	0	0	0	112	A625 I626 T632 F633 I648 C651 V700 T703 R704 L707	A625-L629 WeakPolarHBondContact O-CG 3.49Å; A625-L629 PolarHBondContact O-N 2.94Å; I626-L629 PolarHBondContact O-N 3.1Å; L629-T632 WeakPolarHBondContact O-CB 3.33Å; L629-T632 PolarHBondContact O-N 3.07Å; L629-F633 PolarHBondContact O-N 2.55Å; L629-I648 HydrophobicContact CD2-CB 4.48Å; L629-I648 HydrophobicContact CD2-CG1 4.5Å; L629-I648 HydrophobicContact CD2-CG2 4.15Å; L629-C651 HydrophobicContact CD2-CB 3.71Å; L629-C651 HydrophobicContact CG-CB 4.4Å; L629-V700 HydrophobicContact CD1-CG1 4.27Å; L629-T703 HydrophobicContact CB-CG2 4.32Å; L629-T703 HydrophobicContact CD1-CG2 3.98Å; L629-R704 HydrophobicContact CD1-CB 4.48Å; L629-L707 HydrophobicContact CB-CD1 3.77Å
630	N	91.9	Very high	90.3	Very high	67 Å²	67	60.2 Å²	60.2	36%	0.358	34%	0.342	S	S	.	.	H	α-helix	trans	-64.2	-42.4	179.3	-76.7	-37.8	0	0	0	112.5	I626 N627 T632 F633 S634	I626-N630 WeakPolarHBondContact CG2-ND2 3.47Å; I626-N630 WeakPolarHBondContact O-CB 3.42Å; I626-N630 PolarHBondContact O-N 3.15Å; I626-N630 PolarHBondContact O-ND2 3.18Å; N627-N630 PolarHBondContact O-N 3.18Å; N630-T632 VanDerWaalsContact C-N 3.32Å; N630-T632 PolarHBondContact O-N 2.79Å; N630-F633 PolarHBondContact O-N 3.38Å; N630-S634 WeakPolarHBondContact O-CB 3.31Å; N630-S634 PolarHBondContact O-N 2.83Å
631	N	90.7	Very high	90.2	Very high	100 Å²	100	57.9 Å²	57.9	54%	0.535	33%	0.33	S	S	.	.	H	α-helix	trans	-62	-42.6	175.8	-73.1	-18.4	0	0	0	110.7	N627 F633 S634 L635	N627-N631 WeakPolarHBondContact O-CB 3.15Å; N627-N631 PolarHBondContact O-N 3.47Å; N627-N631 PolarHBondContact O-ND2 2.8Å; N631-F633 PolarHBondContact O-N 3.26Å; N631-S634 WeakPolarHBondContact CA-OG 3.42Å; N631-S634 PolarHBondContact O-N 3.44Å; N631-S634 PolarHBondContact O-OG 3.06Å; N631-L635 WeakPolarHBondContact O-CG 3.37Å; N631-L635 PolarHBondContact O-N 2.92Å
632	T	91	Very high	90	Very high	23 Å²	23	60.8 Å²	60.8	14%	0.141	35%	0.348	C	S	.	.	H	α-helix	trans	-61.2	-44.1	175.9	-57.9	0	0	0	0	111.5	S628 L629 N630 L635 V644 R647 I648	S628-T632 WeakPolarHBondContact O-CB 3.42Å; S628-T632 PolarHBondContact O-N 3.26Å; S628-T632 PolarHBondContact O-OG1 3.17Å; L629-T632 WeakPolarHBondContact O-CB 3.33Å; L629-T632 PolarHBondContact O-N 3.07Å; N630-T632 VanDerWaalsContact C-N 3.32Å; N630-T632 PolarHBondContact O-N 2.79Å; T632-L635 PolarHBondContact O-N 3.48Å; T632-V644 HydrophobicContact CG2-CG1 4.23Å; T632-V644 WeakPolarHBondContact O-CG1 3.45Å; T632-R647 HydrophobicContact CG2-CB 3.68Å; T632-I648 HydrophobicContact CG2-CG1 3.97Å
633	F	92.8	Very high	90	Very high	31 Å²	31	65 Å²	65	14%	0.136	37%	0.366	C	S	.	.	H	α-helix	trans	-66.7	-36.9	176.6	-174.3	-99.4	0	0	0	113	L629 N630 N631 L635 L636 I648 L707 K710 F711 K714	L629-F633 PolarHBondContact O-N 2.55Å; N630-F633 PolarHBondContact O-N 3.38Å; N631-F633 PolarHBondContact O-N 3.26Å; F633-L635 PolarHBondContact O-N 3Å; F633-L636 HydrophobicContact CE2-CD2 4.47Å; F633-L636 WeakPolarHBondContact O-CB 3.33Å; F633-L636 PolarHBondContact O-N 3.19Å; F633-L636 VanDerWaalsContact O-N 3.1Å; F633-I648 HydrophobicContact CB-CD1 4.03Å; F633-I648 HydrophobicContact CD2-CD1 3.92Å; F633-I648 HydrophobicContact CG-CD1 4.5Å; F633-L707 HydrophobicContact CB-CD1 4.18Å; F633-L707 HydrophobicContact CB-CD2 3.9Å; F633-L707 HydrophobicContact CD1-CD2 3.86Å; F633-L707 HydrophobicContact CD2-CB 4.13Å; F633-L707 HydrophobicContact CD2-CD2 4.01Å; F633-L707 HydrophobicContact CE1-CD2 4.37Å; F633-L707 HydrophobicContact CE2-CD2 4.49Å; F633-L707 WeakPolarHBondContact CE2-O 3.45Å; F633-L707 HydrophobicContact CG-CD2 3.66Å; F633-K710 HydrophobicContact CE2-CB 4.37Å; F633-K710 HydrophobicContact CZ-CB 3.87Å; F633-F711 HydrophobicContact CE2-CD2 4.28Å; F633-K714 HydrophobicContact CE1-CG 4.44Å; F633-K714 HydrophobicContact CZ-CB 3.96Å; F633-K714 HydrophobicContact CZ-CG 4.16Å
634	S	88.3	Confident	90	Very high	86 Å²	86	62.7 Å²	62.7	60%	0.601	35%	0.35	S	S	*	.	H	α-helix	trans	-65.1	-24.8	178.6	74.1	0	0	0	0	113.6	N630 N631 L636	N630-S634 WeakPolarHBondContact O-CB 3.31Å; N630-S634 PolarHBondContact O-N 2.83Å; N631-S634 WeakPolarHBondContact CA-OG 3.42Å; N631-S634 PolarHBondContact O-N 3.44Å; N631-S634 PolarHBondContact O-OG 3.06Å; S634-L636 PolarHBondContact O-N 3.18Å
635	L	88	Confident	90.1	Very high	107 Å²	107	64.3 Å²	64.3	56%	0.56	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	1	176.5	-67.7	170	0	0	0	112.9	N631 T632 F633 T637 N640	N631-L635 WeakPolarHBondContact O-CG 3.37Å; N631-L635 PolarHBondContact O-N 2.92Å; T632-L635 PolarHBondContact O-N 3.48Å; F633-L635 PolarHBondContact O-N 3Å; L635-T637 PolarHBondContact O-N 3.34Å; L635-N640 PolarHBondContact O-ND2 3.4Å; L635-N640 PolarHBondContact O-OD1 2.8Å
636	L	90.6	Very high	90.1	Very high	11 Å²	11	69.5 Å²	69.5	6%	0.058	37%	0.367	C	S	.	.			trans	-62.2	119.7	-179.3	-179.7	63.7	0	0	0	112	F633 S634 K641 V644 F711 K714 L718	F633-L636 HydrophobicContact CE2-CD2 4.47Å; F633-L636 WeakPolarHBondContact O-CB 3.33Å; F633-L636 PolarHBondContact O-N 3.19Å; F633-L636 VanDerWaalsContact O-N 3.1Å; S634-L636 PolarHBondContact O-N 3.18Å; L636-K641 HydrophobicContact CD1-CB 3.87Å; L636-V644 HydrophobicContact CB-CG1 4.28Å; L636-V644 HydrophobicContact CD1-CB 4.15Å; L636-V644 HydrophobicContact CD1-CG1 4.2Å; L636-F711 HydrophobicContact CD1-CE2 3.88Å; L636-F711 HydrophobicContact CD1-CZ 3.81Å; L636-F711 HydrophobicContact CD2-CD2 4.33Å; L636-F711 HydrophobicContact CD2-CE2 4.06Å; L636-F711 HydrophobicContact CD2-CZ 4.42Å; L636-K714 HydrophobicContact CD2-CB 3.96Å; L636-K714 HydrophobicContact CD2-CG 3.76Å; L636-L718 HydrophobicContact CG-CD1 4.27Å
637	T	88.3	Confident	90.1	Very high	59 Å²	59	74 Å²	74	36%	0.362	38%	0.381	S	S	.	.			trans	-123.8	168.1	170.2	71.2	0	0	0	0	109.7	L635 D639 N640 K641	L635-T637 PolarHBondContact O-N 3.34Å; T637-D639 PolarHBondContact O-N 2.91Å; T637-D639 PolarHBondContact OG1-N 3.13Å; T637-N640 PolarHBondContact N-OD1 3.4Å; T637-N640 PolarHBondContact O-N 2.77Å; T637-N640 PolarHBondContact O-OD1 3.4Å; T637-N640 VanDerWaalsContact OG1-CG 3.24Å; T637-N640 PolarHBondContact OG1-N 2.99Å; T637-N640 PolarHBondContact OG1-OD1 3.08Å; T637-K641 PolarHBondContact O-N 3.45Å
638	L	84.4	Confident	90.1	Very high	53 Å²	53	69.5 Å²	69.5	28%	0.277	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-25.2	173.3	-70.5	170.9	0	0	0	112.4	L718 L719 K722	L638-L718 HydrophobicContact CD2-CB 4.17Å; L638-L718 HydrophobicContact CG-CB 4.16Å; L638-L719 HydrophobicContact CD1-CD2 4.28Å; L638-L719 HydrophobicContact CD2-CD2 3.97Å; L638-L719 HydrophobicContact CD2-CG 4.09Å; L638-K722 HydrophobicContact CD1-CD 4.09Å
639	D	86.1	Confident	90.1	Very high	160 Å²	160	69.9 Å²	69.9	86%	0.856	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-27.5	-175.3	-58.8	-36.6	0	0	0	113.3	T637	T637-D639 PolarHBondContact O-N 2.91Å; T637-D639 PolarHBondContact OG1-N 3.13Å
640	N	91.1	Very high	90	Very high	40 Å²	40	76 Å²	76	21%	0.214	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	10	-175.5	73.1	8.7	0	0	0	114.5	L635 T637 D642 E643 V644	L635-N640 PolarHBondContact O-ND2 3.4Å; L635-N640 PolarHBondContact O-OD1 2.8Å; T637-N640 PolarHBondContact N-OD1 3.4Å; T637-N640 PolarHBondContact O-N 2.77Å; T637-N640 PolarHBondContact O-OD1 3.4Å; T637-N640 VanDerWaalsContact OG1-CG 3.24Å; T637-N640 PolarHBondContact OG1-N 2.99Å; T637-N640 PolarHBondContact OG1-OD1 3.08Å; N640-D642 VanDerWaalsContact C-N 3.31Å; N640-D642 PolarHBondContact O-N 3.41Å; N640-E643 WeakPolarHBondContact O-CB 2.9Å; N640-E643 PolarHBondContact O-N 3.06Å; N640-E643 VanDerWaalsContact O-N 3.09Å; N640-V644 HydrophobicContact CB-CG2 4.47Å; N640-V644 PolarHBondContact O-N 3.36Å
641	K	89.8	Confident	89.8	Confident	82 Å²	82	74.2 Å²	74.2	36%	0.357	38%	0.378	S	S	.	.	H	α-helix	trans	-50.4	-44.5	-174.4	67.6	-174	-177.6	179.5	0	114.3	L636 T637 E643 V644 K645 F711 I715	L636-K641 HydrophobicContact CD1-CB 3.87Å; T637-K641 PolarHBondContact O-N 3.45Å; K641-E643 VanDerWaalsContact C-N 3.34Å; K641-E643 PolarHBondContact O-N 3.14Å; K641-V644 PolarHBondContact O-N 3.4Å; K641-K645 WeakPolarHBondContact O-CB 3.45Å; K641-K645 PolarHBondContact O-N 2.76Å; K641-F711 HydrophobicContact CB-CZ 4.3Å; K641-F711 VanDerWaalsContact O-CZ 3.29Å; K641-F711 WeakPolarHBondContact O-CZ 3.3Å; K641-I715 HydrophobicContact CB-CD1 4.28Å; K641-I715 HydrophobicContact CD-CD1 4.31Å
642	D	88.7	Confident	89.7	Confident	120 Å²	120	72.6 Å²	72.6	64%	0.642	37%	0.374	S	S	*	.	H	α-helix	trans	-71.2	-34.4	-175.4	-61.5	-45	0	0	0	111.1	N640 K646	N640-D642 VanDerWaalsContact C-N 3.31Å; N640-D642 PolarHBondContact O-N 3.41Å; D642-K646 WeakPolarHBondContact O-CB 3.09Å; D642-K646 PolarHBondContact O-N 3.17Å; D642-K646 VanDerWaalsContact O-N 3.15Å
643	E	89.5	Confident	89.7	Confident	102 Å²	102	73.3 Å²	73.3	48%	0.477	38%	0.377	S	S	.	.	H	α-helix	trans	-70.3	-45.3	176.3	-171.6	-178.5	178.5	0	0	111.8	N640 K641 K646 R647	N640-E643 WeakPolarHBondContact O-CB 2.9Å; N640-E643 PolarHBondContact O-N 3.06Å; N640-E643 VanDerWaalsContact O-N 3.09Å; K641-E643 VanDerWaalsContact C-N 3.34Å; K641-E643 PolarHBondContact O-N 3.14Å; E643-K646 PolarHBondContact O-N 2.81Å; E643-R647 WeakPolarHBondContact O-CG 3.26Å; E643-R647 PolarHBondContact O-N 2.64Å; E643-R647 IonicContact OE1-CZ 3.79Å; E643-R647 IonicContact OE1-NE 2.64Å; E643-R647 PolarHBondContact OE1-NE 2.94Å; E643-R647 IonicContact OE1-NH2 2.76Å; E643-R647 PolarHBondContact OE1-NH2 2.91Å
644	V	91.9	Very high	89.6	Confident	7 Å²	7	77 Å²	77	4%	0.042	40%	0.402	C	S	.	.	H	α-helix	trans	-62.5	-44.6	177.9	172	0	0	0	0	110.8	T632 L636 N640 K641 K646 R647 I648 F711	T632-V644 HydrophobicContact CG2-CG1 4.23Å; T632-V644 WeakPolarHBondContact O-CG1 3.45Å; L636-V644 HydrophobicContact CB-CG1 4.28Å; L636-V644 HydrophobicContact CD1-CB 4.15Å; L636-V644 HydrophobicContact CD1-CG1 4.2Å; N640-V644 HydrophobicContact CB-CG2 4.47Å; N640-V644 PolarHBondContact O-N 3.36Å; K641-V644 PolarHBondContact O-N 3.4Å; V644-K646 VanDerWaalsContact C-N 3.31Å; V644-K646 PolarHBondContact O-N 3.45Å; V644-R647 PolarHBondContact O-N 3.21Å; V644-I648 HydrophobicContact CG1-CD1 3.95Å; V644-I648 WeakPolarHBondContact O-CG1 3.3Å; V644-I648 PolarHBondContact O-N 3.28Å; V644-I648 VanDerWaalsContact O-N 3.07Å; V644-F711 HydrophobicContact CG1-CE2 4.24Å
645	K	91.8	Very high	89.7	Confident	89 Å²	89	73.9 Å²	73.9	39%	0.387	38%	0.378	S	S	.	.	H	α-helix	trans	-58.9	-43.4	176.7	-167.5	169.9	-174.2	165.5	0	111.8	K641 T649 L708 F711	K641-K645 WeakPolarHBondContact O-CB 3.45Å; K641-K645 PolarHBondContact O-N 2.76Å; K645-T649 WeakPolarHBondContact O-CB 3.44Å; K645-T649 PolarHBondContact O-N 3.44Å; K645-T649 VanDerWaalsContact O-N 3.08Å; K645-T649 PolarHBondContact O-OG1 3.41Å; K645-L708 HydrophobicContact CG-CD2 4.29Å; K645-F711 HydrophobicContact CB-CE1 4.11Å; K645-F711 HydrophobicContact CB-CE2 3.87Å; K645-F711 HydrophobicContact CB-CZ 3.61Å; K645-F711 HydrophobicContact CD-CD1 4.16Å; K645-F711 HydrophobicContact CD-CE1 3.84Å; K645-F711 HydrophobicContact CD-CZ 4.24Å; K645-F711 HydrophobicContact CG-CE1 4.26Å; K645-F711 HydrophobicContact CG-CE2 4.37Å; K645-F711 HydrophobicContact CG-CZ 4.19Å
646	K	90.8	Very high	89.9	Confident	120 Å²	120	73.9 Å²	73.9	52%	0.522	38%	0.379	S	S	.	.	H	α-helix	trans	-61.4	-49.9	177.2	-175.4	-178.8	176.7	-174.4	0	111.4	D642 E643 V644 I648 T649 E650	D642-K646 WeakPolarHBondContact O-CB 3.09Å; D642-K646 PolarHBondContact O-N 3.17Å; D642-K646 VanDerWaalsContact O-N 3.15Å; E643-K646 PolarHBondContact O-N 2.81Å; V644-K646 VanDerWaalsContact C-N 3.31Å; V644-K646 PolarHBondContact O-N 3.45Å; K646-I648 VanDerWaalsContact C-N 3.35Å; K646-I648 PolarHBondContact O-N 2.8Å; K646-T649 PolarHBondContact O-N 3.45Å; K646-T649 VanDerWaalsContact O-N 3.14Å; K646-E650 VanDerWaalsContact CE-CD 3.44Å; K646-E650 WeakPolarHBondContact CE-OE1 3.23Å; K646-E650 WeakPolarHBondContact CE-OE2 3.23Å; K646-E650 HydrophobicContact CG-CG 4.35Å; K646-E650 WeakPolarHBondContact CG-OE1 3.36Å; K646-E650 IonicContact NZ-OE1 3.96Å; K646-E650 WeakPolarHBondContact O-CB 3.39Å; K646-E650 WeakPolarHBondContact O-CG 3.43Å; K646-E650 PolarHBondContact O-N 3.26Å
647	R	91.3	Very high	89.9	Confident	135 Å²	135	73.5 Å²	73.5	51%	0.509	38%	0.377	S	S	.	.	H	α-helix	trans	-60.1	-39.7	-179.9	-71.2	179	-175.8	-159.2	3.3	113.3	T632 E643 V644 C651	T632-R647 HydrophobicContact CG2-CB 3.68Å; E643-R647 WeakPolarHBondContact O-CG 3.26Å; E643-R647 PolarHBondContact O-N 2.64Å; E643-R647 IonicContact OE1-CZ 3.79Å; E643-R647 IonicContact OE1-NE 2.64Å; E643-R647 PolarHBondContact OE1-NE 2.94Å; E643-R647 IonicContact OE1-NH2 2.76Å; E643-R647 PolarHBondContact OE1-NH2 2.91Å; V644-R647 PolarHBondContact O-N 3.21Å; R647-C651 PolarHBondContact O-N 3.11Å
648	I	92.3	Very high	89.9	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-66.2	-43.1	175.7	-68	170.6	0	0	0	110.6	L629 T632 F633 V644 K646 E650 C651 R704 L707 L708	L629-I648 HydrophobicContact CD2-CB 4.48Å; L629-I648 HydrophobicContact CD2-CG1 4.5Å; L629-I648 HydrophobicContact CD2-CG2 4.15Å; T632-I648 HydrophobicContact CG2-CG1 3.97Å; F633-I648 HydrophobicContact CB-CD1 4.03Å; F633-I648 HydrophobicContact CD2-CD1 3.92Å; F633-I648 HydrophobicContact CG-CD1 4.5Å; V644-I648 HydrophobicContact CG1-CD1 3.95Å; V644-I648 WeakPolarHBondContact O-CG1 3.3Å; V644-I648 PolarHBondContact O-N 3.28Å; V644-I648 VanDerWaalsContact O-N 3.07Å; K646-I648 VanDerWaalsContact C-N 3.35Å; K646-I648 PolarHBondContact O-N 2.8Å; I648-E650 VanDerWaalsContact C-N 3.34Å; I648-E650 PolarHBondContact O-N 3.23Å; I648-C651 PolarHBondContact O-N 3.26Å; I648-R704 HydrophobicContact CG2-CG 4.01Å; I648-R704 WeakPolarHBondContact O-CD 3.3Å; I648-R704 WeakPolarHBondContact O-CG 3.45Å; I648-L707 HydrophobicContact CD1-CB 4.45Å; I648-L707 HydrophobicContact CG2-CB 4.37Å; I648-L708 HydrophobicContact CG2-CD2 4.15Å; I648-L708 HydrophobicContact CG2-CG 4.04Å
649	T	89.7	Confident	90.1	Very high	73 Å²	73	74.4 Å²	74.4	45%	0.448	38%	0.381	S	S	.	.	H	α-helix	trans	-64.7	-38.4	-179.7	-52.3	0	0	0	0	112	K645 K646	K645-T649 WeakPolarHBondContact O-CB 3.44Å; K645-T649 PolarHBondContact O-N 3.44Å; K645-T649 VanDerWaalsContact O-N 3.08Å; K645-T649 PolarHBondContact O-OG1 3.41Å; K646-T649 PolarHBondContact O-N 3.45Å; K646-T649 VanDerWaalsContact O-N 3.14Å
650	E	90.1	Very high	90.4	Very high	132 Å²	132	68 Å²	68	62%	0.617	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	2.7	-176	-68.1	176.3	171.8	0	0	114.1	K646 I648 S652	K646-E650 VanDerWaalsContact CE-CD 3.44Å; K646-E650 WeakPolarHBondContact CE-OE1 3.23Å; K646-E650 WeakPolarHBondContact CE-OE2 3.23Å; K646-E650 HydrophobicContact CG-CG 4.35Å; K646-E650 WeakPolarHBondContact CG-OE1 3.36Å; K646-E650 IonicContact NZ-OE1 3.96Å; K646-E650 WeakPolarHBondContact O-CB 3.39Å; K646-E650 WeakPolarHBondContact O-CG 3.43Å; K646-E650 PolarHBondContact O-N 3.26Å; I648-E650 VanDerWaalsContact C-N 3.34Å; I648-E650 PolarHBondContact O-N 3.23Å; E650-S652 PolarHBondContact O-N 3.47Å
651	C	88.1	Confident	90.4	Very high	29 Å²	29	66.9 Å²	66.9	20%	0.196	34%	0.34	C	S	.	.			trans	-64.1	125.1	177.3	-174	0	0	0	0	111.5	L629 R647 I648 D653	L629-C651 HydrophobicContact CD2-CB 3.71Å; L629-C651 HydrophobicContact CG-CB 4.4Å; R647-C651 PolarHBondContact O-N 3.11Å; I648-C651 PolarHBondContact O-N 3.26Å; C651-D653 PolarHBondContact O-N 3.28Å
652	S	88.9	Confident	90.3	Very high	66 Å²	66	67.6 Å²	67.6	46%	0.462	35%	0.351	S	S	.	.			trans	-66.9	128.7	-179.7	-179.8	0	0	0	0	111.9	E650 V654	E650-S652 PolarHBondContact O-N 3.47Å; S652-V654 VanDerWaalsContact C-N 3.34Å; S652-V654 PolarHBondContact OG-N 2.91Å; S652-V654 VanDerWaalsContact OG-N 3.13Å; S652-V654 PolarHBondContact OG-O 3.47Å
653	D	90.2	Very high	90.3	Very high	38 Å²	38	66.8 Å²	66.8	20%	0.203	35%	0.346	C	S	.	.			trans	-97.1	13.3	169.3	66.7	-14.6	0	0	0	112.3	C651 Y696 K697 V700	C651-D653 PolarHBondContact O-N 3.28Å; D653-Y696 WeakPolarHBondContact O-CD1 3.2Å; D653-Y696 WeakPolarHBondContact O-CE1 3.21Å; D653-K697 HydrophobicContact CB-CG 4.15Å; D653-K697 WeakPolarHBondContact OD2-CE 3.1Å; D653-V700 HydrophobicContact CB-CB 4.42Å; D653-V700 HydrophobicContact CB-CG1 4.2Å
654	V	90.5	Very high	90.4	Very high	107 Å²	107	65.8 Å²	65.8	65%	0.648	34%	0.344	S	S	*	.			trans	-105	128.9	178.4	-175.9	0	0	0	0	110.3	S652	S652-V654 VanDerWaalsContact C-N 3.34Å; S652-V654 PolarHBondContact OG-N 2.91Å; S652-V654 VanDerWaalsContact OG-N 3.13Å; S652-V654 PolarHBondContact OG-O 3.47Å
655	L	91.7	Very high	90.2	Very high	21 Å²	21	72.1 Å²	72.1	11%	0.11	37%	0.371	C	S	.	.			trans	-119.5	127.8	177	-175.6	68.5	0	0	0	110.4	L618 H621 L657 L660 L693 Y696	L618-L655 HydrophobicContact CD1-CD2 4.44Å; H621-L655 HydrophobicContact CB-CD1 3.75Å; H621-L655 HydrophobicContact CB-CD2 4.26Å; L655-L657 VanDerWaalsContact C-N 3.32Å; L655-L657 HydrophobicContact CD2-CD1 4.37Å; L655-L657 PolarHBondContact O-N 2.9Å; L655-L657 VanDerWaalsContact O-N 3.1Å; L655-L660 HydrophobicContact CD1-CD1 3.6Å; L655-L660 HydrophobicContact CD2-CD1 4.36Å; L655-L660 HydrophobicContact CG-CD1 3.98Å; L655-L693 HydrophobicContact CB-CD2 4.02Å; L655-L693 VanDerWaalsContact O-CD2 3.23Å; L655-L693 WeakPolarHBondContact O-CD2 3.35Å; L655-Y696 HydrophobicContact CB-CD1 3.72Å; L655-Y696 HydrophobicContact CB-CD2 4.38Å; L655-Y696 HydrophobicContact CB-CE1 3.77Å; L655-Y696 HydrophobicContact CB-CE2 4.41Å; L655-Y696 HydrophobicContact CB-CG 4.04Å; L655-Y696 HydrophobicContact CD1-CE2 4.39Å; L655-Y696 HydrophobicContact CD2-CD2 4.05Å; L655-Y696 HydrophobicContact CD2-CE2 4.41Å; L655-Y696 HydrophobicContact CD2-CG 4.22Å
656	D	91.1	Very high	89.9	Confident	107 Å²	107	68.6 Å²	68.6	57%	0.572	36%	0.357	S	S	*	.			trans	-84.2	75.9	171.4	-170.4	-10.8	0	0	0	110.7	G658 H659 L660	D656-G658 PolarHBondContact O-N 3.38Å; D656-G658 PolarHBondContact OD1-N 2.86Å; D656-H659 HydrophobicContact CB-CB 4.32Å; D656-H659 VanDerWaalsContact CG-CB 3.49Å; D656-H659 PolarHBondContact O-N 3.46Å; D656-H659 PolarHBondContact OD1-N 3.13Å; D656-H659 WeakPolarHBondContact OD2-CB 3.23Å; D656-L660 VanDerWaalsContact O-CG 3.32Å; D656-L660 WeakPolarHBondContact O-CG 3.13Å; D656-L660 PolarHBondContact O-N 2.97Å
657	L	91.9	Very high	89.8	Confident	3 Å²	3	68.2 Å²	68.2	2%	0.016	37%	0.37	C	S	.	.	H	α-helix	trans	-62.8	-25.8	-179.7	-170.4	63.4	0	0	0	112.5	L614 L617 L655 F661 Y685 L692 L693	L614-L657 HydrophobicContact CD2-CD1 4.08Å; L614-L657 HydrophobicContact CD2-CD2 4.11Å; L614-L657 HydrophobicContact CD2-CG 3.97Å; L617-L657 HydrophobicContact CB-CD1 4.31Å; L655-L657 VanDerWaalsContact C-N 3.32Å; L655-L657 HydrophobicContact CD2-CD1 4.37Å; L655-L657 PolarHBondContact O-N 2.9Å; L655-L657 VanDerWaalsContact O-N 3.1Å; L657-F661 VanDerWaalsContact O-CB 3.3Å; L657-F661 WeakPolarHBondContact O-CB 3.31Å; L657-F661 PolarHBondContact O-N 2.79Å; L657-Y685 HydrophobicContact CG-CE2 4.26Å; L657-L692 HydrophobicContact CD2-CB 4.2Å; L657-L692 HydrophobicContact CD2-CD1 4.21Å; L657-L693 HydrophobicContact CB-CD2 4Å; L657-L693 HydrophobicContact CB-CG 4.45Å; L657-L693 HydrophobicContact CD2-CG 4.35Å
658	G	88.9	Confident	89.7	Confident	19 Å²	19	66.3 Å²	66.3	20%	0.196	36%	0.363	C	S	.	.	H	α-helix	trans	-69.3	-50.7	179.7	0	0	0	0	0	111.7	D656 L660 F661 V662 Y685	D656-G658 PolarHBondContact O-N 3.38Å; D656-G658 PolarHBondContact OD1-N 2.86Å; G658-L660 VanDerWaalsContact C-N 3.29Å; G658-L660 PolarHBondContact O-N 3.46Å; G658-F661 PolarHBondContact O-N 2.91Å; G658-V662 WeakPolarHBondContact O-CG2 3.3Å; G658-V662 PolarHBondContact O-N 2.88Å; G658-V662 VanDerWaalsContact O-N 3.1Å; G658-Y685 VanDerWaalsContact CA-OH 3.27Å; G658-Y685 WeakPolarHBondContact CA-OH 3.48Å; G658-Y685 PolarHBondContact N-OH 2.87Å
659	H	88.5	Confident	89.2	Confident	113 Å²	113	68.3 Å²	68.3	52%	0.523	38%	0.377	S	S	.	.	H	α-helix	trans	-60.8	-39.9	175.2	-179.5	-93.5	0	0	0	111.9	D656 N663	D656-H659 HydrophobicContact CB-CB 4.32Å; D656-H659 VanDerWaalsContact CG-CB 3.49Å; D656-H659 PolarHBondContact O-N 3.46Å; D656-H659 PolarHBondContact OD1-N 3.13Å; D656-H659 WeakPolarHBondContact OD2-CB 3.23Å; H659-N663 PolarHBondContact CE1-ND2 3.39Å; H659-N663 PolarHBondContact O-N 3.22Å; H659-N663 PolarHBondContact O-ND2 3.15Å; H659-N663 VanDerWaalsContact O-ND2 3.15Å
660	L	91.1	Very high	88.8	Confident	26 Å²	26	70.9 Å²	70.9	14%	0.136	40%	0.398	C	S	.	.	H	α-helix	trans	-63.9	-43.2	177	-69.3	171.4	0	0	0	112.5	L617 H621 L655 D656 G658 N663 N664	L617-L660 HydrophobicContact CD1-CB 4.07Å; L617-L660 HydrophobicContact CD2-CB 4.26Å; H621-L660 WeakPolarHBondContact NE2-CD1 3.42Å; H621-L660 WeakPolarHBondContact NE2-CD2 3.32Å; L655-L660 HydrophobicContact CD1-CD1 3.6Å; L655-L660 HydrophobicContact CD2-CD1 4.36Å; L655-L660 HydrophobicContact CG-CD1 3.98Å; D656-L660 VanDerWaalsContact O-CG 3.32Å; D656-L660 WeakPolarHBondContact O-CG 3.13Å; D656-L660 PolarHBondContact O-N 2.97Å; G658-L660 VanDerWaalsContact C-N 3.29Å; G658-L660 PolarHBondContact O-N 3.46Å; L660-N663 PolarHBondContact O-N 3.36Å; L660-N664 PolarHBondContact O-N 2.84Å; L660-N664 PolarHBondContact O-ND2 3.48Å
661	F	92.3	Very high	88.3	Confident	16 Å²	16	68.5 Å²	68.5	7%	0.07	39%	0.387	C	S	.	.	H	α-helix	trans	-65.7	-41.2	179.2	-179.6	-114.1	0	0	0	112.7	T610 T613 L614 L657 G658 N663 N664 K665 M681 Y685	T610-F661 HydrophobicContact CG2-CE2 3.68Å; T610-F661 HydrophobicContact CG2-CZ 3.59Å; T613-F661 HydrophobicContact CG2-CD2 4.21Å; T613-F661 HydrophobicContact CG2-CE2 4.35Å; L614-F661 HydrophobicContact CD2-CB 4.05Å; L614-F661 HydrophobicContact CD2-CD2 3.73Å; L614-F661 HydrophobicContact CD2-CG 4.03Å; L614-F661 HydrophobicContact CG-CD2 3.97Å; L614-F661 HydrophobicContact CG-CE2 4.31Å; L657-F661 VanDerWaalsContact O-CB 3.3Å; L657-F661 WeakPolarHBondContact O-CB 3.31Å; L657-F661 PolarHBondContact O-N 2.79Å; G658-F661 PolarHBondContact O-N 2.91Å; F661-N663 PolarHBondContact O-N 2.98Å; F661-N664 CarbonylContact O-C 3.4Å; F661-N664 PolarHBondContact O-N 2.87Å; F661-K665 PolarHBondContact O-N 3.35Å; F661-M681 HydrophobicContact CE1-CB 4.41Å; F661-M681 HydrophobicContact CZ-CB 4.13Å; F661-M681 HydrophobicContact CZ-CG 4.41Å; F661-Y685 HydrophobicContact CB-CD2 4.17Å; F661-Y685 HydrophobicContact CB-CE2 4.1Å; F661-Y685 AromaticContact CD1-CD2 3.84Å; F661-Y685 HydrophobicContact CD1-CD2 3.84Å; F661-Y685 HydrophobicContact CD1-CE2 4.45Å; F661-Y685 HydrophobicContact CE1-CD2 4.47Å; F661-Y685 AromaticContact CG-CD2 3.99Å; F661-Y685 HydrophobicContact CG-CD2 3.99Å; F661-Y685 HydrophobicContact CG-CE2 4.42Å
662	V	88.1	Confident	88.2	Confident	97 Å²	97	67.5 Å²	67.5	59%	0.588	38%	0.379	S	S	*	.	H	α-helix	trans	-58.5	-37.4	178.8	170.2	0	0	0	0	111.9	G658 N664	G658-V662 WeakPolarHBondContact O-CG2 3.3Å; G658-V662 PolarHBondContact O-N 2.88Å; G658-V662 VanDerWaalsContact O-N 3.1Å; V662-N664 VanDerWaalsContact C-N 3.34Å
663	N	88.5	Confident	88	Confident	102 Å²	102	70.9 Å²	70.9	55%	0.545	39%	0.388	S	S	.	.	H	α-helix	trans	-80.4	-14	179.3	-67.6	-35.3	0	0	0	113.7	H659 L660 F661	H659-N663 PolarHBondContact CE1-ND2 3.39Å; H659-N663 PolarHBondContact O-N 3.22Å; H659-N663 PolarHBondContact O-ND2 3.15Å; H659-N663 VanDerWaalsContact O-ND2 3.15Å; L660-N663 PolarHBondContact O-N 3.36Å; F661-N663 PolarHBondContact O-N 2.98Å
664	N	90.2	Very high	87.8	Confident	82 Å²	82	74.4 Å²	74.4	44%	0.439	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	23.3	-174.5	-65.9	-78	0	0	0	112.9	T613 L617 L660 F661 V662	T613-N664 HydrophobicContact CG2-CB 4.17Å; T613-N664 WeakPolarHBondContact CG2-O 3.39Å; L617-N664 HydrophobicContact CD1-CB 4.21Å; L617-N664 HydrophobicContact CD2-CB 4.3Å; L660-N664 PolarHBondContact O-N 2.84Å; L660-N664 PolarHBondContact O-ND2 3.48Å; F661-N664 CarbonylContact O-C 3.4Å; F661-N664 PolarHBondContact O-N 2.87Å; V662-N664 VanDerWaalsContact C-N 3.34Å
665	K	87.4	Confident	87.7	Confident	140 Å²	140	74.3 Å²	74.3	61%	0.609	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-57.8	134.1	-178.1	59.7	-178.2	178.1	-179.9	0	111.6	F661 M681	F661-K665 PolarHBondContact O-N 3.35Å; K665-M681 HydrophobicContact CB-SD 4.44Å
666	P	87.4	Confident	87.7	Confident	15 Å²	15	75.9 Å²	75.9	10%	0.097	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-66.5	151.6	177.9	26.7	-33.4	0	0	0	111.7	L606 D609 M681	L606-P666 HydrophobicContact CD1-CG 4.09Å; D609-P666 HydrophobicContact CB-CB 3.93Å; D609-P666 HydrophobicContact CB-CG 4.44Å; P666-M681 HydrophobicContact CG-SD 4.34Å
667	S	87.8	Confident	87.7	Confident	111 Å²	111	70.8 Å²	70.8	78%	0.776	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-74	149.2	172.9	-36.2	0	0	0	0	110.3
668	Y	88.5	Confident	87.6	Confident	95 Å²	95	74.9 Å²	74.9	37%	0.373	40%	0.398	S	S	.	.			trans	-129.2	154.5	176.1	57	-91.1	0	0	0	112.3	L606 I672 A677 M681	L606-Y668 HydrophobicContact CD2-CG 4.41Å; Y668-I672 HydrophobicContact CD2-CB 4.44Å; Y668-A677 HydrophobicContact CD1-CB 3.78Å; Y668-A677 HydrophobicContact CD2-CB 3.62Å; Y668-A677 HydrophobicContact CE1-CB 3.81Å; Y668-A677 HydrophobicContact CE2-CB 3.64Å; Y668-A677 HydrophobicContact CG-CB 3.7Å; Y668-M681 HydrophobicContact CD1-CE 4.18Å; Y668-M681 HydrophobicContact CE1-CE 4.11Å
669	S	82.2	Confident	87.7	Confident	43 Å²	43	79.2 Å²	79.2	30%	0.301	42%	0.417	S	S	.	.			trans	-62	145.1	178.8	176.3	0	0	0	0	111.3	E671 I672	S669-E671 PolarHBondContact O-N 3.5Å; S669-E671 VanDerWaalsContact O-N 3.12Å; S669-E671 WeakPolarHBondContact OG-CB 3.29Å; S669-E671 WeakPolarHBondContact OG-CG 3.45Å; S669-E671 PolarHBondContact OG-N 2.89Å; S669-E671 VanDerWaalsContact OG-N 3.14Å; S669-E671 PolarHBondContact OG-OE2 2.83Å; S669-I672 PolarHBondContact O-N 2.84Å; S669-I672 VanDerWaalsContact O-N 3.08Å
670	S	81.1	Confident	88	Confident	126 Å²	126	75.4 Å²	75.4	88%	0.881	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-10.8	170.9	55.2	0	0	0	0	113.5	I672	S670-I672 VanDerWaalsContact C-N 3.33Å
671	E	79.1	Confident	88.1	Confident	82 Å²	82	75 Å²	75	38%	0.383	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-15.5	173.9	-60.9	173.3	135.5	0	0	113.2	R598 I599 S669	R598-E671 IonicContact NE-OE1 2.95Å; R598-E671 PolarHBondContact NE-OE1 2.9Å; I599-E671 HydrophobicContact CG1-CB 4.3Å; S669-E671 PolarHBondContact O-N 3.5Å; S669-E671 VanDerWaalsContact O-N 3.12Å; S669-E671 WeakPolarHBondContact OG-CB 3.29Å; S669-E671 WeakPolarHBondContact OG-CG 3.45Å; S669-E671 PolarHBondContact OG-N 2.89Å; S669-E671 VanDerWaalsContact OG-N 3.14Å; S669-E671 PolarHBondContact OG-OE2 2.83Å
672	I	86.9	Confident	88.1	Confident	8 Å²	8	78.4 Å²	78.4	4%	0.041	42%	0.416	C	S	.	.	S	Bend	trans	-95.1	126.7	175.3	-52.7	178.2	0	0	0	108.3	A602 K603 L606 Y668 S669 S670 D676 A677	A602-I672 HydrophobicContact CB-CD1 3.81Å; A602-I672 HydrophobicContact CB-CG1 3.9Å; A602-I672 WeakPolarHBondContact O-CD1 3.26Å; K603-I672 HydrophobicContact CG-CD1 4.38Å; K603-I672 HydrophobicContact CG-CG1 4.44Å; L606-I672 HydrophobicContact CB-CD1 4.22Å; L606-I672 HydrophobicContact CD2-CD1 4.05Å; Y668-I672 HydrophobicContact CD2-CB 4.44Å; S669-I672 PolarHBondContact O-N 2.84Å; S669-I672 VanDerWaalsContact O-N 3.08Å; S670-I672 VanDerWaalsContact C-N 3.33Å; I672-D676 HydrophobicContact CG2-CB 3.73Å; I672-A677 HydrophobicContact CG2-CB 3.99Å
673	E	85.4	Confident	88.3	Confident	138 Å²	138	75.5 Å²	75.5	65%	0.645	41%	0.406	S	S	*	.			trans	-62.4	144.2	173.4	-69.8	-166.1	173.6	0	0	111.2	N675 D676 A677	E673-N675 PolarHBondContact O-N 2.91Å; E673-N675 VanDerWaalsContact O-N 3.1Å; E673-D676 HydrophobicContact CB-CB 4.45Å; E673-D676 WeakPolarHBondContact O-CB 3.08Å; E673-D676 PolarHBondContact O-N 2.85Å; E673-A677 PolarHBondContact O-N 2.86Å
674	E	86.2	Confident	88.5	Confident	111 Å²	111	70.7 Å²	70.7	52%	0.519	38%	0.381	S	S	.	.	H	α-helix	trans	-55.1	-35.5	-176	-176	-177.7	165.1	0	0	112.9	K678	E674-K678 WeakPolarHBondContact O-CG 3.28Å; E674-K678 PolarHBondContact O-N 3.33Å; E674-K678 VanDerWaalsContact OE1-CE 3.31Å; E674-K678 WeakPolarHBondContact OE1-CE 3.38Å; E674-K678 IonicContact OE1-NZ 3.4Å; E674-K678 PolarHBondContact OE1-NZ 2.8Å
675	N	88.5	Confident	88.7	Confident	105 Å²	105	69.5 Å²	69.5	56%	0.561	37%	0.37	S	S	*	.	H	α-helix	trans	-70	-43.8	176.8	-68.2	-28.3	0	0	0	111.9	E673 A677 K678 D679	E673-N675 PolarHBondContact O-N 2.91Å; E673-N675 VanDerWaalsContact O-N 3.1Å; N675-A677 VanDerWaalsContact C-N 3.28Å; N675-A677 PolarHBondContact O-N 3.47Å; N675-K678 PolarHBondContact O-N 2.98Å; N675-D679 PolarHBondContact O-N 2.86Å
676	D	90.1	Very high	88.9	Confident	54 Å²	54	70.9 Å²	70.9	29%	0.289	38%	0.376	S	S	.	.	H	α-helix	trans	-59.6	-41.6	174.7	-81.9	-22.3	0	0	0	110.9	K603 I672 E673 D679 I680	K603-D676 WeakPolarHBondContact CE-OD2 3.49Å; K603-D676 VanDerWaalsContact NZ-CG 3.32Å; K603-D676 IonicContact NZ-OD1 2.74Å; K603-D676 IonicContact NZ-OD2 3.2Å; K603-D676 PolarHBondContact NZ-OD2 3.3Å; I672-D676 HydrophobicContact CG2-CB 3.73Å; E673-D676 HydrophobicContact CB-CB 4.45Å; E673-D676 WeakPolarHBondContact O-CB 3.08Å; E673-D676 PolarHBondContact O-N 2.85Å; D676-D679 PolarHBondContact O-N 2.98Å; D676-I680 WeakPolarHBondContact O-CB 3.33Å; D676-I680 WeakPolarHBondContact O-CD1 3.27Å; D676-I680 WeakPolarHBondContact O-CG1 3.22Å; D676-I680 PolarHBondContact O-N 3.31Å
677	A	91.5	Very high	89.1	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-63.1	-44.9	177.5	0	0	0	0	0	111.7	L606 Y668 I672 E673 N675 I680 M681	L606-A677 HydrophobicContact CD2-CB 3.82Å; Y668-A677 HydrophobicContact CD1-CB 3.78Å; Y668-A677 HydrophobicContact CD2-CB 3.62Å; Y668-A677 HydrophobicContact CE1-CB 3.81Å; Y668-A677 HydrophobicContact CE2-CB 3.64Å; Y668-A677 HydrophobicContact CG-CB 3.7Å; I672-A677 HydrophobicContact CG2-CB 3.99Å; E673-A677 PolarHBondContact O-N 2.86Å; N675-A677 VanDerWaalsContact C-N 3.28Å; N675-A677 PolarHBondContact O-N 3.47Å; A677-I680 PolarHBondContact O-N 3.39Å; A677-M681 HydrophobicContact CB-CE 4.18Å; A677-M681 WeakPolarHBondContact O-CB 3.04Å; A677-M681 VanDerWaalsContact O-CE 3.23Å; A677-M681 WeakPolarHBondContact O-CE 3.38Å; A677-M681 WeakPolarHBondContact O-CG 3.38Å; A677-M681 PolarHBondContact O-N 3.09Å
678	K	90.3	Very high	89.3	Confident	90 Å²	90	71.6 Å²	71.6	39%	0.391	37%	0.367	S	S	.	.	H	α-helix	trans	-60.5	-43.6	175.1	-76	171.9	-173.3	163.1	0	111.7	E674 N675 N682	E674-K678 WeakPolarHBondContact O-CG 3.28Å; E674-K678 PolarHBondContact O-N 3.33Å; E674-K678 VanDerWaalsContact OE1-CE 3.31Å; E674-K678 WeakPolarHBondContact OE1-CE 3.38Å; E674-K678 IonicContact OE1-NZ 3.4Å; E674-K678 PolarHBondContact OE1-NZ 2.8Å; N675-K678 PolarHBondContact O-N 2.98Å; K678-N682 VanDerWaalsContact O-CB 3.23Å; K678-N682 WeakPolarHBondContact O-CB 3.42Å; K678-N682 PolarHBondContact O-N 3.39Å; K678-N682 PolarHBondContact O-ND2 3.34Å; K678-N682 VanDerWaalsContact O-ND2 3.11Å
679	D	91.6	Very high	89.5	Confident	109 Å²	109	67.8 Å²	67.8	58%	0.583	35%	0.354	S	S	*	.	H	α-helix	trans	-67.9	-41.3	-178.9	-75	-15.5	0	0	0	112.2	N675 D676 G683	N675-D679 PolarHBondContact O-N 2.86Å; D676-D679 PolarHBondContact O-N 2.98Å; D679-G683 PolarHBondContact O-N 3.5Å
680	I	93.2	Very high	89.9	Confident	34 Å²	34	69.2 Å²	69.2	17%	0.174	37%	0.369	C	S	.	.	H	α-helix	trans	-62.8	-48.3	175.8	-69	163.7	0	0	0	110.6	K603 L606 K607 D676 A677 G683 A684	K603-I680 HydrophobicContact CB-CD1 3.72Å; K603-I680 HydrophobicContact CD-CD1 4.1Å; K603-I680 HydrophobicContact CG-CD1 3.57Å; L606-I680 HydrophobicContact CB-CG2 4.23Å; L606-I680 HydrophobicContact CD2-CB 4.19Å; L606-I680 HydrophobicContact CD2-CD1 4.34Å; L606-I680 HydrophobicContact CD2-CG2 4.13Å; L606-I680 HydrophobicContact CG-CG2 3.96Å; K607-I680 HydrophobicContact CB-CG2 3.88Å; D676-I680 WeakPolarHBondContact O-CB 3.33Å; D676-I680 WeakPolarHBondContact O-CD1 3.27Å; D676-I680 WeakPolarHBondContact O-CG1 3.22Å; D676-I680 PolarHBondContact O-N 3.31Å; A677-I680 PolarHBondContact O-N 3.39Å; I680-G683 PolarHBondContact O-N 3.21Å; I680-A684 WeakPolarHBondContact O-CB 3.42Å; I680-A684 PolarHBondContact O-N 3.49Å
681	M	94.3	Very high	90.4	Very high	16 Å²	16	67.2 Å²	67.2	8%	0.079	36%	0.355	C	S	.	.	H	α-helix	trans	-63.5	-46.2	179.4	-75.4	-175.2	-76.3	0	0	111.9	L606 F661 K665 P666 Y668 A677 G683 A684 Y685	L606-M681 HydrophobicContact CD1-CG 4.16Å; L606-M681 HydrophobicContact CD1-SD 4.47Å; L606-M681 HydrophobicContact CG-CG 4.37Å; F661-M681 HydrophobicContact CE1-CB 4.41Å; F661-M681 HydrophobicContact CZ-CB 4.13Å; F661-M681 HydrophobicContact CZ-CG 4.41Å; K665-M681 HydrophobicContact CB-SD 4.44Å; P666-M681 HydrophobicContact CG-SD 4.34Å; Y668-M681 HydrophobicContact CD1-CE 4.18Å; Y668-M681 HydrophobicContact CE1-CE 4.11Å; A677-M681 HydrophobicContact CB-CE 4.18Å; A677-M681 WeakPolarHBondContact O-CB 3.04Å; A677-M681 VanDerWaalsContact O-CE 3.23Å; A677-M681 WeakPolarHBondContact O-CE 3.38Å; A677-M681 WeakPolarHBondContact O-CG 3.38Å; A677-M681 PolarHBondContact O-N 3.09Å; M681-G683 VanDerWaalsContact C-N 3.31Å; M681-G683 PolarHBondContact O-N 3.26Å; M681-A684 PolarHBondContact O-N 3.35Å; M681-Y685 WeakPolarHBondContact O-CB 3.46Å; M681-Y685 PolarHBondContact O-N 3.32Å
682	N	91.7	Very high	91	Very high	88 Å²	88	64 Å²	64	47%	0.471	34%	0.34	S	S	.	.	H	α-helix	trans	-65.2	-35.6	177.5	-73.9	-29.3	0	0	0	112.2	K678 K686	K678-N682 VanDerWaalsContact O-CB 3.23Å; K678-N682 WeakPolarHBondContact O-CB 3.42Å; K678-N682 PolarHBondContact O-N 3.39Å; K678-N682 PolarHBondContact O-ND2 3.34Å; K678-N682 VanDerWaalsContact O-ND2 3.11Å; N682-K686 WeakPolarHBondContact O-CB 3.36Å; N682-K686 WeakPolarHBondContact O-CG 3.24Å; N682-K686 PolarHBondContact O-N 2.92Å
683	G	92.5	Very high	91.3	Very high	36 Å²	36	66.5 Å²	66.5	37%	0.371	35%	0.353	S	S	.	.	H	α-helix	trans	-63.7	-51.8	175.3	0	0	0	0	0	111.7	D679 I680 M681 Y685 K686 E687	D679-G683 PolarHBondContact O-N 3.5Å; I680-G683 PolarHBondContact O-N 3.21Å; M681-G683 VanDerWaalsContact C-N 3.31Å; M681-G683 PolarHBondContact O-N 3.26Å; G683-Y685 PolarHBondContact O-N 3.23Å; G683-K686 PolarHBondContact O-N 2.88Å; G683-E687 WeakPolarHBondContact O-CB 3.31Å; G683-E687 PolarHBondContact O-N 3.3Å
684	A	92.5	Very high	91.6	Very high	1 Å²	1	62.6 Å²	62.6	1%	0.008	34%	0.344	C	S	.	.	H	α-helix	trans	-60.6	-42.2	175.8	0	0	0	0	0	112.1	K607 T610 I611 I680 M681 K686 E687 I688	K607-A684 HydrophobicContact CG-CB 4.23Å; T610-A684 HydrophobicContact CG2-CB 3.58Å; I611-A684 HydrophobicContact CG1-CB 4.21Å; I680-A684 WeakPolarHBondContact O-CB 3.42Å; I680-A684 PolarHBondContact O-N 3.49Å; M681-A684 PolarHBondContact O-N 3.35Å; A684-K686 PolarHBondContact O-N 3.45Å; A684-E687 WeakPolarHBondContact O-CB 3.26Å; A684-E687 PolarHBondContact O-N 3.1Å; A684-I688 PolarHBondContact O-N 3.18Å
685	Y	94.5	Very high	91.9	Very high	57 Å²	57	59.8 Å²	59.8	22%	0.224	34%	0.337	C	S	.	.	H	α-helix	trans	-57.8	-47.9	174.5	-178.7	-86.8	0	0	0	111.8	L614 L657 G658 F661 M681 G683 E687 S689	L614-Y685 HydrophobicContact CD1-CD2 4.23Å; L614-Y685 HydrophobicContact CD2-CD2 3.8Å; L614-Y685 HydrophobicContact CD2-CE2 4.13Å; L657-Y685 HydrophobicContact CG-CE2 4.26Å; G658-Y685 VanDerWaalsContact CA-OH 3.27Å; G658-Y685 WeakPolarHBondContact CA-OH 3.48Å; G658-Y685 PolarHBondContact N-OH 2.87Å; F661-Y685 HydrophobicContact CB-CD2 4.17Å; F661-Y685 HydrophobicContact CB-CE2 4.1Å; F661-Y685 AromaticContact CD1-CD2 3.84Å; F661-Y685 HydrophobicContact CD1-CD2 3.84Å; F661-Y685 HydrophobicContact CD1-CE2 4.45Å; F661-Y685 HydrophobicContact CE1-CD2 4.47Å; F661-Y685 AromaticContact CG-CD2 3.99Å; F661-Y685 HydrophobicContact CG-CD2 3.99Å; F661-Y685 HydrophobicContact CG-CE2 4.42Å; M681-Y685 WeakPolarHBondContact O-CB 3.46Å; M681-Y685 PolarHBondContact O-N 3.32Å; G683-Y685 PolarHBondContact O-N 3.23Å; Y685-E687 VanDerWaalsContact C-N 3.29Å; Y685-E687 PolarHBondContact O-N 3.39Å; Y685-S689 WeakPolarHBondContact O-CB 3.46Å; Y685-S689 PolarHBondContact O-N 2.99Å; Y685-S689 PolarHBondContact O-OG 3.4Å
686	K	91.5	Very high	92.2	Very high	169 Å²	169	55.6 Å²	55.6	74%	0.735	31%	0.313	S	S	*	.	H	α-helix	trans	-64.8	-32.7	177.5	-78	-179.7	-179.4	178	0	112.9	N682 G683 A684	N682-K686 WeakPolarHBondContact O-CB 3.36Å; N682-K686 WeakPolarHBondContact O-CG 3.24Å; N682-K686 PolarHBondContact O-N 2.92Å; G683-K686 PolarHBondContact O-N 2.88Å; A684-K686 PolarHBondContact O-N 3.45Å
687	E	91.4	Very high	92.3	Very high	113 Å²	113	58.5 Å²	58.5	53%	0.528	32%	0.323	S	S	.	.	H	α-helix	trans	-65.4	-41.9	-177.5	-173.6	173.8	174.3	0	0	112.1	K607 G683 A684 Y685	K607-E687 WeakPolarHBondContact CE-OE2 3.45Å; K607-E687 IonicContact NZ-OE1 2.66Å; K607-E687 PolarHBondContact NZ-OE1 3.02Å; K607-E687 IonicContact NZ-OE2 3.98Å; K607-E687 PolarHBondContact NZ-OE2 3.24Å; G683-E687 WeakPolarHBondContact O-CB 3.31Å; G683-E687 PolarHBondContact O-N 3.3Å; A684-E687 WeakPolarHBondContact O-CB 3.26Å; A684-E687 PolarHBondContact O-N 3.1Å; Y685-E687 VanDerWaalsContact C-N 3.29Å; Y685-E687 PolarHBondContact O-N 3.39Å
688	I	93	Very high	92.4	Very high	28 Å²	28	64.9 Å²	64.9	14%	0.144	35%	0.353	C	S	.	.	H	α-helix	trans	-116.2	-20	-170.9	69.5	177.7	0	0	0	115.3	I611 L614 A684 A690 S691 L692	I611-I688 HydrophobicContact CB-CD1 4.11Å; I611-I688 HydrophobicContact CG1-CD1 4.05Å; I611-I688 HydrophobicContact CG2-CD1 3.9Å; L614-I688 HydrophobicContact CB-CD1 3.75Å; L614-I688 HydrophobicContact CB-CG1 4.43Å; L614-I688 HydrophobicContact CD1-CD1 3.75Å; L614-I688 HydrophobicContact CD1-CG1 3.85Å; L614-I688 HydrophobicContact CG-CD1 4.4Å; A684-I688 PolarHBondContact O-N 3.18Å; I688-A690 VanDerWaalsContact C-N 3.3Å; I688-A690 PolarHBondContact O-N 2.85Å; I688-S691 PolarHBondContact O-N 3.45Å; I688-L692 HydrophobicContact CB-CD1 4.39Å; I688-L692 HydrophobicContact CB-CG 4.44Å; I688-L692 HydrophobicContact CD1-CD1 3.8Å; I688-L692 HydrophobicContact CG1-CD1 3.81Å; I688-L692 HydrophobicContact CG1-CG 4.38Å; I688-L692 WeakPolarHBondContact O-CG 3.43Å; I688-L692 PolarHBondContact O-N 3.4Å
689	S	91.9	Very high	92.4	Very high	16 Å²	16	62.8 Å²	62.8	11%	0.112	35%	0.348	C	S	.	.	H	α-helix	trans	-54.6	-41.2	-173.2	51.8	0	0	0	0	113.9	Y685 S691 L692 L693	Y685-S689 WeakPolarHBondContact O-CB 3.46Å; Y685-S689 PolarHBondContact O-N 2.99Å; Y685-S689 PolarHBondContact O-OG 3.4Å; S689-S691 PolarHBondContact O-N 3.29Å; S689-L692 PolarHBondContact O-N 3.37Å; S689-L693 WeakPolarHBondContact O-CB 3.48Å; S689-L693 VanDerWaalsContact O-CG 3.26Å; S689-L693 WeakPolarHBondContact O-CG 3.25Å; S689-L693 PolarHBondContact O-N 3.34Å
690	A	90.8	Very high	92.5	Very high	73 Å²	73	57.6 Å²	57.6	60%	0.603	32%	0.32	S	S	*	.	H	α-helix	trans	-64.4	-41.2	179.4	0	0	0	0	0	112.2	I688 A694	I688-A690 VanDerWaalsContact C-N 3.3Å; I688-A690 PolarHBondContact O-N 2.85Å; A690-A694 WeakPolarHBondContact O-CB 3.46Å; A690-A694 PolarHBondContact O-N 3.49Å; A690-A694 VanDerWaalsContact O-N 3.07Å
691	S	91.6	Very high	92.4	Very high	84 Å²	84	57.4 Å²	57.4	59%	0.587	32%	0.32	S	S	*	.	H	α-helix	trans	-68.4	-41.3	176.7	179.8	0	0	0	0	111.5	I688 S689 A694 S695	I688-S691 PolarHBondContact O-N 3.45Å; S689-S691 PolarHBondContact O-N 3.29Å; S691-A694 PolarHBondContact O-N 2.7Å; S691-S695 PolarHBondContact O-N 2.89Å
692	L	92.5	Very high	92.3	Very high	13 Å²	13	59.6 Å²	59.6	7%	0.068	34%	0.335	C	S	.	.	H	α-helix	trans	-65.5	-44	178.7	-64.9	178.3	0	0	0	111.6	L614 N615 L618 L657 I688 S689 A694 S695 Y696	L614-L692 HydrophobicContact CB-CD1 3.74Å; N615-L692 VanDerWaalsContact OD1-CD2 3.29Å; N615-L692 WeakPolarHBondContact OD1-CD2 3.28Å; L618-L692 HydrophobicContact CB-CD2 4.39Å; L618-L692 HydrophobicContact CD1-CB 4.45Å; L618-L692 VanDerWaalsContact CD1-O 3.31Å; L618-L692 WeakPolarHBondContact CD1-O 3.45Å; L618-L692 HydrophobicContact CD2-CB 3.92Å; L618-L692 HydrophobicContact CD2-CD2 3.39Å; L618-L692 HydrophobicContact CD2-CG 4.2Å; L618-L692 HydrophobicContact CG-CD2 4.46Å; L657-L692 HydrophobicContact CD2-CB 4.2Å; L657-L692 HydrophobicContact CD2-CD1 4.21Å; I688-L692 HydrophobicContact CB-CD1 4.39Å; I688-L692 HydrophobicContact CB-CG 4.44Å; I688-L692 HydrophobicContact CD1-CD1 3.8Å; I688-L692 HydrophobicContact CG1-CD1 3.81Å; I688-L692 HydrophobicContact CG1-CG 4.38Å; I688-L692 WeakPolarHBondContact O-CG 3.43Å; I688-L692 PolarHBondContact O-N 3.4Å; S689-L692 PolarHBondContact O-N 3.37Å; L692-A694 VanDerWaalsContact C-N 3.35Å; L692-A694 PolarHBondContact O-N 3.23Å; L692-S695 WeakPolarHBondContact O-CB 3.2Å; L692-S695 PolarHBondContact O-N 3.24Å; L692-Y696 PolarHBondContact O-N 3.35Å
693	L	92.7	Very high	92.4	Very high	62 Å²	62	56.3 Å²	56.3	33%	0.325	32%	0.318	S	S	.	.	H	α-helix	trans	-64.5	-38.2	176.7	-72.8	170.8	0	0	0	112.3	L655 L657 S689 Y696 K697	L655-L693 HydrophobicContact CB-CD2 4.02Å; L655-L693 VanDerWaalsContact O-CD2 3.23Å; L655-L693 WeakPolarHBondContact O-CD2 3.35Å; L657-L693 HydrophobicContact CB-CD2 4Å; L657-L693 HydrophobicContact CB-CG 4.45Å; L657-L693 HydrophobicContact CD2-CG 4.35Å; S689-L693 WeakPolarHBondContact O-CB 3.48Å; S689-L693 VanDerWaalsContact O-CG 3.26Å; S689-L693 WeakPolarHBondContact O-CG 3.25Å; S689-L693 PolarHBondContact O-N 3.34Å; L693-Y696 PolarHBondContact O-N 3.22Å; L693-K697 WeakPolarHBondContact O-CB 3.35Å; L693-K697 PolarHBondContact O-N 3.32Å
694	A	91.5	Very high	92.4	Very high	56 Å²	56	56.8 Å²	56.8	46%	0.463	31%	0.309	S	S	.	.	H	α-helix	trans	-63.4	-42.9	173.2	0	0	0	0	0	111.5	A690 S691 L692 K697 Q698	A690-A694 WeakPolarHBondContact O-CB 3.46Å; A690-A694 PolarHBondContact O-N 3.49Å; A690-A694 VanDerWaalsContact O-N 3.07Å; S691-A694 PolarHBondContact O-N 2.7Å; L692-A694 VanDerWaalsContact C-N 3.35Å; L692-A694 PolarHBondContact O-N 3.23Å; A694-K697 PolarHBondContact O-N 2.9Å; A694-Q698 WeakPolarHBondContact O-CB 3.36Å; A694-Q698 PolarHBondContact O-N 3.25Å
695	S	92.2	Very high	92.4	Very high	51 Å²	51	60.3 Å²	60.3	36%	0.357	33%	0.327	S	S	.	.	H	α-helix	trans	-61.5	-48	175.4	-170.6	0	0	0	0	111.7	S691 L692 K697 Q698 T699	S691-S695 PolarHBondContact O-N 2.89Å; L692-S695 WeakPolarHBondContact O-CB 3.2Å; L692-S695 PolarHBondContact O-N 3.24Å; S695-K697 VanDerWaalsContact C-N 3.35Å; S695-K697 PolarHBondContact O-N 3.43Å; S695-Q698 PolarHBondContact O-N 3.32Å; S695-T699 WeakPolarHBondContact O-CB 3.22Å; S695-T699 PolarHBondContact O-N 3Å; S695-T699 PolarHBondContact O-OG1 3.1Å
696	Y	94.6	Very high	92.2	Very high	18 Å²	18	62.1 Å²	62.1	7%	0.071	34%	0.338	C	S	.	.	H	α-helix	trans	-54.2	-52.1	176.2	-179.9	-100.2	0	0	0	111.2	L618 H621 A625 D653 L655 L692 L693 Q698 T699 V700	L618-Y696 HydrophobicContact CD1-CD2 4.22Å; L618-Y696 HydrophobicContact CD1-CG 4.36Å; H621-Y696 HydrophobicContact CB-CE2 4.41Å; A625-Y696 HydrophobicContact CB-CE2 4.31Å; D653-Y696 WeakPolarHBondContact O-CD1 3.2Å; D653-Y696 WeakPolarHBondContact O-CE1 3.21Å; L655-Y696 HydrophobicContact CB-CD1 3.72Å; L655-Y696 HydrophobicContact CB-CD2 4.38Å; L655-Y696 HydrophobicContact CB-CE1 3.77Å; L655-Y696 HydrophobicContact CB-CE2 4.41Å; L655-Y696 HydrophobicContact CB-CG 4.04Å; L655-Y696 HydrophobicContact CD1-CE2 4.39Å; L655-Y696 HydrophobicContact CD2-CD2 4.05Å; L655-Y696 HydrophobicContact CD2-CE2 4.41Å; L655-Y696 HydrophobicContact CD2-CG 4.22Å; L692-Y696 PolarHBondContact O-N 3.35Å; L693-Y696 PolarHBondContact O-N 3.22Å; Y696-Q698 VanDerWaalsContact C-N 3.32Å; Y696-Q698 PolarHBondContact O-N 3.29Å; Y696-T699 PolarHBondContact O-N 3.33Å; Y696-V700 HydrophobicContact CD1-CG2 4.36Å; Y696-V700 HydrophobicContact CD2-CG2 4.23Å; Y696-V700 HydrophobicContact CE1-CG2 3.99Å; Y696-V700 HydrophobicContact CE2-CG2 3.85Å; Y696-V700 HydrophobicContact CG-CG2 4.47Å; Y696-V700 WeakPolarHBondContact O-CG2 3.35Å; Y696-V700 PolarHBondContact O-N 3.23Å
697	K	93.2	Very high	92.2	Very high	115 Å²	115	54.4 Å²	54.4	50%	0.5	31%	0.305	S	S	.	.	H	α-helix	trans	-58.8	-45.4	-178.9	-176.3	175.5	-174.5	174.5	0	111.4	D653 L693 A694 S695 T701	D653-K697 HydrophobicContact CB-CG 4.15Å; D653-K697 WeakPolarHBondContact OD2-CE 3.1Å; L693-K697 WeakPolarHBondContact O-CB 3.35Å; L693-K697 PolarHBondContact O-N 3.32Å; A694-K697 PolarHBondContact O-N 2.9Å; S695-K697 VanDerWaalsContact C-N 3.35Å; S695-K697 PolarHBondContact O-N 3.43Å; K697-T701 WeakPolarHBondContact O-CB 3.5Å; K697-T701 PolarHBondContact O-N 3.03Å; K697-T701 PolarHBondContact O-OG1 3.48Å
698	Q	92.8	Very high	92.2	Very high	134 Å²	134	51.3 Å²	51.3	63%	0.626	29%	0.292	S	S	*	.	H	α-helix	trans	-61.9	-51.4	177.8	-176.7	176.4	0.4	0	0	110.9	A694 S695 Y696 V700 T701 T702	A694-Q698 WeakPolarHBondContact O-CB 3.36Å; A694-Q698 PolarHBondContact O-N 3.25Å; S695-Q698 PolarHBondContact O-N 3.32Å; Y696-Q698 VanDerWaalsContact C-N 3.32Å; Y696-Q698 PolarHBondContact O-N 3.29Å; Q698-V700 PolarHBondContact O-N 3Å; Q698-T701 PolarHBondContact O-N 3.29Å; Q698-T702 WeakPolarHBondContact O-CB 3.33Å; Q698-T702 PolarHBondContact O-N 3.2Å; Q698-T702 PolarHBondContact O-OG1 3.2Å
699	T	91.3	Very high	92	Very high	46 Å²	46	58 Å²	58	28%	0.282	32%	0.324	S	S	.	.	H	α-helix	trans	-59.2	-49.7	-178.5	-58.3	0	0	0	0	112	I626 S695 Y696 T701 T702 T703	I626-T699 HydrophobicContact CD1-CG2 3.65Å; I626-T699 HydrophobicContact CG1-CG2 4.22Å; S695-T699 WeakPolarHBondContact O-CB 3.22Å; S695-T699 PolarHBondContact O-N 3Å; S695-T699 PolarHBondContact O-OG1 3.1Å; Y696-T699 PolarHBondContact O-N 3.33Å; T699-T701 PolarHBondContact O-N 3.37Å; T699-T702 PolarHBondContact O-N 3.16Å; T699-T703 PolarHBondContact O-N 3.01Å; T699-T703 PolarHBondContact O-OG1 3.34Å; T699-T703 VanDerWaalsContact O-OG1 3.11Å
700	V	92.3	Very high	91.9	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-64.3	-41.7	179.5	175.5	0	0	0	0	111.3	A625 L629 D653 Y696 Q698 R704	A625-V700 HydrophobicContact CB-CG2 3.79Å; L629-V700 HydrophobicContact CD1-CG1 4.27Å; D653-V700 HydrophobicContact CB-CB 4.42Å; D653-V700 HydrophobicContact CB-CG1 4.2Å; Y696-V700 HydrophobicContact CD1-CG2 4.36Å; Y696-V700 HydrophobicContact CD2-CG2 4.23Å; Y696-V700 HydrophobicContact CE1-CG2 3.99Å; Y696-V700 HydrophobicContact CE2-CG2 3.85Å; Y696-V700 HydrophobicContact CG-CG2 4.47Å; Y696-V700 WeakPolarHBondContact O-CG2 3.35Å; Y696-V700 PolarHBondContact O-N 3.23Å; Q698-V700 PolarHBondContact O-N 3Å; V700-R704 VanDerWaalsContact O-CB 3.28Å; V700-R704 WeakPolarHBondContact O-CB 3.4Å; V700-R704 PolarHBondContact O-N 3.09Å
701	T	91.9	Very high	91.9	Very high	29 Å²	29	59.3 Å²	59.3	18%	0.178	31%	0.314	C	S	.	.	H	α-helix	trans	-64.6	-46.9	177.7	-63.3	0	0	0	0	111.5	K697 Q698 T699 T703 R704 D705	K697-T701 WeakPolarHBondContact O-CB 3.5Å; K697-T701 PolarHBondContact O-N 3.03Å; K697-T701 PolarHBondContact O-OG1 3.48Å; Q698-T701 PolarHBondContact O-N 3.29Å; T699-T701 PolarHBondContact O-N 3.37Å; T701-T703 PolarHBondContact O-N 3.38Å; T701-R704 WeakPolarHBondContact O-CB 3.39Å; T701-R704 PolarHBondContact O-N 3.02Å; T701-R704 PolarHBondContact OG1-NH2 3.41Å; T701-D705 WeakPolarHBondContact O-CB 3.3Å; T701-D705 PolarHBondContact O-N 2.99Å
702	T	92.1	Very high	91.6	Very high	62 Å²	62	60.6 Å²	60.6	38%	0.38	32%	0.315	S	S	.	.	H	α-helix	trans	-60.7	-46.8	178.7	-62	0	0	0	0	111.2	Q698 T699 R704 D705 E706	Q698-T702 WeakPolarHBondContact O-CB 3.33Å; Q698-T702 PolarHBondContact O-N 3.2Å; Q698-T702 PolarHBondContact O-OG1 3.2Å; T699-T702 PolarHBondContact O-N 3.16Å; T702-R704 PolarHBondContact O-N 3.32Å; T702-D705 PolarHBondContact O-N 3.41Å; T702-E706 WeakPolarHBondContact O-CB 3.44Å; T702-E706 WeakPolarHBondContact O-CG 3.29Å; T702-E706 PolarHBondContact O-N 3.5Å
703	T	92.7	Very high	91.4	Very high	19 Å²	19	64 Å²	64	12%	0.117	34%	0.339	C	S	.	.	H	α-helix	trans	-62.5	-42.5	176.4	-57.2	0	0	0	0	111.9	I626 L629 T699 T701 D705 E706 L707	I626-T703 HydrophobicContact CG2-CG2 4.44Å; L629-T703 HydrophobicContact CB-CG2 4.32Å; L629-T703 HydrophobicContact CD1-CG2 3.98Å; T699-T703 PolarHBondContact O-N 3.01Å; T699-T703 PolarHBondContact O-OG1 3.34Å; T699-T703 VanDerWaalsContact O-OG1 3.11Å; T701-T703 PolarHBondContact O-N 3.38Å; T703-D705 PolarHBondContact O-N 2.83Å; T703-E706 PolarHBondContact O-N 3.48Å; T703-L707 HydrophobicContact CG2-CD1 4.17Å; T703-L707 VanDerWaalsContact O-CG 3.29Å; T703-L707 WeakPolarHBondContact O-CG 3.29Å; T703-L707 PolarHBondContact O-N 3.37Å
704	R	93.3	Very high	91.2	Very high	47 Å²	47	64 Å²	64	18%	0.177	34%	0.337	C	S	.	.	H	α-helix	trans	-58.2	-48.6	175.7	178.8	-176.1	65	-158.8	-8.5	111.4	L629 I648 V700 T701 T702 L707 L708	L629-R704 HydrophobicContact CD1-CB 4.48Å; I648-R704 HydrophobicContact CG2-CG 4.01Å; I648-R704 WeakPolarHBondContact O-CD 3.3Å; I648-R704 WeakPolarHBondContact O-CG 3.45Å; V700-R704 VanDerWaalsContact O-CB 3.28Å; V700-R704 WeakPolarHBondContact O-CB 3.4Å; V700-R704 PolarHBondContact O-N 3.09Å; T701-R704 WeakPolarHBondContact O-CB 3.39Å; T701-R704 PolarHBondContact O-N 3.02Å; T701-R704 PolarHBondContact OG1-NH2 3.41Å; T702-R704 PolarHBondContact O-N 3.32Å; R704-L707 PolarHBondContact O-N 3.33Å; R704-L708 HydrophobicContact CG-CD1 4.08Å; R704-L708 WeakPolarHBondContact O-CG 3.49Å; R704-L708 PolarHBondContact O-N 2.94Å
705	D	91.9	Very high	91	Very high	75 Å²	75	63.1 Å²	63.1	40%	0.401	32%	0.324	S	S	.	.	H	α-helix	trans	-67.9	-38.2	-177	-64.7	-10.1	0	0	0	111.5	T701 T702 T703 L708 M709	T701-D705 WeakPolarHBondContact O-CB 3.3Å; T701-D705 PolarHBondContact O-N 2.99Å; T702-D705 PolarHBondContact O-N 3.41Å; T703-D705 PolarHBondContact O-N 2.83Å; D705-L708 PolarHBondContact O-N 3.34Å; D705-M709 PolarHBondContact O-N 3.13Å
706	E	91.7	Very high	90.6	Very high	94 Å²	94	63.2 Å²	63.2	44%	0.439	33%	0.328	S	S	.	.	H	α-helix	trans	-61.4	-43.6	173.3	-77.8	179.8	-169.4	0	0	112.7	T702 T703 L708 M709 K710	T702-E706 WeakPolarHBondContact O-CB 3.44Å; T702-E706 WeakPolarHBondContact O-CG 3.29Å; T702-E706 PolarHBondContact O-N 3.5Å; T703-E706 PolarHBondContact O-N 3.48Å; E706-L708 VanDerWaalsContact C-N 3.34Å; E706-M709 PolarHBondContact O-N 3.3Å; E706-K710 WeakPolarHBondContact O-CG 3.43Å; E706-K710 PolarHBondContact O-N 3.46Å
707	L	91.9	Very high	90.2	Very high	7 Å²	7	66.5 Å²	66.5	4%	0.037	34%	0.344	C	S	.	.	H	α-helix	trans	-67.7	-37.1	177.6	-68	175.3	0	0	0	111.4	L629 F633 I648 T703 R704 K710 F711	L629-L707 HydrophobicContact CB-CD1 3.77Å; F633-L707 HydrophobicContact CB-CD1 4.18Å; F633-L707 HydrophobicContact CB-CD2 3.9Å; F633-L707 HydrophobicContact CD1-CD2 3.86Å; F633-L707 HydrophobicContact CD2-CB 4.13Å; F633-L707 HydrophobicContact CD2-CD2 4.01Å; F633-L707 HydrophobicContact CE1-CD2 4.37Å; F633-L707 HydrophobicContact CE2-CD2 4.49Å; F633-L707 WeakPolarHBondContact CE2-O 3.45Å; F633-L707 HydrophobicContact CG-CD2 3.66Å; I648-L707 HydrophobicContact CD1-CB 4.45Å; I648-L707 HydrophobicContact CG2-CB 4.37Å; T703-L707 HydrophobicContact CG2-CD1 4.17Å; T703-L707 VanDerWaalsContact O-CG 3.29Å; T703-L707 WeakPolarHBondContact O-CG 3.29Å; T703-L707 PolarHBondContact O-N 3.37Å; R704-L707 PolarHBondContact O-N 3.33Å; L707-K710 PolarHBondContact O-N 3.19Å; L707-F711 PolarHBondContact O-N 3.1Å; L707-F711 VanDerWaalsContact O-N 3.08Å
708	L	90.5	Very high	89.9	Confident	49 Å²	49	62.8 Å²	62.8	26%	0.257	33%	0.329	S	S	.	.	H	α-helix	trans	-66.5	-37.4	173.9	-72.4	172	0	0	0	112.2	K645 I648 R704 D705 E706 F711	K645-L708 HydrophobicContact CG-CD2 4.29Å; I648-L708 HydrophobicContact CG2-CD2 4.15Å; I648-L708 HydrophobicContact CG2-CG 4.04Å; R704-L708 HydrophobicContact CG-CD1 4.08Å; R704-L708 WeakPolarHBondContact O-CG 3.49Å; R704-L708 PolarHBondContact O-N 2.94Å; D705-L708 PolarHBondContact O-N 3.34Å; E706-L708 VanDerWaalsContact C-N 3.34Å; L708-F711 WeakPolarHBondContact O-CB 3.44Å; L708-F711 PolarHBondContact O-N 3.17Å
709	M	88.5	Confident	89.5	Confident	167 Å²	167	60.4 Å²	60.4	82%	0.823	32%	0.32	S	S	*	.	H	α-helix	trans	-64.5	-38.3	172.6	-83.6	-171	159	0	0	112.6	D705 E706 F711	D705-M709 PolarHBondContact O-N 3.13Å; E706-M709 PolarHBondContact O-N 3.3Å; M709-F711 VanDerWaalsContact C-N 3.25Å; M709-F711 PolarHBondContact O-N 2.9Å
710	K	90.4	Very high	89.1	Confident	112 Å²	112	63.3 Å²	63.3	49%	0.487	33%	0.331	S	S	.	.	H	α-helix	trans	-76.4	-13.2	178.2	-70.3	171.2	-176	167.5	0	113.2	F633 E706 L707 D712 S713 K714	F633-K710 HydrophobicContact CE2-CB 4.37Å; F633-K710 HydrophobicContact CZ-CB 3.87Å; E706-K710 WeakPolarHBondContact O-CG 3.43Å; E706-K710 PolarHBondContact O-N 3.46Å; L707-K710 PolarHBondContact O-N 3.19Å; K710-D712 PolarHBondContact O-N 3.08Å; K710-S713 PolarHBondContact O-N 3.35Å; K710-K714 WeakPolarHBondContact O-CB 3.31Å; K710-K714 PolarHBondContact O-N 2.92Å
711	F	90.3	Very high	88.5	Confident	5 Å²	5	67.3 Å²	67.3	2%	0.022	35%	0.351	C	S	.	.	H	α-helix	trans	-59.1	-50.7	-171.6	-162.4	-91.9	0	0	0	112.8	F633 L636 K641 V644 K645 L707 L708 M709 S713 K714 I715	F633-F711 HydrophobicContact CE2-CD2 4.28Å; L636-F711 HydrophobicContact CD1-CE2 3.88Å; L636-F711 HydrophobicContact CD1-CZ 3.81Å; L636-F711 HydrophobicContact CD2-CD2 4.33Å; L636-F711 HydrophobicContact CD2-CE2 4.06Å; L636-F711 HydrophobicContact CD2-CZ 4.42Å; K641-F711 HydrophobicContact CB-CZ 4.3Å; K641-F711 VanDerWaalsContact O-CZ 3.29Å; K641-F711 WeakPolarHBondContact O-CZ 3.3Å; V644-F711 HydrophobicContact CG1-CE2 4.24Å; K645-F711 HydrophobicContact CB-CE1 4.11Å; K645-F711 HydrophobicContact CB-CE2 3.87Å; K645-F711 HydrophobicContact CB-CZ 3.61Å; K645-F711 HydrophobicContact CD-CD1 4.16Å; K645-F711 HydrophobicContact CD-CE1 3.84Å; K645-F711 HydrophobicContact CD-CZ 4.24Å; K645-F711 HydrophobicContact CG-CE1 4.26Å; K645-F711 HydrophobicContact CG-CE2 4.37Å; K645-F711 HydrophobicContact CG-CZ 4.19Å; L707-F711 PolarHBondContact O-N 3.1Å; L707-F711 VanDerWaalsContact O-N 3.08Å; L708-F711 WeakPolarHBondContact O-CB 3.44Å; L708-F711 PolarHBondContact O-N 3.17Å; M709-F711 VanDerWaalsContact C-N 3.25Å; M709-F711 PolarHBondContact O-N 2.9Å; F711-S713 PolarHBondContact O-N 2.78Å; F711-K714 PolarHBondContact O-N 3.03Å; F711-I715 HydrophobicContact CD1-CD1 3.88Å; F711-I715 HydrophobicContact CE1-CD1 3.44Å; F711-I715 VanDerWaalsContact CE1-CD1 3.44Å; F711-I715 HydrophobicContact CE1-CG1 4.34Å; F711-I715 HydrophobicContact CZ-CD1 4.24Å; F711-I715 PolarHBondContact O-N 3.08Å; F711-I715 VanDerWaalsContact O-N 3.11Å
712	D	85.9	Confident	87.9	Confident	112 Å²	112	71.5 Å²	71.5	60%	0.599	37%	0.367	S	S	*	.	H	α-helix	trans	-68.9	-37.8	-177.8	-65.1	-21.8	0	0	0	111.5	K710 K714 I715 A716	K710-D712 PolarHBondContact O-N 3.08Å; D712-K714 VanDerWaalsContact C-N 3.33Å; D712-K714 PolarHBondContact O-N 3.16Å; D712-I715 PolarHBondContact O-N 3.26Å; D712-A716 PolarHBondContact O-N 3.15Å
713	S	87.5	Confident	87.3	Confident	84 Å²	84	74.3 Å²	74.3	59%	0.587	37%	0.374	S	S	*	.	H	α-helix	trans	-62.8	-39.3	174.4	-172.6	0	0	0	0	111.9	K710 F711 A716 E717	K710-S713 PolarHBondContact O-N 3.35Å; F711-S713 PolarHBondContact O-N 2.78Å; S713-A716 PolarHBondContact O-N 3.47Å; S713-E717 PolarHBondContact O-N 3.12Å
714	K	88.3	Confident	86.6	Confident	63 Å²	63	76.2 Å²	76.2	27%	0.274	39%	0.391	S	S	.	.	H	α-helix	trans	-70.4	-35.1	179.5	-168.3	59	177.3	178.8	0	112	F633 L636 K710 F711 D712 E717 L718	F633-K714 HydrophobicContact CE1-CG 4.44Å; F633-K714 HydrophobicContact CZ-CB 3.96Å; F633-K714 HydrophobicContact CZ-CG 4.16Å; L636-K714 HydrophobicContact CD2-CB 3.96Å; L636-K714 HydrophobicContact CD2-CG 3.76Å; K710-K714 WeakPolarHBondContact O-CB 3.31Å; K710-K714 PolarHBondContact O-N 2.92Å; F711-K714 PolarHBondContact O-N 3.03Å; D712-K714 VanDerWaalsContact C-N 3.33Å; D712-K714 PolarHBondContact O-N 3.16Å; K714-E717 WeakPolarHBondContact CD-OE2 3.27Å; K714-E717 IonicContact NZ-OE1 3.34Å; K714-E717 PolarHBondContact NZ-OE1 3.33Å; K714-E717 IonicContact NZ-OE2 3.02Å; K714-E717 PolarHBondContact NZ-OE2 2.72Å; K714-E717 WeakPolarHBondContact O-CB 3.4Å; K714-E717 PolarHBondContact O-N 2.89Å; K714-L718 WeakPolarHBondContact O-CG 3.1Å; K714-L718 PolarHBondContact O-N 3.04Å
715	I	87.7	Confident	85.6	Confident	36 Å²	36	79.8 Å²	79.8	19%	0.185	41%	0.41	C	S	.	.	H	α-helix	trans	-63.3	-43.3	172	-71.4	-179.9	0	0	0	111	K641 F711 D712 E717 L718 L719	K641-I715 HydrophobicContact CB-CD1 4.28Å; K641-I715 HydrophobicContact CD-CD1 4.31Å; F711-I715 HydrophobicContact CD1-CD1 3.88Å; F711-I715 HydrophobicContact CE1-CD1 3.44Å; F711-I715 VanDerWaalsContact CE1-CD1 3.44Å; F711-I715 HydrophobicContact CE1-CG1 4.34Å; F711-I715 HydrophobicContact CZ-CD1 4.24Å; F711-I715 PolarHBondContact O-N 3.08Å; F711-I715 VanDerWaalsContact O-N 3.11Å; D712-I715 PolarHBondContact O-N 3.26Å; I715-E717 VanDerWaalsContact C-N 3.32Å; I715-E717 PolarHBondContact O-N 2.78Å; I715-L718 PolarHBondContact O-N 2.9Å; I715-L719 HydrophobicContact CG2-CD1 4.18Å; I715-L719 WeakPolarHBondContact O-CG 3.43Å; I715-L719 PolarHBondContact O-N 2.93Å; I715-L719 VanDerWaalsContact O-N 3.07Å
716	A	84.4	Confident	84.9	Confident	53 Å²	53	82.4 Å²	82.4	44%	0.438	42%	0.42	S	S	.	.	H	α-helix	trans	-61.1	-42.4	176.4	0	0	0	0	0	111.7	D712 S713 L719 E720	D712-A716 PolarHBondContact O-N 3.15Å; S713-A716 PolarHBondContact O-N 3.47Å; A716-L719 PolarHBondContact O-N 2.87Å; A716-E720 PolarHBondContact O-N 2.99Å; A716-E720 VanDerWaalsContact O-N 3.13Å
717	E	85.7	Confident	84.1	Confident	88 Å²	88	83.1 Å²	83.1	41%	0.411	42%	0.423	S	S	.	.	H	α-helix	trans	-60	-47.5	175.3	-169.1	-164.7	143.4	0	0	112.1	S713 K714 I715 L719 E720 I721	S713-E717 PolarHBondContact O-N 3.12Å; K714-E717 WeakPolarHBondContact CD-OE2 3.27Å; K714-E717 IonicContact NZ-OE1 3.34Å; K714-E717 PolarHBondContact NZ-OE1 3.33Å; K714-E717 IonicContact NZ-OE2 3.02Å; K714-E717 PolarHBondContact NZ-OE2 2.72Å; K714-E717 WeakPolarHBondContact O-CB 3.4Å; K714-E717 PolarHBondContact O-N 2.89Å; I715-E717 VanDerWaalsContact C-N 3.32Å; I715-E717 PolarHBondContact O-N 2.78Å; E717-L719 VanDerWaalsContact C-N 3.28Å; E717-L719 PolarHBondContact O-N 2.97Å; E717-E720 PolarHBondContact O-N 2.78Å; E717-I721 HydrophobicContact CG-CD1 4.17Å; E717-I721 WeakPolarHBondContact O-CG1 3.37Å; E717-I721 PolarHBondContact O-N 3.1Å
718	L	87.5	Confident	83.2	Confident	37 Å²	37	90.3 Å²	90.3	19%	0.194	45%	0.45	C	S	.	.	H	α-helix	trans	-62.9	-32.9	178.5	-70.6	170.6	0	0	0	112.8	L636 L638 K714 I715 K722	L636-L718 HydrophobicContact CG-CD1 4.27Å; L638-L718 HydrophobicContact CD2-CB 4.17Å; L638-L718 HydrophobicContact CG-CB 4.16Å; K714-L718 WeakPolarHBondContact O-CG 3.1Å; K714-L718 PolarHBondContact O-N 3.04Å; I715-L718 PolarHBondContact O-N 2.9Å; L718-K722 PolarHBondContact O-N 3.3Å
719	L	84.1	Confident	82.4	Confident	84 Å²	84	95.6 Å²	95.6	44%	0.44	47%	0.471	S	S	.	.	H	α-helix	trans	-69.8	-38.2	174.9	-73.9	169.9	0	0	0	112.4	L638 I715 A716 E717 K723	L638-L719 HydrophobicContact CD1-CD2 4.28Å; L638-L719 HydrophobicContact CD2-CD2 3.97Å; L638-L719 HydrophobicContact CD2-CG 4.09Å; I715-L719 HydrophobicContact CG2-CD1 4.18Å; I715-L719 WeakPolarHBondContact O-CG 3.43Å; I715-L719 PolarHBondContact O-N 2.93Å; I715-L719 VanDerWaalsContact O-N 3.07Å; A716-L719 PolarHBondContact O-N 2.87Å; E717-L719 VanDerWaalsContact C-N 3.28Å; E717-L719 PolarHBondContact O-N 2.97Å; L719-K723 PolarHBondContact O-N 2.93Å
720	E	83.2	Confident	81.7	Confident	107 Å²	107	97.2 Å²	97.2	50%	0.5	47%	0.468	S	S	.	.	H	α-helix	trans	-72	-39.4	177.5	-74.1	-57.5	130.9	0	0	112.5	A716 E717 K722 K723 A724	A716-E720 PolarHBondContact O-N 2.99Å; A716-E720 VanDerWaalsContact O-N 3.13Å; E717-E720 PolarHBondContact O-N 2.78Å; E720-K722 VanDerWaalsContact C-N 3.28Å; E720-K722 PolarHBondContact O-N 2.95Å; E720-K723 PolarHBondContact O-N 2.96Å; E720-K723 IonicContact OE1-NZ 2.66Å; E720-K723 PolarHBondContact OE1-NZ 3.34Å; E720-A724 PolarHBondContact O-N 3.38Å
721	I	79.4	Confident	80.8	Confident	84 Å²	84	97.8 Å²	97.8	43%	0.431	47%	0.47	S	S	.	.	H	α-helix	trans	-57.6	-43.9	174.2	-68.6	167.5	0	0	0	110.6	E717 K723 A724 E725	E717-I721 HydrophobicContact CG-CD1 4.17Å; E717-I721 WeakPolarHBondContact O-CG1 3.37Å; E717-I721 PolarHBondContact O-N 3.1Å; I721-K723 VanDerWaalsContact C-N 3.35Å; I721-K723 PolarHBondContact O-N 3Å; I721-A724 PolarHBondContact O-N 2.7Å; I721-E725 PolarHBondContact O-N 2.9Å
722	K	79.8	Confident	79.8	Confident	117 Å²	117	102.5 Å²	102.5	51%	0.509	49%	0.492	S	S	.	.	H	α-helix	trans	-61.2	-40.3	178.3	-171.7	174.2	-180	175	0	112.6	L638 L718 E720 E726	L638-K722 HydrophobicContact CD1-CD 4.09Å; L718-K722 PolarHBondContact O-N 3.3Å; E720-K722 VanDerWaalsContact C-N 3.28Å; E720-K722 PolarHBondContact O-N 2.95Å; K722-E726 PolarHBondContact O-N 2.66Å
723	K	79	Confident	78.9	Confident	120 Å²	120	103.2 Å²	103.2	52%	0.522	49%	0.492	S	S	.	.	H	α-helix	trans	-67.6	-41.7	175.6	-69.1	176.7	-169.2	163.8	0	112.2	L719 E720 I721 E726 E727	L719-K723 PolarHBondContact O-N 2.93Å; E720-K723 PolarHBondContact O-N 2.96Å; E720-K723 IonicContact OE1-NZ 2.66Å; E720-K723 PolarHBondContact OE1-NZ 3.34Å; I721-K723 VanDerWaalsContact C-N 3.35Å; I721-K723 PolarHBondContact O-N 3Å; K723-E726 PolarHBondContact O-N 2.82Å; K723-E727 PolarHBondContact O-N 3.43Å
724	A	77.2	Confident	78.2	Confident	59 Å²	59	106.4 Å²	106.4	49%	0.488	50%	0.498	S	S	.	.	H	α-helix	trans	-66.3	-37.2	-178.9	0	0	0	0	0	112.6	E720 I721 E727 R728	E720-A724 PolarHBondContact O-N 3.38Å; I721-A724 PolarHBondContact O-N 2.7Å; A724-E727 PolarHBondContact O-N 3.03Å; A724-R728 WeakPolarHBondContact O-CB 3.49Å; A724-R728 PolarHBondContact O-N 2.63Å
725	E	73.7	Confident	77.3	Confident	123 Å²	123	106.2 Å²	106.2	58%	0.575	51%	0.508	S	S	*	.	H	α-helix	trans	-63.9	-39.8	175.4	-108	-178.3	161.7	0	0	112.9	I721 K729	I721-E725 PolarHBondContact O-N 2.9Å; E725-K729 PolarHBondContact O-N 3.49Å
726	E	75.9	Confident	76.6	Confident	130 Å²	130	112.5 Å²	112.5	61%	0.607	53%	0.529	S	S	*	.	H	α-helix	trans	-66.3	-37.6	176.5	-71.4	177.1	176	0	0	111.8	K722 K723	K722-E726 PolarHBondContact O-N 2.66Å; K723-E726 PolarHBondContact O-N 2.82Å
727	E	75.6	Confident	76	Confident	108 Å²	108	117.1 Å²	117.1	51%	0.505	54%	0.539	S	S	.	.	H	α-helix	trans	-73.6	-37.9	177.5	-160.8	-175.9	156.7	0	0	112.7	K723 A724 K729 R730 K731	K723-E727 PolarHBondContact O-N 3.43Å; A724-E727 PolarHBondContact O-N 3.03Å; E727-K729 PolarHBondContact O-N 2.82Å; E727-R730 WeakPolarHBondContact O-CB 3.39Å; E727-R730 PolarHBondContact O-N 3.06Å; E727-K731 PolarHBondContact O-N 2.88Å; E727-K731 WeakPolarHBondContact OE1-CE 3.45Å; E727-K731 IonicContact OE1-NZ 3.45Å; E727-K731 PolarHBondContact OE1-NZ 3.38Å
728	R	72.7	Confident	75.2	Confident	159 Å²	159	116 Å²	116	60%	0.6	55%	0.546	S	S	*	.	H	α-helix	trans	-63.6	-41	179.9	-165	-177.8	121.7	-163.7	-2.9	112.2	A724 R730 K731 E732	A724-R728 WeakPolarHBondContact O-CB 3.49Å; A724-R728 PolarHBondContact O-N 2.63Å; R728-R730 VanDerWaalsContact C-N 3.25Å; R728-R730 PolarHBondContact O-N 3.16Å; R728-K731 PolarHBondContact O-N 3.07Å; R728-E732 IonicContact CZ-OE1 3.49Å; R728-E732 IonicContact NE-OE1 2.62Å; R728-E732 PolarHBondContact NE-OE1 3.42Å; R728-E732 IonicContact NH2-OE1 2.75Å; R728-E732 PolarHBondContact NH2-OE1 3.19Å; R728-E732 PolarHBondContact O-N 2.84Å; R728-E732 VanDerWaalsContact O-N 3.13Å
729	K	73.1	Confident	74.1	Confident	159 Å²	159	118.6 Å²	118.6	69%	0.691	56%	0.557	S	S	*	*	H	α-helix	trans	-59.9	-34.2	175.5	-79.3	-177.1	177.7	175	0	112.8	E725 E727	E725-K729 PolarHBondContact O-N 3.49Å; E727-K729 PolarHBondContact O-N 2.82Å
730	R	74.2	Confident	73.3	Confident	201 Å²	201	121.7 Å²	121.7	76%	0.758	57%	0.569	S	S	*	*	H	α-helix	trans	-68	-43.1	175.8	-103.7	-178.2	169.3	-175	-2.8	112.7	E727 R728	E727-R730 WeakPolarHBondContact O-CB 3.39Å; E727-R730 PolarHBondContact O-N 3.06Å; R728-R730 VanDerWaalsContact C-N 3.25Å; R728-R730 PolarHBondContact O-N 3.16Å
731	K	72.9	Confident	72.8	Confident	124 Å²	124	123.1 Å²	123.1	54%	0.539	58%	0.576	S	S	.	*	H	α-helix	trans	-72.7	-32.3	-177.3	-70.3	179.9	-176.1	163.9	0	113.4	E727 R728 E733 A735	E727-K731 PolarHBondContact O-N 2.88Å; E727-K731 WeakPolarHBondContact OE1-CE 3.45Å; E727-K731 IonicContact OE1-NZ 3.45Å; E727-K731 PolarHBondContact OE1-NZ 3.38Å; R728-K731 PolarHBondContact O-N 3.07Å; K731-E733 VanDerWaalsContact C-N 3.32Å; K731-E733 PolarHBondContact O-N 3.11Å; K731-A735 PolarHBondContact O-N 3.06Å
732	E	68	Low	72.3	Confident	104 Å²	104	126 Å²	126	49%	0.486	58%	0.581	S	S	.	*	H	α-helix	trans	-65.4	-32.1	177.6	-78.3	173.9	-176	0	0	112.7	R728 R736	R728-E732 IonicContact CZ-OE1 3.49Å; R728-E732 IonicContact NE-OE1 2.62Å; R728-E732 PolarHBondContact NE-OE1 3.42Å; R728-E732 IonicContact NH2-OE1 2.75Å; R728-E732 PolarHBondContact NH2-OE1 3.19Å; R728-E732 PolarHBondContact O-N 2.84Å; R728-E732 VanDerWaalsContact O-N 3.13Å; E732-R736 PolarHBondContact O-N 3.4Å
733	E	67.9	Low	71.8	Confident	127 Å²	127	126.5 Å²	126.5	59%	0.593	58%	0.583	S	S	*	*	H	α-helix	trans	-76.7	-33.5	-179.4	-166.8	164.3	-172.3	0	0	113.1	K731	K731-E733 VanDerWaalsContact C-N 3.32Å; K731-E733 PolarHBondContact O-N 3.11Å
734	E	73.1	Confident	71.5	Confident	151 Å²	151	130.8 Å²	130.8	71%	0.706	60%	0.596	S	S	*	*	H	α-helix	trans	-71.3	-39.5	174.7	-71.9	-178.9	162.6	0	0	112.1	R736 K737	E734-R736 VanDerWaalsContact C-N 3.34Å; E734-R736 PolarHBondContact O-N 3.45Å; E734-K737 PolarHBondContact O-N 3.13Å
735	A	68.9	Low	71.2	Confident	59 Å²	59	135 Å²	135	49%	0.488	60%	0.603	S	S	.	*	H	α-helix	trans	-64.3	-34.3	179.5	0	0	0	0	0	113.3	K731 K737 A738 E739	K731-A735 PolarHBondContact O-N 3.06Å; A735-K737 VanDerWaalsContact C-N 3.31Å; A735-K737 PolarHBondContact O-N 3.14Å; A735-A738 PolarHBondContact O-N 2.98Å; A735-E739 PolarHBondContact O-N 3.43Å
736	R	73	Confident	70.8	Confident	168 Å²	168	133.8 Å²	133.8	63%	0.634	60%	0.598	S	S	*	*	H	α-helix	trans	-63.1	-33.2	-178.8	-160.9	-177.4	75.6	-166.9	-0.6	113.3	E732 E734	E732-R736 PolarHBondContact O-N 3.4Å; E734-R736 VanDerWaalsContact C-N 3.34Å; E734-R736 PolarHBondContact O-N 3.45Å
737	K	70.9	Confident	70.4	Confident	150 Å²	150	133.3 Å²	133.3	65%	0.652	60%	0.595	S	S	*	*	H	α-helix	trans	-78.1	-29.3	-179.5	-72.6	-178.6	179.7	173.5	0	113.2	E734 A735	E734-K737 PolarHBondContact O-N 3.13Å; A735-K737 VanDerWaalsContact C-N 3.31Å; A735-K737 PolarHBondContact O-N 3.14Å
738	A	69.6	Low	70.3	Confident	66 Å²	66	135.6 Å²	135.6	55%	0.545	61%	0.606	S	S	.	*	H	α-helix	trans	-78.7	-28.6	179.1	0	0	0	0	0	113.2	A735	A735-A738 PolarHBondContact O-N 2.98Å
739	E	63.8	Low	70.1	Confident	90 Å²	90	131 Å²	131	42%	0.421	60%	0.603	S	S	.	*	H	α-helix	trans	-66.2	-36.6	179.1	-171.5	91.8	-162.5	0	0	112.9	A735 E741 R742 K743	A735-E739 PolarHBondContact O-N 3.43Å; E739-E741 PolarHBondContact O-N 2.9Å; E739-R742 PolarHBondContact O-N 3.26Å; E739-K743 PolarHBondContact O-N 3.06Å
740	E	68.7	Low	69.9	Low	149 Å²	149	131.6 Å²	131.6	70%	0.696	60%	0.6	S	S	*	*	H	α-helix	trans	-68.1	-33.8	-178.4	-75.3	-178.6	162	0	0	113
741	E	71.4	Confident	69.7	Low	137 Å²	137	129.5 Å²	129.5	64%	0.64	60%	0.597	S	S	*	*	H	α-helix	trans	-77.3	-30.4	179.5	-161.8	177.2	167.8	0	0	112.3	E739	E739-E741 PolarHBondContact O-N 2.9Å
742	R	69	Low	69.7	Low	144 Å²	144	126.8 Å²	126.8	54%	0.543	60%	0.597	S	S	.	*	H	α-helix	trans	-70.7	-40.3	-179.9	-153.7	-177.3	92.2	-157.1	-2	112.6	E739 R744 K745 E746	E739-R742 PolarHBondContact O-N 3.26Å; R742-R744 VanDerWaalsContact C-N 3.26Å; R742-R744 PolarHBondContact O-N 3.43Å; R742-K745 PolarHBondContact O-N 3.37Å; R742-E746 IonicContact CZ-OE1 2.9Å; R742-E746 IonicContact NE-OE1 2.87Å; R742-E746 PolarHBondContact NE-OE1 3.34Å; R742-E746 IonicContact NH2-OE1 2.84Å; R742-E746 PolarHBondContact NH2-OE1 2.95Å; R742-E746 PolarHBondContact O-N 3.4Å
743	K	70.2	Confident	69.6	Low	128 Å²	128	125 Å²	125	56%	0.557	60%	0.6	S	S	*	*	H	α-helix	trans	-61.7	-30.6	-179.7	-76.1	-176.7	178.2	177.9	0	113.6	E739	E739-K743 PolarHBondContact O-N 3.06Å
744	R	71.6	Confident	69.5	Low	210 Å²	210	123.2 Å²	123.2	79%	0.792	59%	0.592	S	S	*	*	H	α-helix	trans	-73.2	-30.3	-178.5	-153.2	177.1	178	-169.2	-1.4	113.2	R742	R742-R744 VanDerWaalsContact C-N 3.26Å; R742-R744 PolarHBondContact O-N 3.43Å
745	K	71.2	Confident	69.4	Low	147 Å²	147	123 Å²	123	64%	0.639	59%	0.591	S	S	*	*	H	α-helix	trans	-83.9	-29	177.3	-73.4	176.4	178.1	167.5	0	113	R742	R742-K745 PolarHBondContact O-N 3.37Å
746	E	66.4	Low	69.4	Low	99 Å²	99	125.5 Å²	125.5	46%	0.463	59%	0.592	S	S	.	*	H	α-helix	trans	-69.9	-29.1	177.2	-79.1	172.4	-176.8	0	0	113.1	R742 R750	R742-E746 IonicContact CZ-OE1 2.9Å; R742-E746 IonicContact NE-OE1 2.87Å; R742-E746 PolarHBondContact NE-OE1 3.34Å; R742-E746 IonicContact NH2-OE1 2.84Å; R742-E746 PolarHBondContact NH2-OE1 2.95Å; R742-E746 PolarHBondContact O-N 3.4Å; E746-R750 PolarHBondContact O-N 3.12Å
747	E	66.6	Low	69.1	Low	119 Å²	119	124.1 Å²	124.1	56%	0.556	59%	0.587	S	S	*	*	H	α-helix	trans	-73.6	-33.7	-179	-165.1	169	-171.1	0	0	113.6
748	E	72.6	Confident	69.1	Low	157 Å²	157	123.5 Å²	123.5	73%	0.734	59%	0.585	S	S	*	*	H	α-helix	trans	-70.9	-37.6	174.9	-74.9	-178.7	159.5	0	0	112.1
749	A	68.7	Low	69.2	Low	63 Å²	63	127 Å²	127	52%	0.521	59%	0.587	S	S	.	*	H	α-helix	trans	-69.8	-30.5	177.6	0	0	0	0	0	113.1	K751 A752 A753	A749-K751 PolarHBondContact O-N 3.1Å; A749-A752 PolarHBondContact O-N 3.4Å; A749-A753 PolarHBondContact O-N 2.88Å
750	R	69.4	Low	69.3	Low	171 Å²	171	128.9 Å²	128.9	65%	0.645	60%	0.596	S	S	*	*	H	α-helix	trans	-66.8	-34.7	-179.3	-158.7	179.2	84	-155.5	3	113.1	E746	E746-R750 PolarHBondContact O-N 3.12Å
751	K	70.3	Confident	69.1	Low	156 Å²	156	126.9 Å²	126.9	68%	0.678	59%	0.587	S	S	*	*	H	α-helix	trans	-69.7	-35.2	178.7	-75.4	-178.1	178.1	175	0	112.8	A749	A749-K751 PolarHBondContact O-N 3.1Å
752	A	73	Confident	69	Low	67 Å²	67	126.9 Å²	126.9	55%	0.554	59%	0.587	S	S	*	*	H	α-helix	trans	-72.6	-34.2	178.6	0	0	0	0	0	112.9	A749 E754	A749-A752 PolarHBondContact O-N 3.4Å; A752-E754 VanDerWaalsContact C-N 3.33Å; A752-E754 PolarHBondContact O-N 2.94Å
753	A	66.1	Low	69.2	Low	66 Å²	66	125.1 Å²	125.1	55%	0.545	59%	0.587	S	S	.	*	H	α-helix	trans	-72.3	-23.9	178.8	0	0	0	0	0	113.7	A749 R757	A749-A753 PolarHBondContact O-N 2.88Å; A753-R757 PolarHBondContact O-N 3.45Å
754	E	65.7	Low	69.1	Low	90 Å²	90	123.6 Å²	123.6	42%	0.421	58%	0.582	S	S	.	*	H	α-helix	trans	-78.2	-28.5	-177.9	-166.4	163.1	-167.4	0	0	113.2	A752	A752-E754 VanDerWaalsContact C-N 3.33Å; A752-E754 PolarHBondContact O-N 2.94Å
755	E	69.7	Low	69.1	Low	148 Å²	148	123.1 Å²	123.1	69%	0.692	58%	0.58	S	S	*	*	H	α-helix	trans	-71.5	-37.1	172.2	-85.3	-174	147.7	0	0	112.7
756	E	68.9	Low	69.3	Low	110 Å²	110	121 Å²	121	51%	0.514	58%	0.575	S	S	.	*	H	α-helix	trans	-72	-34.4	-179.9	-159.9	65.3	-157.9	0	0	111.8	K758 K759 Q760	E756-K758 VanDerWaalsContact C-N 3.34Å; E756-K758 PolarHBondContact O-N 2.87Å; E756-K759 PolarHBondContact O-N 3.41Å; E756-Q760 PolarHBondContact O-N 3.4Å
757	R	68	Low	69.7	Low	139 Å²	139	122.4 Å²	122.4	53%	0.525	58%	0.579	S	S	.	*	H	α-helix	trans	-63.2	-38.1	176.7	-161.4	177.7	77.9	-145.2	-5.1	112.3	A753 K759 Q760 E761	A753-R757 PolarHBondContact O-N 3.45Å; R757-K759 VanDerWaalsContact C-N 3.33Å; R757-K759 PolarHBondContact O-N 2.89Å; R757-Q760 PolarHBondContact O-N 2.98Å; R757-E761 IonicContact NE-OE1 3.35Å; R757-E761 PolarHBondContact NE-OE1 3.21Å; R757-E761 WeakPolarHBondContact O-CG 3.16Å; R757-E761 PolarHBondContact O-N 3.2Å; R757-E761 VanDerWaalsContact O-N 3.14Å
758	K	70.4	Confident	69.8	Low	138 Å²	138	120.8 Å²	120.8	60%	0.6	58%	0.575	S	S	*	*	H	α-helix	trans	-64.5	-34.2	177.3	-74.7	-178.3	178.5	177.8	0	113	E756 E762	E756-K758 VanDerWaalsContact C-N 3.34Å; E756-K758 PolarHBondContact O-N 2.87Å; K758-E762 PolarHBondContact O-N 3.29Å
759	K	72.3	Confident	69.8	Low	138 Å²	138	118 Å²	118	60%	0.6	56%	0.561	S	S	*	*	H	α-helix	trans	-71	-34	176.5	-76.9	179.7	-179.6	168.9	0	113.1	E756 R757	E756-K759 PolarHBondContact O-N 3.41Å; R757-K759 VanDerWaalsContact C-N 3.33Å; R757-K759 PolarHBondContact O-N 2.89Å
760	Q	64.5	Low	70.2	Confident	130 Å²	130	121.5 Å²	121.5	61%	0.607	57%	0.567	S	S	*	*	H	α-helix	trans	-77.2	-33.3	178.7	-69.6	-172.8	-4.3	0	0	112.9	E756 R757 E762 I763 Q764	E756-Q760 PolarHBondContact O-N 3.4Å; R757-Q760 PolarHBondContact O-N 2.98Å; Q760-E762 VanDerWaalsContact C-N 3.32Å; Q760-E762 PolarHBondContact O-N 3.5Å; Q760-I763 PolarHBondContact O-N 3.46Å; Q760-Q764 PolarHBondContact O-N 3.25Å
761	E	65.3	Low	70.3	Confident	107 Å²	107	118.2 Å²	118.2	50%	0.5	56%	0.559	S	S	.	*	H	α-helix	trans	-64.8	-32.9	175.3	-75	171.1	-173.4	0	0	112.7	R757 R765	R757-E761 IonicContact NE-OE1 3.35Å; R757-E761 PolarHBondContact NE-OE1 3.21Å; R757-E761 WeakPolarHBondContact O-CG 3.16Å; R757-E761 PolarHBondContact O-N 3.2Å; R757-E761 VanDerWaalsContact O-N 3.14Å; E761-R765 PolarHBondContact O-N 3.14Å
762	E	69.4	Low	70.4	Confident	138 Å²	138	117.6 Å²	117.6	65%	0.645	55%	0.552	S	S	*	*	H	α-helix	trans	-72.3	-35.6	177.4	-166.5	162.6	-166.3	0	0	112.7	K758 Q760 I766	K758-E762 PolarHBondContact O-N 3.29Å; Q760-E762 VanDerWaalsContact C-N 3.32Å; Q760-E762 PolarHBondContact O-N 3.5Å; E762-I766 PolarHBondContact O-N 3.32Å
763	I	73.9	Confident	70.6	Confident	106 Å²	106	120.8 Å²	120.8	54%	0.544	55%	0.554	S	S	.	*	H	α-helix	trans	-67.8	-35.8	174.9	-66.7	170.8	0	0	0	111.4	Q760	Q760-I763 PolarHBondContact O-N 3.46Å
764	Q	66.3	Low	71.1	Confident	97 Å²	97	126.7 Å²	126.7	45%	0.453	56%	0.562	S	S	.	*	H	α-helix	trans	-71.9	-37.9	179	-168.4	59.4	37	0	0	112.1	Q760 I766 K767 D768	Q760-Q764 PolarHBondContact O-N 3.25Å; Q764-I766 VanDerWaalsContact C-N 3.31Å; Q764-I766 PolarHBondContact O-N 3.37Å; Q764-K767 PolarHBondContact O-N 3.08Å; Q764-D768 PolarHBondContact NE2-OD1 3.36Å; Q764-D768 VanDerWaalsContact O-CG 3.31Å; Q764-D768 PolarHBondContact O-N 2.83Å
765	R	71.8	Confident	71.4	Confident	200 Å²	200	128.3 Å²	128.3	76%	0.755	57%	0.568	S	S	*	*	H	α-helix	trans	-58.2	-39.1	175.4	-87.5	-173.3	170.6	-152.4	-1.5	113.6	E761 E769	E761-R765 PolarHBondContact O-N 3.14Å; R765-E769 WeakPolarHBondContact O-CB 3.11Å; R765-E769 PolarHBondContact O-N 3.01Å; R765-E769 VanDerWaalsContact O-N 3.15Å
766	I	76.2	Confident	71.5	Confident	101 Å²	101	126.6 Å²	126.6	52%	0.518	56%	0.56	S	S	.	*	H	α-helix	trans	-67.7	-39	179.6	-65.7	170.4	0	0	0	111	E762 Q764 E769 E770	E762-I766 PolarHBondContact O-N 3.32Å; Q764-I766 VanDerWaalsContact C-N 3.31Å; Q764-I766 PolarHBondContact O-N 3.37Å; I766-E769 PolarHBondContact O-N 3.14Å; I766-E770 PolarHBondContact O-N 2.94Å
767	K	74.1	Confident	71.9	Confident	129 Å²	129	124.2 Å²	124.2	56%	0.561	56%	0.559	S	S	*	*	H	α-helix	trans	-67.6	-42.1	176.7	-78.8	-177	174.8	178.4	0	112.8	Q764 E769 E770 E771	Q764-K767 PolarHBondContact O-N 3.08Å; K767-E769 VanDerWaalsContact C-N 3.27Å; K767-E769 PolarHBondContact O-N 3Å; K767-E770 PolarHBondContact O-N 3.01Å; K767-E771 PolarHBondContact O-N 3.16Å; K767-E771 VanDerWaalsContact O-N 3.09Å
768	D	70.2	Confident	72.2	Confident	85 Å²	85	124 Å²	124	46%	0.455	56%	0.564	S	S	.	*	H	α-helix	trans	-66.5	-31.8	179.1	-63.1	-11.5	0	0	0	111.5	Q764 R772	Q764-D768 PolarHBondContact NE2-OD1 3.36Å; Q764-D768 VanDerWaalsContact O-CG 3.31Å; Q764-D768 PolarHBondContact O-N 2.83Å; D768-R772 WeakPolarHBondContact O-CB 3.32Å; D768-R772 PolarHBondContact O-N 3.29Å
769	E	71.9	Confident	72.2	Confident	98 Å²	98	123.1 Å²	123.1	46%	0.458	57%	0.565	S	S	.	*	H	α-helix	trans	-76.6	-33.6	178.6	-165.5	159.4	-157.8	0	0	113.5	R765 I766 K767 R772 K773	R765-E769 WeakPolarHBondContact O-CB 3.11Å; R765-E769 PolarHBondContact O-N 3.01Å; R765-E769 VanDerWaalsContact O-N 3.15Å; I766-E769 PolarHBondContact O-N 3.14Å; K767-E769 VanDerWaalsContact C-N 3.27Å; K767-E769 PolarHBondContact O-N 3Å; E769-R772 IonicContact OE1-NH2 2.8Å; E769-K773 PolarHBondContact O-N 3.1Å
770	E	76.3	Confident	72.4	Confident	137 Å²	137	123.5 Å²	123.5	64%	0.64	57%	0.567	S	S	*	*	H	α-helix	trans	-68.9	-39.7	170.3	-76.1	-171.7	156.7	0	0	112.3	I766 K767 K773 R774	I766-E770 PolarHBondContact O-N 2.94Å; K767-E770 PolarHBondContact O-N 3.01Å; E770-K773 PolarHBondContact O-N 3.04Å; E770-R774 PolarHBondContact O-N 2.88Å; E770-R774 VanDerWaalsContact O-N 3.11Å
771	E	72	Confident	73	Confident	103 Å²	103	120.1 Å²	120.1	48%	0.481	56%	0.561	S	S	.	*	H	α-helix	trans	-67.1	-37.8	177.3	-161.1	-174.9	149	0	0	111.9	K767 R774 K775	K767-E771 PolarHBondContact O-N 3.16Å; K767-E771 VanDerWaalsContact O-N 3.09Å; E771-R774 PolarHBondContact O-N 3Å; E771-K775 PolarHBondContact O-N 3.41Å; E771-K775 IonicContact OE1-NZ 2.62Å; E771-K775 PolarHBondContact OE1-NZ 3.32Å
772	R	72.7	Confident	73.5	Confident	142 Å²	142	117.7 Å²	117.7	54%	0.536	56%	0.559	S	S	.	*	H	α-helix	trans	-61.8	-43.7	174.4	-168.1	-178.9	67.5	163.3	-3	112	D768 E769 R774 K775 E776	D768-R772 WeakPolarHBondContact O-CB 3.32Å; D768-R772 PolarHBondContact O-N 3.29Å; E769-R772 IonicContact OE1-NH2 2.8Å; R772-R774 VanDerWaalsContact C-N 3.3Å; R772-R774 PolarHBondContact O-N 3.23Å; R772-K775 PolarHBondContact O-N 3.3Å; R772-E776 WeakPolarHBondContact O-CB 3.36Å; R772-E776 PolarHBondContact O-N 3.41Å
773	K	76.1	Confident	73.6	Confident	134 Å²	134	115.2 Å²	115.2	58%	0.583	55%	0.547	S	S	*	.	H	α-helix	trans	-64.6	-33.4	176.2	-75.1	178.9	-179.2	172.6	0	112.5	E769 E770 A777	E769-K773 PolarHBondContact O-N 3.1Å; E770-K773 PolarHBondContact O-N 3.04Å; K773-A777 WeakPolarHBondContact O-CB 3.41Å; K773-A777 PolarHBondContact O-N 3.41Å; K773-A777 VanDerWaalsContact O-N 3.14Å
774	R	76.9	Confident	73.7	Confident	191 Å²	191	116.9 Å²	116.9	72%	0.721	55%	0.553	S	S	*	*	H	α-helix	trans	-69.7	-44.8	176	-128.5	179.7	-177	-173.5	-0.1	112.1	E770 E771 R772 A777 E778	E770-R774 PolarHBondContact O-N 2.88Å; E770-R774 VanDerWaalsContact O-N 3.11Å; E771-R774 PolarHBondContact O-N 3Å; R772-R774 VanDerWaalsContact C-N 3.3Å; R772-R774 PolarHBondContact O-N 3.23Å; R774-A777 PolarHBondContact O-N 3.33Å; R774-E778 PolarHBondContact O-N 3.41Å
775	K	71.6	Confident	74.2	Confident	124 Å²	124	117.4 Å²	117.4	54%	0.539	56%	0.555	S	S	.	*	H	α-helix	trans	-66.8	-36.7	176.3	-79.7	175.5	170.9	155.1	0	112.8	E771 R772 E778 L779	E771-K775 PolarHBondContact O-N 3.41Å; E771-K775 IonicContact OE1-NZ 2.62Å; E771-K775 PolarHBondContact OE1-NZ 3.32Å; R772-K775 PolarHBondContact O-N 3.3Å; K775-E778 PolarHBondContact O-N 3.28Å; K775-L779 WeakPolarHBondContact O-CB 3.44Å; K775-L779 PolarHBondContact O-N 3.43Å
776	E	72.9	Confident	74.3	Confident	112 Å²	112	114.6 Å²	114.6	52%	0.523	55%	0.545	S	S	.	.	H	α-helix	trans	-66.6	-35.9	173	-79.9	178.8	171.7	0	0	112.5	R772 K780	R772-E776 WeakPolarHBondContact O-CB 3.36Å; R772-E776 PolarHBondContact O-N 3.41Å; E776-K780 PolarHBondContact O-N 2.88Å
777	A	76.2	Confident	74.3	Confident	60 Å²	60	116.1 Å²	116.1	50%	0.496	55%	0.548	S	S	.	.	H	α-helix	trans	-69.8	-40.3	175	0	0	0	0	0	112.4	K773 R774 K780 A781	K773-A777 WeakPolarHBondContact O-CB 3.41Å; K773-A777 PolarHBondContact O-N 3.41Å; K773-A777 VanDerWaalsContact O-N 3.14Å; R774-A777 PolarHBondContact O-N 3.33Å; A777-K780 PolarHBondContact O-N 3.31Å; A777-A781 WeakPolarHBondContact O-CB 3.5Å; A777-A781 PolarHBondContact O-N 2.85Å
778	E	73.9	Confident	74.6	Confident	133 Å²	133	119.2 Å²	119.2	62%	0.621	56%	0.556	S	S	*	*	H	α-helix	trans	-66.1	-39.7	173.7	-79	178.3	167.1	0	0	112.2	R774 K775 A781 A782	R774-E778 PolarHBondContact O-N 3.41Å; K775-E778 PolarHBondContact O-N 3.28Å; E778-A781 PolarHBondContact O-N 3.42Å; E778-A782 WeakPolarHBondContact O-CB 3.4Å; E778-A782 PolarHBondContact O-N 3.01Å
779	L	71.9	Confident	74.8	Confident	121 Å²	121	121 Å²	121	63%	0.634	56%	0.559	S	S	*	*	H	α-helix	trans	-65.1	-40.1	176.4	-160.6	79.8	0	0	0	111.6	K775 E783	K775-L779 WeakPolarHBondContact O-CB 3.44Å; K775-L779 PolarHBondContact O-N 3.43Å; L779-E783 WeakPolarHBondContact O-CB 3.48Å; L779-E783 PolarHBondContact O-N 3.03Å
780	K	76.1	Confident	74.9	Confident	146 Å²	146	121.4 Å²	121.4	64%	0.635	56%	0.562	S	S	*	*	H	α-helix	trans	-65.6	-42.3	174	-101.1	-176.7	174.1	178.6	0	112.8	E776 A777 E783 E784	E776-K780 PolarHBondContact O-N 2.88Å; A777-K780 PolarHBondContact O-N 3.31Å; K780-E783 PolarHBondContact O-N 2.9Å; K780-E784 PolarHBondContact O-N 3.27Å
781	A	77.4	Confident	74.8	Confident	58 Å²	58	117.7 Å²	117.7	48%	0.479	55%	0.554	S	S	.	*	H	α-helix	trans	-65.6	-40.2	177.2	0	0	0	0	0	111.8	A777 E778 E784 E785	A777-A781 WeakPolarHBondContact O-CB 3.5Å; A777-A781 PolarHBondContact O-N 2.85Å; E778-A781 PolarHBondContact O-N 3.42Å; A781-E784 PolarHBondContact O-N 3.11Å; A781-E785 WeakPolarHBondContact O-CB 3.32Å; A781-E785 PolarHBondContact O-N 3.38Å
782	A	74.6	Confident	75	Confident	56 Å²	56	119.3 Å²	119.3	46%	0.463	56%	0.562	S	S	.	*	H	α-helix	trans	-67.8	-35.7	175.2	0	0	0	0	0	112.6	E778 R786	E778-A782 WeakPolarHBondContact O-CB 3.4Å; E778-A782 PolarHBondContact O-N 3.01Å; A782-R786 VanDerWaalsContact O-CB 3.31Å; A782-R786 WeakPolarHBondContact O-CB 3.37Å; A782-R786 PolarHBondContact O-N 3.19Å
783	E	72.1	Confident	75	Confident	86 Å²	86	118.3 Å²	118.3	40%	0.402	57%	0.567	S	S	.	*	H	α-helix	trans	-68.5	-39.3	173	-103.7	-170.2	148.9	0	0	112.9	L779 K780 R786 K787	L779-E783 WeakPolarHBondContact O-CB 3.48Å; L779-E783 PolarHBondContact O-N 3.03Å; K780-E783 PolarHBondContact O-N 2.9Å; E783-R786 PolarHBondContact O-N 2.89Å; E783-K787 WeakPolarHBondContact O-CB 3.46Å; E783-K787 WeakPolarHBondContact O-CG 3.01Å; E783-K787 PolarHBondContact O-N 3.42Å
784	E	77.1	Confident	74.9	Confident	142 Å²	142	118.7 Å²	118.7	66%	0.664	57%	0.568	S	S	*	*	H	α-helix	trans	-67.5	-38.8	175	-79.8	-174.8	166.5	0	0	111.9	K780 A781 K787 R788	K780-E784 PolarHBondContact O-N 3.27Å; A781-E784 PolarHBondContact O-N 3.11Å; E784-K787 PolarHBondContact O-N 3.27Å; E784-R788 PolarHBondContact O-N 2.9Å
785	E	76.1	Confident	75	Confident	107 Å²	107	112.2 Å²	112.2	50%	0.5	56%	0.556	S	S	.	*	H	α-helix	trans	-67.5	-40.6	173.8	-163.8	-174.2	153.8	0	0	111.7	A781 R788 K789	A781-E785 WeakPolarHBondContact O-CB 3.32Å; A781-E785 PolarHBondContact O-N 3.38Å; E785-R788 PolarHBondContact O-N 3.21Å; E785-K789 PolarHBondContact O-N 3.21Å; E785-K789 IonicContact OE1-NZ 3.53Å; E785-K789 PolarHBondContact OE1-NZ 2.68Å
786	R	74.6	Confident	75.2	Confident	142 Å²	142	109.2 Å²	109.2	54%	0.536	55%	0.553	S	S	.	*	H	α-helix	trans	-62.9	-42	174.7	-163.1	179.4	81	-160.3	-2.1	111.4	A782 E783 K789 E790	A782-R786 VanDerWaalsContact O-CB 3.31Å; A782-R786 WeakPolarHBondContact O-CB 3.37Å; A782-R786 PolarHBondContact O-N 3.19Å; E783-R786 PolarHBondContact O-N 2.89Å; R786-K789 PolarHBondContact O-N 2.94Å; R786-E790 WeakPolarHBondContact O-CB 3.34Å; R786-E790 WeakPolarHBondContact O-CG 3.44Å; R786-E790 PolarHBondContact O-N 3.28Å
787	K	76.4	Confident	75.1	Confident	132 Å²	132	108.1 Å²	108.1	57%	0.574	55%	0.548	S	S	*	.	H	α-helix	trans	-65.6	-36.1	174.5	-77.7	177	-179.6	171.8	0	112.7	E783 E784 A791	E783-K787 WeakPolarHBondContact O-CB 3.46Å; E783-K787 WeakPolarHBondContact O-CG 3.01Å; E783-K787 PolarHBondContact O-N 3.42Å; E784-K787 PolarHBondContact O-N 3.27Å; K787-A791 WeakPolarHBondContact O-CB 3.45Å; K787-A791 PolarHBondContact O-N 3.05Å
788	R	78.5	Confident	75	Confident	194 Å²	194	111.7 Å²	111.7	73%	0.732	56%	0.555	S	S	*	*	H	α-helix	trans	-66.3	-45.8	173.1	-97.5	-175.3	173	-178.5	-1.4	112.1	E784 E785 A791 E792	E784-R788 PolarHBondContact O-N 2.9Å; E785-R788 PolarHBondContact O-N 3.21Å; R788-A791 PolarHBondContact O-N 3.07Å; R788-E792 PolarHBondContact O-N 3.36Å
789	K	76.1	Confident	75.1	Confident	122 Å²	122	110.6 Å²	110.6	53%	0.53	55%	0.55	S	S	.	.	H	α-helix	trans	-67.4	-38.5	177.2	-80.2	175.5	171.6	158	0	112.5	E785 R786 A791 E792 L793	E785-K789 PolarHBondContact O-N 3.21Å; E785-K789 IonicContact OE1-NZ 3.53Å; E785-K789 PolarHBondContact OE1-NZ 2.68Å; R786-K789 PolarHBondContact O-N 2.94Å; K789-A791 VanDerWaalsContact C-N 3.35Å; K789-E792 PolarHBondContact O-N 3.22Å; K789-L793 VanDerWaalsContact O-CB 3.24Å; K789-L793 WeakPolarHBondContact O-CB 3.43Å; K789-L793 PolarHBondContact O-N 3.32Å
790	E	72.3	Confident	75.3	Confident	108 Å²	108	112 Å²	112	51%	0.505	55%	0.546	S	S	.	.	H	α-helix	trans	-66.1	-35.8	172.1	-82	176.5	166.5	0	0	112	R786 K794	R786-E790 WeakPolarHBondContact O-CB 3.34Å; R786-E790 WeakPolarHBondContact O-CG 3.44Å; R786-E790 PolarHBondContact O-N 3.28Å; E790-K794 VanDerWaalsContact O-CB 3.31Å; E790-K794 WeakPolarHBondContact O-CB 3.38Å; E790-K794 PolarHBondContact O-N 3.27Å
791	A	75.9	Confident	75.2	Confident	59 Å²	59	110.9 Å²	110.9	49%	0.488	54%	0.542	S	S	.	.	H	α-helix	trans	-71.5	-39.7	175.1	0	0	0	0	0	112.6	K787 R788 K789 A795	K787-A791 WeakPolarHBondContact O-CB 3.45Å; K787-A791 PolarHBondContact O-N 3.05Å; R788-A791 PolarHBondContact O-N 3.07Å; K789-A791 VanDerWaalsContact C-N 3.35Å; A791-A795 VanDerWaalsContact O-CB 3.25Å; A791-A795 WeakPolarHBondContact O-CB 3.45Å; A791-A795 PolarHBondContact O-N 2.89Å
792	E	76.4	Confident	75.3	Confident	136 Å²	136	116.6 Å²	116.6	64%	0.636	55%	0.551	S	S	*	*	H	α-helix	trans	-67.1	-40.7	173	-80.3	179.6	167	0	0	111.6	R788 K789 A795 A796	R788-E792 PolarHBondContact O-N 3.36Å; K789-E792 PolarHBondContact O-N 3.22Å; E792-A795 PolarHBondContact O-N 2.86Å; E792-A796 VanDerWaalsContact O-CB 3.3Å; E792-A796 WeakPolarHBondContact O-CB 3.14Å; E792-A796 PolarHBondContact O-N 3.47Å
793	L	72.2	Confident	75.4	Confident	122 Å²	122	119.9 Å²	119.9	64%	0.639	56%	0.555	S	S	*	*	H	α-helix	trans	-65.2	-44.8	175.3	-163.6	77.1	0	0	0	110.6	K789 A795 A796 E797	K789-L793 VanDerWaalsContact O-CB 3.24Å; K789-L793 WeakPolarHBondContact O-CB 3.43Å; K789-L793 PolarHBondContact O-N 3.32Å; L793-A795 PolarHBondContact O-N 3.04Å; L793-A796 PolarHBondContact O-N 3.14Å; L793-E797 VanDerWaalsContact O-CB 3.24Å; L793-E797 WeakPolarHBondContact O-CB 3.45Å; L793-E797 PolarHBondContact O-N 3.01Å
794	K	74.6	Confident	75.5	Confident	142 Å²	142	120.6 Å²	120.6	62%	0.617	56%	0.558	S	S	*	*	H	α-helix	trans	-61.7	-41.8	173.5	-100	-176.3	170.4	179.3	0	112.8	E790 E797 E798	E790-K794 VanDerWaalsContact O-CB 3.31Å; E790-K794 WeakPolarHBondContact O-CB 3.38Å; E790-K794 PolarHBondContact O-N 3.27Å; K794-E797 PolarHBondContact O-N 3.45Å; K794-E798 VanDerWaalsContact O-CB 3.29Å; K794-E798 WeakPolarHBondContact O-CB 3Å; K794-E798 WeakPolarHBondContact O-CG 3.5Å; K794-E798 PolarHBondContact O-N 3.12Å
795	A	77.3	Confident	75.3	Confident	55 Å²	55	116.6 Å²	116.6	46%	0.455	55%	0.55	S	S	.	.	H	α-helix	trans	-67.1	-40.2	178.7	0	0	0	0	0	111.7	A791 E792 L793 E799	A791-A795 VanDerWaalsContact O-CB 3.25Å; A791-A795 WeakPolarHBondContact O-CB 3.45Å; A791-A795 PolarHBondContact O-N 2.89Å; E792-A795 PolarHBondContact O-N 2.86Å; L793-A795 PolarHBondContact O-N 3.04Å; A795-E799 WeakPolarHBondContact O-CB 3.37Å; A795-E799 PolarHBondContact O-N 3.24Å
796	A	76.8	Confident	75.3	Confident	60 Å²	60	117.4 Å²	117.4	50%	0.496	55%	0.553	S	S	.	*	H	α-helix	trans	-68.2	-37.4	174.7	0	0	0	0	0	112.1	E792 L793 R800	E792-A796 VanDerWaalsContact O-CB 3.3Å; E792-A796 WeakPolarHBondContact O-CB 3.14Å; E792-A796 PolarHBondContact O-N 3.47Å; L793-A796 PolarHBondContact O-N 3.14Å; A796-R800 WeakPolarHBondContact O-CB 3.2Å; A796-R800 PolarHBondContact O-N 3.14Å
797	E	70.4	Confident	75.4	Confident	89 Å²	89	113.5 Å²	113.5	42%	0.416	55%	0.551	S	S	.	*	H	α-helix	trans	-72	-36.5	176.6	-143.4	178.5	-165.8	0	0	111.9	L793 K794 K801	L793-E797 VanDerWaalsContact O-CB 3.24Å; L793-E797 WeakPolarHBondContact O-CB 3.45Å; L793-E797 PolarHBondContact O-N 3.01Å; K794-E797 PolarHBondContact O-N 3.45Å; E797-K801 VanDerWaalsContact O-CB 3.27Å; E797-K801 WeakPolarHBondContact O-CB 2.97Å; E797-K801 VanDerWaalsContact O-CG 3.26Å; E797-K801 WeakPolarHBondContact O-CG 3.49Å; E797-K801 PolarHBondContact O-N 3.12Å
798	E	74.1	Confident	75.3	Confident	136 Å²	136	110.1 Å²	110.1	64%	0.636	55%	0.548	S	S	*	.	H	α-helix	trans	-67.6	-40.8	171.4	-81.5	-178.4	172	0	0	111.7	K794 K801 R802	K794-E798 VanDerWaalsContact O-CB 3.29Å; K794-E798 WeakPolarHBondContact O-CB 3Å; K794-E798 WeakPolarHBondContact O-CG 3.5Å; K794-E798 PolarHBondContact O-N 3.12Å; E798-K801 PolarHBondContact O-N 2.94Å; E798-R802 WeakPolarHBondContact O-CB 3.44Å; E798-R802 PolarHBondContact O-N 3.19Å
799	E	76.7	Confident	75.1	Confident	109 Å²	109	103.6 Å²	103.6	51%	0.509	54%	0.536	S	S	.	.	H	α-helix	trans	-67.2	-38.6	174.9	-166.6	-179.7	157.4	0	0	111.6	A795 R802 K803	A795-E799 WeakPolarHBondContact O-CB 3.37Å; A795-E799 PolarHBondContact O-N 3.24Å; E799-R802 PolarHBondContact O-N 2.89Å; E799-K803 PolarHBondContact O-N 3.41Å; E799-K803 WeakPolarHBondContact OE1-CE 3.49Å; E799-K803 IonicContact OE1-NZ 2.8Å; E799-K803 PolarHBondContact OE1-NZ 3.31Å
800	R	76.5	Confident	75.2	Confident	150 Å²	150	100.7 Å²	100.7	57%	0.566	53%	0.534	S	S	*	.	H	α-helix	trans	-65.4	-46.3	174.3	-158.6	-177.4	92.8	-156.7	-0.5	111.4	A796 R802 K803 E804	A796-R800 WeakPolarHBondContact O-CB 3.2Å; A796-R800 PolarHBondContact O-N 3.14Å; R800-R802 VanDerWaalsContact C-N 3.28Å; R800-R802 PolarHBondContact O-N 3.15Å; R800-K803 PolarHBondContact O-N 2.98Å; R800-E804 IonicContact CZ-OE1 3.1Å; R800-E804 IonicContact NE-OE1 2.82Å; R800-E804 PolarHBondContact NE-OE1 2.96Å; R800-E804 IonicContact NH2-OE1 2.66Å; R800-E804 WeakPolarHBondContact O-CB 3.32Å; R800-E804 WeakPolarHBondContact O-CG 3.48Å; R800-E804 PolarHBondContact O-N 3.43Å
801	K	74.1	Confident	75.2	Confident	123 Å²	123	100.5 Å²	100.5	54%	0.535	53%	0.533	S	S	.	.	H	α-helix	trans	-62.2	-33.7	173.9	-77.6	176.4	179.6	171.9	0	112.2	E797 E798 A805	E797-K801 VanDerWaalsContact O-CB 3.27Å; E797-K801 WeakPolarHBondContact O-CB 2.97Å; E797-K801 VanDerWaalsContact O-CG 3.26Å; E797-K801 WeakPolarHBondContact O-CG 3.49Å; E797-K801 PolarHBondContact O-N 3.12Å; E798-K801 PolarHBondContact O-N 2.94Å; K801-A805 WeakPolarHBondContact O-CB 3.15Å; K801-A805 PolarHBondContact O-N 2.95Å
802	R	78.3	Confident	75	Confident	178 Å²	178	100.4 Å²	100.4	67%	0.672	53%	0.533	S	S	*	.	H	α-helix	trans	-72.2	-40.8	177	-161.9	176.8	-177.7	-176.1	1.6	112	E798 E799 R800 A805 E806	E798-R802 WeakPolarHBondContact O-CB 3.44Å; E798-R802 PolarHBondContact O-N 3.19Å; E799-R802 PolarHBondContact O-N 2.89Å; R800-R802 VanDerWaalsContact C-N 3.28Å; R800-R802 PolarHBondContact O-N 3.15Å; R802-A805 PolarHBondContact O-N 3.05Å; R802-E806 WeakPolarHBondContact O-CB 3.49Å; R802-E806 WeakPolarHBondContact O-CG 3.43Å; R802-E806 PolarHBondContact O-N 2.99Å
803	K	77.6	Confident	75	Confident	126 Å²	126	99.2 Å²	99.2	55%	0.548	53%	0.527	S	S	.	.	H	α-helix	trans	-69.2	-40.3	173.5	-73.8	178.9	-175.4	161.2	0	112.3	E799 R800 E806 A807	E799-K803 PolarHBondContact O-N 3.41Å; E799-K803 WeakPolarHBondContact OE1-CE 3.49Å; E799-K803 IonicContact OE1-NZ 2.8Å; E799-K803 PolarHBondContact OE1-NZ 3.31Å; R800-K803 PolarHBondContact O-N 2.98Å; K803-E806 PolarHBondContact O-N 2.98Å; K803-A807 WeakPolarHBondContact O-CB 3.14Å; K803-A807 PolarHBondContact O-N 3.12Å
804	E	73.1	Confident	75.3	Confident	100 Å²	100	101 Å²	101	47%	0.467	53%	0.526	S	S	.	.	H	α-helix	trans	-65	-40.3	173.2	-77.4	169.9	-169.5	0	0	111.1	R800 A807 A808	R800-E804 IonicContact CZ-OE1 3.1Å; R800-E804 IonicContact NE-OE1 2.82Å; R800-E804 PolarHBondContact NE-OE1 2.96Å; R800-E804 IonicContact NH2-OE1 2.66Å; R800-E804 WeakPolarHBondContact O-CB 3.32Å; R800-E804 WeakPolarHBondContact O-CG 3.48Å; R800-E804 PolarHBondContact O-N 3.43Å; E804-A807 PolarHBondContact O-N 3.02Å; E804-A808 WeakPolarHBondContact O-CB 3.2Å; E804-A808 PolarHBondContact O-N 3.29Å
805	A	72.8	Confident	75.4	Confident	59 Å²	59	100 Å²	100	49%	0.488	52%	0.521	S	S	.	.	H	α-helix	trans	-69.8	-37.3	175.3	0	0	0	0	0	113	K801 R802 A809	K801-A805 WeakPolarHBondContact O-CB 3.15Å; K801-A805 PolarHBondContact O-N 2.95Å; R802-A805 PolarHBondContact O-N 3.05Å; A805-A809 WeakPolarHBondContact O-CB 3.45Å; A805-A809 PolarHBondContact O-N 3.31Å
806	E	76.9	Confident	75.2	Confident	123 Å²	123	100.1 Å²	100.1	58%	0.575	52%	0.523	S	S	*	.	H	α-helix	trans	-67.2	-40	173.1	-83.8	178.4	174.4	0	0	111.7	R802 K803 A809 A810	R802-E806 WeakPolarHBondContact O-CB 3.49Å; R802-E806 WeakPolarHBondContact O-CG 3.43Å; R802-E806 PolarHBondContact O-N 2.99Å; K803-E806 PolarHBondContact O-N 2.98Å; E806-A809 PolarHBondContact O-N 2.98Å; E806-A810 WeakPolarHBondContact O-CB 3.43Å; E806-A810 PolarHBondContact O-N 2.7Å
807	A	76.6	Confident	75.2	Confident	60 Å²	60	103.1 Å²	103.1	50%	0.496	52%	0.524	S	S	.	.	H	α-helix	trans	-66.5	-44.1	174.2	0	0	0	0	0	111.8	K803 E804 A809 A810 E811	K803-A807 WeakPolarHBondContact O-CB 3.14Å; K803-A807 PolarHBondContact O-N 3.12Å; E804-A807 PolarHBondContact O-N 3.02Å; A807-A809 PolarHBondContact O-N 3.03Å; A807-A810 PolarHBondContact O-N 2.82Å; A807-E811 WeakPolarHBondContact O-CB 3.4Å; A807-E811 PolarHBondContact O-N 2.97Å
808	A	73.4	Confident	75.4	Confident	61 Å²	61	103.6 Å²	103.6	50%	0.504	53%	0.526	S	S	.	.	H	α-helix	trans	-66.1	-35.6	175.9	0	0	0	0	0	112.3	E804 A812	E804-A808 WeakPolarHBondContact O-CB 3.2Å; E804-A808 PolarHBondContact O-N 3.29Å; A808-A812 WeakPolarHBondContact O-CB 3.07Å; A808-A812 PolarHBondContact O-N 3.34Å
809	A	75.4	Confident	75.2	Confident	57 Å²	57	101 Å²	101	47%	0.471	52%	0.515	S	S	.	.	H	α-helix	trans	-69.6	-41.2	174.2	0	0	0	0	0	111.9	A805 E806 A807 A812 E813	A805-A809 WeakPolarHBondContact O-CB 3.45Å; A805-A809 PolarHBondContact O-N 3.31Å; E806-A809 PolarHBondContact O-N 2.98Å; A807-A809 PolarHBondContact O-N 3.03Å; A809-A812 PolarHBondContact O-N 2.58Å; A809-E813 WeakPolarHBondContact O-CB 3.5Å; A809-E813 PolarHBondContact O-N 2.82Å
810	A	77.5	Confident	75.1	Confident	61 Å²	61	98.7 Å²	98.7	50%	0.504	51%	0.514	S	S	.	.	H	α-helix	trans	-65.2	-38.8	175.1	0	0	0	0	0	111.9	E806 A807 R814	E806-A810 WeakPolarHBondContact O-CB 3.43Å; E806-A810 PolarHBondContact O-N 2.7Å; A807-A810 PolarHBondContact O-N 2.82Å; A810-R814 WeakPolarHBondContact O-CB 3.34Å; A810-R814 PolarHBondContact O-N 3.34Å
811	E	73.3	Confident	75.1	Confident	104 Å²	104	96.8 Å²	96.8	49%	0.486	51%	0.513	S	S	.	.	H	α-helix	trans	-74.8	-36.3	176.5	-172.2	155.8	164.4	0	0	112.7	A807 R814 K815	A807-E811 WeakPolarHBondContact O-CB 3.4Å; A807-E811 PolarHBondContact O-N 2.97Å; E811-R814 PolarHBondContact O-N 2.91Å; E811-K815 HydrophobicContact CG-CD 4.39Å; E811-K815 WeakPolarHBondContact O-CB 3.35Å; E811-K815 WeakPolarHBondContact O-CG 3.36Å; E811-K815 PolarHBondContact O-N 2.95Å; E811-K815 WeakPolarHBondContact OE1-CE 3.25Å; E811-K815 IonicContact OE1-NZ 3.52Å; E811-K815 PolarHBondContact OE1-NZ 3.36Å; E811-K815 VanDerWaalsContact OE1-NZ 3.1Å
812	A	71.3	Confident	75.2	Confident	58 Å²	58	97.8 Å²	97.8	48%	0.479	51%	0.514	S	S	.	.	H	α-helix	trans	-65.3	-38.2	171.2	0	0	0	0	0	111.7	A808 A809 A816	A808-A812 WeakPolarHBondContact O-CB 3.07Å; A808-A812 PolarHBondContact O-N 3.34Å; A809-A812 PolarHBondContact O-N 2.58Å; A812-A816 WeakPolarHBondContact O-CB 3.43Å; A812-A816 PolarHBondContact O-N 3.14Å
813	E	76.3	Confident	74.9	Confident	110 Å²	110	95.1 Å²	95.1	51%	0.514	51%	0.507	S	S	.	.	H	α-helix	trans	-68.5	-38.2	173.9	-164.5	-172.3	158	0	0	111.4	A809 A816 K817	A809-E813 WeakPolarHBondContact O-CB 3.5Å; A809-E813 PolarHBondContact O-N 2.82Å; E813-A816 PolarHBondContact O-N 3.41Å; E813-K817 WeakPolarHBondContact O-CB 3.17Å; E813-K817 PolarHBondContact O-N 3.19Å; E813-K817 WeakPolarHBondContact OE1-CE 3.4Å; E813-K817 IonicContact OE1-NZ 2.7Å; E813-K817 PolarHBondContact OE1-NZ 2.96Å
814	R	79	Confident	74.8	Confident	161 Å²	161	91.9 Å²	91.9	61%	0.608	50%	0.504	S	S	*	.	H	α-helix	trans	-65.9	-46.9	175.2	-165	-174.5	124.4	-168.1	-7.7	111.6	A810 E811 K817 E818	A810-R814 WeakPolarHBondContact O-CB 3.34Å; A810-R814 PolarHBondContact O-N 3.34Å; E811-R814 PolarHBondContact O-N 2.91Å; R814-K817 PolarHBondContact O-N 2.93Å; R814-E818 IonicContact CZ-OE1 3.21Å; R814-E818 IonicContact NE-OE1 3.5Å; R814-E818 PolarHBondContact NE-OE1 2.99Å; R814-E818 IonicContact NH2-OE1 3.72Å; R814-E818 WeakPolarHBondContact O-CB 3.45Å; R814-E818 WeakPolarHBondContact O-CG 3.24Å; R814-E818 PolarHBondContact O-N 3.44Å
815	K	75.4	Confident	74.8	Confident	119 Å²	119	92.1 Å²	92.1	52%	0.517	51%	0.508	S	S	.	.	H	α-helix	trans	-64.6	-38	174.8	-76.9	179.7	179.9	164.8	0	111.6	E811 E818 E819	E811-K815 HydrophobicContact CG-CD 4.39Å; E811-K815 WeakPolarHBondContact O-CB 3.35Å; E811-K815 WeakPolarHBondContact O-CG 3.36Å; E811-K815 PolarHBondContact O-N 2.95Å; E811-K815 WeakPolarHBondContact OE1-CE 3.25Å; E811-K815 IonicContact OE1-NZ 3.52Å; E811-K815 PolarHBondContact OE1-NZ 3.36Å; E811-K815 VanDerWaalsContact OE1-NZ 3.1Å; K815-E818 PolarHBondContact O-N 3.39Å; K815-E819 WeakPolarHBondContact O-CB 3.37Å; K815-E819 PolarHBondContact O-N 3.34Å
816	A	74.2	Confident	74.7	Confident	59 Å²	59	94.1 Å²	94.1	49%	0.488	51%	0.508	S	S	.	.	H	α-helix	trans	-67.6	-36.4	174.8	0	0	0	0	0	112.7	A812 E813 A820	A812-A816 WeakPolarHBondContact O-CB 3.43Å; A812-A816 PolarHBondContact O-N 3.14Å; E813-A816 PolarHBondContact O-N 3.41Å; A816-A820 WeakPolarHBondContact O-CB 3.45Å; A816-A820 PolarHBondContact O-N 2.86Å
817	K	76.5	Confident	74.5	Confident	123 Å²	123	90.8 Å²	90.8	54%	0.535	50%	0.501	S	S	.	.	H	α-helix	trans	-69.8	-42.9	172.7	-83.2	176.6	-175.2	155.2	0	112.1	E813 R814 A820 I821	E813-K817 WeakPolarHBondContact O-CB 3.17Å; E813-K817 PolarHBondContact O-N 3.19Å; E813-K817 WeakPolarHBondContact OE1-CE 3.4Å; E813-K817 IonicContact OE1-NZ 2.7Å; E813-K817 PolarHBondContact OE1-NZ 2.96Å; R814-K817 PolarHBondContact O-N 2.93Å; K817-A820 PolarHBondContact O-N 3.42Å; K817-I821 WeakPolarHBondContact O-CB 3.38Å; K817-I821 VanDerWaalsContact O-CG1 3.23Å; K817-I821 WeakPolarHBondContact O-CG1 3.2Å; K817-I821 PolarHBondContact O-N 2.76Å
818	E	75.6	Confident	74.5	Confident	98 Å²	98	90.4 Å²	90.4	46%	0.458	50%	0.498	S	S	.	.	H	α-helix	trans	-64.2	-41	175.3	-77.3	171.5	-169.5	0	0	111.3	R814 K815 I821 R822	R814-E818 IonicContact CZ-OE1 3.21Å; R814-E818 IonicContact NE-OE1 3.5Å; R814-E818 PolarHBondContact NE-OE1 2.99Å; R814-E818 IonicContact NH2-OE1 3.72Å; R814-E818 WeakPolarHBondContact O-CB 3.45Å; R814-E818 WeakPolarHBondContact O-CG 3.24Å; R814-E818 PolarHBondContact O-N 3.44Å; K815-E818 PolarHBondContact O-N 3.39Å; E818-I821 PolarHBondContact O-N 3.31Å; E818-R822 WeakPolarHBondContact O-CB 3.49Å; E818-R822 PolarHBondContact O-N 3.29Å
819	E	69.4	Low	74.5	Confident	83 Å²	83	94.5 Å²	94.5	39%	0.388	50%	0.504	S	S	.	.	H	α-helix	trans	-74.2	-32.5	177.2	-162	-179.3	156.6	0	0	112.5	K815 R822 K823	K815-E819 WeakPolarHBondContact O-CB 3.37Å; K815-E819 PolarHBondContact O-N 3.34Å; E819-R822 PolarHBondContact O-N 2.92Å; E819-K823 HydrophobicContact CG-CD 4.35Å; E819-K823 VanDerWaalsContact O-CB 3.25Å; E819-K823 WeakPolarHBondContact O-CB 3.39Å; E819-K823 WeakPolarHBondContact O-CG 2.97Å; E819-K823 PolarHBondContact O-N 2.91Å; E819-K823 WeakPolarHBondContact OE1-CE 3.49Å; E819-K823 IonicContact OE1-NZ 3.7Å; E819-K823 PolarHBondContact OE1-NZ 3.32Å
820	A	74.1	Confident	74.1	Confident	59 Å²	59	97.7 Å²	97.7	49%	0.488	51%	0.51	S	S	.	.	H	α-helix	trans	-67.9	-37.8	171.1	0	0	0	0	0	111.9	A816 K817 A824	A816-A820 WeakPolarHBondContact O-CB 3.45Å; A816-A820 PolarHBondContact O-N 2.86Å; K817-A820 PolarHBondContact O-N 3.42Å; A820-A824 WeakPolarHBondContact O-CB 3.41Å; A820-A824 PolarHBondContact O-N 3.01Å
821	I	77.2	Confident	73.8	Confident	110 Å²	110	100 Å²	100	56%	0.564	51%	0.51	S	S	*	.	H	α-helix	trans	-66.9	-44.2	172.3	-69.4	166.1	0	0	0	110	K817 E818 A824 D825	K817-I821 WeakPolarHBondContact O-CB 3.38Å; K817-I821 VanDerWaalsContact O-CG1 3.23Å; K817-I821 WeakPolarHBondContact O-CG1 3.2Å; K817-I821 PolarHBondContact O-N 2.76Å; E818-I821 PolarHBondContact O-N 3.31Å; I821-A824 PolarHBondContact O-N 3.43Å; I821-D825 PolarHBondContact O-N 3.17Å
822	R	75	Confident	73.7	Confident	144 Å²	144	102.1 Å²	102.1	54%	0.543	52%	0.52	S	S	.	.	H	α-helix	trans	-64.3	-42.3	177.8	-160.8	-177.9	78.5	-153.7	-0.1	112.2	E818 E819 D825 E826	E818-R822 WeakPolarHBondContact O-CB 3.49Å; E818-R822 PolarHBondContact O-N 3.29Å; E819-R822 PolarHBondContact O-N 2.92Å; R822-D825 PolarHBondContact O-N 3.45Å; R822-E826 IonicContact NE-OE2 2.84Å; R822-E826 VanDerWaalsContact O-CB 3.31Å; R822-E826 WeakPolarHBondContact O-CB 3.38Å; R822-E826 WeakPolarHBondContact O-CG 3.19Å; R822-E826 PolarHBondContact O-N 2.86Å
823	K	72.5	Confident	73.5	Confident	122 Å²	122	106.1 Å²	106.1	53%	0.53	53%	0.528	S	S	.	.	H	α-helix	trans	-68.1	-32.2	174.3	-81.1	173.5	168.6	153.4	0	112.4	E819 A827	E819-K823 HydrophobicContact CG-CD 4.35Å; E819-K823 VanDerWaalsContact O-CB 3.25Å; E819-K823 WeakPolarHBondContact O-CB 3.39Å; E819-K823 WeakPolarHBondContact O-CG 2.97Å; E819-K823 PolarHBondContact O-N 2.91Å; E819-K823 WeakPolarHBondContact OE1-CE 3.49Å; E819-K823 IonicContact OE1-NZ 3.7Å; E819-K823 PolarHBondContact OE1-NZ 3.32Å; K823-A827 WeakPolarHBondContact O-CB 3.37Å; K823-A827 PolarHBondContact O-N 3.39Å
824	A	75.1	Confident	73.1	Confident	58 Å²	58	110.1 Å²	110.1	48%	0.479	54%	0.539	S	S	.	.	H	α-helix	trans	-70.1	-40.2	173	0	0	0	0	0	112	A820 I821 A828	A820-A824 WeakPolarHBondContact O-CB 3.41Å; A820-A824 PolarHBondContact O-N 3.01Å; I821-A824 PolarHBondContact O-N 3.43Å; A824-A828 VanDerWaalsContact O-CB 3.26Å; A824-A828 WeakPolarHBondContact O-CB 3.49Å; A824-A828 PolarHBondContact O-N 3.04Å
825	D	74.7	Confident	72.8	Confident	105 Å²	105	108.7 Å²	108.7	56%	0.561	54%	0.537	S	S	*	.	H	α-helix	trans	-71.6	-38	175.3	-93.7	1.3	0	0	0	112.5	I821 R822 A828 K829	I821-D825 PolarHBondContact O-N 3.17Å; R822-D825 PolarHBondContact O-N 3.45Å; D825-A828 PolarHBondContact O-N 2.92Å; D825-K829 WeakPolarHBondContact O-CB 3.36Å; D825-K829 PolarHBondContact O-N 3.13Å
826	E	70.3	Confident	72.7	Confident	102 Å²	102	109 Å²	109	48%	0.477	54%	0.544	S	S	.	.	H	α-helix	trans	-68.3	-41.8	172.8	-81.9	177.1	150.9	0	0	111.2	R822 A828 K829 E830	R822-E826 IonicContact NE-OE2 2.84Å; R822-E826 VanDerWaalsContact O-CB 3.31Å; R822-E826 WeakPolarHBondContact O-CB 3.38Å; R822-E826 WeakPolarHBondContact O-CG 3.19Å; R822-E826 PolarHBondContact O-N 2.86Å; E826-A828 PolarHBondContact O-N 3.33Å; E826-K829 PolarHBondContact O-N 3.02Å; E826-E830 WeakPolarHBondContact O-CB 3.35Å; E826-E830 PolarHBondContact O-N 3.45Å
827	A	72.5	Confident	72.5	Confident	52 Å²	52	108.8 Å²	108.8	43%	0.43	54%	0.542	S	S	.	.	H	α-helix	trans	-65.8	-36.6	174.1	0	0	0	0	0	112.1	K823 E831	K823-A827 WeakPolarHBondContact O-CB 3.37Å; K823-A827 PolarHBondContact O-N 3.39Å; A827-E831 VanDerWaalsContact O-CB 3.29Å; A827-E831 WeakPolarHBondContact O-CB 3.44Å; A827-E831 PolarHBondContact O-N 2.95Å
828	A	75.8	Confident	72.1	Confident	52 Å²	52	105.6 Å²	105.6	43%	0.43	54%	0.539	S	S	.	.	H	α-helix	trans	-67.2	-39.7	173.9	0	0	0	0	0	111.9	A824 D825 E826 Q832	A824-A828 VanDerWaalsContact O-CB 3.26Å; A824-A828 WeakPolarHBondContact O-CB 3.49Å; A824-A828 PolarHBondContact O-N 3.04Å; D825-A828 PolarHBondContact O-N 2.92Å; E826-A828 PolarHBondContact O-N 3.33Å; A828-Q832 WeakPolarHBondContact O-CB 3.34Å; A828-Q832 PolarHBondContact O-N 3.37Å
829	K	72.9	Confident	72	Confident	147 Å²	147	107.8 Å²	107.8	64%	0.639	55%	0.549	S	S	*	.	H	α-helix	trans	-68.8	-40.4	173.8	-83.2	179.2	177.2	173.7	0	112.6	D825 E826 Q832 Q833	D825-K829 WeakPolarHBondContact O-CB 3.36Å; D825-K829 PolarHBondContact O-N 3.13Å; E826-K829 PolarHBondContact O-N 3.02Å; K829-Q832 PolarHBondContact O-N 2.9Å; K829-Q833 WeakPolarHBondContact O-CB 3.39Å; K829-Q833 WeakPolarHBondContact O-CG 3.39Å; K829-Q833 PolarHBondContact O-N 3.5Å
830	E	67	Low	71.9	Confident	125 Å²	125	109 Å²	109	58%	0.584	56%	0.555	S	S	*	*	H	α-helix	trans	-67.6	-35.9	174.3	-83.9	-167.3	151	0	0	112	E826 R834	E826-E830 WeakPolarHBondContact O-CB 3.35Å; E826-E830 PolarHBondContact O-N 3.45Å; E830-R834 VanDerWaalsContact O-CB 3.23Å; E830-R834 WeakPolarHBondContact O-CB 3.23Å; E830-R834 WeakPolarHBondContact O-CG 3.48Å; E830-R834 PolarHBondContact O-N 3.03Å
831	E	71	Confident	71.4	Confident	110 Å²	110	113.1 Å²	113.1	51%	0.514	56%	0.564	S	S	.	*	H	α-helix	trans	-69.7	-38.2	174.5	-165.5	-175.9	150.5	0	0	111.3	A827 R834 K835	A827-E831 VanDerWaalsContact O-CB 3.29Å; A827-E831 WeakPolarHBondContact O-CB 3.44Å; A827-E831 PolarHBondContact O-N 2.95Å; E831-R834 PolarHBondContact O-N 3.34Å; E831-K835 WeakPolarHBondContact O-CB 3.35Å; E831-K835 PolarHBondContact O-N 3Å; E831-K835 IonicContact OE1-NZ 2.76Å; E831-K835 PolarHBondContact OE1-NZ 3.28Å
832	Q	71.7	Confident	71	Confident	147 Å²	147	114.7 Å²	114.7	69%	0.687	57%	0.567	S	S	*	*	H	α-helix	trans	-69.4	-37.1	175.4	-158.9	168.3	6.6	0	0	111.8	A828 K829 L836	A828-Q832 WeakPolarHBondContact O-CB 3.34Å; A828-Q832 PolarHBondContact O-N 3.37Å; K829-Q832 PolarHBondContact O-N 2.9Å; Q832-L836 PolarHBondContact O-N 2.63Å; Q832-L836 VanDerWaalsContact O-N 3.15Å
833	Q	67	Low	70.7	Confident	142 Å²	142	116 Å²	116	66%	0.664	57%	0.572	S	S	*	*	H	α-helix	trans	-71.5	-36.3	171.6	-80.5	-176.6	-13.2	0	0	112.8	K829 L836 A837	K829-Q833 WeakPolarHBondContact O-CB 3.39Å; K829-Q833 WeakPolarHBondContact O-CG 3.39Å; K829-Q833 PolarHBondContact O-N 3.5Å; Q833-L836 PolarHBondContact O-N 3.27Å; Q833-A837 VanDerWaalsContact O-CB 3.26Å; Q833-A837 WeakPolarHBondContact O-CB 3.48Å; Q833-A837 PolarHBondContact O-N 3Å
834	R	68.5	Low	70.3	Confident	194 Å²	194	114.5 Å²	114.5	73%	0.732	57%	0.569	S	S	*	*	H	α-helix	trans	-66.4	-37.6	173.4	-88.2	-177.6	167.7	177.7	-0.4	112.4	E830 E831 A838	E830-R834 VanDerWaalsContact O-CB 3.23Å; E830-R834 WeakPolarHBondContact O-CB 3.23Å; E830-R834 WeakPolarHBondContact O-CG 3.48Å; E830-R834 PolarHBondContact O-N 3.03Å; E831-R834 PolarHBondContact O-N 3.34Å; R834-A838 WeakPolarHBondContact O-CB 3.49Å; R834-A838 PolarHBondContact O-N 2.97Å
835	K	73.4	Confident	69.6	Low	131 Å²	131	114.7 Å²	114.7	57%	0.57	57%	0.571	S	S	*	*	H	α-helix	trans	-64.9	-40.7	173	-82.2	172.6	173.6	150.3	0	111.6	E831 E839	E831-K835 WeakPolarHBondContact O-CB 3.35Å; E831-K835 PolarHBondContact O-N 3Å; E831-K835 IonicContact OE1-NZ 2.76Å; E831-K835 PolarHBondContact OE1-NZ 3.28Å; K835-E839 PolarHBondContact O-N 2.68Å
836	L	72.3	Confident	69	Low	125 Å²	125	115.5 Å²	115.5	65%	0.654	57%	0.571	S	S	*	*	H	α-helix	trans	-69.6	-39.3	176.7	-146.8	82.9	0	0	0	112.4	Q832 Q833 Q840	Q832-L836 PolarHBondContact O-N 2.63Å; Q832-L836 VanDerWaalsContact O-N 3.15Å; Q833-L836 PolarHBondContact O-N 3.27Å; L836-Q840 PolarHBondContact O-N 3.24Å
837	A	69.7	Low	68.5	Low	55 Å²	55	116 Å²	116	46%	0.455	58%	0.577	S	S	.	*	H	α-helix	trans	-71.1	-38	177.6	0	0	0	0	0	112.5	Q833 Q840 E841	Q833-A837 VanDerWaalsContact O-CB 3.26Å; Q833-A837 WeakPolarHBondContact O-CB 3.48Å; Q833-A837 PolarHBondContact O-N 3Å; A837-Q840 PolarHBondContact O-N 2.97Å; A837-E841 PolarHBondContact O-N 2.78Å
838	A	69.7	Low	67.6	Low	57 Å²	57	116.9 Å²	116.9	47%	0.471	59%	0.585	S	S	.	*	H	α-helix	trans	-68.3	-31.7	175.4	0	0	0	0	0	112.7	R834 K842	R834-A838 WeakPolarHBondContact O-CB 3.49Å; R834-A838 PolarHBondContact O-N 2.97Å; A838-K842 WeakPolarHBondContact O-CB 3.34Å; A838-K842 PolarHBondContact O-N 3.14Å; A838-K842 VanDerWaalsContact O-N 3.14Å
839	E	72.9	Confident	66.6	Low	143 Å²	143	117.8 Å²	117.8	67%	0.668	59%	0.592	S	S	*	*	H	α-helix	trans	-69.4	-34.6	170.4	-92.7	-176.1	151.9	0	0	112.5	K835 R843	K835-E839 PolarHBondContact O-N 2.68Å; E839-R843 PolarHBondContact O-N 3.31Å
840	Q	66.8	Low	65.7	Low	108 Å²	108	118.7 Å²	118.7	51%	0.505	60%	0.598	S	S	.	*	H	α-helix	trans	-72.9	-44.7	177.1	-160	73.7	27	0	0	111.7	L836 A837 K842 R843 D844	L836-Q840 PolarHBondContact O-N 3.24Å; A837-Q840 PolarHBondContact O-N 2.97Å; Q840-K842 VanDerWaalsContact C-N 3.29Å; Q840-K842 PolarHBondContact O-N 2.74Å; Q840-R843 PolarHBondContact O-N 2.79Å; Q840-R843 VanDerWaalsContact O-N 3.16Å; Q840-D844 PolarHBondContact O-N 3Å
841	E	63.3	Low	64.8	Low	146 Å²	146	120.8 Å²	120.8	68%	0.682	61%	0.608	S	S	*	*	H	α-helix	trans	-61.8	-35.3	174.4	-99.4	-174.2	157.7	0	0	112.5	A837 R843 D844 A845	A837-E841 PolarHBondContact O-N 2.78Å; E841-R843 VanDerWaalsContact C-N 3.35Å; E841-D844 PolarHBondContact O-N 3.18Å; E841-A845 WeakPolarHBondContact O-CB 3.24Å; E841-A845 PolarHBondContact O-N 3.36Å
842	K	69.4	Low	63.3	Low	144 Å²	144	119.6 Å²	119.6	63%	0.626	62%	0.617	S	S	*	*	H	α-helix	trans	-67.9	-35.1	176.4	-158.2	178.6	-178.3	-172.7	0	112.1	A838 Q840 E846	A838-K842 WeakPolarHBondContact O-CB 3.34Å; A838-K842 PolarHBondContact O-N 3.14Å; A838-K842 VanDerWaalsContact O-N 3.14Å; Q840-K842 VanDerWaalsContact C-N 3.29Å; Q840-K842 PolarHBondContact O-N 2.74Å; K842-E846 WeakPolarHBondContact O-CG 3.48Å; K842-E846 PolarHBondContact O-N 3.42Å
843	R	68.8	Low	62.1	Low	172 Å²	172	119 Å²	119	65%	0.649	62%	0.624	S	S	*	*	H	α-helix	trans	-71.1	-39	172.6	-91.3	179.3	168.2	175.1	-1.8	112.8	E839 Q840 E841 N847	E839-R843 PolarHBondContact O-N 3.31Å; Q840-R843 PolarHBondContact O-N 2.79Å; Q840-R843 VanDerWaalsContact O-N 3.16Å; E841-R843 VanDerWaalsContact C-N 3.35Å; R843-N847 PolarHBondContact O-N 2.94Å; R843-N847 PolarHBondContact O-ND2 3.23Å
844	D	64.2	Low	61.1	Low	90 Å²	90	116.3 Å²	116.3	48%	0.481	63%	0.626	S	S	.	*	H	α-helix	trans	-74.8	-32.8	-179.6	-67.7	-21.3	0	0	0	111.7	Q840 E841 A848	Q840-D844 PolarHBondContact O-N 3Å; E841-D844 PolarHBondContact O-N 3.18Å; D844-A848 WeakPolarHBondContact O-CB 3.43Å; D844-A848 PolarHBondContact O-N 2.67Å
845	A	59.5	Low	59.6	Low	61 Å²	61	116 Å²	116	50%	0.504	63%	0.632	S	S	.	*	H	α-helix	trans	-71	-35.9	172.4	0	0	0	0	0	113.3	E841 A848 A849	E841-A845 WeakPolarHBondContact O-CB 3.24Å; E841-A845 PolarHBondContact O-N 3.36Å; A845-A848 PolarHBondContact O-N 2.79Å; A845-A849 WeakPolarHBondContact O-CB 3.19Å; A845-A849 PolarHBondContact O-N 2.91Å; A845-A849 VanDerWaalsContact O-N 3.12Å
846	E	61.8	Low	57.8	Low	122 Å²	122	114.6 Å²	114.6	57%	0.57	65%	0.646	S	S	*	*	H	α-helix	trans	-67.9	-35.7	174.4	-82.7	178.3	171.2	0	0	112.3	K842	K842-E846 WeakPolarHBondContact O-CG 3.48Å; K842-E846 PolarHBondContact O-N 3.42Å
847	N	59.9	Low	56.2	Low	112 Å²	112	117.6 Å²	117.6	60%	0.599	66%	0.656	S	S	*	*	H	α-helix	trans	-74.5	-34.8	175.1	-75.4	-28.6	0	0	0	112.8	R843	R843-N847 PolarHBondContact O-N 2.94Å; R843-N847 PolarHBondContact O-ND2 3.23Å
848	A	54.6	Low	54.7	Low	72 Å²	72	120.4 Å²	120.4	60%	0.595	67%	0.673	S	S	*	*	H	α-helix	trans	-72	-27.2	177	0	0	0	0	0	113.3	D844 A845	D844-A848 WeakPolarHBondContact O-CB 3.43Å; D844-A848 PolarHBondContact O-N 2.67Å; A845-A848 PolarHBondContact O-N 2.79Å
849	A	54.5	Low	52.8	Low	70 Å²	70	124.9 Å²	124.9	58%	0.579	69%	0.687	S	S	*	*	H	α-helix	trans	-75.3	-20.2	-179.2	0	0	0	0	0	114.6	A845	A845-A849 WeakPolarHBondContact O-CB 3.19Å; A845-A849 PolarHBondContact O-N 2.91Å; A845-A849 VanDerWaalsContact O-N 3.12Å
850	Q	53.4	Low	51	Low	166 Å²	166	127.3 Å²	127.3	78%	0.776	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-15.2	-178	-77.7	-175	-4.7	0	0	114.9
851	H	49	Very low	49.6	Very low	169 Å²	169	126.8 Å²	126.8	78%	0.782	71%	0.71	S	S	*	*	S	Bend	trans	-104.6	-11.9	-164.6	-120.7	-59.5	0	0	0	117.2
852	A	39	Very low	48.4	Very low	85 Å²	85	128.5 Å²	128.5	70%	0.702	72%	0.718	S	S	*	*	S	Bend	trans	-124.9	6.9	-170.2	0	0	0	0	0	116.3	A854	A852-A854 PolarHBondContact O-N 3.12Å
853	T	46.9	Very low	46.7	Very low	136 Å²	136	128.4 Å²	128.4	83%	0.834	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	6.2	166.3	-35.6	0	0	0	0	113.1
854	A	45.7	Very low	44.9	Very low	85 Å²	85	125.5 Å²	125.5	70%	0.702	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.1	-5.7	-167.2	0	0	0	0	0	117.1	A852	A852-A854 PolarHBondContact O-N 3.12Å
855	Q	37	Very low	43.7	Very low	186 Å²	186	127.8 Å²	127.8	87%	0.869	75%	0.753	S	S	*	*			trans	-132.8	24.6	-169.9	-79.6	-175.5	-11.9	0	0	117.6	Q857	Q855-Q857 VanDerWaalsContact C-N 3.35Å; Q855-Q857 PolarHBondContact O-N 2.83Å
856	A	35.5	Very low	42.4	Very low	103 Å²	103	131.7 Å²	131.7	85%	0.851	77%	0.765	S	S	*	*			trans	-76.2	36.7	-180	0	0	0	0	0	117.5
857	Q	39.4	Very low	41.2	Very low	188 Å²	188	133.7 Å²	133.7	88%	0.879	78%	0.78	S	S	*	*			trans	-140	12.6	-168.9	-92.2	-175.7	-11.3	0	0	122.2	Q855	Q855-Q857 VanDerWaalsContact C-N 3.35Å; Q855-Q857 PolarHBondContact O-N 2.83Å
858	S	37.5	Very low	40	Very low	114 Å²	114	133.7 Å²	133.7	80%	0.797	78%	0.784	S	S	*	*			trans	-153.6	98.3	168.6	66.9	0	0	0	0	112
859	L	30.6	Very low	38.9	Very low	150 Å²	150	134.2 Å²	134.2	79%	0.785	78%	0.783	S	S	*	*				52.6	102.1	67.5	-94.5	116.3	0	0	0	116.3
860	F	33.4	Very low	38.1	Very low	195 Å²	195	139.7 Å²	139.7	86%	0.855	79%	0.794	S	S	*	*			trans	58.6	98.8	140.7	-75.2	-102.1	0	0	0	119.9
861	A	39.2	Very low	37	Very low	96 Å²	96	137.4 Å²	137.4	79%	0.793	78%	0.783	S	S	*	*			trans	-173.4	130.1	134.5	0	0	0	0	0	112.1
862	Q	38.3	Very low	36.3	Very low	183 Å²	183	133.8 Å²	133.8	86%	0.855	77%	0.765	S	S	*	*			trans	82.7	69.4	155.7	-63	175.8	-0.3	0	0	118.7
863	T	32.2	Very low	36.1	Very low	141 Å²	141	135.6 Å²	135.6	87%	0.865	76%	0.762	S	S	*	*				0.6	113.4	125.1	40.4	0	0	0	0	118.8
864	S	31.9	Very low	35.3	Very low	111 Å²	111	136.6 Å²	136.6	78%	0.776	76%	0.755	S	S	*	*				-175.1	89.6	126.9	55.4	0	0	0	0	107.8
865	V	39.6	Very low	34.8	Very low	139 Å²	139	135.3 Å²	135.3	84%	0.842	74%	0.738	S	S	*	*			trans	-120.6	117.4	174.3	-171.4	0	0	0	0	108.5
866	D	31.6	Very low	34.7	Very low	142 Å²	142	129.6 Å²	129.6	76%	0.759	72%	0.716	S	S	*	*			trans	-49.6	127.9	168.6	-63.3	-60	0	0	0	112
867	N	36.5	Very low	35	Very low	165 Å²	165	127.5 Å²	127.5	88%	0.882	69%	0.688	S	S	*	*			trans	-116.8	97.6	163.2	-100.4	-18	0	0	0	109.8
868	T	35.5	Very low	35.2	Very low	112 Å²	112	123.9 Å²	123.9	69%	0.687	67%	0.666	S	S	*	*			trans	-62.1	120	166.9	33.2	0	0	0	0	112.6
869	S	30	Very low	35.8	Very low	82 Å²	82	118.8 Å²	118.8	57%	0.573	63%	0.63	S	S	*	*			trans	30.4	107.4	138.6	67.7	0	0	0	0	118.9	K188	K188-S869 PolarHBondContact NZ-OG 2.86Å
870	K	37.7	Very low	37.3	Very low	186 Å²	186	114.6 Å²	114.6	81%	0.809	61%	0.607	S	S	*	*			trans	-122.6	115.2	151.9	-75.9	-176.3	176.4	-179.5	0	108.5
871	Q	30.8	Very low	38.9	Very low	118 Å²	118	107.7 Å²	107.7	55%	0.551	58%	0.581	S	S	*	*			trans	-66.5	133.8	167.6	-79.6	157.9	-48.2	0	0	108	E78	E78-Q871 PolarHBondContact OE1-NE2 2.8Å
872	K	33.4	Very low	40.3	Very low	92 Å²	92	107.4 Å²	107.4	40%	0.4	57%	0.57	S	S	.	*			trans	-112.9	135.6	-173.7	-67.4	-165.5	161.9	173	0	111.3	E925 E926	K872-E925 PolarHBondContact NZ-O 2.81Å; K872-E926 WeakPolarHBondContact CA-OE1 3.27Å; K872-E926 VanDerWaalsContact CB-CD 3.48Å; K872-E926 HydrophobicContact CB-CG 4.06Å; K872-E926 WeakPolarHBondContact CB-OE1 3.34Å; K872-E926 HydrophobicContact CD-CB 3.63Å; K872-E926 HydrophobicContact CD-CG 3.56Å; K872-E926 WeakPolarHBondContact CD-OE2 3.35Å; K872-E926 VanDerWaalsContact CE-OE2 3.22Å; K872-E926 WeakPolarHBondContact CE-OE2 3.17Å; K872-E926 HydrophobicContact CG-CB 4.43Å; K872-E926 HydrophobicContact CG-CG 3.95Å; K872-E926 VanDerWaalsContact CG-OE2 3.27Å; K872-E926 WeakPolarHBondContact CG-OE2 3.46Å
873	I	36.8	Very low	41.8	Very low	124 Å²	124	101.2 Å²	101.2	64%	0.636	54%	0.543	S	S	*	.			trans	-99.9	135.8	-174.3	-68.3	164.3	0	0	0	106.3	V875 E926	I873-V875 HydrophobicContact CG2-CG2 4.27Å; I873-V875 PolarHBondContact O-N 3.42Å; I873-E926 PolarHBondContact N-OE1 3.15Å
874	K	28.5	Very low	43.3	Very low	157 Å²	157	102.4 Å²	102.4	68%	0.683	54%	0.536	S	S	*	.			trans	-72.1	98.6	-173.4	-145.6	174.5	-160.9	140.5	0	110.5	E69	E69-K874 WeakPolarHBondContact OE1-CD 3.46Å; E69-K874 WeakPolarHBondContact OE1-CE 3.48Å; E69-K874 VanDerWaalsContact OE1-CG 3.32Å; E69-K874 WeakPolarHBondContact OE1-CG 3.42Å; E69-K874 IonicContact OE1-NZ 3.92Å; E69-K874 PolarHBondContact OE1-NZ 3.12Å
875	V	36.7	Very low	45.1	Very low	57 Å²	57	100.2 Å²	100.2	35%	0.345	52%	0.515	S	S	.	.			trans	-135.3	117	173	-176.8	0	0	0	0	109.4	I873 K877	I873-V875 HydrophobicContact CG2-CG2 4.27Å; I873-V875 PolarHBondContact O-N 3.42Å; V875-K877 HydrophobicContact CG1-CG 4.12Å
876	T	34.3	Very low	46.6	Very low	67 Å²	67	93.6 Å²	93.6	41%	0.411	48%	0.475	S	S	.	.			trans	-88.3	112.6	176	32.5	0	0	0	0	111	N923	T876-N923 WeakPolarHBondContact CA-OD1 3.44Å; T876-N923 HydrophobicContact CG2-CB 4.15Å
877	K	41.8	Very low	48.2	Very low	58 Å²	58	91.7 Å²	91.7	25%	0.252	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	143.1	172.8	-52	-161	-179.1	-175.7	0	113.6	V875 N923 Y928 Y936 D938	V875-K877 HydrophobicContact CG1-CG 4.12Å; K877-N923 PolarHBondContact N-OD1 3.44Å; K877-N923 PolarHBondContact O-ND2 3.43Å; K877-N923 PolarHBondContact O-OD1 3.28Å; K877-Y928 HydrophobicContact CB-CE1 4.02Å; K877-Y928 HydrophobicContact CD-CD1 4.47Å; K877-Y928 HydrophobicContact CD-CE1 3.59Å; K877-Y928 HydrophobicContact CG-CE1 3.89Å; K877-Y936 HydrophobicContact CB-CD1 3.77Å; K877-Y936 HydrophobicContact CB-CG 4.21Å; K877-D938 WeakPolarHBondContact CE-OD1 3.45Å
878	R	43.7	Very low	49.8	Very low	112 Å²	112	89.3 Å²	89.3	42%	0.423	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	132.9	-179.7	-174	-178.6	-135.6	-158.1	5	112.8	E919 Y936 E937 E939	R878-E919 WeakPolarHBondContact CA-OE1 3.35Å; R878-E919 WeakPolarHBondContact CG-OE1 3.28Å; R878-Y936 WeakPolarHBondContact O-CA 3.42Å; R878-E937 PolarHBondContact N-O 3.23Å; R878-E939 IonicContact NE-OE1 3.6Å
879	L	50.3	Low	51.7	Low	8 Å²	8	86.6 Å²	86.6	4%	0.042	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	114.5	177.9	-162.2	159.5	0	0	0	111.5	V881 I890 C918 I929 I934 Y936	L879-V881 HydrophobicContact CD2-CG2 4.08Å; L879-I890 HydrophobicContact CD2-CD1 3.95Å; L879-C918 HydrophobicContact CD1-CB 3.92Å; L879-I929 HydrophobicContact CD1-CD1 3.82Å; L879-I929 HydrophobicContact CD1-CG1 4.49Å; L879-I934 HydrophobicContact CD1-CG2 4.31Å; L879-I934 HydrophobicContact CD2-CD1 4.19Å; L879-I934 HydrophobicContact CD2-CG1 4.14Å; L879-I934 HydrophobicContact CD2-CG2 3.8Å; L879-I934 HydrophobicContact CG-CG2 3.58Å; L879-Y936 HydrophobicContact CB-CE1 4.1Å; L879-Y936 HydrophobicContact CD1-CE1 4.48Å; L879-Y936 HydrophobicContact CG-CE1 4.32Å
880	I	61.5	Low	53.8	Low	61 Å²	61	83.3 Å²	83.3	31%	0.313	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	119.3	176.4	-56.7	176	0	0	0	110.2	T882 I934 K935 E937	I880-T882 HydrophobicContact CG2-CG2 4.33Å; I880-T882 PolarHBondContact O-N 3.44Å; I880-I934 WeakPolarHBondContact O-CA 3.48Å; I880-K935 PolarHBondContact N-O 3.45Å; I880-K935 PolarHBondContact O-N 3.36Å; I880-E937 HydrophobicContact CD1-CG 4.33Å
881	V	67.6	Low	55.4	Low	51 Å²	51	79 Å²	79	31%	0.309	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	111.2	172	174.1	0	0	0	0	109.4	L879 D883 A886 W887 I890	L879-V881 HydrophobicContact CD2-CG2 4.08Å; V881-D883 VanDerWaalsContact CG1-O 3.27Å; V881-D883 WeakPolarHBondContact CG1-O 3.27Å; V881-A886 HydrophobicContact CB-CB 4.47Å; V881-A886 HydrophobicContact CG1-CB 3.79Å; V881-A886 HydrophobicContact CG2-CB 4.35Å; V881-W887 HydrophobicContact CG2-CZ2 4.27Å; V881-I890 HydrophobicContact CG2-CD1 3.94Å
882	T	68.6	Low	57.4	Low	90 Å²	90	79.9 Å²	79.9	55%	0.552	39%	0.39	S	S	*	.			trans	-94.5	-17.6	179.8	57.1	0	0	0	0	113.5	I880 Y933	I880-T882 HydrophobicContact CG2-CG2 4.33Å; I880-T882 PolarHBondContact O-N 3.44Å; T882-Y933 PolarHBondContact N-O 3.19Å; T882-Y933 WeakPolarHBondContact OG1-CA 3.41Å; T882-Y933 PolarHBondContact OG1-O 2.73Å; T882-Y933 VanDerWaalsContact OG1-O 3.06Å
883	D	69.9	Low	59.2	Low	53 Å²	53	79 Å²	79	28%	0.283	39%	0.387	S	S	.	.	S	Bend	trans	-145.7	152.1	-179.8	-177.1	-111.5	0	0	0	111.3	V881 N885 A886 Y933	V881-D883 VanDerWaalsContact CG1-O 3.27Å; V881-D883 WeakPolarHBondContact CG1-O 3.27Å; D883-N885 PolarHBondContact O-N 3.33Å; D883-N885 VanDerWaalsContact O-N 3.16Å; D883-N885 VanDerWaalsContact OD1-CB 3.23Å; D883-N885 WeakPolarHBondContact OD1-CB 3.43Å; D883-N885 VanDerWaalsContact OD1-CG 3.29Å; D883-N885 PolarHBondContact OD1-N 2.66Å; D883-N885 PolarHBondContact OD1-ND2 2.87Å; D883-A886 VanDerWaalsContact O-CB 3.3Å; D883-A886 WeakPolarHBondContact O-CB 3.01Å; D883-A886 PolarHBondContact O-N 2.81Å; D883-A886 VanDerWaalsContact O-N 3.11Å; D883-Y933 HydrophobicContact CB-CD1 3.33Å; D883-Y933 HydrophobicContact CB-CE1 3.92Å; D883-Y933 HydrophobicContact CB-CG 4Å; D883-Y933 WeakPolarHBondContact OD1-CE1 3.48Å
884	K	62.7	Low	60.5	Low	165 Å²	165	74.5 Å²	74.5	72%	0.717	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-23.6	179.8	61.1	-177.9	177.9	-180	0	113.7	A886	K884-A886 VanDerWaalsContact C-N 3.32Å
885	N	69.6	Low	62.3	Low	65 Å²	65	74.4 Å²	74.4	35%	0.348	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-16.3	178.8	-61	-50.9	0	0	0	113.2	D883 W887 L888 Y933	D883-N885 PolarHBondContact O-N 3.33Å; D883-N885 VanDerWaalsContact O-N 3.16Å; D883-N885 VanDerWaalsContact OD1-CB 3.23Å; D883-N885 WeakPolarHBondContact OD1-CB 3.43Å; D883-N885 VanDerWaalsContact OD1-CG 3.29Å; D883-N885 PolarHBondContact OD1-N 2.66Å; D883-N885 PolarHBondContact OD1-ND2 2.87Å; N885-W887 PolarHBondContact O-N 3.06Å; N885-W887 VanDerWaalsContact O-N 3.11Å; N885-L888 PolarHBondContact O-N 3.3Å; N885-L888 VanDerWaalsContact O-N 3.11Å; N885-Y933 HydrophobicContact CB-CD2 3.97Å; N885-Y933 HydrophobicContact CB-CE1 4.32Å; N885-Y933 HydrophobicContact CB-CE2 3.58Å; N885-Y933 HydrophobicContact CB-CG 4.49Å
886	A	70.2	Confident	63.9	Low	0 Å²	0	77 Å²	77	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-54.9	-31.7	175.1	0	0	0	0	0	112.8	V881 D883 K884 L888 D889 I890 Y933 I934	V881-A886 HydrophobicContact CB-CB 4.47Å; V881-A886 HydrophobicContact CG1-CB 3.79Å; V881-A886 HydrophobicContact CG2-CB 4.35Å; D883-A886 VanDerWaalsContact O-CB 3.3Å; D883-A886 WeakPolarHBondContact O-CB 3.01Å; D883-A886 PolarHBondContact O-N 2.81Å; D883-A886 VanDerWaalsContact O-N 3.11Å; K884-A886 VanDerWaalsContact C-N 3.32Å; A886-L888 PolarHBondContact O-N 2.88Å; A886-D889 PolarHBondContact O-N 2.79Å; A886-I890 HydrophobicContact CB-CD1 4.49Å; A886-I890 WeakPolarHBondContact O-CG1 3.08Å; A886-I890 PolarHBondContact O-N 3.46Å; A886-I890 VanDerWaalsContact O-N 3.13Å; A886-Y933 HydrophobicContact CB-CG 4.4Å; A886-I934 HydrophobicContact CB-CD1 4.49Å; A886-I934 HydrophobicContact CB-CG1 4Å
887	W	65.5	Low	65.3	Low	102 Å²	102	77.9 Å²	77.9	39%	0.386	38%	0.375	S	S	.	.	H	α-helix	trans	-62.9	-29.2	-177.8	-71.5	109.2	0	0	0	112.7	V881 N885 I890 I891 L911	V881-W887 HydrophobicContact CG2-CZ2 4.27Å; N885-W887 PolarHBondContact O-N 3.06Å; N885-W887 VanDerWaalsContact O-N 3.11Å; W887-I890 HydrophobicContact CE3-CD1 4.28Å; W887-I891 VanDerWaalsContact O-CB 3.3Å; W887-I891 WeakPolarHBondContact O-CB 3.49Å; W887-I891 WeakPolarHBondContact O-CD1 3.28Å; W887-I891 WeakPolarHBondContact O-CG1 3.35Å; W887-I891 PolarHBondContact O-N 3.48Å; W887-L911 HydrophobicContact CE3-CD2 4.3Å; W887-L911 HydrophobicContact CH2-CD2 4.12Å; W887-L911 HydrophobicContact CZ3-CD2 3.66Å
888	L	71.1	Confident	66.2	Low	115 Å²	115	80.6 Å²	80.6	60%	0.602	39%	0.389	S	S	*	.	H	α-helix	trans	-66	-46.4	176.9	-76.2	166.9	0	0	0	111.2	N885 A886 I891 Q892	N885-L888 PolarHBondContact O-N 3.3Å; N885-L888 VanDerWaalsContact O-N 3.11Å; A886-L888 PolarHBondContact O-N 2.88Å; L888-I891 PolarHBondContact O-N 3.24Å; L888-Q892 WeakPolarHBondContact O-CB 3.33Å; L888-Q892 PolarHBondContact O-N 2.98Å
889	D	74.9	Confident	66.9	Low	55 Å²	55	75.3 Å²	75.3	29%	0.294	37%	0.37	S	S	.	.	H	α-helix	trans	-64.9	-43	179.2	-60.1	-29.7	0	0	0	111	A886 I891 Q892 Q893 I929 S931	A886-D889 PolarHBondContact O-N 2.79Å; D889-I891 PolarHBondContact O-N 2.81Å; D889-Q892 PolarHBondContact O-N 3.33Å; D889-Q893 WeakPolarHBondContact O-CB 3.27Å; D889-Q893 PolarHBondContact O-N 2.78Å; D889-I929 HydrophobicContact CB-CG2 4.49Å; D889-S931 VanDerWaalsContact OD2-CB 3.3Å; D889-S931 WeakPolarHBondContact OD2-CB 3.32Å; D889-S931 PolarHBondContact OD2-OG 3.46Å
890	I	74.7	Confident	67.5	Low	13 Å²	13	79.4 Å²	79.4	7%	0.067	40%	0.399	C	S	.	.	H	α-helix	trans	-60.6	-45.2	176.2	-64.5	167.8	0	0	0	110.8	L879 V881 A886 W887 W894 I929 I934	L879-I890 HydrophobicContact CD2-CD1 3.95Å; V881-I890 HydrophobicContact CG2-CD1 3.94Å; A886-I890 HydrophobicContact CB-CD1 4.49Å; A886-I890 WeakPolarHBondContact O-CG1 3.08Å; A886-I890 PolarHBondContact O-N 3.46Å; A886-I890 VanDerWaalsContact O-N 3.13Å; W887-I890 HydrophobicContact CE3-CD1 4.28Å; I890-W894 VanDerWaalsContact O-CB 3.25Å; I890-W894 WeakPolarHBondContact O-CB 3.29Å; I890-W894 PolarHBondContact O-N 3.26Å; I890-I929 HydrophobicContact CG1-CD1 4.05Å; I890-I934 HydrophobicContact CD1-CD1 3.85Å; I890-I934 HydrophobicContact CG1-CD1 3.59Å
891	I	69.9	Low	67.3	Low	95 Å²	95	81.4 Å²	81.4	49%	0.487	42%	0.418	S	S	.	.	H	α-helix	trans	-66.1	-41.7	179.2	-71.9	165.9	0	0	0	110.7	W887 L888 D889 W894 W895	W887-I891 VanDerWaalsContact O-CB 3.3Å; W887-I891 WeakPolarHBondContact O-CB 3.49Å; W887-I891 WeakPolarHBondContact O-CD1 3.28Å; W887-I891 WeakPolarHBondContact O-CG1 3.35Å; W887-I891 PolarHBondContact O-N 3.48Å; L888-I891 PolarHBondContact O-N 3.24Å; D889-I891 PolarHBondContact O-N 2.81Å; I891-W894 PolarHBondContact O-N 2.78Å; I891-W895 VanDerWaalsContact O-CB 3.26Å; I891-W895 WeakPolarHBondContact O-CB 3.2Å; I891-W895 PolarHBondContact O-N 2.81Å
892	Q	72.8	Confident	66.8	Low	138 Å²	138	81.7 Å²	81.7	65%	0.645	42%	0.417	S	S	*	.	H	α-helix	trans	-68.1	-40	-177.1	-158.6	167.3	6.6	0	0	111.4	L888 D889 W895 T896	L888-Q892 WeakPolarHBondContact O-CB 3.33Å; L888-Q892 PolarHBondContact O-N 2.98Å; D889-Q892 PolarHBondContact O-N 3.33Å; Q892-W895 PolarHBondContact O-N 2.99Å; Q892-T896 PolarHBondContact O-N 3.37Å; Q892-T896 PolarHBondContact O-OG1 3.22Å
893	Q	72.7	Confident	66.5	Low	72 Å²	72	80.9 Å²	80.9	34%	0.336	42%	0.415	S	S	.	.	H	α-helix	trans	-72.5	-39.2	176.9	-158.4	149.7	17.4	0	0	112	D889 W895 T896 I897	D889-Q893 WeakPolarHBondContact O-CB 3.27Å; D889-Q893 PolarHBondContact O-N 2.78Å; Q893-W895 VanDerWaalsContact C-N 3.35Å; Q893-W895 PolarHBondContact O-N 3.49Å; Q893-T896 WeakPolarHBondContact CA-OG1 3.47Å; Q893-T896 PolarHBondContact O-N 3.32Å; Q893-T896 PolarHBondContact O-OG1 3.47Å; Q893-I897 HydrophobicContact CG-CD1 4.21Å; Q893-I897 WeakPolarHBondContact O-CD1 3.44Å; Q893-I897 VanDerWaalsContact O-CG1 3.27Å; Q893-I897 WeakPolarHBondContact O-CG1 3.36Å; Q893-I897 PolarHBondContact O-N 2.86Å
894	W	64.4	Low	65.7	Low	31 Å²	31	83.6 Å²	83.6	12%	0.117	44%	0.435	C	S	.	.	H	α-helix	trans	-63.7	-38.4	172	177.4	73.1	0	0	0	112.6	I890 I891 T896 I897 E898 G899 M902 M914	I890-W894 VanDerWaalsContact O-CB 3.25Å; I890-W894 WeakPolarHBondContact O-CB 3.29Å; I890-W894 PolarHBondContact O-N 3.26Å; I891-W894 PolarHBondContact O-N 2.78Å; W894-T896 VanDerWaalsContact C-N 3.28Å; W894-T896 PolarHBondContact O-N 2.83Å; W894-I897 PolarHBondContact O-N 3.16Å; W894-E898 PolarHBondContact O-N 3.49Å; W894-G899 PolarHBondContact O-N 2.75Å; W894-M902 HydrophobicContact CH2-CE 4.32Å; W894-M902 HydrophobicContact CH2-SD 4.24Å; W894-M902 HydrophobicContact CZ2-CE 4.29Å; W894-M902 HydrophobicContact CZ2-SD 3.83Å; W894-M914 HydrophobicContact CD2-CE 4.18Å; W894-M914 HydrophobicContact CE3-CE 4.24Å; W894-M914 HydrophobicContact CH2-CE 3.67Å; W894-M914 HydrophobicContact CZ2-CE 3.6Å; W894-M914 HydrophobicContact CZ3-CE 3.99Å
895	W	64.8	Low	65.4	Low	155 Å²	155	83.3 Å²	83.3	59%	0.587	44%	0.441	S	S	*	.	H	α-helix	trans	-62.2	-35.5	176.5	-167.5	-93.2	0	0	0	112.2	I891 Q892 Q893	I891-W895 VanDerWaalsContact O-CB 3.26Å; I891-W895 WeakPolarHBondContact O-CB 3.2Å; I891-W895 PolarHBondContact O-N 2.81Å; Q892-W895 PolarHBondContact O-N 2.99Å; Q893-W895 VanDerWaalsContact C-N 3.35Å; Q893-W895 PolarHBondContact O-N 3.49Å
896	T	71.7	Confident	64.8	Low	110 Å²	110	86.7 Å²	86.7	68%	0.675	45%	0.453	S	S	*	.	H	α-helix	trans	-75.4	-20.3	175.8	43.5	0	0	0	0	114.6	Q892 Q893 W894	Q892-T896 PolarHBondContact O-N 3.37Å; Q892-T896 PolarHBondContact O-OG1 3.22Å; Q893-T896 WeakPolarHBondContact CA-OG1 3.47Å; Q893-T896 PolarHBondContact O-N 3.32Å; Q893-T896 PolarHBondContact O-OG1 3.47Å; W894-T896 VanDerWaalsContact C-N 3.28Å; W894-T896 PolarHBondContact O-N 2.83Å
897	I	63	Low	64	Low	87 Å²	87	91.5 Å²	91.5	45%	0.446	48%	0.478	S	S	.	.	H	α-helix	trans	-96.4	-54.1	-175.3	-63.1	165.6	0	0	0	111.5	Q893 W894	Q893-I897 HydrophobicContact CG-CD1 4.21Å; Q893-I897 WeakPolarHBondContact O-CD1 3.44Å; Q893-I897 VanDerWaalsContact O-CG1 3.27Å; Q893-I897 WeakPolarHBondContact O-CG1 3.36Å; Q893-I897 PolarHBondContact O-N 2.86Å; W894-I897 PolarHBondContact O-N 3.16Å
898	E	60.2	Low	63.2	Low	114 Å²	114	90.8 Å²	90.8	53%	0.533	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.7	-16.6	-173.6	-85.2	-179.2	-179.8	0	0	114.1	W894 S900 S901	W894-E898 PolarHBondContact O-N 3.49Å; E898-S900 PolarHBondContact O-N 3.36Å; E898-S901 PolarHBondContact O-OG 2.91Å
899	G	58.3	Low	62.5	Low	2 Å²	2	90.3 Å²	90.3	2%	0.021	50%	0.501	C	S	.	.	G	3₁₀ helix	trans	-66.2	-19.1	-173.2	0	0	0	0	0	115	W894 S901	W894-G899 PolarHBondContact O-N 2.75Å; G899-S901 PolarHBondContact O-N 2.99Å; G899-S901 VanDerWaalsContact O-N 3.08Å
900	S	63.7	Low	61.6	Low	93 Å²	93	90.1 Å²	90.1	65%	0.65	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-66.7	-7.8	-176.8	62.3	0	0	0	0	115.5	E898	E898-S900 PolarHBondContact O-N 3.36Å
901	S	57.5	Low	60.3	Low	103 Å²	103	93.5 Å²	93.5	72%	0.72	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-124.4	9.1	-171.1	62.6	0	0	0	0	116.3	E898 G899	E898-S901 PolarHBondContact O-OG 2.91Å; G899-S901 PolarHBondContact O-N 2.99Å; G899-S901 VanDerWaalsContact O-N 3.08Å
902	M	57.7	Low	59.7	Low	58 Å²	58	94 Å²	94	29%	0.286	52%	0.515	S	S	.	.			trans	-105.6	144.8	-172	-86.8	180	47	0	0	116.1	W894 K906 K910	W894-M902 HydrophobicContact CH2-CE 4.32Å; W894-M902 HydrophobicContact CH2-SD 4.24Å; W894-M902 HydrophobicContact CZ2-CE 4.29Å; W894-M902 HydrophobicContact CZ2-SD 3.83Å; M902-K906 HydrophobicContact CE-CB 4.16Å; M902-K910 HydrophobicContact CE-CD 3.49Å; M902-K910 VanDerWaalsContact CE-CD 3.49Å; M902-K910 HydrophobicContact SD-CD 4.17Å; M902-K910 PolarHBondContact SD-NZ 3.11Å
903	S	61.1	Low	58.9	Low	72 Å²	72	93.5 Å²	93.5	50%	0.503	51%	0.511	S	S	.	.			trans	-75.5	151.6	176	71.9	0	0	0	0	113.5	D905	S903-D905 PolarHBondContact O-N 2.83Å
904	P	54	Low	58.1	Low	110 Å²	110	91.1 Å²	91.1	71%	0.714	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-59.4	-29.6	-172.6	-26.9	35.6	0	0	0	116.9	K906	P904-K906 VanDerWaalsContact C-N 3.35Å; P904-K906 PolarHBondContact O-N 3.44Å
905	D	55.2	Low	58.4	Low	159 Å²	159	93 Å²	93	85%	0.85	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-79.7	-9.8	-168.7	-60.3	-42.9	0	0	0	115	S903	S903-D905 PolarHBondContact O-N 2.83Å
906	K	57.6	Low	58.7	Low	137 Å²	137	92 Å²	92	60%	0.596	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-93.2	5.7	-176.4	-100.6	178.7	177.2	176.3	0	114.9	M902 P904	M902-K906 HydrophobicContact CE-CB 4.16Å; P904-K906 VanDerWaalsContact C-N 3.35Å; P904-K906 PolarHBondContact O-N 3.44Å
907	L	52.9	Low	58.7	Low	100 Å²	100	88.4 Å²	88.4	52%	0.524	49%	0.488	S	S	.	.	S	Bend	trans	-76.1	-33.4	-162	-139	83.3	0	0	0	115.7
908	A	49.1	Very low	59.1	Low	87 Å²	87	85.1 Å²	85.1	72%	0.719	47%	0.473	S	S	*	.	S	Bend	trans	-84.1	-37.9	-167.1	0	0	0	0	0	115.3	K910	A908-K910 PolarHBondContact O-N 2.68Å
909	S	56.2	Low	59.4	Low	106 Å²	106	80.8 Å²	80.8	74%	0.741	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-11.6	175.1	43.2	0	0	0	0	112.9
910	K	55.3	Low	60.1	Low	50 Å²	50	87.1 Å²	87.1	22%	0.217	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-10	-177.6	-102.8	-177.4	170.6	-156.9	0	114.9	M902 A908 E912 F913 M914	M902-K910 HydrophobicContact CE-CD 3.49Å; M902-K910 VanDerWaalsContact CE-CD 3.49Å; M902-K910 HydrophobicContact SD-CD 4.17Å; M902-K910 PolarHBondContact SD-NZ 3.11Å; A908-K910 PolarHBondContact O-N 2.68Å; K910-E912 PolarHBondContact O-N 3Å; K910-F913 HydrophobicContact CG-CB 4.42Å; K910-F913 HydrophobicContact CG-CD1 4.27Å; K910-F913 CarbonylContact O-C 3.29Å; K910-F913 WeakPolarHBondContact O-CA 3.32Å; K910-F913 WeakPolarHBondContact O-CB 3.44Å; K910-F913 PolarHBondContact O-N 2.77Å; K910-M914 HydrophobicContact CB-CE 3.88Å; K910-M914 HydrophobicContact CB-CG 4.34Å; K910-M914 HydrophobicContact CB-SD 4.14Å; K910-M914 VanDerWaalsContact O-CB 3.28Å; K910-M914 WeakPolarHBondContact O-CB 3.3Å; K910-M914 WeakPolarHBondContact O-CG 3.33Å; K910-M914 PolarHBondContact O-N 3.39Å
911	L	47.6	Very low	60.5	Low	84 Å²	84	85.4 Å²	85.4	44%	0.44	46%	0.461	S	S	.	.	H	α-helix	trans	-61.1	-43.9	-176.8	-84.5	159.7	0	0	0	114.1	W887 F913 M914 R915	W887-L911 HydrophobicContact CE3-CD2 4.3Å; W887-L911 HydrophobicContact CH2-CD2 4.12Å; W887-L911 HydrophobicContact CZ3-CD2 3.66Å; L911-F913 VanDerWaalsContact C-N 3.35Å; L911-M914 HydrophobicContact CD2-SD 4.37Å; L911-M914 WeakPolarHBondContact O-CB 3.41Å; L911-M914 PolarHBondContact O-N 2.83Å; L911-R915 PolarHBondContact O-N 3.2Å
912	E	56.9	Low	61.2	Low	107 Å²	107	80.5 Å²	80.5	50%	0.5	43%	0.427	S	S	.	.	H	α-helix	trans	-72.3	-32.9	176.3	-152.3	64.7	-153.3	0	0	111.5	K910 R915 K916	K910-E912 PolarHBondContact O-N 3Å; E912-R915 PolarHBondContact O-N 2.81Å; E912-R915 IonicContact OE1-CZ 2.81Å; E912-R915 IonicContact OE1-NE 3.42Å; E912-R915 IonicContact OE1-NH1 3.45Å; E912-R915 PolarHBondContact OE1-NH1 2.86Å; E912-K916 WeakPolarHBondContact O-CB 3.1Å; E912-K916 WeakPolarHBondContact O-CG 3.44Å; E912-K916 PolarHBondContact O-N 3.21Å
913	F	57.9	Low	61.2	Low	126 Å²	126	79 Å²	79	55%	0.553	42%	0.42	S	S	*	.	H	α-helix	trans	-66	-38.1	171.7	-177.8	-89.3	0	0	0	111.5	K910 L911 K916 A917	K910-F913 HydrophobicContact CG-CB 4.42Å; K910-F913 HydrophobicContact CG-CD1 4.27Å; K910-F913 CarbonylContact O-C 3.29Å; K910-F913 WeakPolarHBondContact O-CA 3.32Å; K910-F913 WeakPolarHBondContact O-CB 3.44Å; K910-F913 PolarHBondContact O-N 2.77Å; L911-F913 VanDerWaalsContact C-N 3.35Å; F913-K916 CarbonylContact O-C 3.49Å; F913-K916 PolarHBondContact O-N 2.86Å; F913-A917 WeakPolarHBondContact O-CB 3.35Å; F913-A917 PolarHBondContact O-N 3.33Å
914	M	55.7	Low	61.6	Low	22 Å²	22	79.7 Å²	79.7	11%	0.108	42%	0.418	C	S	.	.	H	α-helix	trans	-67.6	-42.2	176.3	-74.5	158.7	169.9	0	0	110.3	W894 K910 L911 A917 C918	W894-M914 HydrophobicContact CD2-CE 4.18Å; W894-M914 HydrophobicContact CE3-CE 4.24Å; W894-M914 HydrophobicContact CH2-CE 3.67Å; W894-M914 HydrophobicContact CZ2-CE 3.6Å; W894-M914 HydrophobicContact CZ3-CE 3.99Å; K910-M914 HydrophobicContact CB-CE 3.88Å; K910-M914 HydrophobicContact CB-CG 4.34Å; K910-M914 HydrophobicContact CB-SD 4.14Å; K910-M914 VanDerWaalsContact O-CB 3.28Å; K910-M914 WeakPolarHBondContact O-CB 3.3Å; K910-M914 WeakPolarHBondContact O-CG 3.33Å; K910-M914 PolarHBondContact O-N 3.39Å; L911-M914 HydrophobicContact CD2-SD 4.37Å; L911-M914 WeakPolarHBondContact O-CB 3.41Å; L911-M914 PolarHBondContact O-N 2.83Å; M914-A917 PolarHBondContact O-N 3.38Å; M914-C918 WeakPolarHBondContact O-CB 3.33Å; M914-C918 PolarHBondContact O-N 2.88Å; M914-C918 PolarHBondContact O-SG 3.45Å
915	R	70.3	Confident	62.4	Low	72 Å²	72	79.3 Å²	79.3	27%	0.272	41%	0.407	S	S	.	.	H	α-helix	trans	-58.9	-51.1	171.5	-164.2	-165.2	102.4	-175.7	17	110.5	L911 E912 A917 C918 E919	L911-R915 PolarHBondContact O-N 3.2Å; E912-R915 PolarHBondContact O-N 2.81Å; E912-R915 IonicContact OE1-CZ 2.81Å; E912-R915 IonicContact OE1-NE 3.42Å; E912-R915 IonicContact OE1-NH1 3.45Å; E912-R915 PolarHBondContact OE1-NH1 2.86Å; R915-A917 VanDerWaalsContact C-N 3.3Å; R915-A917 PolarHBondContact O-N 3.46Å; R915-C918 PolarHBondContact O-N 3.42Å; R915-E919 IonicContact NE-OE2 3.58Å; R915-E919 IonicContact NH2-OE2 3.42Å; R915-E919 WeakPolarHBondContact O-CB 3.43Å; R915-E919 PolarHBondContact O-N 3.04Å
916	K	71.2	Confident	62.6	Low	134 Å²	134	74.6 Å²	74.6	58%	0.583	38%	0.38	S	S	*	.	H	α-helix	trans	-63.2	-32	176.9	-76.7	-173.6	176.3	-174.6	0	113.2	E912 F913 K920	E912-K916 WeakPolarHBondContact O-CB 3.1Å; E912-K916 WeakPolarHBondContact O-CG 3.44Å; E912-K916 PolarHBondContact O-N 3.21Å; F913-K916 CarbonylContact O-C 3.49Å; F913-K916 PolarHBondContact O-N 2.86Å; K916-K920 WeakPolarHBondContact O-CB 3.2Å; K916-K920 PolarHBondContact O-N 2.81Å
917	A	71.5	Confident	63	Low	33 Å²	33	73 Å²	73	27%	0.273	37%	0.374	S	S	.	.	H	α-helix	trans	-74.4	-41.3	176.8	0	0	0	0	0	111.5	F913 M914 R915 E919 K920 H921	F913-A917 WeakPolarHBondContact O-CB 3.35Å; F913-A917 PolarHBondContact O-N 3.33Å; M914-A917 PolarHBondContact O-N 3.38Å; R915-A917 VanDerWaalsContact C-N 3.3Å; R915-A917 PolarHBondContact O-N 3.46Å; A917-E919 VanDerWaalsContact C-N 3.34Å; A917-K920 CarbonylContact O-C 3.51Å; A917-K920 PolarHBondContact O-N 2.64Å; A917-H921 VanDerWaalsContact O-CB 3.27Å; A917-H921 WeakPolarHBondContact O-CB 3.46Å; A917-H921 PolarHBondContact O-N 2.79Å
918	C	70.8	Confident	63.8	Low	19 Å²	19	71.6 Å²	71.6	13%	0.128	36%	0.363	C	S	.	.	H	α-helix	trans	-68.3	-35	173	-63.4	0	0	0	0	111.5	L879 M914 R915 A922	L879-C918 HydrophobicContact CD1-CB 3.92Å; M914-C918 WeakPolarHBondContact O-CB 3.33Å; M914-C918 PolarHBondContact O-N 2.88Å; M914-C918 PolarHBondContact O-SG 3.45Å; R915-C918 PolarHBondContact O-N 3.42Å; C918-A922 WeakPolarHBondContact O-CB 3.44Å; C918-A922 PolarHBondContact O-N 3.36Å
919	E	66.7	Low	64.8	Low	23 Å²	23	68.1 Å²	68.1	11%	0.107	33%	0.332	C	S	.	.	H	α-helix	trans	-66.1	-45.5	172.2	-171	168.7	-169.3	0	0	110.2	R878 R915 A917 A922 N923	R878-E919 WeakPolarHBondContact CA-OE1 3.35Å; R878-E919 WeakPolarHBondContact CG-OE1 3.28Å; R915-E919 IonicContact NE-OE2 3.58Å; R915-E919 IonicContact NH2-OE2 3.42Å; R915-E919 WeakPolarHBondContact O-CB 3.43Å; R915-E919 PolarHBondContact O-N 3.04Å; A917-E919 VanDerWaalsContact C-N 3.34Å; E919-A922 PolarHBondContact O-N 2.97Å; E919-N923 WeakPolarHBondContact O-CB 3.23Å; E919-N923 PolarHBondContact O-N 2.86Å; E919-N923 PolarHBondContact O-ND2 3.28Å; E919-N923 VanDerWaalsContact O-ND2 3.09Å; E919-N923 PolarHBondContact O-OD1 2.88Å
920	K	72.3	Confident	65.4	Low	135 Å²	135	70.1 Å²	70.1	59%	0.587	34%	0.339	S	S	*	.	H	α-helix	trans	-64.8	-39.3	174	-170.9	178.7	-178.5	-173.8	0	112.5	K916 A917 N923 N924	K916-K920 WeakPolarHBondContact O-CB 3.2Å; K916-K920 PolarHBondContact O-N 2.81Å; A917-K920 CarbonylContact O-C 3.51Å; A917-K920 PolarHBondContact O-N 2.64Å; K920-N923 PolarHBondContact O-N 3.13Å; K920-N924 WeakPolarHBondContact O-CB 3.45Å; K920-N924 PolarHBondContact O-N 2.9Å; K920-N924 PolarHBondContact O-OD1 3.21Å
921	H	72.6	Confident	65.9	Low	56 Å²	56	68.5 Å²	68.5	26%	0.259	33%	0.334	S	S	.	.	H	α-helix	trans	-68.7	-45.5	175.2	-171	86.7	0	0	0	110.8	A917 N923 N924 E925 E927	A917-H921 VanDerWaalsContact O-CB 3.27Å; A917-H921 WeakPolarHBondContact O-CB 3.46Å; A917-H921 PolarHBondContact O-N 2.79Å; H921-N923 VanDerWaalsContact C-N 3.26Å; H921-N923 PolarHBondContact O-N 3.39Å; H921-N924 PolarHBondContact O-N 2.93Å; H921-E925 WeakPolarHBondContact O-CA 3.35Å; H921-E925 WeakPolarHBondContact O-CB 3.49Å; H921-E925 PolarHBondContact O-N 3.19Å; H921-E927 IonicContact CD2-OE2 2.68Å; H921-E927 IonicContact CE1-OE2 3.87Å; H921-E927 IonicContact NE2-OE2 3.37Å; H921-E927 PolarHBondContact NE2-OE2 3.08Å
922	A	71.6	Confident	66.8	Low	0 Å²	0	73.5 Å²	73.5	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-60.8	-37.1	174.9	0	0	0	0	0	111.9	C918 E919 E926 Y928 Y936	C918-A922 WeakPolarHBondContact O-CB 3.44Å; C918-A922 PolarHBondContact O-N 3.36Å; E919-A922 PolarHBondContact O-N 2.97Å; A922-E926 WeakPolarHBondContact O-CA 3.41Å; A922-E926 PolarHBondContact O-N 3.47Å; A922-E926 VanDerWaalsContact O-N 3.15Å; A922-Y928 HydrophobicContact CB-CD1 4.35Å; A922-Y936 HydrophobicContact CB-CE1 3.61Å
923	N	59.1	Low	66.5	Low	28 Å²	28	72.3 Å²	72.3	15%	0.15	35%	0.346	C	S	.	.	H	α-helix	trans	-80.4	-33.5	-179.6	-65.3	-16.8	0	0	0	113.4	T876 K877 E919 K920 H921	T876-N923 WeakPolarHBondContact CA-OD1 3.44Å; T876-N923 HydrophobicContact CG2-CB 4.15Å; K877-N923 PolarHBondContact N-OD1 3.44Å; K877-N923 PolarHBondContact O-ND2 3.43Å; K877-N923 PolarHBondContact O-OD1 3.28Å; E919-N923 WeakPolarHBondContact O-CB 3.23Å; E919-N923 PolarHBondContact O-N 2.86Å; E919-N923 PolarHBondContact O-ND2 3.28Å; E919-N923 VanDerWaalsContact O-ND2 3.09Å; E919-N923 PolarHBondContact O-OD1 2.88Å; K920-N923 PolarHBondContact O-N 3.13Å; H921-N923 VanDerWaalsContact C-N 3.26Å; H921-N923 PolarHBondContact O-N 3.39Å
924	N	68.3	Low	66.4	Low	86 Å²	86	67 Å²	67	46%	0.46	32%	0.323	S	S	.	.	H	α-helix	trans	-86.4	-37.9	179.9	-71.3	6.3	0	0	0	112.2	K920 H921	K920-N924 WeakPolarHBondContact O-CB 3.45Å; K920-N924 PolarHBondContact O-N 2.9Å; K920-N924 PolarHBondContact O-OD1 3.21Å; H921-N924 PolarHBondContact O-N 2.93Å
925	E	72.3	Confident	66.7	Low	101 Å²	101	72.5 Å²	72.5	47%	0.472	35%	0.347	S	S	.	.	H	α-helix	trans	-111.8	11.6	-170.4	-59.2	-70.3	162.6	0	0	112	K872 H921 E927	K872-E925 PolarHBondContact NZ-O 2.81Å; H921-E925 WeakPolarHBondContact O-CA 3.35Å; H921-E925 WeakPolarHBondContact O-CB 3.49Å; H921-E925 PolarHBondContact O-N 3.19Å; E925-E927 PolarHBondContact O-N 2.79Å
926	E	57.8	Low	66.1	Low	61 Å²	61	70.8 Å²	70.8	29%	0.285	34%	0.341	S	S	.	.			trans	34.7	30	-173.7	-60.8	172.3	178.8	0	0	115.4	K872 I873 A922 Y928	K872-E926 WeakPolarHBondContact CA-OE1 3.27Å; K872-E926 VanDerWaalsContact CB-CD 3.48Å; K872-E926 HydrophobicContact CB-CG 4.06Å; K872-E926 WeakPolarHBondContact CB-OE1 3.34Å; K872-E926 HydrophobicContact CD-CB 3.63Å; K872-E926 HydrophobicContact CD-CG 3.56Å; K872-E926 WeakPolarHBondContact CD-OE2 3.35Å; K872-E926 VanDerWaalsContact CE-OE2 3.22Å; K872-E926 WeakPolarHBondContact CE-OE2 3.17Å; K872-E926 HydrophobicContact CG-CB 4.43Å; K872-E926 HydrophobicContact CG-CG 3.95Å; K872-E926 VanDerWaalsContact CG-OE2 3.27Å; K872-E926 WeakPolarHBondContact CG-OE2 3.46Å; I873-E926 PolarHBondContact N-OE1 3.15Å; A922-E926 WeakPolarHBondContact O-CA 3.41Å; A922-E926 PolarHBondContact O-N 3.47Å; A922-E926 VanDerWaalsContact O-N 3.15Å; E926-Y928 HydrophobicContact CB-CE2 4.2Å; E926-Y928 PolarHBondContact O-N 3.24Å
927	E	67.3	Low	65.2	Low	104 Å²	104	70.2 Å²	70.2	49%	0.486	34%	0.34	S	S	.	.			trans	-98	86.4	177.3	-85	-172.5	164.6	0	0	107	H921 E925	H921-E927 IonicContact CD2-OE2 2.68Å; H921-E927 IonicContact CE1-OE2 3.87Å; H921-E927 IonicContact NE2-OE2 3.37Å; H921-E927 PolarHBondContact NE2-OE2 3.08Å; E925-E927 PolarHBondContact O-N 2.79Å
928	Y	68.4	Low	64	Low	70 Å²	70	73.7 Å²	73.7	28%	0.275	35%	0.354	S	S	.	.			trans	-73.5	134	174.5	-58.9	-79.2	0	0	0	109.6	K877 A922 E926 V930 Y936	K877-Y928 HydrophobicContact CB-CE1 4.02Å; K877-Y928 HydrophobicContact CD-CD1 4.47Å; K877-Y928 HydrophobicContact CD-CE1 3.59Å; K877-Y928 HydrophobicContact CG-CE1 3.89Å; A922-Y928 HydrophobicContact CB-CD1 4.35Å; E926-Y928 HydrophobicContact CB-CE2 4.2Å; E926-Y928 PolarHBondContact O-N 3.24Å; Y928-V930 PolarHBondContact O-N 3.17Å; Y928-Y936 AromaticContact CD1-CD1 3.68Å; Y928-Y936 HydrophobicContact CD1-CD1 3.68Å; Y928-Y936 AromaticContact CD1-CD2 3.65Å; Y928-Y936 HydrophobicContact CD1-CD2 3.65Å; Y928-Y936 AromaticContact CD1-CE1 3.78Å; Y928-Y936 HydrophobicContact CD1-CE1 3.78Å; Y928-Y936 AromaticContact CD1-CE2 3.78Å; Y928-Y936 HydrophobicContact CD1-CE2 3.78Å; Y928-Y936 AromaticContact CD1-CG 3.59Å; Y928-Y936 HydrophobicContact CD1-CG 3.59Å; Y928-Y936 AromaticContact CD1-CZ 3.82Å; Y928-Y936 HydrophobicContact CE1-CD1 4.07Å; Y928-Y936 HydrophobicContact CE1-CE1 4.42Å; Y928-Y936 HydrophobicContact CE1-CG 4.15Å; Y928-Y936 HydrophobicContact CG-CD2 4.28Å; Y928-Y936 HydrophobicContact CG-CE2 4.23Å
929	I	71.1	Confident	62.7	Low	14 Å²	14	77.6 Å²	77.6	7%	0.072	37%	0.37	C	S	.	.			trans	-67.8	106	172	-53.4	-176.2	0	0	0	107.7	L879 D889 I890 S931 I934 Y936	L879-I929 HydrophobicContact CD1-CD1 3.82Å; L879-I929 HydrophobicContact CD1-CG1 4.49Å; D889-I929 HydrophobicContact CB-CG2 4.49Å; I890-I929 HydrophobicContact CG1-CD1 4.05Å; I929-S931 PolarHBondContact O-N 2.77Å; I929-I934 HydrophobicContact CB-CD1 3.82Å; I929-I934 HydrophobicContact CD1-CD1 4.17Å; I929-I934 HydrophobicContact CG2-CD1 3.5Å; I929-Y936 WeakPolarHBondContact CG1-OH 3.39Å; I929-Y936 PolarHBondContact N-OH 2.88Å
930	V	68.7	Low	61.4	Low	148 Å²	148	83.7 Å²	83.7	90%	0.897	40%	0.399	S	S	*	.			trans	-76.7	90.1	173.7	-177	0	0	0	0	107.9	Y928	Y928-V930 PolarHBondContact O-N 3.17Å
931	S	66.5	Low	60	Low	16 Å²	16	80.5 Å²	80.5	11%	0.112	39%	0.393	C	S	.	.			trans	-131.4	141.5	174.3	178	0	0	0	0	109.3	D889 I929 Y933 I934	D889-S931 VanDerWaalsContact OD2-CB 3.3Å; D889-S931 WeakPolarHBondContact OD2-CB 3.32Å; D889-S931 PolarHBondContact OD2-OG 3.46Å; I929-S931 PolarHBondContact O-N 2.77Å; S931-Y933 PolarHBondContact O-N 2.94Å; S931-Y933 WeakPolarHBondContact OG-CD2 3.39Å; S931-Y933 PolarHBondContact OG-N 2.87Å; S931-I934 PolarHBondContact O-N 2.9Å
932	H	64.9	Low	59.2	Low	188 Å²	188	83 Å²	83	87%	0.87	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-11.9	170.2	-97.4	53.9	0	0	0	112.8
933	Y	51.3	Low	58.5	Low	82 Å²	82	91.6 Å²	91.6	32%	0.322	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	4	-174.1	-48.1	-61.6	0	0	0	114.2	T882 D883 N885 A886 S931	T882-Y933 PolarHBondContact N-O 3.19Å; T882-Y933 WeakPolarHBondContact OG1-CA 3.41Å; T882-Y933 PolarHBondContact OG1-O 2.73Å; T882-Y933 VanDerWaalsContact OG1-O 3.06Å; D883-Y933 HydrophobicContact CB-CD1 3.33Å; D883-Y933 HydrophobicContact CB-CE1 3.92Å; D883-Y933 HydrophobicContact CB-CG 4Å; D883-Y933 WeakPolarHBondContact OD1-CE1 3.48Å; N885-Y933 HydrophobicContact CB-CD2 3.97Å; N885-Y933 HydrophobicContact CB-CE1 4.32Å; N885-Y933 HydrophobicContact CB-CE2 3.58Å; N885-Y933 HydrophobicContact CB-CG 4.49Å; A886-Y933 HydrophobicContact CB-CG 4.4Å; S931-Y933 PolarHBondContact O-N 2.94Å; S931-Y933 WeakPolarHBondContact OG-CD2 3.39Å; S931-Y933 PolarHBondContact OG-N 2.87Å
934	I	55.4	Low	58.6	Low	14 Å²	14	97 Å²	97	7%	0.072	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	127	-178.5	-62.9	172.6	0	0	0	110.2	L879 I880 A886 I890 I929 S931 Y936	L879-I934 HydrophobicContact CD1-CG2 4.31Å; L879-I934 HydrophobicContact CD2-CD1 4.19Å; L879-I934 HydrophobicContact CD2-CG1 4.14Å; L879-I934 HydrophobicContact CD2-CG2 3.8Å; L879-I934 HydrophobicContact CG-CG2 3.58Å; I880-I934 WeakPolarHBondContact O-CA 3.48Å; A886-I934 HydrophobicContact CB-CD1 4.49Å; A886-I934 HydrophobicContact CB-CG1 4Å; I890-I934 HydrophobicContact CD1-CD1 3.85Å; I890-I934 HydrophobicContact CG1-CD1 3.59Å; I929-I934 HydrophobicContact CB-CD1 3.82Å; I929-I934 HydrophobicContact CD1-CD1 4.17Å; I929-I934 HydrophobicContact CG2-CD1 3.5Å; S931-I934 PolarHBondContact O-N 2.9Å; I934-Y936 HydrophobicContact CG2-CD2 4.13Å; I934-Y936 HydrophobicContact CG2-CE2 3.67Å
935	K	62.7	Low	58.8	Low	139 Å²	139	96.6 Å²	96.6	60%	0.604	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.8	146	171.6	-98.6	-176.8	172.8	-176.4	0	110.5	I880	I880-K935 PolarHBondContact N-O 3.45Å; I880-K935 PolarHBondContact O-N 3.36Å
936	Y	57.7	Low	58.7	Low	35 Å²	35	93.2 Å²	93.2	14%	0.137	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	123.9	178.3	-73.3	-85.9	0	0	0	109.6	K877 R878 L879 A922 Y928 I929 I934	K877-Y936 HydrophobicContact CB-CD1 3.77Å; K877-Y936 HydrophobicContact CB-CG 4.21Å; R878-Y936 WeakPolarHBondContact O-CA 3.42Å; L879-Y936 HydrophobicContact CB-CE1 4.1Å; L879-Y936 HydrophobicContact CD1-CE1 4.48Å; L879-Y936 HydrophobicContact CG-CE1 4.32Å; A922-Y936 HydrophobicContact CB-CE1 3.61Å; Y928-Y936 AromaticContact CD1-CD1 3.68Å; Y928-Y936 HydrophobicContact CD1-CD1 3.68Å; Y928-Y936 AromaticContact CD1-CD2 3.65Å; Y928-Y936 HydrophobicContact CD1-CD2 3.65Å; Y928-Y936 AromaticContact CD1-CE1 3.78Å; Y928-Y936 HydrophobicContact CD1-CE1 3.78Å; Y928-Y936 AromaticContact CD1-CE2 3.78Å; Y928-Y936 HydrophobicContact CD1-CE2 3.78Å; Y928-Y936 AromaticContact CD1-CG 3.59Å; Y928-Y936 HydrophobicContact CD1-CG 3.59Å; Y928-Y936 AromaticContact CD1-CZ 3.82Å; Y928-Y936 HydrophobicContact CE1-CD1 4.07Å; Y928-Y936 HydrophobicContact CE1-CE1 4.42Å; Y928-Y936 HydrophobicContact CE1-CG 4.15Å; Y928-Y936 HydrophobicContact CG-CD2 4.28Å; Y928-Y936 HydrophobicContact CG-CE2 4.23Å; I929-Y936 WeakPolarHBondContact CG1-OH 3.39Å; I929-Y936 PolarHBondContact N-OH 2.88Å; I934-Y936 HydrophobicContact CG2-CD2 4.13Å; I934-Y936 HydrophobicContact CG2-CE2 3.67Å
937	E	52.7	Low	59.5	Low	122 Å²	122	97.8 Å²	97.8	57%	0.57	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.4	150	-179.9	-66.1	-177.7	171	0	0	111.1	R878 I880	R878-E937 PolarHBondContact N-O 3.23Å; I880-E937 HydrophobicContact CD1-CG 4.33Å
938	D	46	Very low	60.2	Low	106 Å²	106	94.6 Å²	94.6	57%	0.567	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	131.2	-173.7	-51.9	-41.4	0	0	0	112.8	K877	K877-D938 WeakPolarHBondContact CE-OD1 3.45Å
939	E	43.4	Very low	61.2	Low	101 Å²	101	92 Å²	92	47%	0.472	45%	0.447	S	S	.	.			trans	-95.8	-12.9	-171.1	-134.2	174.5	-157.3	0	0	115	R878 S941	R878-E939 IonicContact NE-OE1 3.6Å; E939-S941 VanDerWaalsContact C-N 3.32Å; E939-S941 PolarHBondContact O-N 3.45Å
940	E	39.8	Very low	61.9	Low	152 Å²	152	91.9 Å²	91.9	71%	0.71	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	1.9	-169.7	-148.2	144.8	-155.9	0	0	114.8
941	S	43.2	Very low	62.9	Low	67 Å²	67	87.1 Å²	87.1	47%	0.469	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-13.2	177.3	75.6	0	0	0	0	114.8	E939 K945	E939-S941 VanDerWaalsContact C-N 3.32Å; E939-S941 PolarHBondContact O-N 3.45Å; S941-K945 WeakPolarHBondContact O-CB 3.39Å; S941-K945 PolarHBondContact O-N 3.48Å; S941-K945 VanDerWaalsContact O-N 3.09Å
942	D	56	Low	64.1	Low	108 Å²	108	86.3 Å²	86.3	58%	0.578	42%	0.415	S	S	*	.	H	α-helix	trans	-82	-31.4	-160.7	-105	-11.2	0	0	0	115.7	A946	D942-A946 WeakPolarHBondContact O-CB 3.47Å; D942-A946 PolarHBondContact O-N 2.98Å
943	K	55.5	Low	65.4	Low	181 Å²	181	77.4 Å²	77.4	79%	0.787	37%	0.373	S	S	*	.	H	α-helix	trans	-73.8	-48.4	178.1	-74.8	-177	-173.9	167.9	0	112.4	K945 A946 F947	K943-K945 VanDerWaalsContact C-N 3.33Å; K943-A946 PolarHBondContact O-N 2.8Å; K943-F947 PolarHBondContact O-N 2.89Å
944	K	61.9	Low	67.3	Low	141 Å²	141	75 Å²	75	61%	0.613	37%	0.366	S	S	*	.	H	α-helix	trans	-60.2	-44.9	174.5	-77.3	-175.2	-178.9	176	0	110.2	A946 F947 H948	K944-A946 PolarHBondContact O-N 3.19Å; K944-F947 PolarHBondContact O-N 3.15Å; K944-H948 WeakPolarHBondContact O-CB 3.43Å; K944-H948 PolarHBondContact O-N 3.28Å
945	K	72.1	Confident	69.1	Low	79 Å²	79	74.5 Å²	74.5	34%	0.343	36%	0.364	S	S	.	.	H	α-helix	trans	-62.7	-41	175	-170.9	174.7	-168.6	167.7	0	112.6	S941 K943 F947 H948 L949	S941-K945 WeakPolarHBondContact O-CB 3.39Å; S941-K945 PolarHBondContact O-N 3.48Å; S941-K945 VanDerWaalsContact O-N 3.09Å; K943-K945 VanDerWaalsContact C-N 3.33Å; K945-F947 VanDerWaalsContact C-N 3.31Å; K945-F947 PolarHBondContact O-N 3.23Å; K945-H948 PolarHBondContact O-N 2.93Å; K945-L949 HydrophobicContact CG-CD1 3.94Å; K945-L949 HydrophobicContact CG-CG 4.19Å; K945-L949 WeakPolarHBondContact O-CB 3.46Å; K945-L949 WeakPolarHBondContact O-CG 3.17Å; K945-L949 PolarHBondContact O-N 2.79Å
946	A	70	Confident	70.5	Confident	30 Å²	30	68.3 Å²	68.3	25%	0.248	34%	0.338	C	S	.	.	H	α-helix	trans	-67	-30.4	176.9	0	0	0	0	0	113.3	D942 K943 K944 G950 K1095	D942-A946 WeakPolarHBondContact O-CB 3.47Å; D942-A946 PolarHBondContact O-N 2.98Å; K943-A946 PolarHBondContact O-N 2.8Å; K944-A946 PolarHBondContact O-N 3.19Å; A946-G950 PolarHBondContact O-N 3.48Å; A946-K1095 PolarHBondContact O-NZ 3.07Å
947	F	75.6	Confident	72.2	Confident	156 Å²	156	67.6 Å²	67.6	68%	0.684	34%	0.337	S	S	*	.	H	α-helix	trans	-74.9	-50.8	172.3	-177.6	-97.4	0	0	0	111	K943 K944 K945 L949 G950 T951	K943-F947 PolarHBondContact O-N 2.89Å; K944-F947 PolarHBondContact O-N 3.15Å; K945-F947 VanDerWaalsContact C-N 3.31Å; K945-F947 PolarHBondContact O-N 3.23Å; F947-L949 PolarHBondContact O-N 3.11Å; F947-G950 CarbonylContact O-C 3.58Å; F947-G950 VanDerWaalsContact O-CA 3.25Å; F947-G950 WeakPolarHBondContact O-CA 3.25Å; F947-G950 PolarHBondContact O-N 2.79Å; F947-T951 PolarHBondContact O-N 3.45Å; F947-T951 PolarHBondContact O-OG1 3.39Å
948	H	81.8	Confident	74	Confident	38 Å²	38	62 Å²	62	18%	0.176	31%	0.311	C	S	.	.	H	α-helix	trans	-55.8	-47.3	177	-177.1	75.8	0	0	0	112	K944 K945 G950 T951 L952 E973 Y975	K944-H948 WeakPolarHBondContact O-CB 3.43Å; K944-H948 PolarHBondContact O-N 3.28Å; K945-H948 PolarHBondContact O-N 2.93Å; H948-G950 VanDerWaalsContact C-N 3.27Å; H948-G950 PolarHBondContact O-N 2.78Å; H948-T951 PolarHBondContact O-N 2.85Å; H948-L952 PolarHBondContact O-N 3.15Å; H948-E973 IonicContact CE1-OE1 2.75Å; H948-E973 PolarHBondContact CE1-OE1 3.17Å; H948-E973 IonicContact ND1-OE1 3.87Å; H948-E973 PolarHBondContact ND1-OE1 2.91Å; H948-E973 IonicContact ND1-OE2 3.92Å; H948-Y975 AromaticContact CD2-CD1 3.69Å; H948-Y975 AromaticContact CD2-CE1 3.42Å; H948-Y975 VanDerWaalsContact CD2-CE1 3.42Å; H948-Y975 WeakPolarHBondContact CD2-CE1 3.48Å; H948-Y975 AromaticContact CE1-CD1 3.6Å; H948-Y975 AromaticContact CE1-CE1 3.19Å; H948-Y975 WeakPolarHBondContact CE1-CE1 3.32Å; H948-Y975 AromaticContact CE1-CE2 3.9Å; H948-Y975 AromaticContact CE1-CZ 3.33Å; H948-Y975 AromaticContact CG-CE1 3.65Å; H948-Y975 AromaticContact ND1-CE1 3.51Å; H948-Y975 AromaticContact ND1-CZ 3.6Å; H948-Y975 PolarHBondContact ND1-OH 2.71Å; H948-Y975 AromaticContact NE2-CD1 3.15Å; H948-Y975 WeakPolarHBondContact NE2-CD1 3.4Å; H948-Y975 AromaticContact NE2-CE1 3.14Å; H948-Y975 WeakPolarHBondContact NE2-CE1 3.07Å; H948-Y975 AromaticContact NE2-CG 3.85Å; H948-Y975 AromaticContact NE2-CZ 3.8Å; H948-Y975 WeakPolarHBondContact O-CE1 3.26Å
949	L	88.3	Confident	76.1	Confident	16 Å²	16	58 Å²	58	8%	0.084	29%	0.289	C	S	.	.	H	α-helix	trans	-63.7	-31.8	172.2	-71.7	177.6	0	0	0	112.8	K945 F947 V953 D979 W982	K945-L949 HydrophobicContact CG-CD1 3.94Å; K945-L949 HydrophobicContact CG-CG 4.19Å; K945-L949 WeakPolarHBondContact O-CB 3.46Å; K945-L949 WeakPolarHBondContact O-CG 3.17Å; K945-L949 PolarHBondContact O-N 2.79Å; F947-L949 PolarHBondContact O-N 3.11Å; L949-V953 PolarHBondContact O-N 2.79Å; L949-D979 HydrophobicContact CD2-CB 3.7Å; L949-W982 HydrophobicContact CB-CE3 4.01Å; L949-W982 HydrophobicContact CB-CH2 3.93Å; L949-W982 HydrophobicContact CB-CZ2 4.5Å; L949-W982 HydrophobicContact CB-CZ3 3.64Å; L949-W982 HydrophobicContact CD1-CD2 4.18Å; L949-W982 HydrophobicContact CD1-CE3 4.38Å; L949-W982 HydrophobicContact CD1-CZ2 4.28Å; L949-W982 HydrophobicContact CD2-CD2 4.06Å; L949-W982 HydrophobicContact CD2-CE3 3.77Å; L949-W982 HydrophobicContact CD2-CG 4.41Å; L949-W982 HydrophobicContact CD2-CZ3 4.29Å; L949-W982 HydrophobicContact CG-CE3 4.28Å; L949-W982 HydrophobicContact CG-CZ3 4.38Å; L949-W982 WeakPolarHBondContact O-CZ3 3.17Å
950	G	86.3	Confident	78.4	Confident	11 Å²	11	56.6 Å²	56.6	11%	0.113	29%	0.288	C	S	.	.	H	α-helix	trans	-64.6	-48.1	174.1	0	0	0	0	0	112	A946 F947 H948 L952 V953 D954 T1048	A946-G950 PolarHBondContact O-N 3.48Å; F947-G950 CarbonylContact O-C 3.58Å; F947-G950 VanDerWaalsContact O-CA 3.25Å; F947-G950 WeakPolarHBondContact O-CA 3.25Å; F947-G950 PolarHBondContact O-N 2.79Å; H948-G950 VanDerWaalsContact C-N 3.27Å; H948-G950 PolarHBondContact O-N 2.78Å; G950-L952 VanDerWaalsContact C-N 3.35Å; G950-L952 PolarHBondContact O-N 2.68Å; G950-V953 PolarHBondContact O-N 2.87Å; G950-D954 PolarHBondContact O-N 2.95Å; G950-T1048 WeakPolarHBondContact CA-OG1 3.34Å
951	T	88.9	Confident	80.8	Confident	47 Å²	47	56.2 Å²	56.2	29%	0.288	29%	0.286	S	S	.	.	H	α-helix	trans	-60.2	-42.1	176.5	-52.2	0	0	0	0	111.8	F947 H948 V953 D954 A955	F947-T951 PolarHBondContact O-N 3.45Å; F947-T951 PolarHBondContact O-OG1 3.39Å; H948-T951 PolarHBondContact O-N 2.85Å; T951-V953 VanDerWaalsContact C-N 3.33Å; T951-V953 PolarHBondContact O-N 2.71Å; T951-D954 PolarHBondContact O-N 3.37Å; T951-A955 WeakPolarHBondContact O-CB 3.47Å; T951-A955 PolarHBondContact O-N 2.83Å
952	L	93.2	Very high	83	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-57.9	-44.7	175	177.4	61	0	0	0	112.5	H948 G950 L956 V970 Y975 D979 W980	H948-L952 PolarHBondContact O-N 3.15Å; G950-L952 VanDerWaalsContact C-N 3.35Å; G950-L952 PolarHBondContact O-N 2.68Å; L952-L956 HydrophobicContact CD1-CD1 3.82Å; L952-L956 HydrophobicContact CD1-CG 4Å; L952-L956 HydrophobicContact CG-CD1 3.84Å; L952-L956 HydrophobicContact CG-CG 4.42Å; L952-L956 VanDerWaalsContact O-CB 3.29Å; L952-L956 WeakPolarHBondContact O-CB 3.35Å; L952-L956 WeakPolarHBondContact O-CG 3.29Å; L952-L956 PolarHBondContact O-N 2.48Å; L952-V970 HydrophobicContact CD1-CG2 3.91Å; L952-Y975 HydrophobicContact CB-CD1 4.04Å; L952-Y975 HydrophobicContact CB-CE1 3.58Å; L952-Y975 HydrophobicContact CD1-CD1 4.23Å; L952-Y975 HydrophobicContact CD1-CD2 4.5Å; L952-Y975 HydrophobicContact CD1-CE1 4.35Å; L952-Y975 HydrophobicContact CD1-CG 4.33Å; L952-Y975 HydrophobicContact CD2-CD1 3.84Å; L952-Y975 HydrophobicContact CD2-CE1 4.26Å; L952-Y975 HydrophobicContact CD2-CG 4.45Å; L952-Y975 HydrophobicContact CG-CD1 4.25Å; L952-Y975 HydrophobicContact CG-CE1 4.26Å; L952-D979 WeakPolarHBondContact CD2-O 3.3Å; L952-W980 HydrophobicContact CD1-CD2 4.33Å; L952-W980 HydrophobicContact CD1-CE3 3.5Å; L952-W980 VanDerWaalsContact CD1-CE3 3.5Å; L952-W980 HydrophobicContact CD1-CH2 4.13Å; L952-W980 HydrophobicContact CD1-CZ3 3.41Å; L952-W980 VanDerWaalsContact CD1-CZ3 3.41Å; L952-W980 HydrophobicContact CD2-CE3 4.42Å
953	V	92.4	Very high	84.7	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-68.6	-38.2	179	169.6	0	0	0	0	111.4	L949 G950 T951 V957 W982 R986 T1048 V1093	L949-V953 PolarHBondContact O-N 2.79Å; G950-V953 PolarHBondContact O-N 2.87Å; T951-V953 VanDerWaalsContact C-N 3.33Å; T951-V953 PolarHBondContact O-N 2.71Å; V953-V957 HydrophobicContact CG1-CG2 4.42Å; V953-V957 WeakPolarHBondContact O-CB 3.49Å; V953-V957 WeakPolarHBondContact O-CG2 3.4Å; V953-V957 PolarHBondContact O-N 3.38Å; V953-W982 HydrophobicContact CG2-CE3 4.14Å; V953-W982 HydrophobicContact CG2-CH2 4.28Å; V953-W982 HydrophobicContact CG2-CZ3 3.44Å; V953-W982 VanDerWaalsContact CG2-CZ3 3.44Å; V953-R986 HydrophobicContact CG1-CB 4.38Å; V953-R986 HydrophobicContact CG2-CB 3.76Å; V953-R986 HydrophobicContact CG2-CG 4.17Å; V953-T1048 HydrophobicContact CB-CG2 3.84Å; V953-T1048 HydrophobicContact CG1-CG2 3.85Å; V953-T1048 HydrophobicContact CG2-CG2 4.31Å; V953-V1093 HydrophobicContact CG1-CG1 3.81Å
954	D	90.9	Very high	86.4	Confident	32 Å²	32	46.5 Å²	46.5	17%	0.171	24%	0.236	C	C	.	.	H	α-helix	trans	-60.4	-56	174.8	-171	36.5	0	0	0	110.3	G950 T951 L956 V957 T958 Q1010	G950-D954 PolarHBondContact O-N 2.95Å; T951-D954 PolarHBondContact O-N 3.37Å; D954-L956 PolarHBondContact O-N 3.12Å; D954-V957 PolarHBondContact O-N 2.81Å; D954-T958 PolarHBondContact O-N 3.42Å; D954-T958 PolarHBondContact O-OG1 3.09Å; D954-T958 WeakPolarHBondContact OD1-CG2 3.46Å; D954-T958 PolarHBondContact OD1-OG1 2.97Å; D954-Q1010 PolarHBondContact OD2-NE2 3.16Å; D954-Q1010 VanDerWaalsContact OD2-NE2 3.09Å
955	A	91.9	Very high	87.8	Confident	3 Å²	3	44.5 Å²	44.5	3%	0.025	23%	0.228	C	C	.	.	H	α-helix	trans	-58.1	-44.4	179.5	0	0	0	0	0	113.2	T951 V957 E959 P960 C963 V970	T951-A955 WeakPolarHBondContact O-CB 3.47Å; T951-A955 PolarHBondContact O-N 2.83Å; A955-V957 PolarHBondContact O-N 3.48Å; A955-V957 VanDerWaalsContact O-N 3.14Å; A955-E959 CarbonylContact O-C 3.6Å; A955-E959 WeakPolarHBondContact O-CA 3.43Å; A955-E959 PolarHBondContact O-N 3.34Å; A955-E959 VanDerWaalsContact O-O 3.12Å; A955-P960 VanDerWaalsContact O-N 3.15Å; A955-C963 VanDerWaalsContact C-SG 3.53Å; A955-V970 HydrophobicContact CB-CB 4.43Å; A955-V970 HydrophobicContact CB-CG1 3.44Å; A955-V970 VanDerWaalsContact CB-CG1 3.44Å; A955-V970 HydrophobicContact CB-CG2 4.07Å
956	L	93.5	Very high	88.5	Confident	9 Å²	9	51.6 Å²	51.6	5%	0.047	25%	0.254	C	S	.	.	H	α-helix	trans	-61.8	-22.7	177.9	-76.7	172	0	0	0	113.7	L952 D954 C963 W980 L984	L952-L956 HydrophobicContact CD1-CD1 3.82Å; L952-L956 HydrophobicContact CD1-CG 4Å; L952-L956 HydrophobicContact CG-CD1 3.84Å; L952-L956 HydrophobicContact CG-CG 4.42Å; L952-L956 VanDerWaalsContact O-CB 3.29Å; L952-L956 WeakPolarHBondContact O-CB 3.35Å; L952-L956 WeakPolarHBondContact O-CG 3.29Å; L952-L956 PolarHBondContact O-N 2.48Å; D954-L956 PolarHBondContact O-N 3.12Å; L956-C963 HydrophobicContact CD2-CB 4.25Å; L956-W980 HydrophobicContact CD2-CZ2 4.34Å; L956-L984 HydrophobicContact CD2-CD2 4.34Å
957	V	92.3	Very high	89.3	Confident	20 Å²	20	52 Å²	52	12%	0.121	26%	0.258	C	S	.	.	H	α-helix	trans	-104.1	-42.6	-175.9	178.6	0	0	0	0	112	V953 D954 A955 L987 L990 L1004 W1037 L1046	V953-V957 HydrophobicContact CG1-CG2 4.42Å; V953-V957 WeakPolarHBondContact O-CB 3.49Å; V953-V957 WeakPolarHBondContact O-CG2 3.4Å; V953-V957 PolarHBondContact O-N 3.38Å; D954-V957 PolarHBondContact O-N 2.81Å; A955-V957 PolarHBondContact O-N 3.48Å; A955-V957 VanDerWaalsContact O-N 3.14Å; V957-L987 HydrophobicContact CB-CD1 4.49Å; V957-L987 HydrophobicContact CG2-CD1 3.62Å; V957-L990 HydrophobicContact CG1-CD1 4.45Å; V957-L990 HydrophobicContact CG2-CD1 3.71Å; V957-L1004 HydrophobicContact CG1-CD2 4.19Å; V957-W1037 HydrophobicContact CG1-CH2 4.49Å; V957-W1037 HydrophobicContact CG1-CZ2 3.48Å; V957-W1037 VanDerWaalsContact CG1-CZ2 3.48Å; V957-L1046 HydrophobicContact CB-CD2 3.56Å; V957-L1046 HydrophobicContact CG1-CD2 3.6Å; V957-L1046 HydrophobicContact CG2-CD2 3.91Å
958	T	91.4	Very high	90.1	Very high	3 Å²	3	47 Å²	47	2%	0.018	24%	0.237	C	C	.	.	H	α-helix	trans	-109.7	-19.1	-167.1	65.8	0	0	0	0	113	D954 G1009 Q1010 D1036 L1046	D954-T958 PolarHBondContact O-N 3.42Å; D954-T958 PolarHBondContact O-OG1 3.09Å; D954-T958 WeakPolarHBondContact OD1-CG2 3.46Å; D954-T958 PolarHBondContact OD1-OG1 2.97Å; T958-G1009 WeakPolarHBondContact O-CA 3.48Å; T958-Q1010 PolarHBondContact O-N 3.37Å; T958-D1036 WeakPolarHBondContact CB-O 3.29Å; T958-D1036 HydrophobicContact CG2-CB 3.93Å; T958-D1036 WeakPolarHBondContact CG2-O 3.44Å; T958-L1046 HydrophobicContact CG2-CB 4.41Å; T958-L1046 HydrophobicContact CG2-CD2 3.97Å
959	E	90.8	Very high	90.6	Very high	24 Å²	24	46 Å²	46	11%	0.112	23%	0.234	C	C	.	.			trans	-141.7	55.5	178.4	-56.5	-176.3	100.5	0	0	111.5	A955 E961 K962 Q1010	A955-E959 CarbonylContact O-C 3.6Å; A955-E959 WeakPolarHBondContact O-CA 3.43Å; A955-E959 PolarHBondContact O-N 3.34Å; A955-E959 VanDerWaalsContact O-O 3.12Å; E959-E961 VanDerWaalsContact C-OE2 3.3Å; E959-E961 PolarHBondContact O-N 3.19Å; E959-K962 HydrophobicContact CB-CB 4.42Å; E959-K962 HydrophobicContact CB-CD 3.77Å; E959-K962 HydrophobicContact CB-CG 4.08Å; E959-K962 VanDerWaalsContact CD-NZ 3.28Å; E959-K962 HydrophobicContact CG-CD 4.29Å; E959-K962 WeakPolarHBondContact O-CB 3.49Å; E959-K962 PolarHBondContact O-N 2.76Å; E959-K962 WeakPolarHBondContact OE1-CD 3.24Å; E959-K962 WeakPolarHBondContact OE1-CE 3.11Å; E959-K962 IonicContact OE1-NZ 2.79Å; E959-K962 PolarHBondContact OE1-NZ 2.97Å; E959-K962 IonicContact OE2-NZ 3.64Å; E959-K962 PolarHBondContact OE2-NZ 2.98Å; E959-Q1010 HydrophobicContact CG-CB 4.06Å; E959-Q1010 HydrophobicContact CG-CG 3.66Å; E959-Q1010 PolarHBondContact OE1-OE1 3.35Å; E959-Q1010 PolarHBondContact OE2-NE2 3.24Å; E959-Q1010 PolarHBondContact OE2-OE1 3.47Å
960	P	90.6	Very high	90.7	Very high	70 Å²	70	45.7 Å²	45.7	46%	0.455	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-59.8	-23.3	-173.8	26.2	-36.1	0	0	0	113.5	A955 K962 C963	A955-P960 VanDerWaalsContact O-N 3.15Å; P960-K962 PolarHBondContact O-N 2.84Å; P960-C963 WeakPolarHBondContact O-CB 3.26Å; P960-C963 PolarHBondContact O-N 2.68Å; P960-C963 VanDerWaalsContact O-N 3.15Å
961	E	89.4	Confident	90.8	Very high	144 Å²	144	49.8 Å²	49.8	67%	0.673	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-64.2	-23.1	173.9	66.8	-78.1	-178.3	0	0	114	E959 C963	E959-E961 VanDerWaalsContact C-OE2 3.3Å; E959-E961 PolarHBondContact O-N 3.19Å; E961-C963 VanDerWaalsContact C-N 3.33Å
962	K	90.1	Very high	90.5	Very high	65 Å²	65	54.8 Å²	54.8	28%	0.283	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-82.6	-12.9	174.7	-65.2	-177.9	163.4	-174.6	0	113.3	E959 P960 V970 D971	E959-K962 HydrophobicContact CB-CB 4.42Å; E959-K962 HydrophobicContact CB-CD 3.77Å; E959-K962 HydrophobicContact CB-CG 4.08Å; E959-K962 VanDerWaalsContact CD-NZ 3.28Å; E959-K962 HydrophobicContact CG-CD 4.29Å; E959-K962 WeakPolarHBondContact O-CB 3.49Å; E959-K962 PolarHBondContact O-N 2.76Å; E959-K962 WeakPolarHBondContact OE1-CD 3.24Å; E959-K962 WeakPolarHBondContact OE1-CE 3.11Å; E959-K962 IonicContact OE1-NZ 2.79Å; E959-K962 PolarHBondContact OE1-NZ 2.97Å; E959-K962 IonicContact OE2-NZ 3.64Å; E959-K962 PolarHBondContact OE2-NZ 2.98Å; P960-K962 PolarHBondContact O-N 2.84Å; K962-V970 HydrophobicContact CB-CG1 4.43Å; K962-V970 WeakPolarHBondContact O-CA 3.46Å; K962-D971 WeakPolarHBondContact CB-OD1 3.42Å; K962-D971 WeakPolarHBondContact CD-OD1 3.25Å; K962-D971 VanDerWaalsContact CD-OD2 3.3Å; K962-D971 WeakPolarHBondContact CD-OD2 3.32Å; K962-D971 WeakPolarHBondContact CE-OD2 3.43Å; K962-D971 VanDerWaalsContact CG-OD1 3.29Å; K962-D971 WeakPolarHBondContact CG-OD1 3.26Å; K962-D971 IonicContact NZ-OD2 3.16Å; K962-D971 PolarHBondContact NZ-OD2 2.71Å; K962-D971 VanDerWaalsContact NZ-OD2 3.17Å; K962-D971 PolarHBondContact O-N 3.06Å
963	C	91.9	Very high	90.2	Very high	13 Å²	13	59.3 Å²	59.3	9%	0.088	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	114.5	-176.6	-63	0	0	0	0	110.8	A955 L956 P960 E961 H965 T969 W980	A955-C963 VanDerWaalsContact C-SG 3.53Å; L956-C963 HydrophobicContact CD2-CB 4.25Å; P960-C963 WeakPolarHBondContact O-CB 3.26Å; P960-C963 PolarHBondContact O-N 2.68Å; P960-C963 VanDerWaalsContact O-N 3.15Å; E961-C963 VanDerWaalsContact C-N 3.33Å; C963-H965 PolarHBondContact O-N 3.09Å; C963-T969 WeakPolarHBondContact CA-O 3.27Å; C963-W980 HydrophobicContact CB-CH2 4.16Å; C963-W980 HydrophobicContact CB-CZ2 4.34Å
964	N	91	Very high	90	Very high	75 Å²	75	67 Å²	67	40%	0.401	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	97	168.1	-173.7	-23.5	0	0	0	109.8	Y966 A967 M968 T969	N964-Y966 PolarHBondContact O-N 3.24Å; N964-Y966 PolarHBondContact OD1-N 3.23Å; N964-Y966 VanDerWaalsContact OD1-N 3.1Å; N964-A967 HydrophobicContact CB-CB 4.12Å; N964-A967 PolarHBondContact O-N 3.37Å; N964-A967 PolarHBondContact OD1-N 3.01Å; N964-M968 VanDerWaalsContact O-CA 3.32Å; N964-M968 WeakPolarHBondContact O-CA 3.45Å; N964-M968 PolarHBondContact O-N 2.79Å; N964-T969 WeakPolarHBondContact CB-OG1 3.37Å; N964-T969 PolarHBondContact N-O 3.33Å; N964-T969 PolarHBondContact O-N 3.47Å
965	H	91.5	Very high	90.1	Very high	98 Å²	98	65.7 Å²	65.7	45%	0.454	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-24.8	-178.8	-65.6	-69.7	0	0	0	114.6	C963 W980	C963-H965 PolarHBondContact O-N 3.09Å; H965-W980 HydrophobicContact CB-CZ2 4.45Å; H965-W980 AromaticContact ND1-CE2 3.79Å; H965-W980 AromaticContact ND1-CZ2 3.55Å; H965-W980 AromaticContact ND1-NE1 3.5Å
966	Y	86.1	Confident	90	Very high	228 Å²	228	69.2 Å²	69.2	89%	0.894	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-42	178.1	-69.5	-79.4	0	0	0	111.6	N964 M968	N964-Y966 PolarHBondContact O-N 3.24Å; N964-Y966 PolarHBondContact OD1-N 3.23Å; N964-Y966 VanDerWaalsContact OD1-N 3.1Å; Y966-M968 VanDerWaalsContact C-N 3.33Å
967	A	87.6	Confident	89.7	Confident	40 Å²	40	75.8 Å²	75.8	33%	0.331	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-13.3	177.1	0	0	0	0	0	113.2	N964 T969	N964-A967 HydrophobicContact CB-CB 4.12Å; N964-A967 PolarHBondContact O-N 3.37Å; N964-A967 PolarHBondContact OD1-N 3.01Å; A967-T969 VanDerWaalsContact C-N 3.3Å; A967-T969 HydrophobicContact CB-CG2 3.97Å
968	M	92.6	Very high	89.6	Confident	50 Å²	50	82.7 Å²	82.7	25%	0.246	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	46.4	-169.4	-59.8	179	-72.7	0	0	111.4	N964 Y966 Y975 E977 W980	N964-M968 VanDerWaalsContact O-CA 3.32Å; N964-M968 WeakPolarHBondContact O-CA 3.45Å; N964-M968 PolarHBondContact O-N 2.79Å; Y966-M968 VanDerWaalsContact C-N 3.33Å; M968-Y975 PolarHBondContact O-N 2.8Å; M968-E977 HydrophobicContact CE-CB 4.41Å; M968-E977 HydrophobicContact SD-CB 4.09Å; M968-E977 HydrophobicContact SD-CG 4.31Å; M968-W980 HydrophobicContact CB-CB 4.43Å; M968-W980 HydrophobicContact CB-CD2 3.87Å; M968-W980 HydrophobicContact CB-CE3 3.92Å; M968-W980 HydrophobicContact CB-CG 4.11Å; M968-W980 HydrophobicContact CB-CZ3 4.42Å; M968-W980 HydrophobicContact CG-CB 4.2Å; M968-W980 HydrophobicContact CG-CD2 4.02Å; M968-W980 HydrophobicContact CG-CG 3.83Å; M968-W980 HydrophobicContact SD-CB 4.07Å; M968-W980 HydrophobicContact SD-CG 4.28Å
969	T	92.8	Very high	89.7	Confident	17 Å²	17	83.4 Å²	83.4	10%	0.104	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	148.6	-179.6	59.9	0	0	0	0	112.4	C963 N964 A967 E973 K974 W980	C963-T969 WeakPolarHBondContact CA-O 3.27Å; N964-T969 WeakPolarHBondContact CB-OG1 3.37Å; N964-T969 PolarHBondContact N-O 3.33Å; N964-T969 PolarHBondContact O-N 3.47Å; A967-T969 VanDerWaalsContact C-N 3.3Å; A967-T969 HydrophobicContact CB-CG2 3.97Å; T969-E973 CarbonylContact C-O 3.54Å; T969-E973 WeakPolarHBondContact CA-O 3.47Å; T969-E973 WeakPolarHBondContact CB-O 3.44Å; T969-K974 HydrophobicContact CG2-CB 3.92Å; T969-K974 HydrophobicContact CG2-CG 4.18Å; T969-W980 WeakPolarHBondContact O-CH2 3.11Å
970	V	90.5	Very high	89.8	Confident	9 Å²	9	82.9 Å²	82.9	6%	0.055	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	119.4	167.4	178.7	0	0	0	0	107.3	L952 A955 K962 D972 E973 Y975 W980	L952-V970 HydrophobicContact CD1-CG2 3.91Å; A955-V970 HydrophobicContact CB-CB 4.43Å; A955-V970 HydrophobicContact CB-CG1 3.44Å; A955-V970 VanDerWaalsContact CB-CG1 3.44Å; A955-V970 HydrophobicContact CB-CG2 4.07Å; K962-V970 HydrophobicContact CB-CG1 4.43Å; K962-V970 WeakPolarHBondContact O-CA 3.46Å; V970-D972 PolarHBondContact O-N 2.89Å; V970-E973 PolarHBondContact N-O 3.13Å; V970-E973 WeakPolarHBondContact O-CB 3.18Å; V970-E973 PolarHBondContact O-N 3.49Å; V970-Y975 HydrophobicContact CB-CE2 3.88Å; V970-Y975 HydrophobicContact CG2-CD2 4.25Å; V970-Y975 HydrophobicContact CG2-CE2 3.81Å; V970-W980 HydrophobicContact CG2-CH2 4.04Å; V970-W980 HydrophobicContact CG2-CZ3 3.9Å
971	D	86.9	Confident	89.9	Confident	98 Å²	98	86.3 Å²	86.3	52%	0.524	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.6	47.4	-173.9	-72.6	-22.3	0	0	0	111.8	K962 E973	K962-D971 WeakPolarHBondContact CB-OD1 3.42Å; K962-D971 WeakPolarHBondContact CD-OD1 3.25Å; K962-D971 VanDerWaalsContact CD-OD2 3.3Å; K962-D971 WeakPolarHBondContact CD-OD2 3.32Å; K962-D971 WeakPolarHBondContact CE-OD2 3.43Å; K962-D971 VanDerWaalsContact CG-OD1 3.29Å; K962-D971 WeakPolarHBondContact CG-OD1 3.26Å; K962-D971 IonicContact NZ-OD2 3.16Å; K962-D971 PolarHBondContact NZ-OD2 2.71Å; K962-D971 VanDerWaalsContact NZ-OD2 3.17Å; K962-D971 PolarHBondContact O-N 3.06Å; D971-E973 PolarHBondContact O-N 2.6Å; D971-E973 VanDerWaalsContact O-N 3.14Å
972	D	83.1	Confident	90.1	Very high	152 Å²	152	81.7 Å²	81.7	81%	0.813	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.5	-5	-177	-54.7	-44.4	0	0	0	117.1	V970 K974	V970-D972 PolarHBondContact O-N 2.89Å; D972-K974 PolarHBondContact O-N 2.94Å
973	E	87.2	Confident	90.2	Very high	95 Å²	95	78.6 Å²	78.6	44%	0.444	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	118.2	172.3	-169.1	-173.4	-170.4	0	0	110.4	H948 T969 V970 D971 Y975	H948-E973 IonicContact CE1-OE1 2.75Å; H948-E973 PolarHBondContact CE1-OE1 3.17Å; H948-E973 IonicContact ND1-OE1 3.87Å; H948-E973 PolarHBondContact ND1-OE1 2.91Å; H948-E973 IonicContact ND1-OE2 3.92Å; T969-E973 CarbonylContact C-O 3.54Å; T969-E973 WeakPolarHBondContact CA-O 3.47Å; T969-E973 WeakPolarHBondContact CB-O 3.44Å; V970-E973 PolarHBondContact N-O 3.13Å; V970-E973 WeakPolarHBondContact O-CB 3.18Å; V970-E973 PolarHBondContact O-N 3.49Å; D971-E973 PolarHBondContact O-N 2.6Å; D971-E973 VanDerWaalsContact O-N 3.14Å; E973-Y975 HydrophobicContact CB-CE2 4.27Å; E973-Y975 HydrophobicContact CG-CE2 4.26Å; E973-Y975 VanDerWaalsContact O-CD2 3.24Å; E973-Y975 WeakPolarHBondContact O-CD2 3.47Å; E973-Y975 WeakPolarHBondContact O-CE2 3.48Å; E973-Y975 PolarHBondContact OE2-OH 2.71Å; E973-Y975 VanDerWaalsContact OE2-OH 3.06Å
974	K	89	Confident	90.3	Very high	161 Å²	161	81.3 Å²	81.3	70%	0.7	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	128.2	-176.4	-167.3	175.7	-174.4	175.4	0	112.3	T969 D972	T969-K974 HydrophobicContact CG2-CB 3.92Å; T969-K974 HydrophobicContact CG2-CG 4.18Å; D972-K974 PolarHBondContact O-N 2.94Å
975	Y	91.3	Very high	90.4	Very high	5 Å²	5	80.4 Å²	80.4	2%	0.02	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-102.4	152.9	175.9	-71.6	-102.5	0	0	0	110.6	H948 L952 M968 V970 E973 D979 W980	H948-Y975 AromaticContact CD2-CD1 3.69Å; H948-Y975 AromaticContact CD2-CE1 3.42Å; H948-Y975 VanDerWaalsContact CD2-CE1 3.42Å; H948-Y975 WeakPolarHBondContact CD2-CE1 3.48Å; H948-Y975 AromaticContact CE1-CD1 3.6Å; H948-Y975 AromaticContact CE1-CE1 3.19Å; H948-Y975 WeakPolarHBondContact CE1-CE1 3.32Å; H948-Y975 AromaticContact CE1-CE2 3.9Å; H948-Y975 AromaticContact CE1-CZ 3.33Å; H948-Y975 AromaticContact CG-CE1 3.65Å; H948-Y975 AromaticContact ND1-CE1 3.51Å; H948-Y975 AromaticContact ND1-CZ 3.6Å; H948-Y975 PolarHBondContact ND1-OH 2.71Å; H948-Y975 AromaticContact NE2-CD1 3.15Å; H948-Y975 WeakPolarHBondContact NE2-CD1 3.4Å; H948-Y975 AromaticContact NE2-CE1 3.14Å; H948-Y975 WeakPolarHBondContact NE2-CE1 3.07Å; H948-Y975 AromaticContact NE2-CG 3.85Å; H948-Y975 AromaticContact NE2-CZ 3.8Å; H948-Y975 WeakPolarHBondContact O-CE1 3.26Å; L952-Y975 HydrophobicContact CB-CD1 4.04Å; L952-Y975 HydrophobicContact CB-CE1 3.58Å; L952-Y975 HydrophobicContact CD1-CD1 4.23Å; L952-Y975 HydrophobicContact CD1-CD2 4.5Å; L952-Y975 HydrophobicContact CD1-CE1 4.35Å; L952-Y975 HydrophobicContact CD1-CG 4.33Å; L952-Y975 HydrophobicContact CD2-CD1 3.84Å; L952-Y975 HydrophobicContact CD2-CE1 4.26Å; L952-Y975 HydrophobicContact CD2-CG 4.45Å; L952-Y975 HydrophobicContact CG-CD1 4.25Å; L952-Y975 HydrophobicContact CG-CE1 4.26Å; M968-Y975 PolarHBondContact O-N 2.8Å; V970-Y975 HydrophobicContact CB-CE2 3.88Å; V970-Y975 HydrophobicContact CG2-CD2 4.25Å; V970-Y975 HydrophobicContact CG2-CE2 3.81Å; E973-Y975 HydrophobicContact CB-CE2 4.27Å; E973-Y975 HydrophobicContact CG-CE2 4.26Å; E973-Y975 VanDerWaalsContact O-CD2 3.24Å; E973-Y975 WeakPolarHBondContact O-CD2 3.47Å; E973-Y975 WeakPolarHBondContact O-CE2 3.48Å; E973-Y975 PolarHBondContact OE2-OH 2.71Å; E973-Y975 VanDerWaalsContact OE2-OH 3.06Å; Y975-D979 HydrophobicContact CD1-CB 4.26Å; Y975-W980 HydrophobicContact CD2-CE3 4.36Å; Y975-W980 HydrophobicContact CD2-CZ3 4.01Å; Y975-W980 HydrophobicContact CG-CE3 4.13Å; Y975-W980 HydrophobicContact CG-CZ3 4.23Å
976	T	89.9	Confident	90.6	Very high	78 Å²	78	76.7 Å²	76.7	48%	0.479	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-72.7	156.8	173.4	74.9	0	0	0	0	111	K978 D979 W980	T976-K978 PolarHBondContact O-N 3.23Å; T976-K978 VanDerWaalsContact O-N 3.17Å; T976-D979 WeakPolarHBondContact CB-OD2 3.39Å; T976-D979 WeakPolarHBondContact CG2-OD2 3.17Å; T976-D979 PolarHBondContact O-N 3.37Å; T976-D979 PolarHBondContact OG1-N 3.05Å; T976-D979 PolarHBondContact OG1-OD2 3.26Å; T976-W980 PolarHBondContact O-N 3.02Å
977	E	88.8	Confident	90.9	Very high	147 Å²	147	67 Å²	67	69%	0.687	33%	0.33	S	S	*	.	H	α-helix	trans	-55.9	-35.2	175.5	-170.2	-171.8	164.4	0	0	112	M968 K981	M968-E977 HydrophobicContact CE-CB 4.41Å; M968-E977 HydrophobicContact SD-CB 4.09Å; M968-E977 HydrophobicContact SD-CG 4.31Å; E977-K981 VanDerWaalsContact O-CB 3.24Å; E977-K981 WeakPolarHBondContact O-CB 3.43Å; E977-K981 PolarHBondContact O-N 3.48Å
978	K	88.9	Confident	91.2	Very high	165 Å²	165	67.6 Å²	67.6	72%	0.717	34%	0.335	S	S	*	.	H	α-helix	trans	-66.3	-41.6	176.6	-173.2	177.7	177.9	179	0	111.6	T976 W982	T976-K978 PolarHBondContact O-N 3.23Å; T976-K978 VanDerWaalsContact O-N 3.17Å; K978-W982 WeakPolarHBondContact O-CB 3.44Å; K978-W982 PolarHBondContact O-N 2.89Å
979	D	93.3	Very high	91.3	Very high	17 Å²	17	66.2 Å²	66.2	9%	0.091	33%	0.329	C	S	.	.	H	α-helix	trans	-70.3	-44	178.3	-58.9	-37.3	0	0	0	110.7	L949 L952 Y975 T976 K981 W982 G983	L949-D979 HydrophobicContact CD2-CB 3.7Å; L952-D979 WeakPolarHBondContact CD2-O 3.3Å; Y975-D979 HydrophobicContact CD1-CB 4.26Å; T976-D979 WeakPolarHBondContact CB-OD2 3.39Å; T976-D979 WeakPolarHBondContact CG2-OD2 3.17Å; T976-D979 PolarHBondContact O-N 3.37Å; T976-D979 PolarHBondContact OG1-N 3.05Å; T976-D979 PolarHBondContact OG1-OD2 3.26Å; D979-K981 PolarHBondContact O-N 2.99Å; D979-W982 CarbonylContact O-C 3.5Å; D979-W982 WeakPolarHBondContact O-CA 3.42Å; D979-W982 VanDerWaalsContact O-CB 3.32Å; D979-W982 WeakPolarHBondContact O-CB 3.5Å; D979-W982 PolarHBondContact O-N 3.17Å; D979-G983 PolarHBondContact O-N 2.77Å
980	W	94.1	Very high	91.3	Very high	13 Å²	13	65.4 Å²	65.4	5%	0.049	32%	0.324	C	S	.	.	H	α-helix	trans	-58.7	-46.5	176.3	-154.2	-106.2	0	0	0	111.8	L952 L956 C963 H965 M968 T969 V970 Y975 T976 W982 G983 L984	L952-W980 HydrophobicContact CD1-CD2 4.33Å; L952-W980 HydrophobicContact CD1-CE3 3.5Å; L952-W980 VanDerWaalsContact CD1-CE3 3.5Å; L952-W980 HydrophobicContact CD1-CH2 4.13Å; L952-W980 HydrophobicContact CD1-CZ3 3.41Å; L952-W980 VanDerWaalsContact CD1-CZ3 3.41Å; L952-W980 HydrophobicContact CD2-CE3 4.42Å; L956-W980 HydrophobicContact CD2-CZ2 4.34Å; C963-W980 HydrophobicContact CB-CH2 4.16Å; C963-W980 HydrophobicContact CB-CZ2 4.34Å; H965-W980 HydrophobicContact CB-CZ2 4.45Å; H965-W980 AromaticContact ND1-CE2 3.79Å; H965-W980 AromaticContact ND1-CZ2 3.55Å; H965-W980 AromaticContact ND1-NE1 3.5Å; M968-W980 HydrophobicContact CB-CB 4.43Å; M968-W980 HydrophobicContact CB-CD2 3.87Å; M968-W980 HydrophobicContact CB-CE3 3.92Å; M968-W980 HydrophobicContact CB-CG 4.11Å; M968-W980 HydrophobicContact CB-CZ3 4.42Å; M968-W980 HydrophobicContact CG-CB 4.2Å; M968-W980 HydrophobicContact CG-CD2 4.02Å; M968-W980 HydrophobicContact CG-CG 3.83Å; M968-W980 HydrophobicContact SD-CB 4.07Å; M968-W980 HydrophobicContact SD-CG 4.28Å; T969-W980 WeakPolarHBondContact O-CH2 3.11Å; V970-W980 HydrophobicContact CG2-CH2 4.04Å; V970-W980 HydrophobicContact CG2-CZ3 3.9Å; Y975-W980 HydrophobicContact CD2-CE3 4.36Å; Y975-W980 HydrophobicContact CD2-CZ3 4.01Å; Y975-W980 HydrophobicContact CG-CE3 4.13Å; Y975-W980 HydrophobicContact CG-CZ3 4.23Å; T976-W980 PolarHBondContact O-N 3.02Å; W980-W982 VanDerWaalsContact C-N 3.32Å; W980-W982 PolarHBondContact O-N 2.65Å; W980-G983 PolarHBondContact O-N 3.33Å; W980-L984 WeakPolarHBondContact O-CG 3.26Å; W980-L984 PolarHBondContact O-N 2.69Å
981	K	92	Very high	91.5	Very high	142 Å²	142	71 Å²	71	62%	0.617	35%	0.348	S	S	*	.	H	α-helix	trans	-62.5	-38.9	174.1	-173.8	172.2	-174.8	167.6	0	112	E977 D979 D985	E977-K981 VanDerWaalsContact O-CB 3.24Å; E977-K981 WeakPolarHBondContact O-CB 3.43Å; E977-K981 PolarHBondContact O-N 3.48Å; D979-K981 PolarHBondContact O-N 2.99Å; K981-D985 WeakPolarHBondContact O-CB 3.38Å; K981-D985 PolarHBondContact O-N 2.87Å
982	W	93.2	Very high	91.8	Very high	47 Å²	47	73.3 Å²	73.3	18%	0.178	35%	0.353	C	S	.	.	H	α-helix	trans	-62.3	-42.6	174.9	-177.1	108.3	0	0	0	111.5	L949 V953 K978 D979 W980 D985 R986 K1095	L949-W982 HydrophobicContact CB-CE3 4.01Å; L949-W982 HydrophobicContact CB-CH2 3.93Å; L949-W982 HydrophobicContact CB-CZ2 4.5Å; L949-W982 HydrophobicContact CB-CZ3 3.64Å; L949-W982 HydrophobicContact CD1-CD2 4.18Å; L949-W982 HydrophobicContact CD1-CE3 4.38Å; L949-W982 HydrophobicContact CD1-CZ2 4.28Å; L949-W982 HydrophobicContact CD2-CD2 4.06Å; L949-W982 HydrophobicContact CD2-CE3 3.77Å; L949-W982 HydrophobicContact CD2-CG 4.41Å; L949-W982 HydrophobicContact CD2-CZ3 4.29Å; L949-W982 HydrophobicContact CG-CE3 4.28Å; L949-W982 HydrophobicContact CG-CZ3 4.38Å; L949-W982 WeakPolarHBondContact O-CZ3 3.17Å; V953-W982 HydrophobicContact CG2-CE3 4.14Å; V953-W982 HydrophobicContact CG2-CH2 4.28Å; V953-W982 HydrophobicContact CG2-CZ3 3.44Å; V953-W982 VanDerWaalsContact CG2-CZ3 3.44Å; K978-W982 WeakPolarHBondContact O-CB 3.44Å; K978-W982 PolarHBondContact O-N 2.89Å; D979-W982 CarbonylContact O-C 3.5Å; D979-W982 WeakPolarHBondContact O-CA 3.42Å; D979-W982 VanDerWaalsContact O-CB 3.32Å; D979-W982 WeakPolarHBondContact O-CB 3.5Å; D979-W982 PolarHBondContact O-N 3.17Å; W980-W982 VanDerWaalsContact C-N 3.32Å; W980-W982 PolarHBondContact O-N 2.65Å; W982-D985 WeakPolarHBondContact O-CB 3.23Å; W982-D985 PolarHBondContact O-N 2.76Å; W982-R986 VanDerWaalsContact CD1-CZ 3.48Å; W982-R986 HydrophobicContact CE3-CG 4.33Å; W982-R986 HydrophobicContact CH2-CG 4.12Å; W982-R986 HydrophobicContact CZ2-CG 4.39Å; W982-R986 HydrophobicContact CZ3-CG 4.1Å; W982-R986 VanDerWaalsContact O-CD 3.22Å; W982-R986 WeakPolarHBondContact O-CD 3.25Å; W982-R986 PolarHBondContact O-N 3.45Å; W982-R986 PolarHBondContact O-NH1 3.44Å; W982-K1095 HydrophobicContact CH2-CG 4.25Å; W982-K1095 HydrophobicContact CZ2-CB 4.01Å; W982-K1095 HydrophobicContact CZ2-CG 4.24Å
983	G	93.3	Very high	92.3	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-64.5	-48.7	176.3	0	0	0	0	0	112.9	D979 W980 D985 R986 L987	D979-G983 PolarHBondContact O-N 2.77Å; W980-G983 PolarHBondContact O-N 3.33Å; G983-D985 VanDerWaalsContact C-N 3.27Å; G983-D985 PolarHBondContact O-N 2.89Å; G983-R986 WeakPolarHBondContact O-CB 3.24Å; G983-R986 PolarHBondContact O-N 2.72Å; G983-L987 PolarHBondContact O-N 2.85Å
984	L	93.9	Very high	92.6	Very high	71 Å²	71	65.1 Å²	65.1	37%	0.372	31%	0.311	S	S	.	.	H	α-helix	trans	-58.8	-38.1	175.8	-71.7	176	0	0	0	112.4	L956 W980 R986 L987 A988	L956-L984 HydrophobicContact CD2-CD2 4.34Å; W980-L984 WeakPolarHBondContact O-CG 3.26Å; W980-L984 PolarHBondContact O-N 2.69Å; L984-R986 PolarHBondContact O-N 2.71Å; L984-L987 PolarHBondContact O-N 2.76Å; L984-A988 WeakPolarHBondContact O-CB 3.02Å; L984-A988 PolarHBondContact O-N 3.34Å
985	D	93.4	Very high	92.7	Very high	55 Å²	55	62.8 Å²	62.8	29%	0.294	31%	0.311	S	S	.	.	H	α-helix	trans	-60.2	-34.2	173.9	-97	5.6	0	0	0	112.3	K981 W982 G983 V989 K1098	K981-D985 WeakPolarHBondContact O-CB 3.38Å; K981-D985 PolarHBondContact O-N 2.87Å; W982-D985 WeakPolarHBondContact O-CB 3.23Å; W982-D985 PolarHBondContact O-N 2.76Å; G983-D985 VanDerWaalsContact C-N 3.27Å; G983-D985 PolarHBondContact O-N 2.89Å; D985-V989 VanDerWaalsContact O-CG2 3.24Å; D985-V989 WeakPolarHBondContact O-CG2 3.32Å; D985-V989 PolarHBondContact O-N 3.11Å; D985-V989 VanDerWaalsContact O-N 3.08Å; D985-K1098 IonicContact OD1-NZ 3.24Å; D985-K1098 WeakPolarHBondContact OD2-CE 3.37Å; D985-K1098 IonicContact OD2-NZ 3.65Å; D985-K1098 PolarHBondContact OD2-NZ 3.31Å
986	R	94.8	Very high	92.8	Very high	21 Å²	21	70.1 Å²	70.1	8%	0.079	34%	0.343	C	S	.	.	H	α-helix	trans	-80.5	-39	-177.4	-80.7	29.3	166.9	-159.4	10.2	110.2	V953 W982 G983 L984 A988 V989 L990 V1093 K1095	V953-R986 HydrophobicContact CG1-CB 4.38Å; V953-R986 HydrophobicContact CG2-CB 3.76Å; V953-R986 HydrophobicContact CG2-CG 4.17Å; W982-R986 VanDerWaalsContact CD1-CZ 3.48Å; W982-R986 HydrophobicContact CE3-CG 4.33Å; W982-R986 HydrophobicContact CH2-CG 4.12Å; W982-R986 HydrophobicContact CZ2-CG 4.39Å; W982-R986 HydrophobicContact CZ3-CG 4.1Å; W982-R986 VanDerWaalsContact O-CD 3.22Å; W982-R986 WeakPolarHBondContact O-CD 3.25Å; W982-R986 PolarHBondContact O-N 3.45Å; W982-R986 PolarHBondContact O-NH1 3.44Å; G983-R986 WeakPolarHBondContact O-CB 3.24Å; G983-R986 PolarHBondContact O-N 2.72Å; L984-R986 PolarHBondContact O-N 2.71Å; R986-A988 VanDerWaalsContact C-N 3.3Å; R986-A988 PolarHBondContact O-N 3.27Å; R986-V989 WeakPolarHBondContact O-CB 3.31Å; R986-V989 PolarHBondContact O-N 3.39Å; R986-L990 PolarHBondContact O-N 2.77Å; R986-V1093 HydrophobicContact CB-CG1 4.29Å; R986-V1093 HydrophobicContact CB-CG2 4.12Å; R986-V1093 HydrophobicContact CG-CG1 4.41Å; R986-V1093 HydrophobicContact CG-CG2 4.11Å; R986-K1095 PolarHBondContact NH2-O 2.79Å
987	L	93.3	Very high	92.9	Very high	23 Å²	23	68.2 Å²	68.2	12%	0.12	33%	0.329	C	S	.	.	H	α-helix	trans	-58.3	-42.4	167.5	179	63.7	0	0	0	111.5	V957 G983 L984 V989 L990 K991	V957-L987 HydrophobicContact CB-CD1 4.49Å; V957-L987 HydrophobicContact CG2-CD1 3.62Å; G983-L987 PolarHBondContact O-N 2.85Å; L984-L987 PolarHBondContact O-N 2.76Å; L987-V989 VanDerWaalsContact C-N 3.33Å; L987-V989 PolarHBondContact O-N 2.77Å; L987-L990 PolarHBondContact O-N 3.35Å; L987-K991 HydrophobicContact CG-CD 4.4Å; L987-K991 WeakPolarHBondContact O-CG 3.43Å; L987-K991 PolarHBondContact O-N 3.02Å
988	A	93.5	Very high	93.1	Very high	54 Å²	54	66.1 Å²	66.1	45%	0.446	33%	0.331	S	S	.	.	H	α-helix	trans	-65	-36	176.3	0	0	0	0	0	112.5	L984 R986 K992	L984-A988 WeakPolarHBondContact O-CB 3.02Å; L984-A988 PolarHBondContact O-N 3.34Å; R986-A988 VanDerWaalsContact C-N 3.3Å; R986-A988 PolarHBondContact O-N 3.27Å; A988-K992 VanDerWaalsContact O-CB 3.24Å; A988-K992 WeakPolarHBondContact O-CB 3.21Å; A988-K992 PolarHBondContact O-N 3.48Å
989	V	94.1	Very high	93.3	Very high	20 Å²	20	61 Å²	61	12%	0.121	31%	0.309	C	S	.	.	H	α-helix	trans	-63.9	-44.5	173.4	168	0	0	0	0	111.2	D985 R986 L987 K992 Q993 V1093 K1098 V1100	D985-V989 VanDerWaalsContact O-CG2 3.24Å; D985-V989 WeakPolarHBondContact O-CG2 3.32Å; D985-V989 PolarHBondContact O-N 3.11Å; D985-V989 VanDerWaalsContact O-N 3.08Å; R986-V989 WeakPolarHBondContact O-CB 3.31Å; R986-V989 PolarHBondContact O-N 3.39Å; L987-V989 VanDerWaalsContact C-N 3.33Å; L987-V989 PolarHBondContact O-N 2.77Å; V989-K992 PolarHBondContact O-N 3.01Å; V989-Q993 PolarHBondContact O-N 3.43Å; V989-V1093 HydrophobicContact CB-CG2 4.48Å; V989-V1093 HydrophobicContact CG1-CG2 4.12Å; V989-K1098 HydrophobicContact CG2-CB 3.62Å; V989-K1098 HydrophobicContact CG2-CD 4.07Å; V989-K1098 HydrophobicContact CG2-CG 3.93Å; V989-V1100 HydrophobicContact CG1-CG2 3.83Å
990	L	93.5	Very high	93.4	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.6	-51	174.7	-75.7	165.8	0	0	0	111.6	V957 R986 L987 K992 Q993 A994 L1000 L1046 V1093 V1100	V957-L990 HydrophobicContact CG1-CD1 4.45Å; V957-L990 HydrophobicContact CG2-CD1 3.71Å; R986-L990 PolarHBondContact O-N 2.77Å; L987-L990 PolarHBondContact O-N 3.35Å; L990-K992 VanDerWaalsContact C-N 3.3Å; L990-K992 PolarHBondContact O-N 3.48Å; L990-Q993 PolarHBondContact O-N 2.9Å; L990-Q993 VanDerWaalsContact O-N 3.11Å; L990-A994 PolarHBondContact O-N 3.41Å; L990-L1000 HydrophobicContact CD2-CD2 4.5Å; L990-L1046 HydrophobicContact CD1-CD1 4.24Å; L990-V1093 HydrophobicContact CD2-CB 4.46Å; L990-V1093 HydrophobicContact CG-CB 4.37Å; L990-V1100 HydrophobicContact CD2-CG1 3.86Å; L990-V1100 HydrophobicContact CD2-CG2 3.79Å; L990-V1100 HydrophobicContact CG-CG2 4.37Å
991	K	93.2	Very high	93.4	Very high	126 Å²	126	62 Å²	62	55%	0.548	32%	0.315	S	S	.	.	H	α-helix	trans	-60.1	-38.3	177.4	-72.1	-178.6	178.2	179.5	0	112.5	L987 A994 T995	L987-K991 HydrophobicContact CG-CD 4.4Å; L987-K991 WeakPolarHBondContact O-CG 3.43Å; L987-K991 PolarHBondContact O-N 3.02Å; K991-A994 WeakPolarHBondContact O-CB 3.33Å; K991-A994 PolarHBondContact O-N 3.36Å; K991-T995 PolarHBondContact O-N 3.25Å
992	K	93.6	Very high	93.5	Very high	147 Å²	147	59.9 Å²	59.9	64%	0.639	31%	0.306	S	S	*	.	H	α-helix	trans	-67	-40.6	175.2	-174.3	176.9	-177.4	177.1	0	111.5	A988 V989 L990 A994 T995	A988-K992 VanDerWaalsContact O-CB 3.24Å; A988-K992 WeakPolarHBondContact O-CB 3.21Å; A988-K992 PolarHBondContact O-N 3.48Å; V989-K992 PolarHBondContact O-N 3.01Å; L990-K992 VanDerWaalsContact C-N 3.3Å; L990-K992 PolarHBondContact O-N 3.48Å; K992-A994 VanDerWaalsContact C-N 3.31Å; K992-T995 PolarHBondContact O-N 3.23Å; K992-T995 PolarHBondContact O-OG1 2.66Å
993	Q	93.9	Very high	93.5	Very high	68 Å²	68	57.7 Å²	57.7	32%	0.318	30%	0.298	S	S	.	.	H	α-helix	trans	-64.7	-37.8	175.8	-175.5	63.4	28.1	0	0	111.4	V989 L990 T995 K996 D997 L1000 V1100	V989-Q993 PolarHBondContact O-N 3.43Å; L990-Q993 PolarHBondContact O-N 2.9Å; L990-Q993 VanDerWaalsContact O-N 3.11Å; Q993-T995 PolarHBondContact O-N 3.07Å; Q993-K996 CarbonylContact O-C 3.56Å; Q993-K996 WeakPolarHBondContact O-CA 3.46Å; Q993-K996 WeakPolarHBondContact O-CB 3.39Å; Q993-K996 PolarHBondContact O-N 3.17Å; Q993-D997 HydrophobicContact CG-CB 4.48Å; Q993-D997 PolarHBondContact O-N 3.27Å; Q993-L1000 HydrophobicContact CB-CD2 3.85Å; Q993-L1000 HydrophobicContact CG-CD2 3.8Å; Q993-V1100 HydrophobicContact CB-CB 4.22Å; Q993-V1100 HydrophobicContact CB-CG2 3.77Å; Q993-V1100 HydrophobicContact CG-CB 3.97Å; Q993-V1100 HydrophobicContact CG-CG1 4.44Å; Q993-V1100 HydrophobicContact CG-CG2 4.1Å
994	A	93.3	Very high	93.5	Very high	7 Å²	7	60.3 Å²	60.3	6%	0.058	31%	0.312	C	S	.	.	H	α-helix	trans	-56.6	-33.2	176.7	0	0	0	0	0	112.9	L990 K991 K992 K996 D997 L1000 D1001 L1004	L990-A994 PolarHBondContact O-N 3.41Å; K991-A994 WeakPolarHBondContact O-CB 3.33Å; K991-A994 PolarHBondContact O-N 3.36Å; K992-A994 VanDerWaalsContact C-N 3.31Å; A994-K996 PolarHBondContact O-N 2.96Å; A994-D997 CarbonylContact O-C 3.56Å; A994-D997 PolarHBondContact O-N 3.35Å; A994-D997 VanDerWaalsContact O-O 3.08Å; A994-L1000 HydrophobicContact CB-CD2 4.36Å; A994-L1000 HydrophobicContact CB-CG 4.12Å; A994-D1001 HydrophobicContact CB-CB 4.14Å; A994-D1001 WeakPolarHBondContact O-CB 3.34Å; A994-L1004 HydrophobicContact CB-CD1 3.78Å
995	T	92.4	Very high	93.4	Very high	112 Å²	112	63.7 Å²	63.7	69%	0.687	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-15.9	173.8	69.9	0	0	0	0	114.4	K991 K992 Q993	K991-T995 PolarHBondContact O-N 3.25Å; K992-T995 PolarHBondContact O-N 3.23Å; K992-T995 PolarHBondContact O-OG1 2.66Å; Q993-T995 PolarHBondContact O-N 3.07Å
996	K	91.8	Very high	93.3	Very high	160 Å²	160	65.4 Å²	65.4	70%	0.696	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	-18	-179.8	-59.6	-177.2	178.5	-174.8	0	113.6	Q993 A994	Q993-K996 CarbonylContact O-C 3.56Å; Q993-K996 WeakPolarHBondContact O-CA 3.46Å; Q993-K996 WeakPolarHBondContact O-CB 3.39Å; Q993-K996 PolarHBondContact O-N 3.17Å; A994-K996 PolarHBondContact O-N 2.96Å
997	D	92.7	Very high	93.2	Very high	37 Å²	37	65.5 Å²	65.5	20%	0.198	34%	0.338	C	S	.	.			trans	-119.9	102.3	-177.1	-177	-25.6	0	0	0	108.3	Q993 A994 F999 L1000 D1001	Q993-D997 HydrophobicContact CG-CB 4.48Å; Q993-D997 PolarHBondContact O-N 3.27Å; A994-D997 CarbonylContact O-C 3.56Å; A994-D997 PolarHBondContact O-N 3.35Å; A994-D997 VanDerWaalsContact O-O 3.08Å; D997-F999 PolarHBondContact O-N 3.19Å; D997-F999 WeakPolarHBondContact OD1-CB 3.22Å; D997-F999 PolarHBondContact OD1-N 2.99Å; D997-L1000 HydrophobicContact CB-CB 3.92Å; D997-L1000 PolarHBondContact O-N 2.96Å; D997-L1000 PolarHBondContact OD1-N 3.06Å; D997-D1001 PolarHBondContact O-N 2.88Å
998	S	92.6	Very high	93	Very high	103 Å²	103	68.6 Å²	68.6	72%	0.72	36%	0.357	S	S	*	.	H	α-helix	trans	-62.1	-27.8	-177.8	55	0	0	0	0	112.9	F1002	S998-F1002 WeakPolarHBondContact O-CB 3.33Å; S998-F1002 PolarHBondContact O-N 3.18Å
999	F	94.5	Very high	92.7	Very high	57 Å²	57	67 Å²	67	25%	0.25	35%	0.346	C	S	.	.	H	α-helix	trans	-75.6	-44.5	177.2	-176.2	-112.3	0	0	0	110.5	D997 D1001 F1002 V1003 L1039 F1042 F1089 F1091 Y1102	D997-F999 PolarHBondContact O-N 3.19Å; D997-F999 WeakPolarHBondContact OD1-CB 3.22Å; D997-F999 PolarHBondContact OD1-N 2.99Å; F999-D1001 VanDerWaalsContact C-N 3.32Å; F999-D1001 PolarHBondContact O-N 3.21Å; F999-F1002 WeakPolarHBondContact O-CB 3.17Å; F999-F1002 PolarHBondContact O-N 3.17Å; F999-V1003 HydrophobicContact CD1-CG2 4.29Å; F999-V1003 HydrophobicContact CE1-CG2 3.91Å; F999-V1003 HydrophobicContact CE2-CG2 4.29Å; F999-V1003 HydrophobicContact CZ-CG2 3.91Å; F999-V1003 VanDerWaalsContact O-CG2 3.31Å; F999-V1003 WeakPolarHBondContact O-CG2 3.16Å; F999-V1003 PolarHBondContact O-N 3.49Å; F999-L1039 HydrophobicContact CE2-CD1 4.43Å; F999-L1039 HydrophobicContact CZ-CD1 4.32Å; F999-F1042 HydrophobicContact CE2-CZ 4.23Å; F999-F1042 HydrophobicContact CZ-CE2 4.08Å; F999-F1042 HydrophobicContact CZ-CZ 4.18Å; F999-F1089 HydrophobicContact CE1-CB 4.47Å; F999-F1089 AromaticContact CE1-CD1 3.98Å; F999-F1089 HydrophobicContact CE1-CD1 3.98Å; F999-F1089 HydrophobicContact CE1-CD2 4.2Å; F999-F1089 HydrophobicContact CE1-CE1 4.23Å; F999-F1089 HydrophobicContact CE1-CE2 4.44Å; F999-F1089 AromaticContact CE1-CG 3.96Å; F999-F1089 HydrophobicContact CE1-CG 3.96Å; F999-F1089 HydrophobicContact CE1-CZ 4.45Å; F999-F1089 AromaticContact CZ-CD1 3.86Å; F999-F1089 HydrophobicContact CZ-CD1 3.86Å; F999-F1089 AromaticContact CZ-CE1 3.91Å; F999-F1089 HydrophobicContact CZ-CE1 3.91Å; F999-F1089 HydrophobicContact CZ-CG 4.31Å; F999-F1089 HydrophobicContact CZ-CZ 4.41Å; F999-F1091 AromaticContact CD1-CE2 3.98Å; F999-F1091 HydrophobicContact CD1-CE2 3.98Å; F999-F1091 AromaticContact CD1-CZ 3.93Å; F999-F1091 HydrophobicContact CD1-CZ 3.93Å; F999-F1091 HydrophobicContact CE1-CE2 4.05Å; F999-F1091 HydrophobicContact CE1-CZ 4.44Å; F999-Y1102 AromaticContact CD1-CE2 3.93Å; F999-Y1102 HydrophobicContact CD1-CE2 3.93Å; F999-Y1102 AromaticContact CE1-CE2 3.87Å; F999-Y1102 HydrophobicContact CE1-CE2 3.87Å
1000	L	94.3	Very high	92.5	Very high	0 Å²	0	68 Å²	68	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-62.2	-39.1	173.4	-177.5	59.1	0	0	0	112.1	L990 Q993 A994 D997 F1002 V1003 L1004 F1091 V1100	L990-L1000 HydrophobicContact CD2-CD2 4.5Å; Q993-L1000 HydrophobicContact CB-CD2 3.85Å; Q993-L1000 HydrophobicContact CG-CD2 3.8Å; A994-L1000 HydrophobicContact CB-CD2 4.36Å; A994-L1000 HydrophobicContact CB-CG 4.12Å; D997-L1000 HydrophobicContact CB-CB 3.92Å; D997-L1000 PolarHBondContact O-N 2.96Å; D997-L1000 PolarHBondContact OD1-N 3.06Å; L1000-F1002 VanDerWaalsContact C-N 3.34Å; L1000-V1003 PolarHBondContact O-N 2.92Å; L1000-L1004 HydrophobicContact CD1-CD1 4.36Å; L1000-L1004 HydrophobicContact CD1-CG 4.14Å; L1000-L1004 HydrophobicContact CG-CD1 4.26Å; L1000-L1004 HydrophobicContact CG-CG 4.44Å; L1000-L1004 WeakPolarHBondContact O-CG 3.28Å; L1000-L1004 PolarHBondContact O-N 3.39Å; L1000-F1091 HydrophobicContact CB-CE1 4Å; L1000-F1091 HydrophobicContact CB-CE2 4.4Å; L1000-F1091 HydrophobicContact CB-CZ 3.72Å; L1000-F1091 HydrophobicContact CD1-CD1 4.13Å; L1000-F1091 HydrophobicContact CD1-CD2 3.98Å; L1000-F1091 HydrophobicContact CD1-CE1 4.01Å; L1000-F1091 HydrophobicContact CD1-CE2 3.88Å; L1000-F1091 HydrophobicContact CD1-CG 4.12Å; L1000-F1091 HydrophobicContact CD1-CZ 3.88Å; L1000-F1091 HydrophobicContact CD2-CE1 4.28Å; L1000-F1091 HydrophobicContact CG-CE1 4.31Å; L1000-F1091 HydrophobicContact CG-CZ 4.29Å; L1000-V1100 HydrophobicContact CD2-CG1 4.36Å
1001	D	94.6	Very high	92.3	Very high	53 Å²	53	72.3 Å²	72.3	28%	0.283	37%	0.369	S	S	.	.	H	α-helix	trans	-61.3	-42.2	173	-175.6	63.7	0	0	0	112.1	A994 D997 F999 K1005	A994-D1001 HydrophobicContact CB-CB 4.14Å; A994-D1001 WeakPolarHBondContact O-CB 3.34Å; D997-D1001 PolarHBondContact O-N 2.88Å; F999-D1001 VanDerWaalsContact C-N 3.32Å; F999-D1001 PolarHBondContact O-N 3.21Å; D1001-K1005 WeakPolarHBondContact O-CB 3.24Å; D1001-K1005 VanDerWaalsContact O-CG 3.31Å; D1001-K1005 WeakPolarHBondContact O-CG 3.45Å; D1001-K1005 PolarHBondContact O-N 2.89Å; D1001-K1005 WeakPolarHBondContact OD1-CE 3.42Å; D1001-K1005 IonicContact OD1-NZ 3.58Å; D1001-K1005 PolarHBondContact OD1-NZ 2.9Å; D1001-K1005 WeakPolarHBondContact OD2-CE 3.43Å; D1001-K1005 IonicContact OD2-NZ 2.79Å; D1001-K1005 PolarHBondContact OD2-NZ 3.46Å
1002	F	94.4	Very high	92.1	Very high	97 Å²	97	69 Å²	69	43%	0.425	36%	0.359	S	S	.	.	H	α-helix	trans	-62.7	-45.4	173.9	179.1	-98.2	0	0	0	111.8	S998 F999 L1000 K1005 N1006 L1039	S998-F1002 WeakPolarHBondContact O-CB 3.33Å; S998-F1002 PolarHBondContact O-N 3.18Å; F999-F1002 WeakPolarHBondContact O-CB 3.17Å; F999-F1002 PolarHBondContact O-N 3.17Å; L1000-F1002 VanDerWaalsContact C-N 3.34Å; F1002-K1005 PolarHBondContact O-N 3.48Å; F1002-N1006 WeakPolarHBondContact CD2-ND2 3.49Å; F1002-N1006 HydrophobicContact CE2-CB 4.22Å; F1002-N1006 WeakPolarHBondContact CE2-ND2 3.5Å; F1002-N1006 HydrophobicContact CZ-CB 4.22Å; F1002-N1006 WeakPolarHBondContact O-CB 3.45Å; F1002-N1006 PolarHBondContact O-N 3.46Å; F1002-N1006 PolarHBondContact O-ND2 2.95Å; F1002-L1039 HydrophobicContact CD1-CD2 4.17Å; F1002-L1039 HydrophobicContact CE1-CD1 4.28Å; F1002-L1039 HydrophobicContact CE1-CD2 3.82Å
1003	V	93.5	Very high	91.8	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-59.7	-53	177.6	171.5	0	0	0	0	111	F999 L1000 K1005 N1006 A1007 W1037 L1039 F1089 F1091	F999-V1003 HydrophobicContact CD1-CG2 4.29Å; F999-V1003 HydrophobicContact CE1-CG2 3.91Å; F999-V1003 HydrophobicContact CE2-CG2 4.29Å; F999-V1003 HydrophobicContact CZ-CG2 3.91Å; F999-V1003 VanDerWaalsContact O-CG2 3.31Å; F999-V1003 WeakPolarHBondContact O-CG2 3.16Å; F999-V1003 PolarHBondContact O-N 3.49Å; L1000-V1003 PolarHBondContact O-N 2.92Å; V1003-K1005 PolarHBondContact O-N 2.94Å; V1003-K1005 VanDerWaalsContact O-N 3.16Å; V1003-N1006 PolarHBondContact O-N 3.01Å; V1003-A1007 HydrophobicContact CG1-CB 4.12Å; V1003-A1007 WeakPolarHBondContact O-CB 3.48Å; V1003-A1007 PolarHBondContact O-N 3.22Å; V1003-W1037 HydrophobicContact CG1-CB 4.26Å; V1003-W1037 HydrophobicContact CG1-CD2 3.65Å; V1003-W1037 HydrophobicContact CG1-CE3 3.99Å; V1003-W1037 HydrophobicContact CG1-CG 3.81Å; V1003-W1037 HydrophobicContact CG1-CZ2 4.39Å; V1003-W1037 HydrophobicContact CG1-CZ3 4.49Å; V1003-L1039 HydrophobicContact CG2-CD1 4.2Å; V1003-L1039 HydrophobicContact CG2-CD2 4.48Å; V1003-F1089 HydrophobicContact CB-CZ 4.44Å; V1003-F1089 HydrophobicContact CG1-CE2 4.05Å; V1003-F1089 HydrophobicContact CG1-CZ 3.9Å; V1003-F1089 HydrophobicContact CG2-CE1 4.29Å; V1003-F1089 HydrophobicContact CG2-CE2 3.94Å; V1003-F1089 HydrophobicContact CG2-CZ 3.57Å; V1003-F1091 HydrophobicContact CG2-CE2 4.43Å
1004	L	92	Very high	91.5	Very high	55 Å²	55	64.4 Å²	64.4	29%	0.288	34%	0.341	S	S	.	.	H	α-helix	trans	-63.7	-23.4	-178	-69.5	178.4	0	0	0	113.8	V957 A994 L1000 W1037	V957-L1004 HydrophobicContact CG1-CD2 4.19Å; A994-L1004 HydrophobicContact CB-CD1 3.78Å; L1000-L1004 HydrophobicContact CD1-CD1 4.36Å; L1000-L1004 HydrophobicContact CD1-CG 4.14Å; L1000-L1004 HydrophobicContact CG-CD1 4.26Å; L1000-L1004 HydrophobicContact CG-CG 4.44Å; L1000-L1004 WeakPolarHBondContact O-CG 3.28Å; L1000-L1004 PolarHBondContact O-N 3.39Å; L1004-W1037 HydrophobicContact CD2-CZ2 4.01Å
1005	K	91.3	Very high	91.1	Very high	142 Å²	142	64.8 Å²	64.8	62%	0.617	34%	0.342	S	S	*	.	H	α-helix	trans	-91.5	-33.7	179.5	-74.6	173.2	179.6	165.2	0	113.9	D1001 F1002 V1003	D1001-K1005 WeakPolarHBondContact O-CB 3.24Å; D1001-K1005 VanDerWaalsContact O-CG 3.31Å; D1001-K1005 WeakPolarHBondContact O-CG 3.45Å; D1001-K1005 PolarHBondContact O-N 2.89Å; D1001-K1005 WeakPolarHBondContact OD1-CE 3.42Å; D1001-K1005 IonicContact OD1-NZ 3.58Å; D1001-K1005 PolarHBondContact OD1-NZ 2.9Å; D1001-K1005 WeakPolarHBondContact OD2-CE 3.43Å; D1001-K1005 IonicContact OD2-NZ 2.79Å; D1001-K1005 PolarHBondContact OD2-NZ 3.46Å; F1002-K1005 PolarHBondContact O-N 3.48Å; V1003-K1005 PolarHBondContact O-N 2.94Å; V1003-K1005 VanDerWaalsContact O-N 3.16Å
1006	N	93.1	Very high	90.7	Very high	92 Å²	92	62.9 Å²	62.9	49%	0.492	33%	0.332	S	S	.	.	H	α-helix	trans	-118.8	-17.3	-166.4	-58.5	-83.1	0	0	0	113.9	F1002 V1003 V1008	F1002-N1006 WeakPolarHBondContact CD2-ND2 3.49Å; F1002-N1006 HydrophobicContact CE2-CB 4.22Å; F1002-N1006 WeakPolarHBondContact CE2-ND2 3.5Å; F1002-N1006 HydrophobicContact CZ-CB 4.22Å; F1002-N1006 WeakPolarHBondContact O-CB 3.45Å; F1002-N1006 PolarHBondContact O-N 3.46Å; F1002-N1006 PolarHBondContact O-ND2 2.95Å; V1003-N1006 PolarHBondContact O-N 3.01Å; N1006-V1008 PolarHBondContact O-N 2.94Å
1007	A	91.7	Very high	90.4	Very high	22 Å²	22	61 Å²	61	18%	0.182	33%	0.325	C	S	.	.			trans	-68.9	130.5	176.5	0	0	0	0	0	110.2	V1003 W1037 W1038 L1039	V1003-A1007 HydrophobicContact CG1-CB 4.12Å; V1003-A1007 WeakPolarHBondContact O-CB 3.48Å; V1003-A1007 PolarHBondContact O-N 3.22Å; A1007-W1037 HydrophobicContact CB-CB 3.74Å; A1007-W1037 HydrophobicContact CB-CG 3.91Å; A1007-W1038 WeakPolarHBondContact CA-O 3.48Å; A1007-L1039 HydrophobicContact CB-CD2 3.79Å; A1007-L1039 HydrophobicContact CB-CG 4.47Å
1008	V	90	Very high	89.9	Confident	88 Å²	88	60.3 Å²	60.3	53%	0.533	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-64.9	140.4	156.4	-178.7	0	0	0	0	106.2	N1006 W1037 W1038	N1006-V1008 PolarHBondContact O-N 2.94Å; V1008-W1037 CarbonylContact O-C 3.43Å; V1008-W1037 WeakPolarHBondContact O-CA 2.93Å; V1008-W1038 HydrophobicContact CB-CB 4.42Å; V1008-W1038 PolarHBondContact N-O 3Å; V1008-W1038 PolarHBondContact O-N 2.95Å
1009	G	87.5	Confident	89.4	Confident	21 Å²	21	62.5 Å²	62.5	22%	0.216	32%	0.318	C	S	.	.	S	Bend	trans	-60.3	-148.8	171.7	0	0	0	0	0	112.7	T958 K1011 D1036	T958-G1009 WeakPolarHBondContact O-CA 3.48Å; G1009-K1011 PolarHBondContact O-N 3.34Å; G1009-D1036 CarbonylContact C-O 3.58Å; G1009-D1036 WeakPolarHBondContact CA-O 3.32Å
1010	Q	88	Confident	88.4	Confident	42 Å²	42	62.4 Å²	62.4	20%	0.196	32%	0.319	C	S	.	.	S	Bend	trans	-52.7	116.1	-171.6	-72	-173.6	5.2	0	0	113.9	D954 T958 E959 F1035 D1036	D954-Q1010 PolarHBondContact OD2-NE2 3.16Å; D954-Q1010 VanDerWaalsContact OD2-NE2 3.09Å; T958-Q1010 PolarHBondContact O-N 3.37Å; E959-Q1010 HydrophobicContact CG-CB 4.06Å; E959-Q1010 HydrophobicContact CG-CG 3.66Å; E959-Q1010 PolarHBondContact OE1-OE1 3.35Å; E959-Q1010 PolarHBondContact OE2-NE2 3.24Å; E959-Q1010 PolarHBondContact OE2-OE1 3.47Å; Q1010-F1035 CarbonylContact C-O 3.57Å; Q1010-F1035 VanDerWaalsContact CA-O 3.26Å; Q1010-F1035 WeakPolarHBondContact CA-O 3.04Å; Q1010-D1036 PolarHBondContact N-O 3.45Å
1011	K	89.3	Confident	87.2	Confident	90 Å²	90	69.1 Å²	69.1	39%	0.391	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	124.2	-178.7	-170.9	69.6	176.6	-177.4	0	110.8	G1009 F1013 K1034 F1035 W1038	G1009-K1011 PolarHBondContact O-N 3.34Å; K1011-F1013 HydrophobicContact CB-CE2 4.43Å; K1011-F1013 HydrophobicContact CG-CD2 4.37Å; K1011-F1013 HydrophobicContact CG-CE2 3.62Å; K1011-F1013 HydrophobicContact CG-CZ 4.07Å; K1011-K1034 CarbonylContact O-C 3.55Å; K1011-K1034 WeakPolarHBondContact O-CA 2.94Å; K1011-F1035 PolarHBondContact N-O 3.43Å; K1011-F1035 PolarHBondContact O-N 2.96Å; K1011-W1038 HydrophobicContact CB-CB 3.51Å; K1011-W1038 HydrophobicContact CB-CG 3.93Å; K1011-W1038 HydrophobicContact CG-CB 3.94Å; K1011-W1038 HydrophobicContact CG-CD2 4.25Å; K1011-W1038 HydrophobicContact CG-CG 3.78Å
1012	T	89.9	Confident	85.5	Confident	57 Å²	57	73.4 Å²	73.4	35%	0.35	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	134.8	178.7	-58.3	0	0	0	0	111.2	I1014 R1032 C1033	T1012-I1014 HydrophobicContact CG2-CG1 4.4Å; T1012-R1032 HydrophobicContact CG2-CG 3.47Å; T1012-R1032 VanDerWaalsContact CG2-CG 3.47Å; T1012-C1033 CarbonylContact C-O 3.52Å; T1012-C1033 WeakPolarHBondContact CA-O 2.78Å
1013	F	88.3	Confident	83.6	Confident	23 Å²	23	77 Å²	77	10%	0.101	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	145.4	169	-68.6	-95.9	0	0	0	109.9	K1011 R1032 C1033 F1035 W1038 L1076 T1077 I1080 Y1084	K1011-F1013 HydrophobicContact CB-CE2 4.43Å; K1011-F1013 HydrophobicContact CG-CD2 4.37Å; K1011-F1013 HydrophobicContact CG-CE2 3.62Å; K1011-F1013 HydrophobicContact CG-CZ 4.07Å; F1013-R1032 VanDerWaalsContact O-CA 3.3Å; F1013-R1032 WeakPolarHBondContact O-CA 3.46Å; F1013-C1033 PolarHBondContact N-O 2.81Å; F1013-C1033 PolarHBondContact O-N 2.88Å; F1013-F1035 AromaticContact CD2-CD2 3.76Å; F1013-F1035 HydrophobicContact CD2-CD2 3.76Å; F1013-F1035 AromaticContact CD2-CE2 3.61Å; F1013-F1035 HydrophobicContact CD2-CE2 3.61Å; F1013-F1035 AromaticContact CE2-CD2 3.83Å; F1013-F1035 HydrophobicContact CE2-CD2 3.83Å; F1013-F1035 AromaticContact CE2-CE2 3.86Å; F1013-F1035 HydrophobicContact CE2-CE2 3.86Å; F1013-W1038 HydrophobicContact CD2-CZ3 4.49Å; F1013-W1038 HydrophobicContact CE1-CH2 4.26Å; F1013-W1038 HydrophobicContact CE1-CZ2 4.1Å; F1013-W1038 AromaticContact CE2-CD2 3.73Å; F1013-W1038 HydrophobicContact CE2-CD2 3.73Å; F1013-W1038 AromaticContact CE2-CE2 3.89Å; F1013-W1038 AromaticContact CE2-CE3 3.55Å; F1013-W1038 HydrophobicContact CE2-CE3 3.55Å; F1013-W1038 AromaticContact CE2-CH2 3.74Å; F1013-W1038 HydrophobicContact CE2-CH2 3.74Å; F1013-W1038 AromaticContact CE2-CZ2 3.92Å; F1013-W1038 HydrophobicContact CE2-CZ2 3.92Å; F1013-W1038 AromaticContact CE2-CZ3 3.54Å; F1013-W1038 HydrophobicContact CE2-CZ3 3.54Å; F1013-W1038 AromaticContact CZ-CD2 3.78Å; F1013-W1038 HydrophobicContact CZ-CD2 3.78Å; F1013-W1038 AromaticContact CZ-CE2 3.42Å; F1013-W1038 VanDerWaalsContact CZ-CE2 3.42Å; F1013-W1038 AromaticContact CZ-CE3 3.94Å; F1013-W1038 HydrophobicContact CZ-CE3 3.94Å; F1013-W1038 AromaticContact CZ-CH2 3.45Å; F1013-W1038 HydrophobicContact CZ-CH2 3.45Å; F1013-W1038 VanDerWaalsContact CZ-CH2 3.45Å; F1013-W1038 AromaticContact CZ-CZ2 3.26Å; F1013-W1038 HydrophobicContact CZ-CZ2 3.26Å; F1013-W1038 AromaticContact CZ-CZ3 3.77Å; F1013-W1038 HydrophobicContact CZ-CZ3 3.77Å; F1013-L1076 HydrophobicContact CB-CD2 4.18Å; F1013-T1077 HydrophobicContact CB-CG2 4.31Å; F1013-T1077 HydrophobicContact CD1-CG2 4.17Å; F1013-T1077 HydrophobicContact CD2-CG2 3.85Å; F1013-T1077 HydrophobicContact CE2-CG2 4.25Å; F1013-T1077 HydrophobicContact CG-CG2 3.83Å; F1013-I1080 HydrophobicContact CB-CD1 3.76Å; F1013-I1080 HydrophobicContact CD1-CD1 4.15Å; F1013-I1080 HydrophobicContact CG-CD1 4.41Å; F1013-Y1084 HydrophobicContact CE1-CD2 4.11Å; F1013-Y1084 HydrophobicContact CE1-CE2 4.02Å
1014	I	87.3	Confident	81.9	Confident	94 Å²	94	79.7 Å²	79.7	48%	0.482	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	117.3	176.5	-58.5	175.9	0	0	0	106.6	T1012 P1016 V1031 R1032	T1012-I1014 HydrophobicContact CG2-CG1 4.4Å; I1014-P1016 WeakPolarHBondContact O-CD 3.21Å; I1014-V1031 WeakPolarHBondContact CA-O 3.28Å; I1014-R1032 HydrophobicContact CG1-CB 4.49Å; I1014-R1032 HydrophobicContact CG1-CG 4.38Å
1015	N	85	Confident	80.1	Confident	15 Å²	15	84.1 Å²	84.1	8%	0.08	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	106.4	165.2	-176.6	-9.1	0	0	0	107.7	H1017 M1018 P1030 V1031 L1076 S1079 I1080	N1015-H1017 VanDerWaalsContact C-N 3.27Å; N1015-H1017 PolarHBondContact O-N 2.89Å; N1015-H1017 PolarHBondContact OD1-N 3.32Å; N1015-M1018 PolarHBondContact OD1-N 2.99Å; N1015-P1030 WeakPolarHBondContact O-CA 3.49Å; N1015-V1031 HydrophobicContact CB-CG2 3.83Å; N1015-V1031 PolarHBondContact N-O 3.26Å; N1015-V1031 PolarHBondContact O-N 2.83Å; N1015-L1076 HydrophobicContact CB-CD2 4.13Å; N1015-L1076 HydrophobicContact CB-CG 4.2Å; N1015-S1079 PolarHBondContact ND2-OG 3.05Å; N1015-I1080 HydrophobicContact CB-CD1 3.99Å; N1015-I1080 HydrophobicContact CB-CG1 3.75Å
1016	P	83.4	Confident	79.5	Confident	73 Å²	73	84.3 Å²	84.3	47%	0.474	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	-18.1	-179.3	27	-32	0	0	0	114	I1014	I1014-P1016 WeakPolarHBondContact O-CD 3.21Å
1017	H	84.9	Confident	78.9	Confident	119 Å²	119	83 Å²	83	55%	0.551	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.7	43.6	-170.6	-64.7	-72	0	0	0	112	N1015 K1019 E1028	N1015-H1017 VanDerWaalsContact C-N 3.27Å; N1015-H1017 PolarHBondContact O-N 2.89Å; N1015-H1017 PolarHBondContact OD1-N 3.32Å; H1017-K1019 PolarHBondContact O-N 3.2Å; H1017-E1028 IonicContact CG-OE2 3.7Å; H1017-E1028 IonicContact ND1-OE2 3.88Å; H1017-E1028 PolarHBondContact ND1-OE2 3.19Å
1018	M	82.9	Confident	78.5	Confident	23 Å²	23	86.5 Å²	86.5	11%	0.113	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	111.8	176.3	179.2	67.2	99.9	0	0	109.2	N1015 M1020 E1028 L1029 V1031 L1076	N1015-M1018 PolarHBondContact OD1-N 2.99Å; M1018-M1020 HydrophobicContact CB-CE 4.35Å; M1018-M1020 HydrophobicContact CG-CE 3.82Å; M1018-M1020 HydrophobicContact CG-CG 4.25Å; M1018-M1020 PolarHBondContact O-N 2.79Å; M1018-E1028 WeakPolarHBondContact O-CA 3.32Å; M1018-L1029 WeakPolarHBondContact CB-O 3.25Å; M1018-L1029 PolarHBondContact N-O 2.79Å; M1018-L1029 PolarHBondContact O-N 2.95Å; M1018-V1031 HydrophobicContact CB-CG1 4.29Å; M1018-V1031 HydrophobicContact CB-CG2 3.41Å; M1018-V1031 VanDerWaalsContact CB-CG2 3.41Å; M1018-V1031 HydrophobicContact CE-CG2 4.22Å; M1018-V1031 HydrophobicContact CG-CG2 3.93Å; M1018-L1076 HydrophobicContact CE-CB 3.97Å; M1018-L1076 HydrophobicContact CE-CG 4.1Å
1019	K	81.2	Confident	77.8	Confident	150 Å²	150	86 Å²	86	65%	0.652	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.1	129.1	172.9	-67.2	-173.3	177.7	-168.3	0	109.6	H1017 E1028	H1017-K1019 PolarHBondContact O-N 3.2Å; K1019-E1028 WeakPolarHBondContact CE-OE1 3.41Å; K1019-E1028 HydrophobicContact CG-CG 3.89Å
1020	M	74.8	Confident	77.6	Confident	54 Å²	54	89.8 Å²	89.8	27%	0.266	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	144	176.1	-61.4	-170.9	-175.2	0	0	108.9	M1018 E1026 F1027 L1029 V1031	M1018-M1020 HydrophobicContact CB-CE 4.35Å; M1018-M1020 HydrophobicContact CG-CE 3.82Å; M1018-M1020 HydrophobicContact CG-CG 4.25Å; M1018-M1020 PolarHBondContact O-N 2.79Å; M1020-E1026 WeakPolarHBondContact O-CA 3.27Å; M1020-F1027 HydrophobicContact CB-CD2 4.43Å; M1020-F1027 HydrophobicContact CB-CE1 4Å; M1020-F1027 HydrophobicContact CB-CE2 3.92Å; M1020-F1027 HydrophobicContact CB-CZ 3.68Å; M1020-F1027 PolarHBondContact N-O 2.83Å; M1020-F1027 WeakPolarHBondContact O-CD1 3.48Å; M1020-F1027 PolarHBondContact O-N 2.98Å; M1020-F1027 VanDerWaalsContact O-O 3.11Å; M1020-F1027 HydrophobicContact SD-CE2 4.22Å; M1020-F1027 HydrophobicContact SD-CZ 4.4Å; M1020-L1029 HydrophobicContact CE-CB 4.22Å; M1020-L1029 HydrophobicContact CE-CD1 4.43Å; M1020-L1029 HydrophobicContact SD-CB 4.44Å; M1020-L1029 HydrophobicContact SD-CD1 3.94Å; M1020-V1031 HydrophobicContact CE-CG1 3.44Å; M1020-V1031 VanDerWaalsContact CE-CG1 3.44Å
1021	E	68.3	Low	77.4	Confident	142 Å²	142	88.5 Å²	88.5	66%	0.664	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.9	129	172	-168.2	-165.2	147.5	0	0	108.7	G1024 F1025	E1021-G1024 WeakPolarHBondContact OE1-CA 3.36Å; E1021-G1024 PolarHBondContact OE1-N 3.3Å; E1021-F1025 WeakPolarHBondContact CA-O 3.27Å
1022	Y	58.5	Low	77.3	Confident	143 Å²	143	92 Å²	92	56%	0.561	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.6	113.4	171.2	-176.5	-96.9	0	0	0	109.3	G1024 F1025	Y1022-G1024 VanDerWaalsContact C-N 3.32Å; Y1022-G1024 PolarHBondContact O-N 2.85Å; Y1022-F1025 PolarHBondContact N-O 3.32Å; Y1022-F1025 WeakPolarHBondContact O-CB 3.46Å; Y1022-F1025 PolarHBondContact O-N 3.35Å
1023	Q	54.4	Low	77.2	Confident	171 Å²	171	89.4 Å²	89.4	80%	0.799	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	42.8	-179.3	-58.5	-174.8	-30.5	0	0	113.2	F1025	Q1023-F1025 PolarHBondContact O-N 2.84Å
1024	G	57.7	Low	77.3	Confident	58 Å²	58	92.1 Å²	92.1	60%	0.598	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	0	-178.3	0	0	0	0	0	115.1	E1021 Y1022	E1021-G1024 WeakPolarHBondContact OE1-CA 3.36Å; E1021-G1024 PolarHBondContact OE1-N 3.3Å; Y1022-G1024 VanDerWaalsContact C-N 3.32Å; Y1022-G1024 PolarHBondContact O-N 2.85Å
1025	F	54.2	Low	77.6	Confident	148 Å²	148	87.7 Å²	87.7	65%	0.649	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.6	114.7	171.3	-169.8	-102.4	0	0	0	109.6	E1021 Y1022 Q1023 F1027	E1021-F1025 WeakPolarHBondContact CA-O 3.27Å; Y1022-F1025 PolarHBondContact N-O 3.32Å; Y1022-F1025 WeakPolarHBondContact O-CB 3.46Å; Y1022-F1025 PolarHBondContact O-N 3.35Å; Q1023-F1025 PolarHBondContact O-N 2.84Å; F1025-F1027 HydrophobicContact CD1-CB 4.14Å; F1025-F1027 AromaticContact CD1-CD1 3.92Å; F1025-F1027 HydrophobicContact CD1-CD1 3.92Å; F1025-F1027 HydrophobicContact CD1-CG 4.4Å; F1025-F1027 HydrophobicContact CE1-CB 3.9Å; F1025-F1027 HydrophobicContact CE1-CD1 4.48Å; F1025-F1027 WeakPolarHBondContact O-CD1 3.49Å
1026	E	79.7	Confident	78	Confident	146 Å²	146	87.5 Å²	87.5	68%	0.682	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	130.6	170.9	-68.1	-171.9	171.8	0	0	110.3	M1020	M1020-E1026 WeakPolarHBondContact O-CA 3.27Å
1027	F	79	Confident	78.5	Confident	65 Å²	65	84.3 Å²	84.3	29%	0.285	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	159.8	173.9	61.8	-77.7	0	0	0	110.6	M1020 F1025 L1029	M1020-F1027 HydrophobicContact CB-CD2 4.43Å; M1020-F1027 HydrophobicContact CB-CE1 4Å; M1020-F1027 HydrophobicContact CB-CE2 3.92Å; M1020-F1027 HydrophobicContact CB-CZ 3.68Å; M1020-F1027 PolarHBondContact N-O 2.83Å; M1020-F1027 WeakPolarHBondContact O-CD1 3.48Å; M1020-F1027 PolarHBondContact O-N 2.98Å; M1020-F1027 VanDerWaalsContact O-O 3.11Å; M1020-F1027 HydrophobicContact SD-CE2 4.22Å; M1020-F1027 HydrophobicContact SD-CZ 4.4Å; F1025-F1027 HydrophobicContact CD1-CB 4.14Å; F1025-F1027 AromaticContact CD1-CD1 3.92Å; F1025-F1027 HydrophobicContact CD1-CD1 3.92Å; F1025-F1027 HydrophobicContact CD1-CG 4.4Å; F1025-F1027 HydrophobicContact CE1-CB 3.9Å; F1025-F1027 HydrophobicContact CE1-CD1 4.48Å; F1025-F1027 WeakPolarHBondContact O-CD1 3.49Å; F1027-L1029 HydrophobicContact CD2-CD1 4.21Å; F1027-L1029 HydrophobicContact CD2-CD2 4.44Å; F1027-L1029 HydrophobicContact CD2-CG 3.83Å; F1027-L1029 HydrophobicContact CE2-CD1 3.56Å; F1027-L1029 HydrophobicContact CE2-CG 3.71Å
1028	E	84.1	Confident	78.9	Confident	95 Å²	95	79.4 Å²	79.4	44%	0.444	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	138.4	176.7	-69.7	179.3	-178.2	0	0	110.4	H1017 M1018 K1019	H1017-E1028 IonicContact CG-OE2 3.7Å; H1017-E1028 IonicContact ND1-OE2 3.88Å; H1017-E1028 PolarHBondContact ND1-OE2 3.19Å; M1018-E1028 WeakPolarHBondContact O-CA 3.32Å; K1019-E1028 WeakPolarHBondContact CE-OE1 3.41Å; K1019-E1028 HydrophobicContact CG-CG 3.89Å
1029	L	75.8	Confident	79.4	Confident	77 Å²	77	79.9 Å²	79.9	40%	0.403	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	143.9	172.1	-73.7	179.8	0	0	0	111.8	M1018 M1020 F1027 V1031	M1018-L1029 WeakPolarHBondContact CB-O 3.25Å; M1018-L1029 PolarHBondContact N-O 2.79Å; M1018-L1029 PolarHBondContact O-N 2.95Å; M1020-L1029 HydrophobicContact CE-CB 4.22Å; M1020-L1029 HydrophobicContact CE-CD1 4.43Å; M1020-L1029 HydrophobicContact SD-CB 4.44Å; M1020-L1029 HydrophobicContact SD-CD1 3.94Å; F1027-L1029 HydrophobicContact CD2-CD1 4.21Å; F1027-L1029 HydrophobicContact CD2-CD2 4.44Å; F1027-L1029 HydrophobicContact CD2-CG 3.83Å; F1027-L1029 HydrophobicContact CE2-CD1 3.56Å; F1027-L1029 HydrophobicContact CE2-CG 3.71Å; L1029-V1031 PolarHBondContact O-N 2.77Å
1030	P	82.2	Confident	79.7	Confident	100 Å²	100	74.3 Å²	74.3	65%	0.649	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	123.8	167.7	29.6	-32.1	0	0	0	109.6	N1015	N1015-P1030 WeakPolarHBondContact O-CA 3.49Å
1031	V	84.1	Confident	80.4	Confident	15 Å²	15	77.7 Å²	77.7	9%	0.091	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	145.4	179.2	-67.7	0	0	0	0	110.4	I1014 N1015 M1018 M1020 L1029 W1072 L1076	I1014-V1031 WeakPolarHBondContact CA-O 3.28Å; N1015-V1031 HydrophobicContact CB-CG2 3.83Å; N1015-V1031 PolarHBondContact N-O 3.26Å; N1015-V1031 PolarHBondContact O-N 2.83Å; M1018-V1031 HydrophobicContact CB-CG1 4.29Å; M1018-V1031 HydrophobicContact CB-CG2 3.41Å; M1018-V1031 VanDerWaalsContact CB-CG2 3.41Å; M1018-V1031 HydrophobicContact CE-CG2 4.22Å; M1018-V1031 HydrophobicContact CG-CG2 3.93Å; M1020-V1031 HydrophobicContact CE-CG1 3.44Å; M1020-V1031 VanDerWaalsContact CE-CG1 3.44Å; L1029-V1031 PolarHBondContact O-N 2.77Å; V1031-W1072 HydrophobicContact CB-CH2 4.18Å; V1031-W1072 HydrophobicContact CB-CZ2 4.15Å; V1031-W1072 HydrophobicContact CG1-CH2 4.31Å; V1031-W1072 HydrophobicContact CG1-CZ2 3.98Å; V1031-L1076 HydrophobicContact CB-CD1 3.62Å; V1031-L1076 HydrophobicContact CG2-CD1 3.28Å; V1031-L1076 HydrophobicContact CG2-CG 3.82Å
1032	R	88.3	Confident	81.5	Confident	165 Å²	165	72.8 Å²	72.8	62%	0.623	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	140.5	178.6	174.7	-172.9	-85	-156.2	-4	109.4	T1012 F1013 I1014	T1012-R1032 HydrophobicContact CG2-CG 3.47Å; T1012-R1032 VanDerWaalsContact CG2-CG 3.47Å; F1013-R1032 VanDerWaalsContact O-CA 3.3Å; F1013-R1032 WeakPolarHBondContact O-CA 3.46Å; I1014-R1032 HydrophobicContact CG1-CB 4.49Å; I1014-R1032 HydrophobicContact CG1-CG 4.38Å
1033	C	88.1	Confident	82.9	Confident	1 Å²	1	66 Å²	66	1%	0.007	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	154.2	164.6	83	0	0	0	0	111.2	T1012 F1013 F1035 Y1073 L1076	T1012-C1033 CarbonylContact C-O 3.52Å; T1012-C1033 WeakPolarHBondContact CA-O 2.78Å; F1013-C1033 PolarHBondContact N-O 2.81Å; F1013-C1033 PolarHBondContact O-N 2.88Å; C1033-F1035 WeakPolarHBondContact SG-CE2 3.03Å; C1033-Y1073 HydrophobicContact CB-CD1 3.82Å; C1033-Y1073 HydrophobicContact CB-CD2 3.42Å; C1033-Y1073 VanDerWaalsContact CB-CD2 3.42Å; C1033-Y1073 HydrophobicContact CB-CE1 4.09Å; C1033-Y1073 HydrophobicContact CB-CE2 3.77Å; C1033-Y1073 HydrophobicContact CB-CG 3.51Å; C1033-L1076 HydrophobicContact CB-CD1 4.01Å; C1033-L1076 HydrophobicContact CB-CD2 4.12Å; C1033-L1076 HydrophobicContact CB-CG 4.49Å
1034	K	90	Very high	84.8	Confident	80 Å²	80	57.9 Å²	57.9	35%	0.348	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	114	-175.1	-178.6	-169	173.3	-167.6	0	110	K1011 Y1073	K1011-K1034 CarbonylContact O-C 3.55Å; K1011-K1034 WeakPolarHBondContact O-CA 2.94Å; K1034-Y1073 VanDerWaalsContact N-CE2 3.32Å; K1034-Y1073 VanDerWaalsContact O-CE2 3.22Å; K1034-Y1073 WeakPolarHBondContact O-CE2 3.23Å
1035	F	92.4	Very high	86.5	Confident	1 Å²	1	55.6 Å²	55.6	0%	0.004	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	140.1	174	-59.6	-93.8	0	0	0	109.5	Q1010 K1011 F1013 C1033 W1037 W1038 G1043 Y1073 T1077 D1088	Q1010-F1035 CarbonylContact C-O 3.57Å; Q1010-F1035 VanDerWaalsContact CA-O 3.26Å; Q1010-F1035 WeakPolarHBondContact CA-O 3.04Å; K1011-F1035 PolarHBondContact N-O 3.43Å; K1011-F1035 PolarHBondContact O-N 2.96Å; F1013-F1035 AromaticContact CD2-CD2 3.76Å; F1013-F1035 HydrophobicContact CD2-CD2 3.76Å; F1013-F1035 AromaticContact CD2-CE2 3.61Å; F1013-F1035 HydrophobicContact CD2-CE2 3.61Å; F1013-F1035 AromaticContact CE2-CD2 3.83Å; F1013-F1035 HydrophobicContact CE2-CD2 3.83Å; F1013-F1035 AromaticContact CE2-CE2 3.86Å; F1013-F1035 HydrophobicContact CE2-CE2 3.86Å; C1033-F1035 WeakPolarHBondContact SG-CE2 3.03Å; F1035-W1037 VanDerWaalsContact C-N 3.33Å; F1035-W1037 WeakPolarHBondContact CB-O 3.3Å; F1035-W1038 HydrophobicContact CB-CE3 4.41Å; F1035-W1038 HydrophobicContact CD1-CE3 4.49Å; F1035-W1038 AromaticContact CD2-CE3 3.76Å; F1035-W1038 HydrophobicContact CD2-CE3 3.76Å; F1035-W1038 AromaticContact CD2-CZ3 3.89Å; F1035-W1038 HydrophobicContact CD2-CZ3 3.89Å; F1035-W1038 HydrophobicContact CE1-CZ3 4.35Å; F1035-W1038 HydrophobicContact CE2-CE3 4.09Å; F1035-W1038 AromaticContact CE2-CZ3 3.71Å; F1035-W1038 HydrophobicContact CE2-CZ3 3.71Å; F1035-W1038 AromaticContact CG-CE3 3.98Å; F1035-W1038 HydrophobicContact CG-CE3 3.98Å; F1035-W1038 HydrophobicContact CG-CZ3 4.31Å; F1035-W1038 AromaticContact CZ-CZ3 3.94Å; F1035-W1038 HydrophobicContact CZ-CZ3 3.94Å; F1035-G1043 VanDerWaalsContact CD1-CA 3.45Å; F1035-Y1073 HydrophobicContact CE1-CD2 4.43Å; F1035-Y1073 HydrophobicContact CZ-CD2 4.42Å; F1035-T1077 HydrophobicContact CE2-CG2 3.34Å; F1035-T1077 HydrophobicContact CZ-CG2 3.48Å; F1035-T1077 VanDerWaalsContact CZ-CG2 3.48Å; F1035-D1088 WeakPolarHBondContact CE1-OD2 3.34Å
1036	D	93.7	Very high	88.4	Confident	12 Å²	12	48.9 Å²	48.9	6%	0.064	24%	0.241	C	C	.	.	S	Bend	trans	-73.3	-32.6	174	-65.1	-20.2	0	0	0	110.8	T958 G1009 Q1010 G1044 L1046	T958-D1036 WeakPolarHBondContact CB-O 3.29Å; T958-D1036 HydrophobicContact CG2-CB 3.93Å; T958-D1036 WeakPolarHBondContact CG2-O 3.44Å; G1009-D1036 CarbonylContact C-O 3.58Å; G1009-D1036 WeakPolarHBondContact CA-O 3.32Å; Q1010-D1036 PolarHBondContact N-O 3.45Å; D1036-G1044 PolarHBondContact N-O 3.37Å; D1036-G1044 VanDerWaalsContact N-O 3.1Å; D1036-L1046 HydrophobicContact CB-CB 4.24Å; D1036-L1046 PolarHBondContact OD2-N 3.32Å
1037	W	94.1	Very high	89	Confident	6 Å²	6	44.4 Å²	44.4	2%	0.023	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	138.5	170.8	-71.3	-52.6	0	0	0	111.6	V957 V1003 L1004 A1007 V1008 F1035 G1043 G1044 L1046 F1089 F1091	V957-W1037 HydrophobicContact CG1-CH2 4.49Å; V957-W1037 HydrophobicContact CG1-CZ2 3.48Å; V957-W1037 VanDerWaalsContact CG1-CZ2 3.48Å; V1003-W1037 HydrophobicContact CG1-CB 4.26Å; V1003-W1037 HydrophobicContact CG1-CD2 3.65Å; V1003-W1037 HydrophobicContact CG1-CE3 3.99Å; V1003-W1037 HydrophobicContact CG1-CG 3.81Å; V1003-W1037 HydrophobicContact CG1-CZ2 4.39Å; V1003-W1037 HydrophobicContact CG1-CZ3 4.49Å; L1004-W1037 HydrophobicContact CD2-CZ2 4.01Å; A1007-W1037 HydrophobicContact CB-CB 3.74Å; A1007-W1037 HydrophobicContact CB-CG 3.91Å; V1008-W1037 CarbonylContact O-C 3.43Å; V1008-W1037 WeakPolarHBondContact O-CA 2.93Å; F1035-W1037 VanDerWaalsContact C-N 3.33Å; F1035-W1037 WeakPolarHBondContact CB-O 3.3Å; W1037-G1043 CarbonylContact O-C 3.51Å; W1037-G1043 WeakPolarHBondContact O-CA 3.31Å; W1037-G1044 PolarHBondContact N-O 3.37Å; W1037-G1044 PolarHBondContact O-N 3.07Å; W1037-L1046 HydrophobicContact CE3-CB 4.33Å; W1037-L1046 HydrophobicContact CH2-CB 3.91Å; W1037-L1046 HydrophobicContact CH2-CD1 3.73Å; W1037-L1046 HydrophobicContact CH2-CD2 4.27Å; W1037-L1046 HydrophobicContact CH2-CG 4.17Å; W1037-L1046 HydrophobicContact CZ2-CB 4.41Å; W1037-L1046 HydrophobicContact CZ2-CD1 4.46Å; W1037-L1046 HydrophobicContact CZ2-CD2 4.24Å; W1037-L1046 HydrophobicContact CZ3-CB 3.82Å; W1037-L1046 HydrophobicContact CZ3-CD1 4.26Å; W1037-F1089 HydrophobicContact CB-CZ 4.31Å; W1037-F1089 AromaticContact CE3-CE2 3.71Å; W1037-F1089 HydrophobicContact CE3-CE2 3.71Å; W1037-F1089 HydrophobicContact CE3-CZ 4.32Å; W1037-F1089 HydrophobicContact CZ3-CE2 4.16Å; W1037-F1091 HydrophobicContact CH2-CB 4.14Å; W1037-F1091 HydrophobicContact CH2-CD2 4.42Å; W1037-F1091 HydrophobicContact CZ3-CB 3.89Å; W1037-F1091 AromaticContact CZ3-CD2 3.94Å; W1037-F1091 HydrophobicContact CZ3-CD2 3.94Å; W1037-F1091 HydrophobicContact CZ3-CG 4.36Å
1038	W	94	Very high	89.6	Confident	16 Å²	16	42.5 Å²	42.5	6%	0.061	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	120.8	175	-174.7	-103.8	0	0	0	111.9	A1007 V1008 K1011 F1013 F1035 G1040 F1042 T1077 Y1084	A1007-W1038 WeakPolarHBondContact CA-O 3.48Å; V1008-W1038 HydrophobicContact CB-CB 4.42Å; V1008-W1038 PolarHBondContact N-O 3Å; V1008-W1038 PolarHBondContact O-N 2.95Å; K1011-W1038 HydrophobicContact CB-CB 3.51Å; K1011-W1038 HydrophobicContact CB-CG 3.93Å; K1011-W1038 HydrophobicContact CG-CB 3.94Å; K1011-W1038 HydrophobicContact CG-CD2 4.25Å; K1011-W1038 HydrophobicContact CG-CG 3.78Å; F1013-W1038 HydrophobicContact CD2-CZ3 4.49Å; F1013-W1038 HydrophobicContact CE1-CH2 4.26Å; F1013-W1038 HydrophobicContact CE1-CZ2 4.1Å; F1013-W1038 AromaticContact CE2-CD2 3.73Å; F1013-W1038 HydrophobicContact CE2-CD2 3.73Å; F1013-W1038 AromaticContact CE2-CE2 3.89Å; F1013-W1038 AromaticContact CE2-CE3 3.55Å; F1013-W1038 HydrophobicContact CE2-CE3 3.55Å; F1013-W1038 AromaticContact CE2-CH2 3.74Å; F1013-W1038 HydrophobicContact CE2-CH2 3.74Å; F1013-W1038 AromaticContact CE2-CZ2 3.92Å; F1013-W1038 HydrophobicContact CE2-CZ2 3.92Å; F1013-W1038 AromaticContact CE2-CZ3 3.54Å; F1013-W1038 HydrophobicContact CE2-CZ3 3.54Å; F1013-W1038 AromaticContact CZ-CD2 3.78Å; F1013-W1038 HydrophobicContact CZ-CD2 3.78Å; F1013-W1038 AromaticContact CZ-CE2 3.42Å; F1013-W1038 VanDerWaalsContact CZ-CE2 3.42Å; F1013-W1038 AromaticContact CZ-CE3 3.94Å; F1013-W1038 HydrophobicContact CZ-CE3 3.94Å; F1013-W1038 AromaticContact CZ-CH2 3.45Å; F1013-W1038 HydrophobicContact CZ-CH2 3.45Å; F1013-W1038 VanDerWaalsContact CZ-CH2 3.45Å; F1013-W1038 AromaticContact CZ-CZ2 3.26Å; F1013-W1038 HydrophobicContact CZ-CZ2 3.26Å; F1013-W1038 AromaticContact CZ-CZ3 3.77Å; F1013-W1038 HydrophobicContact CZ-CZ3 3.77Å; F1035-W1038 HydrophobicContact CB-CE3 4.41Å; F1035-W1038 HydrophobicContact CD1-CE3 4.49Å; F1035-W1038 AromaticContact CD2-CE3 3.76Å; F1035-W1038 HydrophobicContact CD2-CE3 3.76Å; F1035-W1038 AromaticContact CD2-CZ3 3.89Å; F1035-W1038 HydrophobicContact CD2-CZ3 3.89Å; F1035-W1038 HydrophobicContact CE1-CZ3 4.35Å; F1035-W1038 HydrophobicContact CE2-CE3 4.09Å; F1035-W1038 AromaticContact CE2-CZ3 3.71Å; F1035-W1038 HydrophobicContact CE2-CZ3 3.71Å; F1035-W1038 AromaticContact CG-CE3 3.98Å; F1035-W1038 HydrophobicContact CG-CE3 3.98Å; F1035-W1038 HydrophobicContact CG-CZ3 4.31Å; F1035-W1038 AromaticContact CZ-CZ3 3.94Å; F1035-W1038 HydrophobicContact CZ-CZ3 3.94Å; W1038-G1040 WeakPolarHBondContact CZ2-O 3.44Å; W1038-G1040 VanDerWaalsContact NE1-CA 3.31Å; W1038-G1040 PolarHBondContact NE1-O 2.98Å; W1038-F1042 VanDerWaalsContact CZ3-C 3.48Å; W1038-T1077 HydrophobicContact CH2-CG2 4.37Å; W1038-T1077 HydrophobicContact CZ3-CG2 4.34Å; W1038-Y1084 HydrophobicContact CH2-CD1 4.3Å; W1038-Y1084 HydrophobicContact CH2-CD2 4.37Å; W1038-Y1084 HydrophobicContact CH2-CG 4.04Å; W1038-Y1084 HydrophobicContact CZ2-CD1 4.03Å; W1038-Y1084 HydrophobicContact CZ2-CD2 4.32Å; W1038-Y1084 HydrophobicContact CZ2-CE1 4.18Å; W1038-Y1084 HydrophobicContact CZ2-CE2 4.49Å; W1038-Y1084 HydrophobicContact CZ2-CG 4.11Å
1039	L	92.6	Very high	89.9	Confident	32 Å²	32	38 Å²	38	17%	0.168	19%	0.191	C	C	.	.			trans	-97.8	6.4	-176.4	-67.3	172.6	0	0	0	114	F999 F1002 V1003 A1007 F1042 F1089	F999-L1039 HydrophobicContact CE2-CD1 4.43Å; F999-L1039 HydrophobicContact CZ-CD1 4.32Å; F1002-L1039 HydrophobicContact CD1-CD2 4.17Å; F1002-L1039 HydrophobicContact CE1-CD1 4.28Å; F1002-L1039 HydrophobicContact CE1-CD2 3.82Å; V1003-L1039 HydrophobicContact CG2-CD1 4.2Å; V1003-L1039 HydrophobicContact CG2-CD2 4.48Å; A1007-L1039 HydrophobicContact CB-CD2 3.79Å; A1007-L1039 HydrophobicContact CB-CG 4.47Å; L1039-F1042 HydrophobicContact CB-CE1 4.42Å; L1039-F1042 WeakPolarHBondContact CB-O 3.44Å; L1039-F1042 HydrophobicContact CD1-CD2 4.33Å; L1039-F1042 HydrophobicContact CD1-CE1 3.99Å; L1039-F1042 HydrophobicContact CD1-CE2 3.62Å; L1039-F1042 HydrophobicContact CD1-CZ 3.4Å; L1039-F1042 VanDerWaalsContact CD1-CZ 3.4Å; L1039-F1042 PolarHBondContact N-O 2.74Å; L1039-F1089 HydrophobicContact CD1-CE1 3.77Å; L1039-F1089 HydrophobicContact CD1-CZ 4.22Å
1040	G	88.6	Confident	90.4	Very high	33 Å²	33	37.4 Å²	37.4	34%	0.34	20%	0.198	S	C	.	.	S	Bend	trans	104.3	-48.4	-179.2	0	0	0	0	0	113	W1038 Y1084	W1038-G1040 WeakPolarHBondContact CZ2-O 3.44Å; W1038-G1040 VanDerWaalsContact NE1-CA 3.31Å; W1038-G1040 PolarHBondContact NE1-O 2.98Å; G1040-Y1084 WeakPolarHBondContact O-CE1 3.37Å
1041	E	87.8	Confident	90.7	Very high	125 Å²	125	32.8 Å²	32.8	58%	0.584	17%	0.168	S	C	*	.	S	Bend	trans	-107.6	-29.7	178.6	-65.8	-177.2	165	0	0	113.2	Y1084 G1085	E1041-Y1084 WeakPolarHBondContact O-CA 3.39Å; E1041-Y1084 WeakPolarHBondContact O-CB 3.39Å; E1041-Y1084 WeakPolarHBondContact O-CD1 3.5Å; E1041-G1085 PolarHBondContact O-N 3.13Å
1042	F	91.8	Very high	90.9	Very high	39 Å²	39	34.3 Å²	34.3	17%	0.171	18%	0.178	C	C	.	.			trans	-143	164.3	177.5	66.6	-77.6	0	0	0	110.6	F999 W1038 L1039 Q1087 F1089	F999-F1042 HydrophobicContact CE2-CZ 4.23Å; F999-F1042 HydrophobicContact CZ-CE2 4.08Å; F999-F1042 HydrophobicContact CZ-CZ 4.18Å; W1038-F1042 VanDerWaalsContact CZ3-C 3.48Å; L1039-F1042 HydrophobicContact CB-CE1 4.42Å; L1039-F1042 WeakPolarHBondContact CB-O 3.44Å; L1039-F1042 HydrophobicContact CD1-CD2 4.33Å; L1039-F1042 HydrophobicContact CD1-CE1 3.99Å; L1039-F1042 HydrophobicContact CD1-CE2 3.62Å; L1039-F1042 HydrophobicContact CD1-CZ 3.4Å; L1039-F1042 VanDerWaalsContact CD1-CZ 3.4Å; L1039-F1042 PolarHBondContact N-O 2.74Å; F1042-Q1087 HydrophobicContact CB-CB 4.47Å; F1042-Q1087 WeakPolarHBondContact CB-O 3.31Å; F1042-Q1087 HydrophobicContact CD2-CB 4.1Å; F1042-Q1087 HydrophobicContact CG-CB 4.21Å; F1042-F1089 HydrophobicContact CD2-CD1 4.06Å; F1042-F1089 HydrophobicContact CD2-CE1 4.1Å; F1042-F1089 AromaticContact CE2-CD1 3.69Å; F1042-F1089 HydrophobicContact CE2-CD1 3.69Å; F1042-F1089 AromaticContact CE2-CE1 3.7Å; F1042-F1089 HydrophobicContact CE2-CE1 3.7Å
1043	G	89.1	Confident	91.1	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.01	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	-174.3	-179.9	0	0	0	0	0	113.4	F1035 W1037 F1089	F1035-G1043 VanDerWaalsContact CD1-CA 3.45Å; W1037-G1043 CarbonylContact O-C 3.51Å; W1037-G1043 WeakPolarHBondContact O-CA 3.31Å; G1043-F1089 WeakPolarHBondContact O-CD1 3.44Å; G1043-F1089 WeakPolarHBondContact O-CE1 3.31Å
1044	G	93	Very high	91.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	168.3	173.7	0	0	0	0	0	111.2	D1036 W1037 D1088 F1089	D1036-G1044 PolarHBondContact N-O 3.37Å; D1036-G1044 VanDerWaalsContact N-O 3.1Å; W1037-G1044 PolarHBondContact N-O 3.37Å; W1037-G1044 PolarHBondContact O-N 3.07Å; G1044-D1088 WeakPolarHBondContact CA-OD1 3.37Å; G1044-F1089 CarbonylContact C-O 3.48Å; G1044-F1089 WeakPolarHBondContact CA-O 3.43Å
1045	D	93.9	Very high	91.2	Very high	10 Å²	10	34.9 Å²	34.9	5%	0.053	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	141	-173	-171.1	88.8	0	0	0	110.3	K1047 R1070 F1089 I1090 F1091	D1045-K1047 IonicContact OD1-NZ 3.42Å; D1045-K1047 PolarHBondContact OD1-NZ 2.94Å; D1045-K1047 WeakPolarHBondContact OD2-CD 3.15Å; D1045-K1047 WeakPolarHBondContact OD2-CE 3.22Å; D1045-K1047 VanDerWaalsContact OD2-CG 3.3Å; D1045-K1047 WeakPolarHBondContact OD2-CG 3.33Å; D1045-K1047 IonicContact OD2-NZ 2.71Å; D1045-K1047 PolarHBondContact OD2-NZ 3.48Å; D1045-R1070 IonicContact OD1-NH1 2.6Å; D1045-R1070 PolarHBondContact OD1-NH1 3.32Å; D1045-F1089 PolarHBondContact N-O 3.31Å; D1045-I1090 WeakPolarHBondContact O-CA 3.41Å; D1045-F1091 PolarHBondContact O-N 3.45Å
1046	L	94.2	Very high	91	Very high	8 Å²	8	39.4 Å²	39.4	4%	0.042	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	123.2	178.9	175.3	61.1	0	0	0	109.7	V957 T958 L990 D1036 W1037 F1091	V957-L1046 HydrophobicContact CB-CD2 3.56Å; V957-L1046 HydrophobicContact CG1-CD2 3.6Å; V957-L1046 HydrophobicContact CG2-CD2 3.91Å; T958-L1046 HydrophobicContact CG2-CB 4.41Å; T958-L1046 HydrophobicContact CG2-CD2 3.97Å; L990-L1046 HydrophobicContact CD1-CD1 4.24Å; D1036-L1046 HydrophobicContact CB-CB 4.24Å; D1036-L1046 PolarHBondContact OD2-N 3.32Å; W1037-L1046 HydrophobicContact CE3-CB 4.33Å; W1037-L1046 HydrophobicContact CH2-CB 3.91Å; W1037-L1046 HydrophobicContact CH2-CD1 3.73Å; W1037-L1046 HydrophobicContact CH2-CD2 4.27Å; W1037-L1046 HydrophobicContact CH2-CG 4.17Å; W1037-L1046 HydrophobicContact CZ2-CB 4.41Å; W1037-L1046 HydrophobicContact CZ2-CD1 4.46Å; W1037-L1046 HydrophobicContact CZ2-CD2 4.24Å; W1037-L1046 HydrophobicContact CZ3-CB 3.82Å; W1037-L1046 HydrophobicContact CZ3-CD1 4.26Å; L1046-F1091 WeakPolarHBondContact CA-O 3.37Å
1047	K	92.6	Very high	90.9	Very high	52 Å²	52	38.9 Å²	38.9	23%	0.226	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	151.6	178.3	-65	-64.6	-173.7	-109.4	0	112.7	D1045 W1066 I1090 F1091 A1092 V1093	D1045-K1047 IonicContact OD1-NZ 3.42Å; D1045-K1047 PolarHBondContact OD1-NZ 2.94Å; D1045-K1047 WeakPolarHBondContact OD2-CD 3.15Å; D1045-K1047 WeakPolarHBondContact OD2-CE 3.22Å; D1045-K1047 VanDerWaalsContact OD2-CG 3.3Å; D1045-K1047 WeakPolarHBondContact OD2-CG 3.33Å; D1045-K1047 IonicContact OD2-NZ 2.71Å; D1045-K1047 PolarHBondContact OD2-NZ 3.48Å; K1047-W1066 HydrophobicContact CB-CH2 3.72Å; K1047-W1066 HydrophobicContact CB-CZ2 4.22Å; K1047-W1066 HydrophobicContact CB-CZ3 3.91Å; K1047-W1066 HydrophobicContact CD-CD2 4.47Å; K1047-W1066 HydrophobicContact CD-CH2 4.18Å; K1047-W1066 HydrophobicContact CD-CZ2 3.78Å; K1047-W1066 HydrophobicContact CG-CD2 4.19Å; K1047-W1066 HydrophobicContact CG-CE3 4.07Å; K1047-W1066 HydrophobicContact CG-CH2 3.83Å; K1047-W1066 HydrophobicContact CG-CZ2 3.91Å; K1047-W1066 HydrophobicContact CG-CZ3 3.92Å; K1047-I1090 HydrophobicContact CG-CG2 4.05Å; K1047-F1091 PolarHBondContact N-O 2.66Å; K1047-A1092 HydrophobicContact CB-CB 3.97Å; K1047-A1092 CarbonylContact O-C 3.54Å; K1047-A1092 WeakPolarHBondContact O-CA 3.49Å; K1047-V1093 PolarHBondContact O-N 3.44Å
1048	T	91.2	Very high	90.7	Very high	24 Å²	24	42.1 Å²	42.1	15%	0.147	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.5	163.7	56.6	0	0	0	0	109.1	G950 V953 V1093 K1095	G950-T1048 WeakPolarHBondContact CA-OG1 3.34Å; V953-T1048 HydrophobicContact CB-CG2 3.84Å; V953-T1048 HydrophobicContact CG1-CG2 3.85Å; V953-T1048 HydrophobicContact CG2-CG2 4.31Å; T1048-V1093 WeakPolarHBondContact CA-O 3.44Å; T1048-V1093 HydrophobicContact CG2-CG1 3.96Å; T1048-K1095 VanDerWaalsContact CB-CE 3.45Å; T1048-K1095 VanDerWaalsContact O-CE 3.3Å; T1048-K1095 WeakPolarHBondContact O-CE 3.32Å; T1048-K1095 WeakPolarHBondContact OG1-CE 3.26Å
1049	T	90.5	Very high	89.9	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	148.9	-169.3	171.5	0	0	0	0	112.4	A1051 F1057 Q1060 A1092 V1093 S1094 K1095 F1101	T1049-A1051 VanDerWaalsContact C-N 3.26Å; T1049-A1051 HydrophobicContact CG2-CB 4.1Å; T1049-A1051 WeakPolarHBondContact OG1-CB 3.28Å; T1049-A1051 PolarHBondContact OG1-N 2.91Å; T1049-F1057 HydrophobicContact CG2-CD2 4.31Å; T1049-Q1060 PolarHBondContact OG1-OE1 2.89Å; T1049-A1092 HydrophobicContact CG2-CB 3.6Å; T1049-V1093 PolarHBondContact N-O 3.3Å; T1049-S1094 CarbonylContact O-C 3.58Å; T1049-S1094 VanDerWaalsContact O-CA 3.28Å; T1049-S1094 WeakPolarHBondContact O-CA 3.45Å; T1049-K1095 WeakPolarHBondContact O-CG 3.4Å; T1049-K1095 PolarHBondContact O-N 2.9Å; T1049-F1101 HydrophobicContact CG2-CD2 3.73Å; T1049-F1101 HydrophobicContact CG2-CE2 3.97Å
1050	A	87	Confident	89.5	Confident	65 Å²	65	45.1 Å²	45.1	54%	0.537	25%	0.25	S	C	.	.			trans	-80.4	-8.1	169	0	0	0	0	0	112.9
1051	A	87	Confident	89.3	Confident	4 Å²	4	43.7 Å²	43.7	3%	0.033	24%	0.235	C	C	.	.			trans	-56.7	143.6	-178.8	0	0	0	0	0	112	T1049 Q1056 F1057 S1094 F1101	T1049-A1051 VanDerWaalsContact C-N 3.26Å; T1049-A1051 HydrophobicContact CG2-CB 4.1Å; T1049-A1051 WeakPolarHBondContact OG1-CB 3.28Å; T1049-A1051 PolarHBondContact OG1-N 2.91Å; A1051-Q1056 HydrophobicContact CB-CB 3.85Å; A1051-F1057 HydrophobicContact CB-CB 3.83Å; A1051-S1094 WeakPolarHBondContact O-CB 3.37Å; A1051-S1094 PolarHBondContact O-OG 2.81Å; A1051-F1101 HydrophobicContact CB-CD2 4.38Å; A1051-F1101 HydrophobicContact CB-CE2 3.92Å; A1051-F1101 HydrophobicContact CB-CZ 4.36Å; A1051-F1101 VanDerWaalsContact O-CE2 3.25Å; A1051-F1101 WeakPolarHBondContact O-CE2 3.13Å; A1051-F1101 WeakPolarHBondContact O-CZ 3.21Å
1052	T	89.9	Confident	88.6	Confident	47 Å²	47	40.9 Å²	40.9	29%	0.288	22%	0.223	S	C	.	.	S	Bend	trans	-115.8	-13.1	-179.6	68.5	0	0	0	0	112.9	Q1056 K1097 K1099	T1052-Q1056 PolarHBondContact OG1-OE1 3.25Å; T1052-K1097 HydrophobicContact CG2-CB 4.41Å; T1052-K1097 HydrophobicContact CG2-CG 3.54Å; T1052-K1099 PolarHBondContact O-NZ 2.8Å
1053	S	91.5	Very high	87.7	Confident	34 Å²	34	46.5 Å²	46.5	24%	0.238	25%	0.248	C	C	.	.	S	Bend	trans	-135	161.5	174.6	67.4	0	0	0	0	111	E1055 Q1056 F1057 F1101	S1053-E1055 VanDerWaalsContact C-N 3.3Å; S1053-E1055 PolarHBondContact O-N 3.38Å; S1053-Q1056 PolarHBondContact O-N 3.45Å; S1053-Q1056 WeakPolarHBondContact OG-CG 3.24Å; S1053-Q1056 PolarHBondContact OG-N 2.85Å; S1053-F1057 PolarHBondContact O-N 3.18Å; S1053-F1057 VanDerWaalsContact O-N 3.12Å; S1053-F1101 WeakPolarHBondContact O-CE1 3.31Å
1054	Q	92.7	Very high	87.1	Confident	71 Å²	71	49.4 Å²	49.4	33%	0.332	27%	0.266	S	S	.	.	H	α-helix	trans	-60.5	-40.1	175.6	-177.7	66.6	28.8	0	0	111.3	Q1056 F1057 E1058 F1101 Y1102	Q1054-Q1056 PolarHBondContact O-N 2.57Å; Q1054-F1057 WeakPolarHBondContact O-CB 3.28Å; Q1054-F1057 PolarHBondContact O-N 3.07Å; Q1054-F1057 VanDerWaalsContact O-N 3.13Å; Q1054-E1058 WeakPolarHBondContact O-CG 3.18Å; Q1054-E1058 PolarHBondContact O-N 3.46Å; Q1054-F1101 HydrophobicContact CB-CD1 4.4Å; Q1054-Y1102 PolarHBondContact NE2-O 2.8Å
1055	E	88.1	Confident	86.3	Confident	153 Å²	153	52 Å²	52	72%	0.715	28%	0.28	S	S	*	.	H	α-helix	trans	-60.8	-42.6	176.6	-66.1	158.6	172.6	0	0	112.3	S1053 F1057 E1058 A1059	S1053-E1055 VanDerWaalsContact C-N 3.3Å; S1053-E1055 PolarHBondContact O-N 3.38Å; E1055-F1057 VanDerWaalsContact C-N 3.3Å; E1055-F1057 PolarHBondContact O-N 2.77Å; E1055-E1058 PolarHBondContact O-N 2.83Å; E1055-A1059 WeakPolarHBondContact O-CB 3.27Å; E1055-A1059 PolarHBondContact O-N 2.81Å
1056	Q	87.9	Confident	85.9	Confident	96 Å²	96	53.2 Å²	53.2	45%	0.449	28%	0.283	S	S	.	.	H	α-helix	trans	-65.6	-35.2	175.1	-77.7	-178.7	-13.8	0	0	112.1	A1051 T1052 S1053 Q1054 Q1060	A1051-Q1056 HydrophobicContact CB-CB 3.85Å; T1052-Q1056 PolarHBondContact OG1-OE1 3.25Å; S1053-Q1056 PolarHBondContact O-N 3.45Å; S1053-Q1056 WeakPolarHBondContact OG-CG 3.24Å; S1053-Q1056 PolarHBondContact OG-N 2.85Å; Q1054-Q1056 PolarHBondContact O-N 2.57Å; Q1056-Q1060 WeakPolarHBondContact O-CB 3.28Å; Q1056-Q1060 PolarHBondContact O-N 3.02Å
1057	F	92.4	Very high	85.3	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-68.7	-42.5	175.9	170.9	-114.5	0	0	0	111.6	T1049 A1051 S1053 Q1054 E1055 Q1060 I1061 W1066 I1090 A1092 F1101 K1103	T1049-F1057 HydrophobicContact CG2-CD2 4.31Å; A1051-F1057 HydrophobicContact CB-CB 3.83Å; S1053-F1057 PolarHBondContact O-N 3.18Å; S1053-F1057 VanDerWaalsContact O-N 3.12Å; Q1054-F1057 WeakPolarHBondContact O-CB 3.28Å; Q1054-F1057 PolarHBondContact O-N 3.07Å; Q1054-F1057 VanDerWaalsContact O-N 3.13Å; E1055-F1057 VanDerWaalsContact C-N 3.3Å; E1055-F1057 PolarHBondContact O-N 2.77Å; F1057-Q1060 CarbonylContact O-C 3.59Å; F1057-Q1060 WeakPolarHBondContact O-CB 3.37Å; F1057-Q1060 PolarHBondContact O-N 2.86Å; F1057-Q1060 VanDerWaalsContact O-N 3.15Å; F1057-I1061 HydrophobicContact CD1-CD1 3.99Å; F1057-I1061 HydrophobicContact CE1-CD1 3.49Å; F1057-I1061 VanDerWaalsContact CE1-CD1 3.49Å; F1057-I1061 HydrophobicContact CE1-CG1 4.45Å; F1057-I1061 HydrophobicContact CE2-CD1 4.04Å; F1057-I1061 HydrophobicContact CE2-CG1 4.17Å; F1057-I1061 HydrophobicContact CZ-CD1 3.54Å; F1057-I1061 HydrophobicContact CZ-CG1 4.14Å; F1057-I1061 PolarHBondContact O-N 3.31Å; F1057-W1066 HydrophobicContact CD2-CZ3 4.35Å; F1057-W1066 HydrophobicContact CE2-CE3 4.32Å; F1057-W1066 AromaticContact CE2-CZ3 3.82Å; F1057-W1066 HydrophobicContact CE2-CZ3 3.82Å; F1057-I1090 HydrophobicContact CE2-CG2 4.42Å; F1057-I1090 HydrophobicContact CZ-CB 4.35Å; F1057-I1090 HydrophobicContact CZ-CG2 3.9Å; F1057-A1092 HydrophobicContact CD2-CB 3.81Å; F1057-A1092 HydrophobicContact CE2-CB 3.21Å; F1057-A1092 HydrophobicContact CZ-CB 3.74Å; F1057-F1101 HydrophobicContact CB-CB 3.91Å; F1057-F1101 HydrophobicContact CB-CD1 4.3Å; F1057-F1101 HydrophobicContact CB-CD2 4.08Å; F1057-F1101 HydrophobicContact CB-CG 3.83Å; F1057-F1101 HydrophobicContact CD1-CB 3.33Å; F1057-F1101 HydrophobicContact CD1-CG 4.21Å; F1057-F1101 HydrophobicContact CD2-CB 4.12Å; F1057-F1101 HydrophobicContact CE1-CB 3.75Å; F1057-F1101 HydrophobicContact CE2-CB 4.49Å; F1057-F1101 HydrophobicContact CG-CB 3.5Å; F1057-F1101 HydrophobicContact CG-CD2 4.26Å; F1057-F1101 AromaticContact CG-CG 3.96Å; F1057-F1101 HydrophobicContact CG-CG 3.96Å; F1057-F1101 HydrophobicContact CZ-CB 4.3Å; F1057-K1103 HydrophobicContact CE1-CB 4.07Å
1058	E	88.6	Confident	84.7	Confident	75 Å²	75	56.9 Å²	56.9	35%	0.35	30%	0.295	S	S	.	.	H	α-helix	trans	-65.4	-40.7	175.2	-70	-173.8	150.7	0	0	112.2	Q1054 E1055 Q1060 I1061 D1062 K1103	Q1054-E1058 WeakPolarHBondContact O-CG 3.18Å; Q1054-E1058 PolarHBondContact O-N 3.46Å; E1055-E1058 PolarHBondContact O-N 2.83Å; E1058-Q1060 VanDerWaalsContact C-N 3.25Å; E1058-Q1060 PolarHBondContact O-N 2.85Å; E1058-I1061 WeakPolarHBondContact O-CB 3.29Å; E1058-I1061 PolarHBondContact O-N 3.13Å; E1058-D1062 PolarHBondContact O-N 3.15Å; E1058-K1103 HydrophobicContact CG-CD 4.47Å; E1058-K1103 IonicContact OE1-NZ 3.9Å; E1058-K1103 PolarHBondContact OE1-NZ 3.3Å
1059	A	78.7	Confident	84.4	Confident	60 Å²	60	58.5 Å²	58.5	50%	0.496	31%	0.308	S	S	.	.	H	α-helix	trans	-62.6	-33.9	171.6	0	0	0	0	0	112	E1055 F1063	E1055-A1059 WeakPolarHBondContact O-CB 3.27Å; E1055-A1059 PolarHBondContact O-N 2.81Å; A1059-F1063 VanDerWaalsContact O-CB 3.24Å; A1059-F1063 WeakPolarHBondContact O-CB 3.45Å; A1059-F1063 PolarHBondContact O-N 2.9Å
1060	Q	83.8	Confident	84.3	Confident	50 Å²	50	58.8 Å²	58.8	23%	0.234	31%	0.309	C	S	.	.	H	α-helix	trans	-71.6	-37.2	174.5	-171.8	175.6	1.4	0	0	112.3	T1049 Q1056 F1057 E1058 D1062 F1063 V1064 W1066	T1049-Q1060 PolarHBondContact OG1-OE1 2.89Å; Q1056-Q1060 WeakPolarHBondContact O-CB 3.28Å; Q1056-Q1060 PolarHBondContact O-N 3.02Å; F1057-Q1060 CarbonylContact O-C 3.59Å; F1057-Q1060 WeakPolarHBondContact O-CB 3.37Å; F1057-Q1060 PolarHBondContact O-N 2.86Å; F1057-Q1060 VanDerWaalsContact O-N 3.15Å; E1058-Q1060 VanDerWaalsContact C-N 3.25Å; E1058-Q1060 PolarHBondContact O-N 2.85Å; Q1060-D1062 VanDerWaalsContact C-N 3.32Å; Q1060-F1063 PolarHBondContact O-N 3.2Å; Q1060-V1064 HydrophobicContact CG-CG2 3.96Å; Q1060-V1064 WeakPolarHBondContact O-CB 3.41Å; Q1060-V1064 VanDerWaalsContact O-CG2 3.26Å; Q1060-V1064 WeakPolarHBondContact O-CG2 3.4Å; Q1060-V1064 PolarHBondContact O-N 3.42Å; Q1060-W1066 HydrophobicContact CG-CH2 4.35Å; Q1060-W1066 HydrophobicContact CG-CZ3 4.4Å
1061	I	83.3	Confident	84.3	Confident	4 Å²	4	56 Å²	56	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-57.4	-48.7	172.5	-74.7	165.9	0	0	0	109.8	F1057 E1058 V1064 D1065 W1066 D1067 I1090 K1103	F1057-I1061 HydrophobicContact CD1-CD1 3.99Å; F1057-I1061 HydrophobicContact CE1-CD1 3.49Å; F1057-I1061 VanDerWaalsContact CE1-CD1 3.49Å; F1057-I1061 HydrophobicContact CE1-CG1 4.45Å; F1057-I1061 HydrophobicContact CE2-CD1 4.04Å; F1057-I1061 HydrophobicContact CE2-CG1 4.17Å; F1057-I1061 HydrophobicContact CZ-CD1 3.54Å; F1057-I1061 HydrophobicContact CZ-CG1 4.14Å; F1057-I1061 PolarHBondContact O-N 3.31Å; E1058-I1061 WeakPolarHBondContact O-CB 3.29Å; E1058-I1061 PolarHBondContact O-N 3.13Å; I1061-V1064 PolarHBondContact O-N 3.04Å; I1061-D1065 PolarHBondContact O-N 3.11Å; I1061-W1066 HydrophobicContact CG1-CB 4.48Å; I1061-W1066 HydrophobicContact CG1-CE3 3.79Å; I1061-W1066 HydrophobicContact CG2-CB 4.32Å; I1061-W1066 PolarHBondContact O-N 3.36Å; I1061-W1066 VanDerWaalsContact O-N 3.16Å; I1061-D1067 HydrophobicContact CG2-CB 3.77Å; I1061-I1090 HydrophobicContact CD1-CD1 4.22Å; I1061-I1090 HydrophobicContact CG1-CD1 4.25Å; I1061-K1103 HydrophobicContact CD1-CB 3.59Å; I1061-K1103 HydrophobicContact CD1-CG 3.86Å
1062	D	73.4	Confident	84.3	Confident	65 Å²	65	60.9 Å²	60.9	35%	0.348	30%	0.304	S	S	.	.	H	α-helix	trans	-64.5	-40.3	178.9	-167.5	22.6	0	0	0	111.9	E1058 Q1060 R1114	E1058-D1062 PolarHBondContact O-N 3.15Å; Q1060-D1062 VanDerWaalsContact C-N 3.32Å; D1062-R1114 IonicContact OD1-CZ 2.69Å; D1062-R1114 IonicContact OD1-NH1 2.65Å; D1062-R1114 PolarHBondContact OD1-NH1 3.05Å; D1062-R1114 IonicContact OD1-NH2 2.85Å; D1062-R1114 PolarHBondContact OD1-NH2 3.23Å; D1062-R1114 IonicContact OD2-NH1 3.33Å; D1062-R1114 IonicContact OD2-NH2 3.02Å
1063	F	72.2	Confident	84.3	Confident	158 Å²	158	61.3 Å²	61.3	69%	0.693	30%	0.3	S	S	*	.	H	α-helix	trans	-69.5	-35.1	-179.9	-178.9	-98	0	0	0	113.6	A1059 Q1060	A1059-F1063 VanDerWaalsContact O-CB 3.24Å; A1059-F1063 WeakPolarHBondContact O-CB 3.45Å; A1059-F1063 PolarHBondContact O-N 2.9Å; Q1060-F1063 PolarHBondContact O-N 3.2Å
1064	V	77	Confident	84.2	Confident	62 Å²	62	59.7 Å²	59.7	38%	0.376	29%	0.289	S	S	.	.	H	α-helix	trans	-97.4	-2	-175.2	-168.5	0	0	0	0	112.2	Q1060 I1061 W1066	Q1060-V1064 HydrophobicContact CG-CG2 3.96Å; Q1060-V1064 WeakPolarHBondContact O-CB 3.41Å; Q1060-V1064 VanDerWaalsContact O-CG2 3.26Å; Q1060-V1064 WeakPolarHBondContact O-CG2 3.4Å; Q1060-V1064 PolarHBondContact O-N 3.42Å; I1061-V1064 PolarHBondContact O-N 3.04Å; V1064-W1066 HydrophobicContact CB-CD2 4.43Å; V1064-W1066 HydrophobicContact CB-CG 4.3Å; V1064-W1066 HydrophobicContact CG1-CG 4.39Å; V1064-W1066 PolarHBondContact O-N 2.95Å
1065	D	76.3	Confident	83.9	Confident	55 Å²	55	58.9 Å²	58.9	29%	0.294	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	37.4	-174.3	-66	-37.8	0	0	0	112.5	I1061 D1067 R1068 S1069	I1061-D1065 PolarHBondContact O-N 3.11Å; D1065-D1067 VanDerWaalsContact C-N 3.33Å; D1065-R1068 HydrophobicContact CB-CB 4.2Å; D1065-R1068 PolarHBondContact O-N 2.99Å; D1065-S1069 PolarHBondContact O-N 2.88Å; D1065-S1069 VanDerWaalsContact O-N 3.14Å; D1065-S1069 PolarHBondContact O-OG 2.74Å; D1065-S1069 VanDerWaalsContact O-OG 3.11Å
1066	W	85	Confident	83.8	Confident	34 Å²	34	51.6 Å²	51.6	13%	0.129	25%	0.253	C	S	.	.	H	α-helix	trans	-65.5	-39.1	177.6	-78	-11.9	0	0	0	111.4	K1047 F1057 Q1060 I1061 V1064 S1069 R1070 I1090	K1047-W1066 HydrophobicContact CB-CH2 3.72Å; K1047-W1066 HydrophobicContact CB-CZ2 4.22Å; K1047-W1066 HydrophobicContact CB-CZ3 3.91Å; K1047-W1066 HydrophobicContact CD-CD2 4.47Å; K1047-W1066 HydrophobicContact CD-CH2 4.18Å; K1047-W1066 HydrophobicContact CD-CZ2 3.78Å; K1047-W1066 HydrophobicContact CG-CD2 4.19Å; K1047-W1066 HydrophobicContact CG-CE3 4.07Å; K1047-W1066 HydrophobicContact CG-CH2 3.83Å; K1047-W1066 HydrophobicContact CG-CZ2 3.91Å; K1047-W1066 HydrophobicContact CG-CZ3 3.92Å; F1057-W1066 HydrophobicContact CD2-CZ3 4.35Å; F1057-W1066 HydrophobicContact CE2-CE3 4.32Å; F1057-W1066 AromaticContact CE2-CZ3 3.82Å; F1057-W1066 HydrophobicContact CE2-CZ3 3.82Å; Q1060-W1066 HydrophobicContact CG-CH2 4.35Å; Q1060-W1066 HydrophobicContact CG-CZ3 4.4Å; I1061-W1066 HydrophobicContact CG1-CB 4.48Å; I1061-W1066 HydrophobicContact CG1-CE3 3.79Å; I1061-W1066 HydrophobicContact CG2-CB 4.32Å; I1061-W1066 PolarHBondContact O-N 3.36Å; I1061-W1066 VanDerWaalsContact O-N 3.16Å; V1064-W1066 HydrophobicContact CB-CD2 4.43Å; V1064-W1066 HydrophobicContact CB-CG 4.3Å; V1064-W1066 HydrophobicContact CG1-CG 4.39Å; V1064-W1066 PolarHBondContact O-N 2.95Å; W1066-S1069 PolarHBondContact O-N 3.39Å; W1066-R1070 WeakPolarHBondContact O-CB 3.35Å; W1066-R1070 WeakPolarHBondContact O-CG 3.47Å; W1066-R1070 PolarHBondContact O-N 3.45Å; W1066-I1090 HydrophobicContact CB-CD1 3.86Å
1067	D	82.4	Confident	83.8	Confident	5 Å²	5	47 Å²	47	3%	0.027	23%	0.232	C	C	.	.	H	α-helix	trans	-58.9	-45.1	174.5	56.3	-15.6	0	0	0	112.5	I1061 D1065 S1069 R1070 A1071 L1111	I1061-D1067 HydrophobicContact CG2-CB 3.77Å; D1065-D1067 VanDerWaalsContact C-N 3.33Å; D1067-S1069 PolarHBondContact O-N 3.02Å; D1067-R1070 PolarHBondContact O-N 3.29Å; D1067-A1071 WeakPolarHBondContact O-CB 3.48Å; D1067-A1071 PolarHBondContact O-N 2.98Å; D1067-L1111 HydrophobicContact CB-CD1 4.35Å; D1067-L1111 HydrophobicContact CB-CD2 3.54Å; D1067-L1111 HydrophobicContact CB-CG 3.76Å
1068	R	80.2	Confident	83.5	Confident	132 Å²	132	49.8 Å²	49.8	50%	0.498	25%	0.245	S	C	.	.	H	α-helix	trans	-64.4	-41.6	177.8	-168.2	-179.9	-172.3	162.9	11.7	112.4	D1065 R1070 A1071 W1072	D1065-R1068 HydrophobicContact CB-CB 4.2Å; D1065-R1068 PolarHBondContact O-N 2.99Å; R1068-R1070 PolarHBondContact O-N 3.22Å; R1068-A1071 PolarHBondContact O-N 3.42Å; R1068-W1072 WeakPolarHBondContact O-CB 3.26Å; R1068-W1072 PolarHBondContact O-N 3.38Å
1069	S	84.5	Confident	83.2	Confident	58 Å²	58	48.9 Å²	48.9	41%	0.406	25%	0.246	S	C	.	.	H	α-helix	trans	-59.8	-40.8	175.4	-61.1	0	0	0	0	110.8	D1065 W1066 D1067 W1072 Y1073	D1065-S1069 PolarHBondContact O-N 2.88Å; D1065-S1069 VanDerWaalsContact O-N 3.14Å; D1065-S1069 PolarHBondContact O-OG 2.74Å; D1065-S1069 VanDerWaalsContact O-OG 3.11Å; W1066-S1069 PolarHBondContact O-N 3.39Å; D1067-S1069 PolarHBondContact O-N 3.02Å; S1069-W1072 PolarHBondContact O-N 3.39Å; S1069-Y1073 WeakPolarHBondContact O-CD1 3.17Å; S1069-Y1073 PolarHBondContact O-N 2.72Å; S1069-Y1073 VanDerWaalsContact O-N 3.13Å
1070	R	89.4	Confident	83.5	Confident	6 Å²	6	49.3 Å²	49.3	2%	0.023	24%	0.239	C	C	.	.	H	α-helix	trans	-72.7	-41.9	-179.6	-60.5	-87.7	34.1	120	-0	111.8	D1045 W1066 D1067 R1068 W1072 Y1073 M1074 D1088 I1090 I1105	D1045-R1070 IonicContact OD1-NH1 2.6Å; D1045-R1070 PolarHBondContact OD1-NH1 3.32Å; W1066-R1070 WeakPolarHBondContact O-CB 3.35Å; W1066-R1070 WeakPolarHBondContact O-CG 3.47Å; W1066-R1070 PolarHBondContact O-N 3.45Å; D1067-R1070 PolarHBondContact O-N 3.29Å; R1068-R1070 PolarHBondContact O-N 3.22Å; R1070-W1072 VanDerWaalsContact C-N 3.29Å; R1070-W1072 PolarHBondContact O-N 3.31Å; R1070-Y1073 VanDerWaalsContact CZ-CD2 3.41Å; R1070-Y1073 VanDerWaalsContact NH1-CD2 3.35Å; R1070-Y1073 WeakPolarHBondContact O-CB 3.22Å; R1070-Y1073 PolarHBondContact O-N 3.17Å; R1070-M1074 WeakPolarHBondContact O-CG 3.35Å; R1070-M1074 PolarHBondContact O-N 3.4Å; R1070-D1088 IonicContact CZ-OD2 3.39Å; R1070-D1088 VanDerWaalsContact CZ-OD2 3.31Å; R1070-D1088 IonicContact NE-OD1 2.77Å; R1070-D1088 PolarHBondContact NE-OD1 3.28Å; R1070-D1088 IonicContact NE-OD2 2.79Å; R1070-D1088 PolarHBondContact NE-OD2 3Å; R1070-D1088 IonicContact NH2-OD2 3.37Å; R1070-D1088 PolarHBondContact NH2-OD2 3.23Å; R1070-I1090 HydrophobicContact CG-CD1 4.05Å; R1070-I1090 HydrophobicContact CG-CG1 4.09Å; R1070-I1105 HydrophobicContact CB-CD1 3.44Å; R1070-I1105 VanDerWaalsContact CB-CD1 3.44Å; R1070-I1105 HydrophobicContact CG-CD1 3.97Å
1071	A	87.2	Confident	83.5	Confident	7 Å²	7	48.4 Å²	48.4	6%	0.058	24%	0.237	C	C	.	.	H	α-helix	trans	-56.6	-42.5	171.6	0	0	0	0	0	111.9	D1067 R1068 Y1073 M1074 D1075 Y1112	D1067-A1071 WeakPolarHBondContact O-CB 3.48Å; D1067-A1071 PolarHBondContact O-N 2.98Å; R1068-A1071 PolarHBondContact O-N 3.42Å; A1071-Y1073 VanDerWaalsContact C-N 3.34Å; A1071-Y1073 PolarHBondContact O-N 2.99Å; A1071-M1074 WeakPolarHBondContact O-CB 3.26Å; A1071-M1074 PolarHBondContact O-N 3.42Å; A1071-D1075 PolarHBondContact O-N 2.74Å; A1071-Y1112 HydrophobicContact CB-CD2 3.6Å; A1071-Y1112 HydrophobicContact CB-CE2 4.1Å; A1071-Y1112 HydrophobicContact CB-CG 4.32Å
1072	W	85.6	Confident	83.6	Confident	107 Å²	107	52.4 Å²	52.4	41%	0.405	26%	0.263	S	S	.	.	H	α-helix	trans	-65.1	-35.1	175.2	-172.8	64.6	0	0	0	113	V1031 R1068 S1069 R1070 D1075 L1076	V1031-W1072 HydrophobicContact CB-CH2 4.18Å; V1031-W1072 HydrophobicContact CB-CZ2 4.15Å; V1031-W1072 HydrophobicContact CG1-CH2 4.31Å; V1031-W1072 HydrophobicContact CG1-CZ2 3.98Å; R1068-W1072 WeakPolarHBondContact O-CB 3.26Å; R1068-W1072 PolarHBondContact O-N 3.38Å; S1069-W1072 PolarHBondContact O-N 3.39Å; R1070-W1072 VanDerWaalsContact C-N 3.29Å; R1070-W1072 PolarHBondContact O-N 3.31Å; W1072-D1075 PolarHBondContact O-N 2.95Å; W1072-L1076 HydrophobicContact CH2-CD1 4.15Å; W1072-L1076 HydrophobicContact CZ2-CD1 4.3Å; W1072-L1076 HydrophobicContact CZ3-CD1 4.5Å; W1072-L1076 WeakPolarHBondContact O-CB 3.23Å; W1072-L1076 PolarHBondContact O-N 2.61Å
1073	Y	90.1	Very high	84.3	Confident	55 Å²	55	56.9 Å²	56.9	22%	0.216	28%	0.275	C	S	.	.	H	α-helix	trans	-71.6	-34.8	176.4	-76.9	33.7	0	0	0	111.2	C1033 K1034 F1035 S1069 R1070 A1071 L1076 T1077	C1033-Y1073 HydrophobicContact CB-CD1 3.82Å; C1033-Y1073 HydrophobicContact CB-CD2 3.42Å; C1033-Y1073 VanDerWaalsContact CB-CD2 3.42Å; C1033-Y1073 HydrophobicContact CB-CE1 4.09Å; C1033-Y1073 HydrophobicContact CB-CE2 3.77Å; C1033-Y1073 HydrophobicContact CB-CG 3.51Å; K1034-Y1073 VanDerWaalsContact N-CE2 3.32Å; K1034-Y1073 VanDerWaalsContact O-CE2 3.22Å; K1034-Y1073 WeakPolarHBondContact O-CE2 3.23Å; F1035-Y1073 HydrophobicContact CE1-CD2 4.43Å; F1035-Y1073 HydrophobicContact CZ-CD2 4.42Å; S1069-Y1073 WeakPolarHBondContact O-CD1 3.17Å; S1069-Y1073 PolarHBondContact O-N 2.72Å; S1069-Y1073 VanDerWaalsContact O-N 3.13Å; R1070-Y1073 VanDerWaalsContact CZ-CD2 3.41Å; R1070-Y1073 VanDerWaalsContact NH1-CD2 3.35Å; R1070-Y1073 WeakPolarHBondContact O-CB 3.22Å; R1070-Y1073 PolarHBondContact O-N 3.17Å; A1071-Y1073 VanDerWaalsContact C-N 3.34Å; A1071-Y1073 PolarHBondContact O-N 2.99Å; Y1073-L1076 PolarHBondContact O-N 3.12Å; Y1073-T1077 PolarHBondContact O-N 3.35Å; Y1073-T1077 PolarHBondContact O-OG1 3.02Å
1074	M	90	Very high	85.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.6	-50.3	169.9	-68.3	169.8	69.5	0	0	109.5	R1070 A1071 L1076 T1077 H1078 G1085 D1088 I1105 R1107 Y1112	R1070-M1074 WeakPolarHBondContact O-CG 3.35Å; R1070-M1074 PolarHBondContact O-N 3.4Å; A1071-M1074 WeakPolarHBondContact O-CB 3.26Å; A1071-M1074 PolarHBondContact O-N 3.42Å; M1074-L1076 VanDerWaalsContact C-N 3.35Å; M1074-L1076 PolarHBondContact O-N 3.2Å; M1074-T1077 PolarHBondContact O-N 3.11Å; M1074-T1077 PolarHBondContact O-OG1 3.48Å; M1074-H1078 WeakPolarHBondContact O-CB 3.33Å; M1074-H1078 PolarHBondContact O-N 3.25Å; M1074-G1085 WeakPolarHBondContact CB-O 3.46Å; M1074-G1085 WeakPolarHBondContact CE-O 3.31Å; M1074-D1088 HydrophobicContact CG-CB 3.68Å; M1074-D1088 HydrophobicContact SD-CB 3.55Å; M1074-D1088 VanDerWaalsContact SD-CB 3.55Å; M1074-I1105 HydrophobicContact SD-CB 4.28Å; M1074-I1105 HydrophobicContact SD-CG2 3.73Å; M1074-R1107 HydrophobicContact CE-CB 3.79Å; M1074-R1107 VanDerWaalsContact CE-N 3.26Å; M1074-R1107 PolarHBondContact O-NH2 3.13Å; M1074-Y1112 HydrophobicContact CB-CE2 4.42Å; M1074-Y1112 HydrophobicContact CE-CD2 4.3Å; M1074-Y1112 HydrophobicContact SD-CD2 4.3Å
1075	D	86.3	Confident	85.3	Confident	54 Å²	54	48.9 Å²	48.9	29%	0.289	23%	0.234	S	C	.	.	H	α-helix	trans	-58	-45.1	177.1	-68.3	-18.8	0	0	0	113.1	A1071 W1072 H1078 S1079 R1107 Y1112	A1071-D1075 PolarHBondContact O-N 2.74Å; W1072-D1075 PolarHBondContact O-N 2.95Å; D1075-H1078 PolarHBondContact O-N 3.44Å; D1075-S1079 VanDerWaalsContact O-CB 3.27Å; D1075-S1079 WeakPolarHBondContact O-CB 3.39Å; D1075-S1079 PolarHBondContact O-N 2.93Å; D1075-S1079 PolarHBondContact O-OG 3.41Å; D1075-R1107 VanDerWaalsContact N-NH2 3.18Å; D1075-R1107 IonicContact OD1-CZ 3.67Å; D1075-R1107 IonicContact OD1-NH1 3.72Å; D1075-R1107 PolarHBondContact OD1-NH1 2.85Å; D1075-R1107 IonicContact OD1-NH2 3.87Å; D1075-R1107 PolarHBondContact OD1-NH2 2.88Å; D1075-Y1112 WeakPolarHBondContact OD1-CE2 3.17Å; D1075-Y1112 VanDerWaalsContact OD1-CZ 3.31Å; D1075-Y1112 PolarHBondContact OD1-OH 3.43Å
1076	L	86.3	Confident	86	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.6	-47.2	178.3	-165.5	153.7	0	0	0	111.5	F1013 N1015 M1018 V1031 C1033 W1072 Y1073 M1074 S1079 I1080	F1013-L1076 HydrophobicContact CB-CD2 4.18Å; N1015-L1076 HydrophobicContact CB-CD2 4.13Å; N1015-L1076 HydrophobicContact CB-CG 4.2Å; M1018-L1076 HydrophobicContact CE-CB 3.97Å; M1018-L1076 HydrophobicContact CE-CG 4.1Å; V1031-L1076 HydrophobicContact CB-CD1 3.62Å; V1031-L1076 HydrophobicContact CG2-CD1 3.28Å; V1031-L1076 HydrophobicContact CG2-CG 3.82Å; C1033-L1076 HydrophobicContact CB-CD1 4.01Å; C1033-L1076 HydrophobicContact CB-CD2 4.12Å; C1033-L1076 HydrophobicContact CB-CG 4.49Å; W1072-L1076 HydrophobicContact CH2-CD1 4.15Å; W1072-L1076 HydrophobicContact CZ2-CD1 4.3Å; W1072-L1076 HydrophobicContact CZ3-CD1 4.5Å; W1072-L1076 WeakPolarHBondContact O-CB 3.23Å; W1072-L1076 PolarHBondContact O-N 2.61Å; Y1073-L1076 PolarHBondContact O-N 3.12Å; M1074-L1076 VanDerWaalsContact C-N 3.35Å; M1074-L1076 PolarHBondContact O-N 3.2Å; L1076-S1079 PolarHBondContact O-N 2.89Å; L1076-S1079 PolarHBondContact O-OG 2.93Å; L1076-I1080 HydrophobicContact CD2-CD1 3.67Å; L1076-I1080 WeakPolarHBondContact O-CG1 3.32Å; L1076-I1080 PolarHBondContact O-N 2.89Å
1077	T	87.9	Confident	86.3	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	25%	0.248	C	C	.	.	H	α-helix	trans	-68.5	-42.6	179.5	46.9	0	0	0	0	113	F1013 F1035 W1038 Y1073 M1074 S1079 I1080 D1081 G1085	F1013-T1077 HydrophobicContact CB-CG2 4.31Å; F1013-T1077 HydrophobicContact CD1-CG2 4.17Å; F1013-T1077 HydrophobicContact CD2-CG2 3.85Å; F1013-T1077 HydrophobicContact CE2-CG2 4.25Å; F1013-T1077 HydrophobicContact CG-CG2 3.83Å; F1035-T1077 HydrophobicContact CE2-CG2 3.34Å; F1035-T1077 HydrophobicContact CZ-CG2 3.48Å; F1035-T1077 VanDerWaalsContact CZ-CG2 3.48Å; W1038-T1077 HydrophobicContact CH2-CG2 4.37Å; W1038-T1077 HydrophobicContact CZ3-CG2 4.34Å; Y1073-T1077 PolarHBondContact O-N 3.35Å; Y1073-T1077 PolarHBondContact O-OG1 3.02Å; M1074-T1077 PolarHBondContact O-N 3.11Å; M1074-T1077 PolarHBondContact O-OG1 3.48Å; T1077-S1079 PolarHBondContact O-N 2.99Å; T1077-I1080 WeakPolarHBondContact O-CB 3.42Å; T1077-I1080 PolarHBondContact O-N 3.03Å; T1077-D1081 PolarHBondContact O-N 3.18Å; T1077-G1085 WeakPolarHBondContact OG1-CA 3.45Å
1078	H	86.3	Confident	86.8	Confident	58 Å²	58	51.2 Å²	51.2	27%	0.269	25%	0.247	S	C	.	.	H	α-helix	trans	-63.2	-32.1	176.1	-171.6	-80	0	0	0	112.1	M1074 D1075 I1080 D1081 P1082 Y1084	M1074-H1078 WeakPolarHBondContact O-CB 3.33Å; M1074-H1078 PolarHBondContact O-N 3.25Å; D1075-H1078 PolarHBondContact O-N 3.44Å; H1078-I1080 VanDerWaalsContact C-N 3.29Å; H1078-I1080 PolarHBondContact O-N 3.48Å; H1078-D1081 WeakPolarHBondContact CA-O 3.3Å; H1078-D1081 CarbonylContact O-C 3.44Å; H1078-D1081 VanDerWaalsContact O-C 3.29Å; H1078-P1082 PolarHBondContact CD2-O 3.41Å; H1078-P1082 PolarHBondContact NE2-O 3.13Å; H1078-Y1084 WeakPolarHBondContact CA-O 3.1Å; H1078-Y1084 VanDerWaalsContact CB-O 3.23Å; H1078-Y1084 WeakPolarHBondContact CB-O 3.35Å; H1078-Y1084 PolarHBondContact CD2-O 3.5Å
1079	S	82.5	Confident	87.5	Confident	56 Å²	56	45 Å²	45	39%	0.392	22%	0.223	S	C	.	.	H	α-helix	trans	-69.9	-23.5	173.9	72.8	0	0	0	0	113.7	N1015 D1075 L1076 T1077	N1015-S1079 PolarHBondContact ND2-OG 3.05Å; D1075-S1079 VanDerWaalsContact O-CB 3.27Å; D1075-S1079 WeakPolarHBondContact O-CB 3.39Å; D1075-S1079 PolarHBondContact O-N 2.93Å; D1075-S1079 PolarHBondContact O-OG 3.41Å; L1076-S1079 PolarHBondContact O-N 2.89Å; L1076-S1079 PolarHBondContact O-OG 2.93Å; T1077-S1079 PolarHBondContact O-N 2.99Å
1080	I	83.3	Confident	88	Confident	68 Å²	68	42.2 Å²	42.2	35%	0.349	20%	0.204	S	C	.	.	H	α-helix	trans	-82.4	-46.2	174.9	-66.2	167	0	0	0	110.5	F1013 N1015 L1076 T1077 H1078	F1013-I1080 HydrophobicContact CB-CD1 3.76Å; F1013-I1080 HydrophobicContact CD1-CD1 4.15Å; F1013-I1080 HydrophobicContact CG-CD1 4.41Å; N1015-I1080 HydrophobicContact CB-CD1 3.99Å; N1015-I1080 HydrophobicContact CB-CG1 3.75Å; L1076-I1080 HydrophobicContact CD2-CD1 3.67Å; L1076-I1080 WeakPolarHBondContact O-CG1 3.32Å; L1076-I1080 PolarHBondContact O-N 2.89Å; T1077-I1080 WeakPolarHBondContact O-CB 3.42Å; T1077-I1080 PolarHBondContact O-N 3.03Å; H1078-I1080 VanDerWaalsContact C-N 3.29Å; H1078-I1080 PolarHBondContact O-N 3.48Å
1081	D	84.8	Confident	88.3	Confident	32 Å²	32	42 Å²	42	17%	0.171	20%	0.203	C	C	.	.			trans	-146.8	120	176.2	-169.7	-44.2	0	0	0	108.6	T1077 H1078 R1083 Y1084	T1077-D1081 PolarHBondContact O-N 3.18Å; H1078-D1081 WeakPolarHBondContact CA-O 3.3Å; H1078-D1081 CarbonylContact O-C 3.44Å; H1078-D1081 VanDerWaalsContact O-C 3.29Å; D1081-R1083 PolarHBondContact O-N 2.99Å; D1081-R1083 VanDerWaalsContact OD1-CB 3.28Å; D1081-R1083 WeakPolarHBondContact OD1-CB 3.14Å; D1081-R1083 WeakPolarHBondContact OD1-CG 3.41Å; D1081-R1083 IonicContact OD1-CZ 3.77Å; D1081-R1083 PolarHBondContact OD1-N 3.13Å; D1081-R1083 IonicContact OD1-NE 3.57Å; D1081-R1083 PolarHBondContact OD1-NE 2.92Å; D1081-R1083 IonicContact OD1-NH2 3.45Å; D1081-R1083 IonicContact OD2-CZ 3.3Å; D1081-R1083 IonicContact OD2-NE 2.77Å; D1081-R1083 PolarHBondContact OD2-NE 2.77Å; D1081-R1083 IonicContact OD2-NH2 3.9Å; D1081-R1083 PolarHBondContact OD2-NH2 3.23Å; D1081-Y1084 HydrophobicContact CB-CD2 3.55Å; D1081-Y1084 HydrophobicContact CB-CE2 3.58Å; D1081-Y1084 HydrophobicContact CB-CG 4.15Å; D1081-Y1084 WeakPolarHBondContact O-CB 3.48Å; D1081-Y1084 PolarHBondContact O-N 3.29Å
1082	P	85.4	Confident	88.6	Confident	88 Å²	88	41.7 Å²	41.7	57%	0.571	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-15.1	-178.6	-26.2	34.7	0	0	0	115	H1078 Y1084	H1078-P1082 PolarHBondContact CD2-O 3.41Å; H1078-P1082 PolarHBondContact NE2-O 3.13Å; P1082-Y1084 PolarHBondContact O-N 2.82Å
1083	R	88	Confident	89	Confident	159 Å²	159	36.6 Å²	36.6	60%	0.6	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-20.6	172.3	-62.8	175.6	-69.3	173.8	0.7	112	D1081	D1081-R1083 PolarHBondContact O-N 2.99Å; D1081-R1083 VanDerWaalsContact OD1-CB 3.28Å; D1081-R1083 WeakPolarHBondContact OD1-CB 3.14Å; D1081-R1083 WeakPolarHBondContact OD1-CG 3.41Å; D1081-R1083 IonicContact OD1-CZ 3.77Å; D1081-R1083 PolarHBondContact OD1-N 3.13Å; D1081-R1083 IonicContact OD1-NE 3.57Å; D1081-R1083 PolarHBondContact OD1-NE 2.92Å; D1081-R1083 IonicContact OD1-NH2 3.45Å; D1081-R1083 IonicContact OD2-CZ 3.3Å; D1081-R1083 IonicContact OD2-NE 2.77Å; D1081-R1083 PolarHBondContact OD2-NE 2.77Å; D1081-R1083 IonicContact OD2-NH2 3.9Å; D1081-R1083 PolarHBondContact OD2-NH2 3.23Å
1084	Y	88.4	Confident	89.1	Confident	51 Å²	51	34 Å²	34	20%	0.2	17%	0.171	C	C	.	.	S	Bend	trans	-95.6	162.7	-176.1	-54.7	-26.7	0	0	0	114.1	F1013 W1038 G1040 E1041 H1078 D1081 P1082 N1086	F1013-Y1084 HydrophobicContact CE1-CD2 4.11Å; F1013-Y1084 HydrophobicContact CE1-CE2 4.02Å; W1038-Y1084 HydrophobicContact CH2-CD1 4.3Å; W1038-Y1084 HydrophobicContact CH2-CD2 4.37Å; W1038-Y1084 HydrophobicContact CH2-CG 4.04Å; W1038-Y1084 HydrophobicContact CZ2-CD1 4.03Å; W1038-Y1084 HydrophobicContact CZ2-CD2 4.32Å; W1038-Y1084 HydrophobicContact CZ2-CE1 4.18Å; W1038-Y1084 HydrophobicContact CZ2-CE2 4.49Å; W1038-Y1084 HydrophobicContact CZ2-CG 4.11Å; G1040-Y1084 WeakPolarHBondContact O-CE1 3.37Å; E1041-Y1084 WeakPolarHBondContact O-CA 3.39Å; E1041-Y1084 WeakPolarHBondContact O-CB 3.39Å; E1041-Y1084 WeakPolarHBondContact O-CD1 3.5Å; H1078-Y1084 WeakPolarHBondContact CA-O 3.1Å; H1078-Y1084 VanDerWaalsContact CB-O 3.23Å; H1078-Y1084 WeakPolarHBondContact CB-O 3.35Å; H1078-Y1084 PolarHBondContact CD2-O 3.5Å; D1081-Y1084 HydrophobicContact CB-CD2 3.55Å; D1081-Y1084 HydrophobicContact CB-CE2 3.58Å; D1081-Y1084 HydrophobicContact CB-CG 4.15Å; D1081-Y1084 WeakPolarHBondContact O-CB 3.48Å; D1081-Y1084 PolarHBondContact O-N 3.29Å; P1082-Y1084 PolarHBondContact O-N 2.82Å; Y1084-N1086 VanDerWaalsContact C-N 3.3Å; Y1084-N1086 PolarHBondContact O-N 2.99Å
1085	G	81.4	Confident	89	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.01	18%	0.181	C	C	.	.			trans	69.5	24.9	167	0	0	0	0	0	114.3	E1041 M1074 T1077 R1107	E1041-G1085 PolarHBondContact O-N 3.13Å; M1074-G1085 WeakPolarHBondContact CB-O 3.46Å; M1074-G1085 WeakPolarHBondContact CE-O 3.31Å; T1077-G1085 WeakPolarHBondContact OG1-CA 3.45Å; G1085-R1107 VanDerWaalsContact O-CZ 3.31Å; G1085-R1107 PolarHBondContact O-NE 2.86Å; G1085-R1107 PolarHBondContact O-NH2 3.5Å
1086	N	90.6	Very high	88.7	Confident	73 Å²	73	38.3 Å²	38.3	39%	0.39	20%	0.195	S	C	.	.	S	Bend	trans	-84	-21.7	171	-72.3	-45.2	0	0	0	112.6	Y1084 R1107	Y1084-N1086 VanDerWaalsContact C-N 3.3Å; Y1084-N1086 PolarHBondContact O-N 2.99Å; N1086-R1107 PolarHBondContact O-N 2.95Å
1087	Q	92	Very high	88.5	Confident	69 Å²	69	44 Å²	44	32%	0.322	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	160.7	176.4	-60.9	-176.3	4.4	0	0	109.1	F1042 I1105 E1106	F1042-Q1087 HydrophobicContact CB-CB 4.47Å; F1042-Q1087 WeakPolarHBondContact CB-O 3.31Å; F1042-Q1087 HydrophobicContact CD2-CB 4.1Å; F1042-Q1087 HydrophobicContact CG-CB 4.21Å; Q1087-I1105 CarbonylContact C-O 3.58Å; Q1087-I1105 WeakPolarHBondContact CA-O 3.19Å; Q1087-E1106 HydrophobicContact CG-CG 4.37Å
1088	D	93.5	Very high	88.4	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	168.3	169.8	-157.3	-26.4	0	0	0	107.9	F1035 G1044 R1070 M1074 I1105	F1035-D1088 WeakPolarHBondContact CE1-OD2 3.34Å; G1044-D1088 WeakPolarHBondContact CA-OD1 3.37Å; R1070-D1088 IonicContact CZ-OD2 3.39Å; R1070-D1088 VanDerWaalsContact CZ-OD2 3.31Å; R1070-D1088 IonicContact NE-OD1 2.77Å; R1070-D1088 PolarHBondContact NE-OD1 3.28Å; R1070-D1088 IonicContact NE-OD2 2.79Å; R1070-D1088 PolarHBondContact NE-OD2 3Å; R1070-D1088 IonicContact NH2-OD2 3.37Å; R1070-D1088 PolarHBondContact NH2-OD2 3.23Å; M1074-D1088 HydrophobicContact CG-CB 3.68Å; M1074-D1088 HydrophobicContact SD-CB 3.55Å; M1074-D1088 VanDerWaalsContact SD-CB 3.55Å; D1088-I1105 HydrophobicContact CB-CB 4.37Å; D1088-I1105 PolarHBondContact N-O 3.49Å; D1088-I1105 PolarHBondContact O-N 2.99Å; D1088-I1105 VanDerWaalsContact O-O 3.1Å
1089	F	94.4	Very high	88.6	Confident	1 Å²	1	52.1 Å²	52.1	0%	0.004	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	156.5	177.1	61.5	-87.4	0	0	0	112.9	F999 V1003 W1037 L1039 F1042 G1043 G1044 D1045 F1091 Y1102 K1103	F999-F1089 HydrophobicContact CE1-CB 4.47Å; F999-F1089 AromaticContact CE1-CD1 3.98Å; F999-F1089 HydrophobicContact CE1-CD1 3.98Å; F999-F1089 HydrophobicContact CE1-CD2 4.2Å; F999-F1089 HydrophobicContact CE1-CE1 4.23Å; F999-F1089 HydrophobicContact CE1-CE2 4.44Å; F999-F1089 AromaticContact CE1-CG 3.96Å; F999-F1089 HydrophobicContact CE1-CG 3.96Å; F999-F1089 HydrophobicContact CE1-CZ 4.45Å; F999-F1089 AromaticContact CZ-CD1 3.86Å; F999-F1089 HydrophobicContact CZ-CD1 3.86Å; F999-F1089 AromaticContact CZ-CE1 3.91Å; F999-F1089 HydrophobicContact CZ-CE1 3.91Å; F999-F1089 HydrophobicContact CZ-CG 4.31Å; F999-F1089 HydrophobicContact CZ-CZ 4.41Å; V1003-F1089 HydrophobicContact CB-CZ 4.44Å; V1003-F1089 HydrophobicContact CG1-CE2 4.05Å; V1003-F1089 HydrophobicContact CG1-CZ 3.9Å; V1003-F1089 HydrophobicContact CG2-CE1 4.29Å; V1003-F1089 HydrophobicContact CG2-CE2 3.94Å; V1003-F1089 HydrophobicContact CG2-CZ 3.57Å; W1037-F1089 HydrophobicContact CB-CZ 4.31Å; W1037-F1089 AromaticContact CE3-CE2 3.71Å; W1037-F1089 HydrophobicContact CE3-CE2 3.71Å; W1037-F1089 HydrophobicContact CE3-CZ 4.32Å; W1037-F1089 HydrophobicContact CZ3-CE2 4.16Å; L1039-F1089 HydrophobicContact CD1-CE1 3.77Å; L1039-F1089 HydrophobicContact CD1-CZ 4.22Å; F1042-F1089 HydrophobicContact CD2-CD1 4.06Å; F1042-F1089 HydrophobicContact CD2-CE1 4.1Å; F1042-F1089 AromaticContact CE2-CD1 3.69Å; F1042-F1089 HydrophobicContact CE2-CD1 3.69Å; F1042-F1089 AromaticContact CE2-CE1 3.7Å; F1042-F1089 HydrophobicContact CE2-CE1 3.7Å; G1043-F1089 WeakPolarHBondContact O-CD1 3.44Å; G1043-F1089 WeakPolarHBondContact O-CE1 3.31Å; G1044-F1089 CarbonylContact C-O 3.48Å; G1044-F1089 WeakPolarHBondContact CA-O 3.43Å; D1045-F1089 PolarHBondContact N-O 3.31Å; F1089-F1091 AromaticContact CD2-CD2 3.55Å; F1089-F1091 HydrophobicContact CD2-CD2 3.55Å; F1089-F1091 AromaticContact CD2-CE2 3.74Å; F1089-F1091 HydrophobicContact CD2-CE2 3.74Å; F1089-F1091 AromaticContact CE2-CD2 3.67Å; F1089-F1091 HydrophobicContact CE2-CD2 3.67Å; F1089-F1091 AromaticContact CE2-CE2 3.86Å; F1089-F1091 HydrophobicContact CE2-CE2 3.86Å; F1089-Y1102 HydrophobicContact CB-CE2 3.76Å; F1089-Y1102 HydrophobicContact CD2-CE2 4.46Å; F1089-Y1102 HydrophobicContact CG-CE2 4.36Å; F1089-K1103 CarbonylContact C-O 3.56Å; F1089-K1103 VanDerWaalsContact CA-O 3.31Å; F1089-K1103 WeakPolarHBondContact CA-O 3.25Å
1090	I	94.3	Very high	89.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	120.3	172.9	-50.2	173.1	0	0	0	107.8	D1045 K1047 F1057 I1061 W1066 R1070 Y1102 K1103 I1105	D1045-I1090 WeakPolarHBondContact O-CA 3.41Å; K1047-I1090 HydrophobicContact CG-CG2 4.05Å; F1057-I1090 HydrophobicContact CE2-CG2 4.42Å; F1057-I1090 HydrophobicContact CZ-CB 4.35Å; F1057-I1090 HydrophobicContact CZ-CG2 3.9Å; I1061-I1090 HydrophobicContact CD1-CD1 4.22Å; I1061-I1090 HydrophobicContact CG1-CD1 4.25Å; W1066-I1090 HydrophobicContact CB-CD1 3.86Å; R1070-I1090 HydrophobicContact CG-CD1 4.05Å; R1070-I1090 HydrophobicContact CG-CG1 4.09Å; I1090-Y1102 CarbonylContact O-C 3.45Å; I1090-Y1102 WeakPolarHBondContact O-CA 3.38Å; I1090-K1103 PolarHBondContact N-O 2.9Å; I1090-K1103 PolarHBondContact O-N 3.3Å; I1090-I1105 HydrophobicContact CD1-CD1 4.23Å; I1090-I1105 HydrophobicContact CG1-CD1 4.33Å
1091	F	95.3	Very high	89.8	Confident	1 Å²	1	47.9 Å²	47.9	0%	0.004	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	144.4	159.5	-77.1	-81.5	0	0	0	109.6	F999 L1000 V1003 W1037 D1045 L1046 K1047 F1089 V1100 F1101 Y1102	F999-F1091 AromaticContact CD1-CE2 3.98Å; F999-F1091 HydrophobicContact CD1-CE2 3.98Å; F999-F1091 AromaticContact CD1-CZ 3.93Å; F999-F1091 HydrophobicContact CD1-CZ 3.93Å; F999-F1091 HydrophobicContact CE1-CE2 4.05Å; F999-F1091 HydrophobicContact CE1-CZ 4.44Å; L1000-F1091 HydrophobicContact CB-CE1 4Å; L1000-F1091 HydrophobicContact CB-CE2 4.4Å; L1000-F1091 HydrophobicContact CB-CZ 3.72Å; L1000-F1091 HydrophobicContact CD1-CD1 4.13Å; L1000-F1091 HydrophobicContact CD1-CD2 3.98Å; L1000-F1091 HydrophobicContact CD1-CE1 4.01Å; L1000-F1091 HydrophobicContact CD1-CE2 3.88Å; L1000-F1091 HydrophobicContact CD1-CG 4.12Å; L1000-F1091 HydrophobicContact CD1-CZ 3.88Å; L1000-F1091 HydrophobicContact CD2-CE1 4.28Å; L1000-F1091 HydrophobicContact CG-CE1 4.31Å; L1000-F1091 HydrophobicContact CG-CZ 4.29Å; V1003-F1091 HydrophobicContact CG2-CE2 4.43Å; W1037-F1091 HydrophobicContact CH2-CB 4.14Å; W1037-F1091 HydrophobicContact CH2-CD2 4.42Å; W1037-F1091 HydrophobicContact CZ3-CB 3.89Å; W1037-F1091 AromaticContact CZ3-CD2 3.94Å; W1037-F1091 HydrophobicContact CZ3-CD2 3.94Å; W1037-F1091 HydrophobicContact CZ3-CG 4.36Å; D1045-F1091 PolarHBondContact O-N 3.45Å; L1046-F1091 WeakPolarHBondContact CA-O 3.37Å; K1047-F1091 PolarHBondContact N-O 2.66Å; F1089-F1091 AromaticContact CD2-CD2 3.55Å; F1089-F1091 HydrophobicContact CD2-CD2 3.55Å; F1089-F1091 AromaticContact CD2-CE2 3.74Å; F1089-F1091 HydrophobicContact CD2-CE2 3.74Å; F1089-F1091 AromaticContact CE2-CD2 3.67Å; F1089-F1091 HydrophobicContact CE2-CD2 3.67Å; F1089-F1091 AromaticContact CE2-CE2 3.86Å; F1089-F1091 HydrophobicContact CE2-CE2 3.86Å; F1091-V1100 HydrophobicContact CD1-CG1 3.84Å; F1091-F1101 CarbonylContact C-O 3.6Å; F1091-F1101 WeakPolarHBondContact CA-O 3.38Å; F1091-Y1102 AromaticContact CD1-CD2 3.76Å; F1091-Y1102 HydrophobicContact CD1-CD2 3.76Å; F1091-Y1102 HydrophobicContact CD1-CG 4.24Å; F1091-Y1102 HydrophobicContact CD2-CD2 4.05Å; F1091-Y1102 HydrophobicContact CD2-CE2 4.49Å; F1091-Y1102 AromaticContact CE1-CD2 3.38Å; F1091-Y1102 HydrophobicContact CE1-CD2 3.38Å; F1091-Y1102 HydrophobicContact CE1-CE2 4.27Å; F1091-Y1102 AromaticContact CE1-CG 3.79Å; F1091-Y1102 HydrophobicContact CE1-CG 3.79Å; F1091-Y1102 AromaticContact CE2-CD2 3.67Å; F1091-Y1102 HydrophobicContact CE2-CD2 3.67Å; F1091-Y1102 AromaticContact CE2-CE2 3.87Å; F1091-Y1102 HydrophobicContact CE2-CE2 3.87Å; F1091-Y1102 HydrophobicContact CG-CD2 4.09Å; F1091-Y1102 AromaticContact CZ-CD2 3.33Å; F1091-Y1102 HydrophobicContact CZ-CD2 3.33Å; F1091-Y1102 AromaticContact CZ-CE2 3.75Å; F1091-Y1102 HydrophobicContact CZ-CE2 3.75Å; F1091-Y1102 HydrophobicContact CZ-CG 4.09Å
1092	A	94	Very high	90.2	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	136.5	172.4	0	0	0	0	0	112.7	K1047 T1049 F1057 V1100 F1101	K1047-A1092 HydrophobicContact CB-CB 3.97Å; K1047-A1092 CarbonylContact O-C 3.54Å; K1047-A1092 WeakPolarHBondContact O-CA 3.49Å; T1049-A1092 HydrophobicContact CG2-CB 3.6Å; F1057-A1092 HydrophobicContact CD2-CB 3.81Å; F1057-A1092 HydrophobicContact CE2-CB 3.21Å; F1057-A1092 HydrophobicContact CZ-CB 3.74Å; A1092-V1100 CarbonylContact O-C 3.5Å; A1092-V1100 VanDerWaalsContact O-CA 3.26Å; A1092-V1100 WeakPolarHBondContact O-CA 3.5Å; A1092-F1101 PolarHBondContact N-O 3.48Å; A1092-F1101 PolarHBondContact O-N 2.92Å
1093	V	94.1	Very high	90.6	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	130.6	171.8	65.7	0	0	0	0	110.2	V953 R986 V989 L990 K1047 T1048 T1049 K1095	V953-V1093 HydrophobicContact CG1-CG1 3.81Å; R986-V1093 HydrophobicContact CB-CG1 4.29Å; R986-V1093 HydrophobicContact CB-CG2 4.12Å; R986-V1093 HydrophobicContact CG-CG1 4.41Å; R986-V1093 HydrophobicContact CG-CG2 4.11Å; V989-V1093 HydrophobicContact CB-CG2 4.48Å; V989-V1093 HydrophobicContact CG1-CG2 4.12Å; L990-V1093 HydrophobicContact CD2-CB 4.46Å; L990-V1093 HydrophobicContact CG-CB 4.37Å; K1047-V1093 PolarHBondContact O-N 3.44Å; T1048-V1093 WeakPolarHBondContact CA-O 3.44Å; T1048-V1093 HydrophobicContact CG2-CG1 3.96Å; T1049-V1093 PolarHBondContact N-O 3.3Å; V1093-K1095 PolarHBondContact O-N 3.34Å
1094	S	91.8	Very high	90.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	129.5	179.7	-175.2	0	0	0	0	111.4	T1049 A1051 T1096 K1097 K1099	T1049-S1094 CarbonylContact O-C 3.58Å; T1049-S1094 VanDerWaalsContact O-CA 3.28Å; T1049-S1094 WeakPolarHBondContact O-CA 3.45Å; A1051-S1094 WeakPolarHBondContact O-CB 3.37Å; A1051-S1094 PolarHBondContact O-OG 2.81Å; S1094-T1096 VanDerWaalsContact C-N 3.26Å; S1094-T1096 PolarHBondContact O-N 3.01Å; S1094-T1096 PolarHBondContact OG-N 3.33Å; S1094-K1097 WeakPolarHBondContact CB-O 3.5Å; S1094-K1097 PolarHBondContact OG-N 3.22Å; S1094-K1097 PolarHBondContact OG-O 2.9Å; S1094-K1099 PolarHBondContact N-O 3.13Å
1095	K	87.5	Confident	90.9	Very high	51 Å²	51	42 Å²	42	22%	0.222	20%	0.196	C	C	.	.	S	Bend	trans	-63.4	-34.7	175.3	-65.2	-175.2	-174.7	-168.4	0	111.5	A946 W982 R986 T1048 T1049 V1093	A946-K1095 PolarHBondContact O-NZ 3.07Å; W982-K1095 HydrophobicContact CH2-CG 4.25Å; W982-K1095 HydrophobicContact CZ2-CB 4.01Å; W982-K1095 HydrophobicContact CZ2-CG 4.24Å; R986-K1095 PolarHBondContact NH2-O 2.79Å; T1048-K1095 VanDerWaalsContact CB-CE 3.45Å; T1048-K1095 VanDerWaalsContact O-CE 3.3Å; T1048-K1095 WeakPolarHBondContact O-CE 3.32Å; T1048-K1095 WeakPolarHBondContact OG1-CE 3.26Å; T1049-K1095 WeakPolarHBondContact O-CG 3.4Å; T1049-K1095 PolarHBondContact O-N 2.9Å; V1093-K1095 PolarHBondContact O-N 3.34Å
1096	T	82	Confident	91.3	Very high	95 Å²	95	45.1 Å²	45.1	58%	0.583	21%	0.211	S	C	*	.	S	Bend	trans	-107.5	-39.6	-170.6	57.1	0	0	0	0	113.3	S1094	S1094-T1096 VanDerWaalsContact C-N 3.26Å; S1094-T1096 PolarHBondContact O-N 3.01Å; S1094-T1096 PolarHBondContact OG-N 3.33Å
1097	K	80.1	Confident	91.1	Very high	120 Å²	120	44.8 Å²	44.8	52%	0.522	20%	0.204	S	C	.	.	S	Bend	trans	-119.1	85.2	-172.3	-65.7	-68.8	-172.9	177.9	0	109.3	T1052 S1094 K1099	T1052-K1097 HydrophobicContact CG2-CB 4.41Å; T1052-K1097 HydrophobicContact CG2-CG 3.54Å; S1094-K1097 WeakPolarHBondContact CB-O 3.5Å; S1094-K1097 PolarHBondContact OG-N 3.22Å; S1094-K1097 PolarHBondContact OG-O 2.9Å; K1097-K1099 WeakPolarHBondContact O-CA 3.41Å; K1097-K1099 WeakPolarHBondContact O-CB 3.27Å; K1097-K1099 WeakPolarHBondContact O-CG 3.45Å; K1097-K1099 PolarHBondContact O-N 3.39Å
1098	K	86.3	Confident	90.6	Very high	118 Å²	118	43.4 Å²	43.4	51%	0.513	21%	0.208	S	C	.	.	S	Bend	trans	-25.7	69.4	175.9	-66.6	-168.2	177.8	-166.7	0	116	D985 V989	D985-K1098 IonicContact OD1-NZ 3.24Å; D985-K1098 WeakPolarHBondContact OD2-CE 3.37Å; D985-K1098 IonicContact OD2-NZ 3.65Å; D985-K1098 PolarHBondContact OD2-NZ 3.31Å; V989-K1098 HydrophobicContact CG2-CB 3.62Å; V989-K1098 HydrophobicContact CG2-CD 4.07Å; V989-K1098 HydrophobicContact CG2-CG 3.93Å
1099	K	92	Very high	90	Very high	110 Å²	110	47 Å²	47	48%	0.478	23%	0.228	S	C	.	.			trans	-145.6	152.2	-171.3	-73.5	-172.9	178.4	-178.8	0	107.3	T1052 S1094 K1097 F1101	T1052-K1099 PolarHBondContact O-NZ 2.8Å; S1094-K1099 PolarHBondContact N-O 3.13Å; K1097-K1099 WeakPolarHBondContact O-CA 3.41Å; K1097-K1099 WeakPolarHBondContact O-CB 3.27Å; K1097-K1099 WeakPolarHBondContact O-CG 3.45Å; K1097-K1099 PolarHBondContact O-N 3.39Å; K1099-F1101 HydrophobicContact CB-CZ 4.16Å; K1099-F1101 HydrophobicContact CD-CE1 4.45Å; K1099-F1101 HydrophobicContact CD-CZ 4.33Å
1100	V	94.2	Very high	89	Confident	25 Å²	25	55.7 Å²	55.7	15%	0.152	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	138.3	176.2	-175.9	0	0	0	0	107.8	V989 L990 Q993 L1000 F1091 A1092	V989-V1100 HydrophobicContact CG1-CG2 3.83Å; L990-V1100 HydrophobicContact CD2-CG1 3.86Å; L990-V1100 HydrophobicContact CD2-CG2 3.79Å; L990-V1100 HydrophobicContact CG-CG2 4.37Å; Q993-V1100 HydrophobicContact CB-CB 4.22Å; Q993-V1100 HydrophobicContact CB-CG2 3.77Å; Q993-V1100 HydrophobicContact CG-CB 3.97Å; Q993-V1100 HydrophobicContact CG-CG1 4.44Å; Q993-V1100 HydrophobicContact CG-CG2 4.1Å; L1000-V1100 HydrophobicContact CD2-CG1 4.36Å; F1091-V1100 HydrophobicContact CD1-CG1 3.84Å; A1092-V1100 CarbonylContact O-C 3.5Å; A1092-V1100 VanDerWaalsContact O-CA 3.26Å; A1092-V1100 WeakPolarHBondContact O-CA 3.5Å
1101	F	95.5	Very high	87.9	Confident	10 Å²	10	57.9 Å²	57.9	4%	0.044	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	156.5	173.9	-51.9	-72	0	0	0	109.4	T1049 A1051 S1053 Q1054 F1057 F1091 A1092 K1099	T1049-F1101 HydrophobicContact CG2-CD2 3.73Å; T1049-F1101 HydrophobicContact CG2-CE2 3.97Å; A1051-F1101 HydrophobicContact CB-CD2 4.38Å; A1051-F1101 HydrophobicContact CB-CE2 3.92Å; A1051-F1101 HydrophobicContact CB-CZ 4.36Å; A1051-F1101 VanDerWaalsContact O-CE2 3.25Å; A1051-F1101 WeakPolarHBondContact O-CE2 3.13Å; A1051-F1101 WeakPolarHBondContact O-CZ 3.21Å; S1053-F1101 WeakPolarHBondContact O-CE1 3.31Å; Q1054-F1101 HydrophobicContact CB-CD1 4.4Å; F1057-F1101 HydrophobicContact CB-CB 3.91Å; F1057-F1101 HydrophobicContact CB-CD1 4.3Å; F1057-F1101 HydrophobicContact CB-CD2 4.08Å; F1057-F1101 HydrophobicContact CB-CG 3.83Å; F1057-F1101 HydrophobicContact CD1-CB 3.33Å; F1057-F1101 HydrophobicContact CD1-CG 4.21Å; F1057-F1101 HydrophobicContact CD2-CB 4.12Å; F1057-F1101 HydrophobicContact CE1-CB 3.75Å; F1057-F1101 HydrophobicContact CE2-CB 4.49Å; F1057-F1101 HydrophobicContact CG-CB 3.5Å; F1057-F1101 HydrophobicContact CG-CD2 4.26Å; F1057-F1101 AromaticContact CG-CG 3.96Å; F1057-F1101 HydrophobicContact CG-CG 3.96Å; F1057-F1101 HydrophobicContact CZ-CB 4.3Å; F1091-F1101 CarbonylContact C-O 3.6Å; F1091-F1101 WeakPolarHBondContact CA-O 3.38Å; A1092-F1101 PolarHBondContact N-O 3.48Å; A1092-F1101 PolarHBondContact O-N 2.92Å; K1099-F1101 HydrophobicContact CB-CZ 4.16Å; K1099-F1101 HydrophobicContact CD-CE1 4.45Å; K1099-F1101 HydrophobicContact CD-CZ 4.33Å
1102	Y	94.3	Very high	87	Confident	68 Å²	68	59.9 Å²	59.9	27%	0.267	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	140.1	-173.8	170.6	-108.8	0	0	0	110.8	F999 Q1054 F1089 I1090 F1091 K1104	F999-Y1102 AromaticContact CD1-CE2 3.93Å; F999-Y1102 HydrophobicContact CD1-CE2 3.93Å; F999-Y1102 AromaticContact CE1-CE2 3.87Å; F999-Y1102 HydrophobicContact CE1-CE2 3.87Å; Q1054-Y1102 PolarHBondContact NE2-O 2.8Å; F1089-Y1102 HydrophobicContact CB-CE2 3.76Å; F1089-Y1102 HydrophobicContact CD2-CE2 4.46Å; F1089-Y1102 HydrophobicContact CG-CE2 4.36Å; I1090-Y1102 CarbonylContact O-C 3.45Å; I1090-Y1102 WeakPolarHBondContact O-CA 3.38Å; F1091-Y1102 AromaticContact CD1-CD2 3.76Å; F1091-Y1102 HydrophobicContact CD1-CD2 3.76Å; F1091-Y1102 HydrophobicContact CD1-CG 4.24Å; F1091-Y1102 HydrophobicContact CD2-CD2 4.05Å; F1091-Y1102 HydrophobicContact CD2-CE2 4.49Å; F1091-Y1102 AromaticContact CE1-CD2 3.38Å; F1091-Y1102 HydrophobicContact CE1-CD2 3.38Å; F1091-Y1102 HydrophobicContact CE1-CE2 4.27Å; F1091-Y1102 AromaticContact CE1-CG 3.79Å; F1091-Y1102 HydrophobicContact CE1-CG 3.79Å; F1091-Y1102 AromaticContact CE2-CD2 3.67Å; F1091-Y1102 HydrophobicContact CE2-CD2 3.67Å; F1091-Y1102 AromaticContact CE2-CE2 3.87Å; F1091-Y1102 HydrophobicContact CE2-CE2 3.87Å; F1091-Y1102 HydrophobicContact CG-CD2 4.09Å; F1091-Y1102 AromaticContact CZ-CD2 3.33Å; F1091-Y1102 HydrophobicContact CZ-CD2 3.33Å; F1091-Y1102 AromaticContact CZ-CE2 3.75Å; F1091-Y1102 HydrophobicContact CZ-CE2 3.75Å; F1091-Y1102 HydrophobicContact CZ-CG 4.09Å; Y1102-K1104 HydrophobicContact CE1-CB 4.13Å; Y1102-K1104 WeakPolarHBondContact OH-CB 3.38Å
1103	K	92.5	Very high	85.9	Confident	54 Å²	54	65 Å²	65	24%	0.235	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	128.9	168.7	-169.4	67	165.4	-175.7	0	109.9	F1057 E1058 I1061 F1089 I1090	F1057-K1103 HydrophobicContact CE1-CB 4.07Å; E1058-K1103 HydrophobicContact CG-CD 4.47Å; E1058-K1103 IonicContact OE1-NZ 3.9Å; E1058-K1103 PolarHBondContact OE1-NZ 3.3Å; I1061-K1103 HydrophobicContact CD1-CB 3.59Å; I1061-K1103 HydrophobicContact CD1-CG 3.86Å; F1089-K1103 CarbonylContact C-O 3.56Å; F1089-K1103 VanDerWaalsContact CA-O 3.31Å; F1089-K1103 WeakPolarHBondContact CA-O 3.25Å; I1090-K1103 PolarHBondContact N-O 2.9Å; I1090-K1103 PolarHBondContact O-N 3.3Å
1104	K	92.4	Very high	84.5	Confident	82 Å²	82	68.6 Å²	68.6	36%	0.357	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	146.4	171.4	-163.2	-178.9	-176.7	-170.4	0	110.3	Y1102 E1106	Y1102-K1104 HydrophobicContact CE1-CB 4.13Å; Y1102-K1104 WeakPolarHBondContact OH-CB 3.38Å; K1104-E1106 HydrophobicContact CD-CG 4.3Å; K1104-E1106 WeakPolarHBondContact CE-OE1 3.36Å; K1104-E1106 HydrophobicContact CG-CG 4.48Å; K1104-E1106 IonicContact NZ-OE1 2.68Å; K1104-E1106 PolarHBondContact NZ-OE1 3.46Å
1105	I	90.4	Very high	83.1	Confident	3 Å²	3	74.5 Å²	74.5	2%	0.015	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	125.9	175.2	-50.3	176.7	0	0	0	107.7	R1070 M1074 Q1087 D1088 I1090 L1111	R1070-I1105 HydrophobicContact CB-CD1 3.44Å; R1070-I1105 VanDerWaalsContact CB-CD1 3.44Å; R1070-I1105 HydrophobicContact CG-CD1 3.97Å; M1074-I1105 HydrophobicContact SD-CB 4.28Å; M1074-I1105 HydrophobicContact SD-CG2 3.73Å; Q1087-I1105 CarbonylContact C-O 3.58Å; Q1087-I1105 WeakPolarHBondContact CA-O 3.19Å; D1088-I1105 HydrophobicContact CB-CB 4.37Å; D1088-I1105 PolarHBondContact N-O 3.49Å; D1088-I1105 PolarHBondContact O-N 2.99Å; D1088-I1105 VanDerWaalsContact O-O 3.1Å; I1090-I1105 HydrophobicContact CD1-CD1 4.23Å; I1090-I1105 HydrophobicContact CG1-CD1 4.33Å; I1105-L1111 HydrophobicContact CD1-CD2 4.41Å; I1105-L1111 HydrophobicContact CG1-CD2 3.96Å; I1105-L1111 HydrophobicContact CG2-CD2 4.44Å
1106	E	90.4	Very high	82.1	Confident	67 Å²	67	75.3 Å²	75.3	31%	0.313	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	144.6	175.6	-54.2	-170.7	172.1	0	0	110.4	Q1087 K1104 G1108 D1109 Y1112	Q1087-E1106 HydrophobicContact CG-CG 4.37Å; K1104-E1106 HydrophobicContact CD-CG 4.3Å; K1104-E1106 WeakPolarHBondContact CE-OE1 3.36Å; K1104-E1106 HydrophobicContact CG-CG 4.48Å; K1104-E1106 IonicContact NZ-OE1 2.68Å; K1104-E1106 PolarHBondContact NZ-OE1 3.46Å; E1106-G1108 PolarHBondContact O-N 3.41Å; E1106-D1109 WeakPolarHBondContact CB-OD2 3.28Å; E1106-D1109 WeakPolarHBondContact O-CB 3.34Å; E1106-D1109 PolarHBondContact O-N 2.85Å; E1106-Y1112 VanDerWaalsContact O-CB 3.32Å; E1106-Y1112 WeakPolarHBondContact O-CB 3.37Å
1107	R	86	Confident	81.4	Confident	65 Å²	65	72.2 Å²	72.2	25%	0.245	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	126.5	178.7	177.6	-179.5	-70.6	-77.5	-12.3	108.9	M1074 D1075 G1085 N1086 Y1112	M1074-R1107 HydrophobicContact CE-CB 3.79Å; M1074-R1107 VanDerWaalsContact CE-N 3.26Å; M1074-R1107 PolarHBondContact O-NH2 3.13Å; D1075-R1107 VanDerWaalsContact N-NH2 3.18Å; D1075-R1107 IonicContact OD1-CZ 3.67Å; D1075-R1107 IonicContact OD1-NH1 3.72Å; D1075-R1107 PolarHBondContact OD1-NH1 2.85Å; D1075-R1107 IonicContact OD1-NH2 3.87Å; D1075-R1107 PolarHBondContact OD1-NH2 2.88Å; G1085-R1107 VanDerWaalsContact O-CZ 3.31Å; G1085-R1107 PolarHBondContact O-NE 2.86Å; G1085-R1107 PolarHBondContact O-NH2 3.5Å; N1086-R1107 PolarHBondContact O-N 2.95Å; R1107-Y1112 HydrophobicContact CG-CE1 4.13Å; R1107-Y1112 HydrophobicContact CG-CE2 4.18Å; R1107-Y1112 PolarHBondContact NH1-OH 2.96Å
1108	G	82.2	Confident	81.1	Confident	40 Å²	40	73.6 Å²	73.6	41%	0.412	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.7	-6.7	-179.9	0	0	0	0	0	114.9	E1106 L1113	E1106-G1108 PolarHBondContact O-N 3.41Å; G1108-L1113 VanDerWaalsContact O-CD1 3.25Å; G1108-L1113 WeakPolarHBondContact O-CD1 3.31Å
1109	D	80.5	Confident	80.9	Confident	78 Å²	78	69 Å²	69	42%	0.417	33%	0.331	S	S	.	.	S	Bend	trans	-69.6	161.4	172.8	-83.5	-2.3	0	0	0	111.7	E1106 L1111 Y1112 L1113	E1106-D1109 WeakPolarHBondContact CB-OD2 3.28Å; E1106-D1109 WeakPolarHBondContact O-CB 3.34Å; E1106-D1109 PolarHBondContact O-N 2.85Å; D1109-L1111 PolarHBondContact O-N 3.36Å; D1109-L1111 VanDerWaalsContact O-N 3.15Å; D1109-Y1112 WeakPolarHBondContact O-CA 3.22Å; D1109-Y1112 WeakPolarHBondContact O-CB 3.23Å; D1109-Y1112 PolarHBondContact O-N 3.45Å; D1109-L1113 PolarHBondContact O-N 3.4Å
1110	E	72.9	Confident	80.5	Confident	182 Å²	182	70 Å²	70	85%	0.85	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-38.7	-179.5	-172.8	-179.5	-180	0	0	112.7	Y1112 L1113 R1114	E1110-Y1112 VanDerWaalsContact C-N 3.35Å; E1110-L1113 PolarHBondContact O-N 2.85Å; E1110-R1114 PolarHBondContact O-N 3.21Å
1111	L	71.3	Confident	79.9	Confident	47 Å²	47	75.5 Å²	75.5	25%	0.246	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-37.3	177.1	-158.1	88.2	0	0	0	112.1	D1067 I1105 D1109	D1067-L1111 HydrophobicContact CB-CD1 4.35Å; D1067-L1111 HydrophobicContact CB-CD2 3.54Å; D1067-L1111 HydrophobicContact CB-CG 3.76Å; I1105-L1111 HydrophobicContact CD1-CD2 4.41Å; I1105-L1111 HydrophobicContact CG1-CD2 3.96Å; I1105-L1111 HydrophobicContact CG2-CD2 4.44Å; D1109-L1111 PolarHBondContact O-N 3.36Å; D1109-L1111 VanDerWaalsContact O-N 3.15Å
1112	Y	77	Confident	79.6	Confident	42 Å²	42	80.2 Å²	80.2	17%	0.165	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-34.8	179.5	166.6	-83.7	0	0	0	111.8	A1071 M1074 D1075 E1106 R1107 D1109 E1110 R1114	A1071-Y1112 HydrophobicContact CB-CD2 3.6Å; A1071-Y1112 HydrophobicContact CB-CE2 4.1Å; A1071-Y1112 HydrophobicContact CB-CG 4.32Å; M1074-Y1112 HydrophobicContact CB-CE2 4.42Å; M1074-Y1112 HydrophobicContact CE-CD2 4.3Å; M1074-Y1112 HydrophobicContact SD-CD2 4.3Å; D1075-Y1112 WeakPolarHBondContact OD1-CE2 3.17Å; D1075-Y1112 VanDerWaalsContact OD1-CZ 3.31Å; D1075-Y1112 PolarHBondContact OD1-OH 3.43Å; E1106-Y1112 VanDerWaalsContact O-CB 3.32Å; E1106-Y1112 WeakPolarHBondContact O-CB 3.37Å; R1107-Y1112 HydrophobicContact CG-CE1 4.13Å; R1107-Y1112 HydrophobicContact CG-CE2 4.18Å; R1107-Y1112 PolarHBondContact NH1-OH 2.96Å; D1109-Y1112 WeakPolarHBondContact O-CA 3.22Å; D1109-Y1112 WeakPolarHBondContact O-CB 3.23Å; D1109-Y1112 PolarHBondContact O-N 3.45Å; E1110-Y1112 VanDerWaalsContact C-N 3.35Å; Y1112-R1114 VanDerWaalsContact C-N 3.33Å; Y1112-R1114 PolarHBondContact O-N 3.39Å
1113	L	70.4	Confident	79.5	Confident	109 Å²	109	77.5 Å²	77.5	57%	0.571	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	5.7	-177.6	-65.8	176.6	0	0	0	114.7	G1108 D1109 E1110 D1115	G1108-L1113 VanDerWaalsContact O-CD1 3.25Å; G1108-L1113 WeakPolarHBondContact O-CD1 3.31Å; D1109-L1113 PolarHBondContact O-N 3.4Å; E1110-L1113 PolarHBondContact O-N 2.85Å; L1113-D1115 PolarHBondContact O-N 3.04Å; L1113-D1115 VanDerWaalsContact O-N 3.15Å
1114	R	65.4	Low	79.3	Confident	75 Å²	75	77.9 Å²	77.9	28%	0.283	37%	0.372	S	S	.	.			trans	-78.2	102.5	-171	-168.5	174.2	176	-165.5	-4.3	112.4	D1062 E1110 Y1112	D1062-R1114 IonicContact OD1-CZ 2.69Å; D1062-R1114 IonicContact OD1-NH1 2.65Å; D1062-R1114 PolarHBondContact OD1-NH1 3.05Å; D1062-R1114 IonicContact OD1-NH2 2.85Å; D1062-R1114 PolarHBondContact OD1-NH2 3.23Å; D1062-R1114 IonicContact OD2-NH1 3.33Å; D1062-R1114 IonicContact OD2-NH2 3.02Å; E1110-R1114 PolarHBondContact O-N 3.21Å; Y1112-R1114 VanDerWaalsContact C-N 3.33Å; Y1112-R1114 PolarHBondContact O-N 3.39Å
1115	D	61.7	Low	79.3	Confident	123 Å²	123	78.8 Å²	78.8	66%	0.658	38%	0.378	S	S	*	.			trans	-77	-26.9	-177.7	-79.2	-29.8	0	0	0	115.2	L1113	L1113-D1115 PolarHBondContact O-N 3.04Å; L1113-D1115 VanDerWaalsContact O-N 3.15Å
1116	K	66.7	Low	79.4	Confident	68 Å²	68	79 Å²	79	30%	0.296	38%	0.381	S	S	.	.	S	Bend	trans	-139	148.7	-173.1	-59.5	-72.4	168.3	163.1	0	112.1	K1179 K1180 T1182 N1183	K1116-K1179 PolarHBondContact NZ-O 3.2Å; K1116-K1180 WeakPolarHBondContact CD-O 3.47Å; K1116-T1182 PolarHBondContact NZ-O 2.98Å; K1116-N1183 VanDerWaalsContact CE-OD1 3.28Å; K1116-N1183 WeakPolarHBondContact CE-OD1 3.34Å
1117	P	68.2	Low	79.6	Confident	30 Å²	30	75.8 Å²	75.8	20%	0.195	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-60.5	150.1	174	-18.5	31	0	0	0	111.5	K1180 F1181	P1117-K1180 VanDerWaalsContact CD-O 3.27Å; P1117-K1180 WeakPolarHBondContact CD-O 3.35Å; P1117-K1180 HydrophobicContact CG-CG 3.97Å; P1117-F1181 HydrophobicContact CB-CD1 4.31Å; P1117-F1181 HydrophobicContact CB-CE1 3.78Å; P1117-F1181 HydrophobicContact CB-CZ 4.33Å; P1117-F1181 HydrophobicContact CG-CE1 4.2Å; P1117-F1181 HydrophobicContact CG-CZ 4.5Å
1118	K	72.2	Confident	80.1	Confident	150 Å²	150	78.6 Å²	78.6	65%	0.652	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-85	141.6	178	-173.1	-179.1	175.8	-176.8	0	108.8
1119	L	81.9	Confident	80.7	Confident	21 Å²	21	82 Å²	82	11%	0.11	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-70.6	145.9	171.7	-62.5	-173.5	0	0	0	110.7	Q1123 V1127 V1148 V1152 F1181	L1119-Q1123 HydrophobicContact CB-CB 4.21Å; L1119-V1127 HydrophobicContact CD1-CG2 3.91Å; L1119-V1148 HydrophobicContact CD2-CG1 3.29Å; L1119-V1152 HydrophobicContact CD1-CB 4.41Å; L1119-V1152 HydrophobicContact CD1-CG1 4.04Å; L1119-V1152 HydrophobicContact CD1-CG2 4.36Å; L1119-F1181 HydrophobicContact CD2-CD1 3.98Å; L1119-F1181 HydrophobicContact CD2-CE1 4.19Å
1120	Y	84	Confident	81.4	Confident	131 Å²	131	78.4 Å²	78.4	51%	0.514	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-67.3	151.9	167.2	-62.5	-64.4	0	0	0	110.3	Y1122 Q1123 E1124	Y1120-Y1122 AromaticContact CD2-CE1 3.81Å; Y1120-Y1122 HydrophobicContact CD2-CE1 3.81Å; Y1120-Y1122 HydrophobicContact CG-CD1 4.46Å; Y1120-Y1122 AromaticContact CG-CE1 3.77Å; Y1120-Y1122 HydrophobicContact CG-CE1 3.77Å; Y1120-Y1122 PolarHBondContact O-N 3.16Å; Y1120-Y1122 VanDerWaalsContact O-N 3.14Å; Y1120-Q1123 HydrophobicContact CD2-CG 4.46Å; Y1120-Q1123 VanDerWaalsContact N-OE1 3.07Å; Y1120-Q1123 WeakPolarHBondContact O-CA 3.31Å; Y1120-Q1123 WeakPolarHBondContact O-CB 3.5Å; Y1120-Q1123 PolarHBondContact O-N 3.33Å; Y1120-E1124 PolarHBondContact O-N 3.22Å
1121	D	82.1	Confident	82.5	Confident	140 Å²	140	71.9 Å²	71.9	75%	0.749	33%	0.334	S	S	*	.	H	α-helix	trans	-55.3	-38.1	-175.9	-64.2	-18.9	0	0	0	113.2	Q1123 E1124 E1125	D1121-Q1123 VanDerWaalsContact C-N 3.35Å; D1121-E1124 WeakPolarHBondContact O-CB 3.44Å; D1121-E1124 PolarHBondContact O-N 2.7Å; D1121-E1125 PolarHBondContact O-N 3.31Å; D1121-E1125 VanDerWaalsContact O-N 3.07Å
1122	Y	90	Very high	83.6	Confident	109 Å²	109	73.4 Å²	73.4	43%	0.427	35%	0.354	S	S	.	.	H	α-helix	trans	-70.2	-29.8	176.5	75.8	-90.2	0	0	0	112.9	Y1120 E1125 G1126 T1144	Y1120-Y1122 AromaticContact CD2-CE1 3.81Å; Y1120-Y1122 HydrophobicContact CD2-CE1 3.81Å; Y1120-Y1122 HydrophobicContact CG-CD1 4.46Å; Y1120-Y1122 AromaticContact CG-CE1 3.77Å; Y1120-Y1122 HydrophobicContact CG-CE1 3.77Å; Y1120-Y1122 PolarHBondContact O-N 3.16Å; Y1120-Y1122 VanDerWaalsContact O-N 3.14Å; Y1122-E1125 WeakPolarHBondContact O-CB 3.32Å; Y1122-E1125 PolarHBondContact O-N 2.8Å; Y1122-G1126 PolarHBondContact O-N 3.08Å; Y1122-T1144 WeakPolarHBondContact CE2-O 3.23Å; Y1122-T1144 PolarHBondContact OH-O 3.45Å
1123	Q	90.8	Very high	84.4	Confident	12 Å²	12	75.7 Å²	75.7	6%	0.056	37%	0.367	C	S	.	.	H	α-helix	trans	-72.2	-37.9	174.8	-64.1	176.2	-31.3	0	0	110.3	L1119 Y1120 D1121 E1125 G1126 V1127 T1144 Q1149	L1119-Q1123 HydrophobicContact CB-CB 4.21Å; Y1120-Q1123 HydrophobicContact CD2-CG 4.46Å; Y1120-Q1123 VanDerWaalsContact N-OE1 3.07Å; Y1120-Q1123 WeakPolarHBondContact O-CA 3.31Å; Y1120-Q1123 WeakPolarHBondContact O-CB 3.5Å; Y1120-Q1123 PolarHBondContact O-N 3.33Å; D1121-Q1123 VanDerWaalsContact C-N 3.35Å; Q1123-E1125 VanDerWaalsContact C-N 3.3Å; Q1123-E1125 PolarHBondContact O-N 2.85Å; Q1123-G1126 PolarHBondContact O-N 3.27Å; Q1123-V1127 VanDerWaalsContact O-CG2 3.26Å; Q1123-V1127 WeakPolarHBondContact O-CG2 3.26Å; Q1123-V1127 PolarHBondContact O-N 3.47Å; Q1123-T1144 PolarHBondContact NE2-O 3.08Å; Q1123-Q1149 HydrophobicContact CB-CG 4Å; Q1123-Q1149 HydrophobicContact CG-CG 4.26Å
1124	E	89.1	Confident	85.7	Confident	62 Å²	62	74.4 Å²	74.4	29%	0.29	36%	0.357	S	S	.	.	H	α-helix	trans	-63.2	-36.5	174.1	-170.3	63.8	-150.6	0	0	111.6	Y1120 D1121 R1128 R1156	Y1120-E1124 PolarHBondContact O-N 3.22Å; D1121-E1124 WeakPolarHBondContact O-CB 3.44Å; D1121-E1124 PolarHBondContact O-N 2.7Å; E1124-R1128 PolarHBondContact O-N 3.19Å; E1124-R1128 VanDerWaalsContact O-N 3.15Å; E1124-R1156 IonicContact OE1-CZ 2.9Å; E1124-R1156 IonicContact OE1-NH1 2.67Å; E1124-R1156 PolarHBondContact OE1-NH1 2.89Å; E1124-R1156 IonicContact OE1-NH2 3.58Å; E1124-R1156 PolarHBondContact OE1-NH2 3.01Å; E1124-R1156 VanDerWaalsContact OE1-NH2 3.17Å; E1124-R1156 IonicContact OE2-CZ 3.74Å; E1124-R1156 IonicContact OE2-NH1 4Å; E1124-R1156 IonicContact OE2-NH2 2.93Å; E1124-R1156 PolarHBondContact OE2-NH2 3.08Å
1125	E	91.5	Very high	87.1	Confident	101 Å²	101	74.5 Å²	74.5	47%	0.472	36%	0.357	S	S	.	.	H	α-helix	trans	-61.7	-49.5	169.4	-170.1	63.8	-141.8	0	0	111.9	D1121 Y1122 Q1123 V1127 R1128 M1129	D1121-E1125 PolarHBondContact O-N 3.31Å; D1121-E1125 VanDerWaalsContact O-N 3.07Å; Y1122-E1125 WeakPolarHBondContact O-CB 3.32Å; Y1122-E1125 PolarHBondContact O-N 2.8Å; Q1123-E1125 VanDerWaalsContact C-N 3.3Å; Q1123-E1125 PolarHBondContact O-N 2.85Å; E1125-V1127 PolarHBondContact O-N 2.66Å; E1125-R1128 WeakPolarHBondContact O-CB 3.24Å; E1125-R1128 PolarHBondContact O-N 3.24Å; E1125-R1128 VanDerWaalsContact O-N 3.13Å; E1125-R1128 IonicContact OE1-CZ 3.83Å; E1125-R1128 IonicContact OE1-NH1 3.04Å; E1125-R1128 PolarHBondContact OE1-NH1 3.21Å; E1125-R1128 IonicContact OE2-CZ 3.55Å; E1125-R1128 IonicContact OE2-NH1 3.51Å; E1125-R1128 PolarHBondContact OE2-NH1 3.3Å; E1125-R1128 IonicContact OE2-NH2 2.8Å; E1125-R1128 PolarHBondContact OE2-NH2 3.47Å; E1125-M1129 PolarHBondContact O-N 3.35Å
1126	G	93.6	Very high	88.7	Confident	7 Å²	7	69.4 Å²	69.4	7%	0.072	33%	0.331	C	S	.	.	H	α-helix	trans	-57	-46.5	177.5	0	0	0	0	0	112.7	Y1122 Q1123 R1128 M1129 E1130	Y1122-G1126 PolarHBondContact O-N 3.08Å; Q1123-G1126 PolarHBondContact O-N 3.27Å; G1126-R1128 VanDerWaalsContact C-N 3.31Å; G1126-R1128 PolarHBondContact O-N 3.42Å; G1126-M1129 PolarHBondContact O-N 3.32Å; G1126-E1130 WeakPolarHBondContact O-CG 3.4Å; G1126-E1130 PolarHBondContact O-N 3.14Å
1127	V	95	Very high	90	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-57.1	-44.1	174.8	171.9	0	0	0	0	111.4	L1119 Q1123 E1125 M1129 E1130 L1131 Q1149 V1152 A1153	L1119-V1127 HydrophobicContact CD1-CG2 3.91Å; Q1123-V1127 VanDerWaalsContact O-CG2 3.26Å; Q1123-V1127 WeakPolarHBondContact O-CG2 3.26Å; Q1123-V1127 PolarHBondContact O-N 3.47Å; E1125-V1127 PolarHBondContact O-N 2.66Å; V1127-M1129 VanDerWaalsContact C-N 3.33Å; V1127-E1130 PolarHBondContact O-N 3.1Å; V1127-L1131 HydrophobicContact CG1-CD1 3.98Å; V1127-L1131 HydrophobicContact CG1-CG 4.5Å; V1127-L1131 WeakPolarHBondContact O-CB 3.21Å; V1127-L1131 VanDerWaalsContact O-CG 3.29Å; V1127-L1131 WeakPolarHBondContact O-CG 3.44Å; V1127-L1131 PolarHBondContact O-N 3.19Å; V1127-Q1149 HydrophobicContact CG2-CB 4.18Å; V1127-Q1149 WeakPolarHBondContact CG2-O 3.26Å; V1127-V1152 HydrophobicContact CG1-CG1 4.18Å; V1127-V1152 HydrophobicContact CG2-CB 4.15Å; V1127-V1152 HydrophobicContact CG2-CG1 4.17Å; V1127-A1153 HydrophobicContact CG1-CB 4.14Å
1128	R	94.7	Very high	91.2	Very high	123 Å²	123	67.3 Å²	67.3	46%	0.464	32%	0.321	S	S	.	.	H	α-helix	trans	-66.2	-38.3	-179.7	-159.2	-179.8	-27.9	100.4	6.8	111.8	E1124 E1125 G1126 A1132	E1124-R1128 PolarHBondContact O-N 3.19Å; E1124-R1128 VanDerWaalsContact O-N 3.15Å; E1125-R1128 WeakPolarHBondContact O-CB 3.24Å; E1125-R1128 PolarHBondContact O-N 3.24Å; E1125-R1128 VanDerWaalsContact O-N 3.13Å; E1125-R1128 IonicContact OE1-CZ 3.83Å; E1125-R1128 IonicContact OE1-NH1 3.04Å; E1125-R1128 PolarHBondContact OE1-NH1 3.21Å; E1125-R1128 IonicContact OE2-CZ 3.55Å; E1125-R1128 IonicContact OE2-NH1 3.51Å; E1125-R1128 PolarHBondContact OE2-NH1 3.3Å; E1125-R1128 IonicContact OE2-NH2 2.8Å; E1125-R1128 PolarHBondContact OE2-NH2 3.47Å; G1126-R1128 VanDerWaalsContact C-N 3.31Å; G1126-R1128 PolarHBondContact O-N 3.42Å; R1128-A1132 WeakPolarHBondContact O-CB 3.35Å; R1128-A1132 PolarHBondContact O-N 2.94Å
1129	M	94.6	Very high	92.1	Very high	111 Å²	111	61.9 Å²	61.9	55%	0.547	31%	0.308	S	S	.	.	H	α-helix	trans	-67.4	-45.8	176.9	-172.5	168.7	65.2	0	0	111.7	E1125 G1126 V1127 L1131 A1132 M1133	E1125-M1129 PolarHBondContact O-N 3.35Å; G1126-M1129 PolarHBondContact O-N 3.32Å; V1127-M1129 VanDerWaalsContact C-N 3.33Å; M1129-L1131 PolarHBondContact O-N 3.04Å; M1129-A1132 PolarHBondContact O-N 3.3Å; M1129-M1133 HydrophobicContact CG-CG 4.23Å; M1129-M1133 WeakPolarHBondContact O-CB 3.46Å; M1129-M1133 VanDerWaalsContact O-CG 3.27Å; M1129-M1133 WeakPolarHBondContact O-CG 3.48Å; M1129-M1133 PolarHBondContact O-N 2.81Å
1130	E	96.2	Very high	92.5	Very high	3 Å²	3	63.4 Å²	63.4	1%	0.014	32%	0.316	C	S	.	.	H	α-helix	trans	-59.7	-45.4	176	-73.3	179.2	152.5	0	0	111.5	G1126 V1127 A1132 M1133 K1134 N1138 S1150 A1153 Y1277	G1126-E1130 WeakPolarHBondContact O-CG 3.4Å; G1126-E1130 PolarHBondContact O-N 3.14Å; V1127-E1130 PolarHBondContact O-N 3.1Å; E1130-A1132 VanDerWaalsContact C-N 3.34Å; E1130-A1132 PolarHBondContact O-N 3Å; E1130-M1133 PolarHBondContact O-N 3.22Å; E1130-K1134 PolarHBondContact O-N 2.67Å; E1130-N1138 PolarHBondContact OE1-ND2 3.46Å; E1130-S1150 PolarHBondContact OE1-OG 2.96Å; E1130-S1150 WeakPolarHBondContact OE2-CA 3.35Å; E1130-S1150 PolarHBondContact OE2-N 3.17Å; E1130-A1153 HydrophobicContact CB-CB 3.95Å; E1130-Y1277 HydrophobicContact CB-CD1 4.5Å; E1130-Y1277 HydrophobicContact CB-CE1 3.92Å; E1130-Y1277 HydrophobicContact CB-CE2 4.28Å; E1130-Y1277 PolarHBondContact O-OH 3.22Å
1131	L	95	Very high	92.7	Very high	45 Å²	45	63 Å²	63	24%	0.236	32%	0.323	C	S	.	.	H	α-helix	trans	-58	-42	174.7	-78.4	171.2	0	0	0	113	V1127 M1129 A1153 R1156 A1157	V1127-L1131 HydrophobicContact CG1-CD1 3.98Å; V1127-L1131 HydrophobicContact CG1-CG 4.5Å; V1127-L1131 WeakPolarHBondContact O-CB 3.21Å; V1127-L1131 VanDerWaalsContact O-CG 3.29Å; V1127-L1131 WeakPolarHBondContact O-CG 3.44Å; V1127-L1131 PolarHBondContact O-N 3.19Å; M1129-L1131 PolarHBondContact O-N 3.04Å; L1131-A1153 HydrophobicContact CD2-CB 4.48Å; L1131-A1153 VanDerWaalsContact CD2-O 3.22Å; L1131-A1153 WeakPolarHBondContact CD2-O 3.5Å; L1131-A1153 HydrophobicContact CG-CB 4.18Å; L1131-R1156 HydrophobicContact CD1-CB 4.02Å; L1131-R1156 HydrophobicContact CD2-CB 4.2Å; L1131-A1157 HydrophobicContact CD2-CB 3.76Å
1132	A	95.5	Very high	92.9	Very high	80 Å²	80	63.6 Å²	63.6	66%	0.661	32%	0.323	S	S	*	.	H	α-helix	trans	-71.7	-41.5	-180	0	0	0	0	0	112.2	R1128 M1129 E1130	R1128-A1132 WeakPolarHBondContact O-CB 3.35Å; R1128-A1132 PolarHBondContact O-N 2.94Å; M1129-A1132 PolarHBondContact O-N 3.3Å; E1130-A1132 VanDerWaalsContact C-N 3.34Å; E1130-A1132 PolarHBondContact O-N 3Å
1133	M	94.4	Very high	92.6	Very high	90 Å²	90	62.2 Å²	62.2	44%	0.443	34%	0.342	S	S	.	.	H	α-helix	trans	-79	-28.8	-175.5	-68.9	-66.3	-75	0	0	113.1	M1129 E1130 R1135 C1136 R1300	M1129-M1133 HydrophobicContact CG-CG 4.23Å; M1129-M1133 WeakPolarHBondContact O-CB 3.46Å; M1129-M1133 VanDerWaalsContact O-CG 3.27Å; M1129-M1133 WeakPolarHBondContact O-CG 3.48Å; M1129-M1133 PolarHBondContact O-N 2.81Å; E1130-M1133 PolarHBondContact O-N 3.22Å; M1133-R1135 PolarHBondContact O-N 2.89Å; M1133-C1136 HydrophobicContact CB-CB 3.95Å; M1133-R1300 PolarHBondContact O-NH2 3.09Å; M1133-R1300 VanDerWaalsContact O-NH2 3.11Å
1134	K	96.3	Very high	92.4	Very high	82 Å²	82	63.1 Å²	63.1	36%	0.357	35%	0.348	S	S	.	.	S	Bend	trans	61.5	-44.2	-176.8	-52.8	-177.2	175.7	-170.5	0	115.3	E1130 E1274 Y1275 I1276 Y1277	E1130-K1134 PolarHBondContact O-N 2.67Å; K1134-E1274 HydrophobicContact CD-CG 4.06Å; K1134-E1274 IonicContact NZ-OE1 3.37Å; K1134-E1274 PolarHBondContact NZ-OE1 3.4Å; K1134-Y1275 HydrophobicContact CB-CD1 4.07Å; K1134-Y1275 HydrophobicContact CB-CE1 4.1Å; K1134-Y1275 HydrophobicContact CD-CE1 4.5Å; K1134-Y1275 HydrophobicContact CG-CD1 4.34Å; K1134-Y1275 HydrophobicContact CG-CE1 3.85Å; K1134-Y1275 CarbonylContact O-C 3.19Å; K1134-Y1275 VanDerWaalsContact O-CA 3.24Å; K1134-Y1275 WeakPolarHBondContact O-CA 3.3Å; K1134-I1276 PolarHBondContact O-N 3.1Å; K1134-Y1277 WeakPolarHBondContact O-CE1 3.5Å
1135	R	96	Very high	92.4	Very high	76 Å²	76	61.2 Å²	61.2	29%	0.287	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	108.1	176.1	-59.1	-176.3	-179.8	170	0.2	109.6	M1133 K1273 E1274 I1276 L1298 R1300	M1133-R1135 PolarHBondContact O-N 2.89Å; R1135-K1273 VanDerWaalsContact CZ-O 3.22Å; R1135-K1273 PolarHBondContact NE-O 3.36Å; R1135-K1273 PolarHBondContact NH2-O 3.29Å; R1135-E1274 WeakPolarHBondContact CG-O 3.47Å; R1135-I1276 VanDerWaalsContact CA-O 3.26Å; R1135-I1276 WeakPolarHBondContact CA-O 3.28Å; R1135-I1276 HydrophobicContact CG-CB 4.2Å; R1135-I1276 HydrophobicContact CG-CD1 4.29Å; R1135-I1276 HydrophobicContact CG-CG1 4.3Å; R1135-L1298 HydrophobicContact CB-CD2 4.27Å; R1135-L1298 VanDerWaalsContact CD-O 3.26Å; R1135-L1298 WeakPolarHBondContact CD-O 3.43Å; R1135-R1300 VanDerWaalsContact O-CZ 3.29Å; R1135-R1300 PolarHBondContact O-NE 3.47Å; R1135-R1300 PolarHBondContact O-NH2 3.19Å
1136	C	94.8	Very high	92.5	Very high	17 Å²	17	57.3 Å²	57.3	12%	0.115	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	164.1	-173	56.4	0	0	0	0	113.5	M1133 I1276 E1278	M1133-C1136 HydrophobicContact CB-CB 3.95Å; C1136-I1276 PolarHBondContact N-O 3.14Å; C1136-E1278 PolarHBondContact O-N 2.72Å
1137	I	93.3	Very high	92.5	Very high	44 Å²	44	58.2 Å²	58.2	23%	0.226	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	119.5	166.9	-52.9	-177.6	0	0	0	107.8	G1139 E1278 T1280 P1283 M1291 Q1294 L1298	I1137-G1139 PolarHBondContact O-N 3.32Å; I1137-E1278 CarbonylContact C-O 3.53Å; I1137-E1278 VanDerWaalsContact CA-O 3.26Å; I1137-E1278 WeakPolarHBondContact CA-O 3.14Å; I1137-E1278 HydrophobicContact CG1-CB 4.18Å; I1137-E1278 HydrophobicContact CG2-CB 4.47Å; I1137-T1280 HydrophobicContact CG2-CG2 3.82Å; I1137-P1283 HydrophobicContact CG2-CB 4.38Å; I1137-M1291 HydrophobicContact CD1-CE 4.02Å; I1137-Q1294 HydrophobicContact CD1-CB 4.29Å; I1137-L1298 HydrophobicContact CD1-CD1 4.29Å; I1137-L1298 HydrophobicContact CG1-CD1 3.64Å
1138	N	94.3	Very high	92.4	Very high	9 Å²	9	58.5 Å²	58.5	5%	0.048	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	97.4	167.7	-170	-27.7	0	0	0	108.7	E1130 D1140 K1146 Q1149 E1278 L1279 T1280	E1130-N1138 PolarHBondContact OE1-ND2 3.46Å; N1138-D1140 WeakPolarHBondContact OD1-CB 3.5Å; N1138-D1140 PolarHBondContact OD1-N 3.49Å; N1138-K1146 WeakPolarHBondContact O-CD 3.29Å; N1138-Q1149 PolarHBondContact ND2-OE1 3.41Å; N1138-E1278 PolarHBondContact N-O 3.31Å; N1138-L1279 HydrophobicContact CB-CD2 3.7Å; N1138-T1280 PolarHBondContact O-N 3.3Å; N1138-T1280 VanDerWaalsContact O-N 3.14Å
1139	G	91.1	Very high	92.5	Very high	36 Å²	36	52.7 Å²	52.7	37%	0.371	31%	0.31	S	S	.	.			trans	-93.5	15.2	-176.6	0	0	0	0	0	114.8	I1137 T1280	I1137-G1139 PolarHBondContact O-N 3.32Å; G1139-T1280 CarbonylContact C-O 3.58Å; G1139-T1280 WeakPolarHBondContact CA-O 3.33Å
1140	D	90.5	Very high	92.6	Very high	54 Å²	54	47.4 Å²	47.4	29%	0.289	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-58.6	154.9	-179.3	-74	-6.8	0	0	0	111.8	N1138 T1144 K1146 Q1149	N1138-D1140 WeakPolarHBondContact OD1-CB 3.5Å; N1138-D1140 PolarHBondContact OD1-N 3.49Å; D1140-T1144 HydrophobicContact CB-CG2 4.28Å; D1140-T1144 VanDerWaalsContact CB-OG1 3.24Å; D1140-T1144 WeakPolarHBondContact CB-OG1 3.41Å; D1140-K1146 HydrophobicContact CB-CD 4.11Å; D1140-K1146 HydrophobicContact CB-CG 3.86Å; D1140-K1146 PolarHBondContact O-NZ 2.69Å; D1140-Q1149 PolarHBondContact OD2-NE2 3.33Å; D1140-Q1149 PolarHBondContact OD2-OE1 3.34Å
1141	D	87.1	Confident	92.6	Very high	122 Å²	122	47.3 Å²	47.3	65%	0.652	28%	0.284	S	S	*	.	P	Polyproline II helix	trans	-55.9	157.2	177.9	-81.3	-18.2	0	0	0	113.1	G1143 T1144 K1146	D1141-G1143 PolarHBondContact O-N 3.33Å; D1141-T1144 HydrophobicContact CB-CG2 3.99Å; D1141-T1144 WeakPolarHBondContact O-CG2 3.27Å; D1141-T1144 PolarHBondContact O-N 3.12Å; D1141-T1144 PolarHBondContact O-OG1 2.94Å; D1141-K1146 PolarHBondContact O-NZ 3.03Å
1142	M	87.5	Confident	92.5	Very high	153 Å²	153	45.5 Å²	45.5	75%	0.754	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	132.1	175.3	-61.3	178.6	73.7	0	0	110.3
1143	G	83.7	Confident	92.6	Very high	80 Å²	80	41.7 Å²	41.7	83%	0.825	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	93	-4.4	179.7	0	0	0	0	0	116.2	D1141 G1145	D1141-G1143 PolarHBondContact O-N 3.33Å; G1143-G1145 PolarHBondContact O-N 3.05Å
1144	T	86	Confident	92.7	Very high	30 Å²	30	37.4 Å²	37.4	18%	0.184	22%	0.222	C	C	.	.	S	Bend	trans	-74.6	-5.7	176.8	60.4	0	0	0	0	114.3	Y1122 Q1123 D1140 D1141	Y1122-T1144 WeakPolarHBondContact CE2-O 3.23Å; Y1122-T1144 PolarHBondContact OH-O 3.45Å; Q1123-T1144 PolarHBondContact NE2-O 3.08Å; D1140-T1144 HydrophobicContact CB-CG2 4.28Å; D1140-T1144 VanDerWaalsContact CB-OG1 3.24Å; D1140-T1144 WeakPolarHBondContact CB-OG1 3.41Å; D1141-T1144 HydrophobicContact CB-CG2 3.99Å; D1141-T1144 WeakPolarHBondContact O-CG2 3.27Å; D1141-T1144 PolarHBondContact O-N 3.12Å; D1141-T1144 PolarHBondContact O-OG1 2.94Å
1145	G	88.9	Confident	92.6	Very high	22 Å²	22	36 Å²	36	23%	0.227	22%	0.217	C	C	.	.			trans	82.9	33.9	-180	0	0	0	0	0	114.9	G1143 T1147 V1148 Q1149	G1143-G1145 PolarHBondContact O-N 3.05Å; G1145-T1147 PolarHBondContact O-N 3.22Å; G1145-V1148 WeakPolarHBondContact O-CB 3.37Å; G1145-V1148 PolarHBondContact O-N 3.39Å; G1145-Q1149 PolarHBondContact O-N 2.94Å; G1145-Q1149 VanDerWaalsContact O-N 3.12Å
1146	K	94.2	Very high	92.5	Very high	20 Å²	20	37.4 Å²	37.4	9%	0.087	22%	0.222	C	C	.	.	H	α-helix	trans	-45	-44.4	172.2	-67.9	-172.3	-74.2	-76	0	113.6	N1138 D1140 D1141 V1148 Q1149 S1150 L1279	N1138-K1146 WeakPolarHBondContact O-CD 3.29Å; D1140-K1146 HydrophobicContact CB-CD 4.11Å; D1140-K1146 HydrophobicContact CB-CG 3.86Å; D1140-K1146 PolarHBondContact O-NZ 2.69Å; D1141-K1146 PolarHBondContact O-NZ 3.03Å; K1146-V1148 VanDerWaalsContact C-N 3.28Å; K1146-V1148 PolarHBondContact O-N 3.36Å; K1146-Q1149 PolarHBondContact O-N 3.38Å; K1146-S1150 PolarHBondContact O-N 2.94Å; K1146-S1150 PolarHBondContact O-OG 3.03Å; K1146-S1150 VanDerWaalsContact O-OG 3.12Å; K1146-L1279 HydrophobicContact CB-CD1 4.5Å
1147	T	93.9	Very high	92.5	Very high	25 Å²	25	37.7 Å²	37.7	15%	0.153	23%	0.226	C	C	.	.	H	α-helix	trans	-52	-45.7	176	-55.3	0	0	0	0	112.4	G1145 I1151 W1174 E1177	G1145-T1147 PolarHBondContact O-N 3.22Å; T1147-I1151 WeakPolarHBondContact O-CG2 3.41Å; T1147-I1151 PolarHBondContact O-N 3.29Å; T1147-W1174 HydrophobicContact CG2-CD2 3.84Å; T1147-W1174 HydrophobicContact CG2-CE3 3.68Å; T1147-W1174 HydrophobicContact CG2-CH2 3.76Å; T1147-W1174 HydrophobicContact CG2-CZ2 3.92Å; T1147-W1174 HydrophobicContact CG2-CZ3 3.65Å; T1147-E1177 HydrophobicContact CG2-CB 3.85Å; T1147-E1177 HydrophobicContact CG2-CG 4.05Å
1148	V	93.3	Very high	92.6	Very high	6 Å²	6	43.7 Å²	43.7	4%	0.036	25%	0.25	C	S	.	.	H	α-helix	trans	-71.9	-42.8	-178.1	-179	0	0	0	0	110.7	L1119 G1145 K1146 S1150 I1151 V1152 F1181	L1119-V1148 HydrophobicContact CD2-CG1 3.29Å; G1145-V1148 WeakPolarHBondContact O-CB 3.37Å; G1145-V1148 PolarHBondContact O-N 3.39Å; K1146-V1148 VanDerWaalsContact C-N 3.28Å; K1146-V1148 PolarHBondContact O-N 3.36Å; V1148-S1150 PolarHBondContact O-N 2.87Å; V1148-I1151 WeakPolarHBondContact O-CG2 3.15Å; V1148-V1152 HydrophobicContact CG1-CG2 4.17Å; V1148-V1152 WeakPolarHBondContact O-CB 3.42Å; V1148-V1152 WeakPolarHBondContact O-CG2 3.39Å; V1148-V1152 PolarHBondContact O-N 2.94Å; V1148-F1181 HydrophobicContact CB-CD2 4.4Å; V1148-F1181 HydrophobicContact CB-CG 4.45Å; V1148-F1181 HydrophobicContact CG1-CB 3.97Å; V1148-F1181 HydrophobicContact CG1-CD1 3.54Å; V1148-F1181 HydrophobicContact CG1-CD2 3.93Å; V1148-F1181 HydrophobicContact CG1-CE1 3.91Å; V1148-F1181 HydrophobicContact CG1-CE2 4.29Å; V1148-F1181 HydrophobicContact CG1-CG 3.54Å; V1148-F1181 HydrophobicContact CG1-CZ 4.28Å; V1148-F1181 HydrophobicContact CG2-CD2 3.55Å; V1148-F1181 HydrophobicContact CG2-CE1 4.48Å; V1148-F1181 HydrophobicContact CG2-CE2 3.53Å; V1148-F1181 HydrophobicContact CG2-CG 4.08Å; V1148-F1181 HydrophobicContact CG2-CZ 4.01Å
1149	Q	95.2	Very high	92.6	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-55.9	-53.7	176.8	-62.2	179.1	21.8	0	0	110.6	Q1123 V1127 N1138 D1140 G1145 K1146 I1151 V1152 A1153	Q1123-Q1149 HydrophobicContact CB-CG 4Å; Q1123-Q1149 HydrophobicContact CG-CG 4.26Å; V1127-Q1149 HydrophobicContact CG2-CB 4.18Å; V1127-Q1149 WeakPolarHBondContact CG2-O 3.26Å; N1138-Q1149 PolarHBondContact ND2-OE1 3.41Å; D1140-Q1149 PolarHBondContact OD2-NE2 3.33Å; D1140-Q1149 PolarHBondContact OD2-OE1 3.34Å; G1145-Q1149 PolarHBondContact O-N 2.94Å; G1145-Q1149 VanDerWaalsContact O-N 3.12Å; K1146-Q1149 PolarHBondContact O-N 3.38Å; Q1149-I1151 PolarHBondContact O-N 3.26Å; Q1149-V1152 PolarHBondContact O-N 3.12Å; Q1149-A1153 WeakPolarHBondContact O-CB 2.97Å; Q1149-A1153 PolarHBondContact O-N 2.98Å
1150	S	96.7	Very high	92.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-67.9	-39.3	-174.4	-49.7	0	0	0	0	113.6	E1130 K1146 V1148 A1153 I1154 L1279	E1130-S1150 PolarHBondContact OE1-OG 2.96Å; E1130-S1150 WeakPolarHBondContact OE2-CA 3.35Å; E1130-S1150 PolarHBondContact OE2-N 3.17Å; K1146-S1150 PolarHBondContact O-N 2.94Å; K1146-S1150 PolarHBondContact O-OG 3.03Å; K1146-S1150 VanDerWaalsContact O-OG 3.12Å; V1148-S1150 PolarHBondContact O-N 2.87Å; S1150-A1153 PolarHBondContact O-N 3.41Å; S1150-I1154 WeakPolarHBondContact O-CG1 3.42Å; S1150-I1154 PolarHBondContact O-N 3.1Å; S1150-L1279 WeakPolarHBondContact OG-CD2 3.23Å
1151	I	96	Very high	92.9	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-70	-40	177.9	-166.5	73.3	0	0	0	112.1	T1147 V1148 Q1149 A1153 I1154 E1155 I1178 T1182 L1184 V1209	T1147-I1151 WeakPolarHBondContact O-CG2 3.41Å; T1147-I1151 PolarHBondContact O-N 3.29Å; V1148-I1151 WeakPolarHBondContact O-CG2 3.15Å; Q1149-I1151 PolarHBondContact O-N 3.26Å; I1151-A1153 VanDerWaalsContact C-N 3.31Å; I1151-A1153 PolarHBondContact O-N 2.88Å; I1151-I1154 PolarHBondContact O-N 2.88Å; I1151-E1155 PolarHBondContact O-N 3.04Å; I1151-I1178 HydrophobicContact CD1-CD1 4.23Å; I1151-I1178 HydrophobicContact CD1-CG1 3.81Å; I1151-I1178 HydrophobicContact CG1-CB 4.5Å; I1151-I1178 HydrophobicContact CG1-CG1 3.81Å; I1151-I1178 HydrophobicContact CG1-CG2 4.42Å; I1151-T1182 HydrophobicContact CB-CG2 4.4Å; I1151-T1182 HydrophobicContact CG1-CG2 3.86Å; I1151-T1182 HydrophobicContact CG2-CG2 3.8Å; I1151-L1184 HydrophobicContact CD1-CD1 4Å; I1151-L1184 HydrophobicContact CG1-CD1 4.22Å; I1151-V1209 HydrophobicContact CD1-CG2 4.03Å
1152	V	94.6	Very high	93.4	Very high	8 Å²	8	35.5 Å²	35.5	5%	0.048	20%	0.201	C	C	.	.	H	α-helix	trans	-66.5	-37.2	176.9	174	0	0	0	0	110.2	L1119 V1127 V1148 Q1149 E1155 R1156 F1181 T1182	L1119-V1152 HydrophobicContact CD1-CB 4.41Å; L1119-V1152 HydrophobicContact CD1-CG1 4.04Å; L1119-V1152 HydrophobicContact CD1-CG2 4.36Å; V1127-V1152 HydrophobicContact CG1-CG1 4.18Å; V1127-V1152 HydrophobicContact CG2-CB 4.15Å; V1127-V1152 HydrophobicContact CG2-CG1 4.17Å; V1148-V1152 HydrophobicContact CG1-CG2 4.17Å; V1148-V1152 WeakPolarHBondContact O-CB 3.42Å; V1148-V1152 WeakPolarHBondContact O-CG2 3.39Å; V1148-V1152 PolarHBondContact O-N 2.94Å; Q1149-V1152 PolarHBondContact O-N 3.12Å; V1152-E1155 PolarHBondContact O-N 3.36Å; V1152-R1156 HydrophobicContact CG1-CG 4.29Å; V1152-R1156 VanDerWaalsContact CG1-NE 3.28Å; V1152-R1156 WeakPolarHBondContact O-CB 3.46Å; V1152-R1156 VanDerWaalsContact O-CG 3.26Å; V1152-R1156 WeakPolarHBondContact O-CG 3.33Å; V1152-R1156 PolarHBondContact O-N 3.49Å; V1152-F1181 HydrophobicContact CG2-CB 4.4Å; V1152-T1182 HydrophobicContact CG2-CG2 4.03Å
1153	A	96.4	Very high	93.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61	-43.6	172.2	0	0	0	0	0	112	V1127 E1130 L1131 Q1149 S1150 I1151 R1156 A1157 Y1277	V1127-A1153 HydrophobicContact CG1-CB 4.14Å; E1130-A1153 HydrophobicContact CB-CB 3.95Å; L1131-A1153 HydrophobicContact CD2-CB 4.48Å; L1131-A1153 VanDerWaalsContact CD2-O 3.22Å; L1131-A1153 WeakPolarHBondContact CD2-O 3.5Å; L1131-A1153 HydrophobicContact CG-CB 4.18Å; Q1149-A1153 WeakPolarHBondContact O-CB 2.97Å; Q1149-A1153 PolarHBondContact O-N 2.98Å; S1150-A1153 PolarHBondContact O-N 3.41Å; I1151-A1153 VanDerWaalsContact C-N 3.31Å; I1151-A1153 PolarHBondContact O-N 2.88Å; A1153-R1156 PolarHBondContact O-N 3.22Å; A1153-A1157 VanDerWaalsContact O-CB 3.23Å; A1153-A1157 WeakPolarHBondContact O-CB 3.38Å; A1153-A1157 PolarHBondContact O-N 3.17Å; A1153-Y1277 HydrophobicContact CB-CE2 3.82Å
1154	I	96.8	Very high	94.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.7	-42.9	175.7	-70.9	-53.2	0	0	0	112.4	S1150 I1151 A1157 K1158 A1159 T1160 C1162 I1248 Y1275 Y1277	S1150-I1154 WeakPolarHBondContact O-CG1 3.42Å; S1150-I1154 PolarHBondContact O-N 3.1Å; I1151-I1154 PolarHBondContact O-N 2.88Å; I1154-A1157 PolarHBondContact O-N 3.16Å; I1154-K1158 PolarHBondContact O-N 2.95Å; I1154-K1158 VanDerWaalsContact O-N 3.12Å; I1154-A1159 HydrophobicContact CD1-CB 4.26Å; I1154-A1159 HydrophobicContact CG2-CB 4.48Å; I1154-A1159 PolarHBondContact O-N 2.84Å; I1154-A1159 VanDerWaalsContact O-N 3.17Å; I1154-T1160 HydrophobicContact CG2-CG2 4.24Å; I1154-C1162 HydrophobicContact CG2-CB 3.84Å; I1154-I1248 HydrophobicContact CG1-CD1 3.86Å; I1154-I1248 HydrophobicContact CG1-CG1 4.21Å; I1154-Y1275 HydrophobicContact CD1-CG 4.42Å; I1154-Y1277 HydrophobicContact CD1-CD2 3.92Å; I1154-Y1277 HydrophobicContact CD1-CE2 3.47Å; I1154-Y1277 VanDerWaalsContact CD1-CE2 3.47Å; I1154-Y1277 HydrophobicContact CG1-CD2 4.07Å; I1154-Y1277 HydrophobicContact CG1-CE2 3.8Å
1155	E	94.6	Very high	95.1	Very high	51 Å²	51	23 Å²	23	24%	0.238	12%	0.117	C	C	.	.	H	α-helix	trans	-60.7	-48.7	176.6	-176.1	176.7	-139.3	0	0	111	I1151 V1152 A1157 K1158 T1182 N1183 L1184	I1151-E1155 PolarHBondContact O-N 3.04Å; V1152-E1155 PolarHBondContact O-N 3.36Å; E1155-A1157 VanDerWaalsContact C-N 3.32Å; E1155-A1157 PolarHBondContact O-N 2.71Å; E1155-K1158 PolarHBondContact O-N 3.45Å; E1155-T1182 HydrophobicContact CB-CG2 4.49Å; E1155-T1182 VanDerWaalsContact OE2-CB 3.23Å; E1155-T1182 WeakPolarHBondContact OE2-CB 3.36Å; E1155-T1182 WeakPolarHBondContact OE2-CG2 3.42Å; E1155-N1183 PolarHBondContact OE1-N 3.25Å; E1155-L1184 HydrophobicContact CB-CD1 3.93Å; E1155-L1184 HydrophobicContact CB-CD2 4.41Å; E1155-L1184 HydrophobicContact CB-CG 4.14Å; E1155-L1184 HydrophobicContact CG-CD1 4.45Å; E1155-L1184 HydrophobicContact CG-CD2 4.1Å; E1155-L1184 HydrophobicContact CG-CG 4.12Å
1156	R	94.1	Very high	95.5	Very high	107 Å²	107	22 Å²	22	40%	0.404	11%	0.106	S	C	.	.	H	α-helix	trans	-64.7	-34.6	178.5	-70.4	177.4	-172.6	-172.3	5.9	112.6	E1124 L1131 V1152 A1153 K1158	E1124-R1156 IonicContact OE1-CZ 2.9Å; E1124-R1156 IonicContact OE1-NH1 2.67Å; E1124-R1156 PolarHBondContact OE1-NH1 2.89Å; E1124-R1156 IonicContact OE1-NH2 3.58Å; E1124-R1156 PolarHBondContact OE1-NH2 3.01Å; E1124-R1156 VanDerWaalsContact OE1-NH2 3.17Å; E1124-R1156 IonicContact OE2-CZ 3.74Å; E1124-R1156 IonicContact OE2-NH1 4Å; E1124-R1156 IonicContact OE2-NH2 2.93Å; E1124-R1156 PolarHBondContact OE2-NH2 3.08Å; L1131-R1156 HydrophobicContact CD1-CB 4.02Å; L1131-R1156 HydrophobicContact CD2-CB 4.2Å; V1152-R1156 HydrophobicContact CG1-CG 4.29Å; V1152-R1156 VanDerWaalsContact CG1-NE 3.28Å; V1152-R1156 WeakPolarHBondContact O-CB 3.46Å; V1152-R1156 VanDerWaalsContact O-CG 3.26Å; V1152-R1156 WeakPolarHBondContact O-CG 3.33Å; V1152-R1156 PolarHBondContact O-N 3.49Å; A1153-R1156 PolarHBondContact O-N 3.22Å; R1156-K1158 PolarHBondContact O-N 3.47Å
1157	A	95.1	Very high	95.5	Very high	23 Å²	23	21.6 Å²	21.6	19%	0.19	11%	0.105	C	C	.	.	H	α-helix	trans	-71.6	-13.2	173.3	0	0	0	0	0	113.5	L1131 A1153 I1154 E1155 A1159 Y1275	L1131-A1157 HydrophobicContact CD2-CB 3.76Å; A1153-A1157 VanDerWaalsContact O-CB 3.23Å; A1153-A1157 WeakPolarHBondContact O-CB 3.38Å; A1153-A1157 PolarHBondContact O-N 3.17Å; I1154-A1157 PolarHBondContact O-N 3.16Å; E1155-A1157 VanDerWaalsContact C-N 3.32Å; E1155-A1157 PolarHBondContact O-N 2.71Å; A1157-A1159 HydrophobicContact CB-CB 3.92Å; A1157-A1159 PolarHBondContact O-N 3.45Å; A1157-Y1275 HydrophobicContact CB-CD1 4.24Å; A1157-Y1275 HydrophobicContact CB-CE1 3.7Å; A1157-Y1275 HydrophobicContact CB-CE2 4.01Å
1158	K	94	Very high	95.5	Very high	170 Å²	170	22.9 Å²	22.9	74%	0.739	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.3	35	-170	-57.7	-178.2	179.4	-178.4	0	112.2	I1154 E1155 R1156 T1160	I1154-K1158 PolarHBondContact O-N 2.95Å; I1154-K1158 VanDerWaalsContact O-N 3.12Å; E1155-K1158 PolarHBondContact O-N 3.45Å; R1156-K1158 PolarHBondContact O-N 3.47Å; K1158-T1160 PolarHBondContact O-N 3.34Å; K1158-T1160 VanDerWaalsContact O-N 3.16Å
1159	A	95.3	Very high	95.5	Very high	5 Å²	5	27.1 Å²	27.1	4%	0.041	15%	0.154	C	C	.	.			trans	-90.3	43.1	-173.1	0	0	0	0	0	112.2	I1154 A1157 S1246 Y1275	I1154-A1159 HydrophobicContact CD1-CB 4.26Å; I1154-A1159 HydrophobicContact CG2-CB 4.48Å; I1154-A1159 PolarHBondContact O-N 2.84Å; I1154-A1159 VanDerWaalsContact O-N 3.17Å; A1157-A1159 HydrophobicContact CB-CB 3.92Å; A1157-A1159 PolarHBondContact O-N 3.45Å; A1159-S1246 WeakPolarHBondContact O-CB 3.48Å; A1159-S1246 PolarHBondContact O-OG 3.32Å; A1159-Y1275 HydrophobicContact CB-CD2 3.45Å; A1159-Y1275 VanDerWaalsContact CB-CD2 3.45Å; A1159-Y1275 HydrophobicContact CB-CE2 3.93Å; A1159-Y1275 HydrophobicContact CB-CG 3.99Å
1160	T	93	Very high	95.4	Very high	28 Å²	28	29.7 Å²	29.7	17%	0.172	17%	0.168	C	C	.	.			trans	-102.3	144.7	179	58.5	0	0	0	0	110.9	I1154 K1158 L1184 D1208 K1245	I1154-T1160 HydrophobicContact CG2-CG2 4.24Å; K1158-T1160 PolarHBondContact O-N 3.34Å; K1158-T1160 VanDerWaalsContact O-N 3.16Å; T1160-L1184 HydrophobicContact CG2-CD1 4.19Å; T1160-L1184 HydrophobicContact CG2-CD2 3.97Å; T1160-D1208 WeakPolarHBondContact CB-O 3.41Å; T1160-D1208 HydrophobicContact CG2-CB 3.94Å; T1160-K1245 WeakPolarHBondContact O-CD 3.38Å; T1160-K1245 WeakPolarHBondContact O-CE 3.4Å; T1160-K1245 PolarHBondContact O-NZ 2.94Å
1161	P	94.9	Very high	95.4	Very high	16 Å²	16	31.7 Å²	31.7	10%	0.104	18%	0.176	C	C	.	.	S	Bend	cis	-75.7	138.3	8.5	-19	33.7	0	0	0	115.3	L1201 D1208 I1243 L1244 K1245	P1161-L1201 HydrophobicContact CB-CD2 3.36Å; P1161-L1201 HydrophobicContact CG-CD2 3.86Å; P1161-D1208 CarbonylContact C-O 3.56Å; P1161-D1208 VanDerWaalsContact CA-O 3.27Å; P1161-D1208 WeakPolarHBondContact CA-O 3.42Å; P1161-I1243 HydrophobicContact CG-CG2 4.21Å; P1161-L1244 HydrophobicContact CB-CD2 4.27Å; P1161-L1244 CarbonylContact O-C 3.59Å; P1161-L1244 WeakPolarHBondContact O-CA 3.41Å; P1161-K1245 PolarHBondContact O-N 3.48Å
1162	C	96.6	Very high	95.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	138.9	179.8	177.9	0	0	0	0	111.3	I1154 D1208 V1209 V1210 S1246	I1154-C1162 HydrophobicContact CG2-CB 3.84Å; C1162-D1208 PolarHBondContact N-O 2.92Å; C1162-V1209 HydrophobicContact CB-CG1 4.35Å; C1162-V1209 HydrophobicContact CB-CG2 4.29Å; C1162-V1209 CarbonylContact O-C 3.59Å; C1162-V1209 WeakPolarHBondContact O-CA 3.43Å; C1162-V1210 PolarHBondContact O-N 3.03Å; C1162-S1246 WeakPolarHBondContact CA-OG 3.23Å; C1162-S1246 WeakPolarHBondContact CB-OG 3.43Å; C1162-S1246 PolarHBondContact SG-OG 3.46Å
1163	L	97.5	Very high	94.8	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	119.2	169	173.2	64.4	0	0	0	111	I1165 V1210 C1212 F1221 L1244 S1246 V1247 I1248 I1269	L1163-I1165 HydrophobicContact CD1-CG1 4.45Å; L1163-I1165 HydrophobicContact CD2-CD1 4.03Å; L1163-I1165 HydrophobicContact CD2-CG1 4.03Å; L1163-I1165 HydrophobicContact CG-CD1 4.43Å; L1163-I1165 HydrophobicContact CG-CG1 3.91Å; L1163-V1210 CarbonylContact C-O 3.56Å; L1163-V1210 WeakPolarHBondContact CA-O 3.31Å; L1163-V1210 HydrophobicContact CB-CG2 4.27Å; L1163-V1210 HydrophobicContact CD1-CG2 3.87Å; L1163-C1212 HydrophobicContact CD1-CB 3.99Å; L1163-F1221 HydrophobicContact CD1-CE2 3.99Å; L1163-F1221 HydrophobicContact CD1-CZ 3.63Å; L1163-F1221 HydrophobicContact CD2-CE1 4.38Å; L1163-F1221 HydrophobicContact CD2-CE2 3.86Å; L1163-F1221 HydrophobicContact CD2-CZ 3.78Å; L1163-F1221 HydrophobicContact CG-CZ 4.35Å; L1163-L1244 HydrophobicContact CB-CD1 3.76Å; L1163-L1244 HydrophobicContact CB-CD2 3.96Å; L1163-L1244 HydrophobicContact CB-CG 4.44Å; L1163-L1244 HydrophobicContact CD2-CD1 3.92Å; L1163-L1244 HydrophobicContact CG-CD1 4.41Å; L1163-S1246 PolarHBondContact N-O 3.45Å; L1163-V1247 CarbonylContact O-C 3.6Å; L1163-V1247 VanDerWaalsContact O-CA 3.3Å; L1163-V1247 WeakPolarHBondContact O-CA 3.4Å; L1163-I1248 PolarHBondContact O-N 3.43Å; L1163-I1269 HydrophobicContact CD2-CD1 4.41Å; L1163-I1269 HydrophobicContact CD2-CG2 3.82Å
1164	V	98.2	Very high	94.9	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	126	168.7	176.6	0	0	0	0	109.2	C1166 W1174 V1209 V1210 I1211 C1212 I1248	V1164-C1166 HydrophobicContact CG1-CB 4.46Å; V1164-W1174 HydrophobicContact CG1-CD2 3.52Å; V1164-W1174 HydrophobicContact CG1-CE3 3.8Å; V1164-W1174 HydrophobicContact CG1-CG 3.89Å; V1164-W1174 HydrophobicContact CG1-CH2 4.4Å; V1164-W1174 HydrophobicContact CG1-CZ2 4.15Å; V1164-W1174 HydrophobicContact CG1-CZ3 4.23Å; V1164-W1174 HydrophobicContact CG2-CE3 4.03Å; V1164-W1174 HydrophobicContact CG2-CZ3 4.14Å; V1164-V1209 HydrophobicContact CG2-CG1 3.64Å; V1164-V1210 PolarHBondContact N-O 3.19Å; V1164-I1211 HydrophobicContact CB-CG1 4.21Å; V1164-I1211 HydrophobicContact CB-CG2 4.43Å; V1164-I1211 HydrophobicContact CG1-CG2 4.29Å; V1164-I1211 WeakPolarHBondContact O-CA 3.39Å; V1164-C1212 PolarHBondContact O-N 3.37Å; V1164-I1248 CarbonylContact C-O 3.54Å; V1164-I1248 WeakPolarHBondContact CA-O 3.36Å; V1164-I1248 HydrophobicContact CG2-CB 4.29Å; V1164-I1248 HydrophobicContact CG2-CD1 4.33Å
1165	I	98	Very high	94.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	113.8	174.8	-52.9	178.6	0	0	0	108	L1163 C1212 Y1214 L1217 V1247 I1248 I1249 D1250 I1266	L1163-I1165 HydrophobicContact CD1-CG1 4.45Å; L1163-I1165 HydrophobicContact CD2-CD1 4.03Å; L1163-I1165 HydrophobicContact CD2-CG1 4.03Å; L1163-I1165 HydrophobicContact CG-CD1 4.43Å; L1163-I1165 HydrophobicContact CG-CG1 3.91Å; I1165-C1212 VanDerWaalsContact CA-O 3.32Å; I1165-C1212 WeakPolarHBondContact CA-O 3.32Å; I1165-Y1214 HydrophobicContact CG2-CD1 3.91Å; I1165-Y1214 HydrophobicContact CG2-CD2 4.15Å; I1165-Y1214 HydrophobicContact CG2-CE1 3.85Å; I1165-Y1214 HydrophobicContact CG2-CE2 4.1Å; I1165-Y1214 HydrophobicContact CG2-CG 4.06Å; I1165-L1217 HydrophobicContact CD1-CD1 4.44Å; I1165-L1217 HydrophobicContact CD1-CD2 3.74Å; I1165-L1217 HydrophobicContact CG1-CD2 4.01Å; I1165-L1217 HydrophobicContact CG2-CD1 4.13Å; I1165-L1217 HydrophobicContact CG2-CD2 4.15Å; I1165-L1217 HydrophobicContact CG2-CG 4.49Å; I1165-V1247 HydrophobicContact CD1-CG1 4.1Å; I1165-V1247 HydrophobicContact CG1-CG1 4.49Å; I1165-I1248 PolarHBondContact N-O 2.89Å; I1165-I1249 HydrophobicContact CD1-CG1 4.4Å; I1165-D1250 PolarHBondContact O-N 3.04Å; I1165-I1266 HydrophobicContact CD1-CD1 4.24Å; I1165-I1266 HydrophobicContact CD1-CG1 3.93Å; I1165-I1266 HydrophobicContact CG2-CD1 4.38Å
1166	C	97.1	Very high	94.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	165.2	-176.7	70.6	0	0	0	0	112.4	V1164 L1170 C1212 N1213 D1250	V1164-C1166 HydrophobicContact CG1-CB 4.46Å; C1166-L1170 HydrophobicContact CB-CB 4.32Å; C1166-C1212 PolarHBondContact N-O 3.29Å; C1166-N1213 WeakPolarHBondContact O-CA 3.25Å; C1166-D1250 HydrophobicContact CB-CB 3.85Å
1167	P	95.2	Very high	94.3	Very high	12 Å²	12	42 Å²	42	8%	0.078	23%	0.23	C	C	.	.			trans	-52.4	147.5	165.6	-25.1	33.2	0	0	0	112.1	A1169 L1170 E1251	P1167-A1169 PolarHBondContact O-N 2.99Å; P1167-A1169 VanDerWaalsContact O-N 3.12Å; P1167-L1170 HydrophobicContact CB-CG 4.39Å; P1167-L1170 HydrophobicContact CG-CD1 4.1Å; P1167-L1170 HydrophobicContact CG-CG 4.5Å; P1167-L1170 PolarHBondContact O-N 2.95Å; P1167-E1251 HydrophobicContact CG-CB 4.02Å; P1167-E1251 HydrophobicContact CG-CG 3.81Å
1168	A	93.5	Very high	94.2	Very high	53 Å²	53	40.9 Å²	40.9	44%	0.438	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-55.8	-34.3	-177.2	0	0	0	0	0	113.7	L1170 N1213	A1168-L1170 VanDerWaalsContact C-N 3.29Å; A1168-L1170 PolarHBondContact O-N 3.4Å; A1168-N1213 HydrophobicContact CB-CB 4.07Å
1169	A	91.9	Very high	93.9	Very high	94 Å²	94	37.8 Å²	37.8	78%	0.777	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-68.4	-21.4	178	0	0	0	0	0	114.1	P1167	P1167-A1169 PolarHBondContact O-N 2.99Å; P1167-A1169 VanDerWaalsContact O-N 3.12Å
1170	L	93.8	Very high	93.4	Very high	56 Å²	56	42.1 Å²	42.1	29%	0.293	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-95.8	-5.1	-174.7	-63.1	-174.6	0	0	0	114.1	C1166 P1167 A1168 V1172 N1173 W1174 D1250	C1166-L1170 HydrophobicContact CB-CB 4.32Å; P1167-L1170 HydrophobicContact CB-CG 4.39Å; P1167-L1170 HydrophobicContact CG-CD1 4.1Å; P1167-L1170 HydrophobicContact CG-CG 4.5Å; P1167-L1170 PolarHBondContact O-N 2.95Å; A1168-L1170 VanDerWaalsContact C-N 3.29Å; A1168-L1170 PolarHBondContact O-N 3.4Å; L1170-V1172 PolarHBondContact O-N 2.97Å; L1170-N1173 WeakPolarHBondContact O-CB 3.36Å; L1170-N1173 PolarHBondContact O-N 3.18Å; L1170-N1173 VanDerWaalsContact O-N 3.1Å; L1170-W1174 PolarHBondContact O-N 3.38Å; L1170-D1250 WeakPolarHBondContact CD1-OD2 3.36Å
1171	K	95.8	Very high	93.1	Very high	41 Å²	41	42.4 Å²	42.4	18%	0.178	22%	0.224	C	C	.	.	H	α-helix	trans	-57.7	-44.7	-175.6	-64.3	-171.4	-63.2	-178.4	0	113.4	E1175 I1188 I1211 N1213	K1171-E1175 PolarHBondContact O-N 3.25Å; K1171-E1175 VanDerWaalsContact O-N 3.13Å; K1171-I1188 HydrophobicContact CB-CD1 4.21Å; K1171-I1188 HydrophobicContact CB-CG2 4.23Å; K1171-I1188 HydrophobicContact CD-CG2 3.96Å; K1171-I1211 HydrophobicContact CB-CG2 4.1Å; K1171-I1211 HydrophobicContact CG-CG2 4.06Å; K1171-N1213 HydrophobicContact CD-CB 4.18Å
1172	V	89.9	Confident	92.7	Very high	87 Å²	87	41.8 Å²	41.8	53%	0.527	22%	0.22	S	C	.	.	H	α-helix	trans	-71.1	-33.2	178.9	179.6	0	0	0	0	111.2	L1170 E1175 R1176 I1188	L1170-V1172 PolarHBondContact O-N 2.97Å; V1172-E1175 PolarHBondContact O-N 3.49Å; V1172-R1176 WeakPolarHBondContact O-CB 3.48Å; V1172-R1176 PolarHBondContact O-N 3.27Å; V1172-I1188 HydrophobicContact CG2-CD1 4.34Å
1173	N	90.2	Very high	92.1	Very high	54 Å²	54	47.7 Å²	47.7	29%	0.289	25%	0.251	S	S	.	.	H	α-helix	trans	-66.1	-46.4	175.4	-166.8	66.5	0	0	0	111	L1170 E1175 R1176 E1177	L1170-N1173 WeakPolarHBondContact O-CB 3.36Å; L1170-N1173 PolarHBondContact O-N 3.18Å; L1170-N1173 VanDerWaalsContact O-N 3.1Å; N1173-E1175 VanDerWaalsContact C-N 3.34Å; N1173-E1175 PolarHBondContact O-N 2.97Å; N1173-R1176 WeakPolarHBondContact O-CB 3.33Å; N1173-R1176 PolarHBondContact O-N 3.04Å; N1173-R1176 VanDerWaalsContact O-N 3.14Å; N1173-E1177 WeakPolarHBondContact O-CG 3.49Å; N1173-E1177 PolarHBondContact O-N 3.22Å
1174	W	96.9	Very high	91.8	Very high	1 Å²	1	48.6 Å²	48.6	0%	0.004	26%	0.256	C	S	.	.	H	α-helix	trans	-55.3	-47.9	173	-89.3	96.8	0	0	0	112	T1147 V1164 L1170 R1176 E1177 I1178 I1211 I1248 D1250 L1279	T1147-W1174 HydrophobicContact CG2-CD2 3.84Å; T1147-W1174 HydrophobicContact CG2-CE3 3.68Å; T1147-W1174 HydrophobicContact CG2-CH2 3.76Å; T1147-W1174 HydrophobicContact CG2-CZ2 3.92Å; T1147-W1174 HydrophobicContact CG2-CZ3 3.65Å; V1164-W1174 HydrophobicContact CG1-CD2 3.52Å; V1164-W1174 HydrophobicContact CG1-CE3 3.8Å; V1164-W1174 HydrophobicContact CG1-CG 3.89Å; V1164-W1174 HydrophobicContact CG1-CH2 4.4Å; V1164-W1174 HydrophobicContact CG1-CZ2 4.15Å; V1164-W1174 HydrophobicContact CG1-CZ3 4.23Å; V1164-W1174 HydrophobicContact CG2-CE3 4.03Å; V1164-W1174 HydrophobicContact CG2-CZ3 4.14Å; L1170-W1174 PolarHBondContact O-N 3.38Å; W1174-R1176 VanDerWaalsContact C-N 3.3Å; W1174-R1176 PolarHBondContact O-N 3.43Å; W1174-E1177 PolarHBondContact O-N 3.28Å; W1174-I1178 HydrophobicContact CE3-CD1 4.3Å; W1174-I1178 HydrophobicContact CE3-CG1 4.43Å; W1174-I1178 WeakPolarHBondContact O-CB 3.02Å; W1174-I1178 VanDerWaalsContact O-CD1 3.32Å; W1174-I1178 WeakPolarHBondContact O-CD1 3.11Å; W1174-I1178 WeakPolarHBondContact O-CG1 3.09Å; W1174-I1178 PolarHBondContact O-N 2.97Å; W1174-I1211 HydrophobicContact CB-CD1 3.95Å; W1174-I1211 HydrophobicContact CB-CG2 4.35Å; W1174-I1248 HydrophobicContact CH2-CD1 4.36Å; W1174-I1248 HydrophobicContact CH2-CG2 3.71Å; W1174-I1248 HydrophobicContact CZ2-CG2 4.15Å; W1174-I1248 HydrophobicContact CZ3-CD1 4.29Å; W1174-D1250 HydrophobicContact CZ2-CB 3.91Å; W1174-D1250 PolarHBondContact NE1-OD2 2.88Å; W1174-L1279 HydrophobicContact CH2-CD1 3.75Å; W1174-L1279 HydrophobicContact CZ2-CD1 3.72Å
1175	E	94.9	Very high	91.5	Very high	49 Å²	49	53 Å²	53	23%	0.229	27%	0.273	C	S	.	.	H	α-helix	trans	-57.4	-42.9	176.5	-165.8	-164.8	178.7	0	0	112.5	K1171 V1172 N1173 K1179 P1186 I1188 I1211	K1171-E1175 PolarHBondContact O-N 3.25Å; K1171-E1175 VanDerWaalsContact O-N 3.13Å; V1172-E1175 PolarHBondContact O-N 3.49Å; N1173-E1175 VanDerWaalsContact C-N 3.34Å; N1173-E1175 PolarHBondContact O-N 2.97Å; E1175-K1179 HydrophobicContact CG-CD 4.34Å; E1175-K1179 WeakPolarHBondContact O-CB 3.12Å; E1175-K1179 WeakPolarHBondContact O-CG 3.49Å; E1175-K1179 PolarHBondContact O-N 3.46Å; E1175-K1179 VanDerWaalsContact O-N 3.15Å; E1175-K1179 IonicContact OE1-NZ 3.66Å; E1175-K1179 PolarHBondContact OE1-NZ 3.42Å; E1175-P1186 HydrophobicContact CB-CG 4.49Å; E1175-P1186 HydrophobicContact CG-CB 4.09Å; E1175-P1186 HydrophobicContact CG-CG 3.58Å; E1175-I1188 HydrophobicContact CB-CD1 4.15Å; E1175-I1188 HydrophobicContact CB-CG1 4.47Å; E1175-I1211 HydrophobicContact CB-CD1 4.1Å
1176	R	87.4	Confident	91.4	Very high	155 Å²	155	53.5 Å²	53.5	59%	0.585	28%	0.276	S	S	*	.	H	α-helix	trans	-64.2	-48	178.2	-175.3	-172.2	-64.1	154.1	-2.8	112	V1172 N1173 W1174 K1179 K1180	V1172-R1176 WeakPolarHBondContact O-CB 3.48Å; V1172-R1176 PolarHBondContact O-N 3.27Å; N1173-R1176 WeakPolarHBondContact O-CB 3.33Å; N1173-R1176 PolarHBondContact O-N 3.04Å; N1173-R1176 VanDerWaalsContact O-N 3.14Å; W1174-R1176 VanDerWaalsContact C-N 3.3Å; W1174-R1176 PolarHBondContact O-N 3.43Å; R1176-K1179 PolarHBondContact O-N 2.88Å; R1176-K1180 VanDerWaalsContact O-CB 3.3Å; R1176-K1180 WeakPolarHBondContact O-CB 3.45Å; R1176-K1180 PolarHBondContact O-N 2.87Å
1177	E	91.7	Very high	91.3	Very high	38 Å²	38	53.7 Å²	53.7	18%	0.178	28%	0.277	C	S	.	.	H	α-helix	trans	-65.2	-42.6	-179.2	-67.4	-60.4	151	0	0	111.6	T1147 N1173 W1174 K1179 K1180 F1181	T1147-E1177 HydrophobicContact CG2-CB 3.85Å; T1147-E1177 HydrophobicContact CG2-CG 4.05Å; N1173-E1177 WeakPolarHBondContact O-CG 3.49Å; N1173-E1177 PolarHBondContact O-N 3.22Å; W1174-E1177 PolarHBondContact O-N 3.28Å; E1177-K1179 PolarHBondContact O-N 2.99Å; E1177-K1180 PolarHBondContact O-N 3.45Å; E1177-F1181 PolarHBondContact O-N 3.44Å; E1177-F1181 WeakPolarHBondContact OE2-CD2 3.22Å; E1177-F1181 WeakPolarHBondContact OE2-CE2 3.26Å
1178	I	93.3	Very high	91.4	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-57.2	-49.7	174.9	-65.4	162.6	0	0	0	110.1	I1151 W1174 K1180 T1182 L1184 P1186 V1209 I1211	I1151-I1178 HydrophobicContact CD1-CD1 4.23Å; I1151-I1178 HydrophobicContact CD1-CG1 3.81Å; I1151-I1178 HydrophobicContact CG1-CB 4.5Å; I1151-I1178 HydrophobicContact CG1-CG1 3.81Å; I1151-I1178 HydrophobicContact CG1-CG2 4.42Å; W1174-I1178 HydrophobicContact CE3-CD1 4.3Å; W1174-I1178 HydrophobicContact CE3-CG1 4.43Å; W1174-I1178 WeakPolarHBondContact O-CB 3.02Å; W1174-I1178 VanDerWaalsContact O-CD1 3.32Å; W1174-I1178 WeakPolarHBondContact O-CD1 3.11Å; W1174-I1178 WeakPolarHBondContact O-CG1 3.09Å; W1174-I1178 PolarHBondContact O-N 2.97Å; I1178-K1180 VanDerWaalsContact C-N 3.31Å; I1178-K1180 PolarHBondContact O-N 3.13Å; I1178-T1182 WeakPolarHBondContact CG2-OG1 3.44Å; I1178-T1182 WeakPolarHBondContact O-CA 3.48Å; I1178-T1182 WeakPolarHBondContact O-CB 3.42Å; I1178-T1182 PolarHBondContact O-N 3.24Å; I1178-T1182 PolarHBondContact O-OG1 3.4Å; I1178-L1184 HydrophobicContact CG2-CB 3.99Å; I1178-P1186 HydrophobicContact CB-CB 4.45Å; I1178-P1186 HydrophobicContact CB-CG 4.37Å; I1178-P1186 HydrophobicContact CD1-CB 3.88Å; I1178-P1186 HydrophobicContact CG2-CB 4.19Å; I1178-P1186 HydrophobicContact CG2-CG 4.11Å; I1178-V1209 HydrophobicContact CD1-CB 4.42Å; I1178-V1209 HydrophobicContact CD1-CG1 3.96Å; I1178-I1211 HydrophobicContact CD1-CD1 3.95Å; I1178-I1211 HydrophobicContact CD1-CG1 4.41Å
1179	K	87.8	Confident	91.4	Very high	104 Å²	104	52.1 Å²	52.1	45%	0.452	26%	0.26	S	S	.	.	H	α-helix	trans	-64.8	-33.8	178.8	-74.9	172.9	172	172.3	0	112.9	K1116 E1175 R1176 E1177 P1186	K1116-K1179 PolarHBondContact NZ-O 3.2Å; E1175-K1179 HydrophobicContact CG-CD 4.34Å; E1175-K1179 WeakPolarHBondContact O-CB 3.12Å; E1175-K1179 WeakPolarHBondContact O-CG 3.49Å; E1175-K1179 PolarHBondContact O-N 3.46Å; E1175-K1179 VanDerWaalsContact O-N 3.15Å; E1175-K1179 IonicContact OE1-NZ 3.66Å; E1175-K1179 PolarHBondContact OE1-NZ 3.42Å; R1176-K1179 PolarHBondContact O-N 2.88Å; E1177-K1179 PolarHBondContact O-N 2.99Å; K1179-P1186 HydrophobicContact CD-CG 4.48Å; K1179-P1186 HydrophobicContact CG-CG 4.11Å
1180	K	83.4	Confident	91.3	Very high	96 Å²	96	48.9 Å²	48.9	42%	0.417	23%	0.231	S	C	.	.	H	α-helix	trans	-72.5	-44.5	-179	-179.1	173.5	175.7	178.4	0	112.3	K1116 P1117 R1176 E1177 I1178	K1116-K1180 WeakPolarHBondContact CD-O 3.47Å; P1117-K1180 VanDerWaalsContact CD-O 3.27Å; P1117-K1180 WeakPolarHBondContact CD-O 3.35Å; P1117-K1180 HydrophobicContact CG-CG 3.97Å; R1176-K1180 VanDerWaalsContact O-CB 3.3Å; R1176-K1180 WeakPolarHBondContact O-CB 3.45Å; R1176-K1180 PolarHBondContact O-N 2.87Å; E1177-K1180 PolarHBondContact O-N 3.45Å; I1178-K1180 VanDerWaalsContact C-N 3.31Å; I1178-K1180 PolarHBondContact O-N 3.13Å
1181	F	87	Confident	90.9	Very high	35 Å²	35	51.7 Å²	51.7	15%	0.154	25%	0.246	C	C	.	.	H	α-helix	trans	-104.8	-17.8	-169.6	-74	-83.4	0	0	0	115.1	P1117 L1119 V1148 V1152 E1177	P1117-F1181 HydrophobicContact CB-CD1 4.31Å; P1117-F1181 HydrophobicContact CB-CE1 3.78Å; P1117-F1181 HydrophobicContact CB-CZ 4.33Å; P1117-F1181 HydrophobicContact CG-CE1 4.2Å; P1117-F1181 HydrophobicContact CG-CZ 4.5Å; L1119-F1181 HydrophobicContact CD2-CD1 3.98Å; L1119-F1181 HydrophobicContact CD2-CE1 4.19Å; V1148-F1181 HydrophobicContact CB-CD2 4.4Å; V1148-F1181 HydrophobicContact CB-CG 4.45Å; V1148-F1181 HydrophobicContact CG1-CB 3.97Å; V1148-F1181 HydrophobicContact CG1-CD1 3.54Å; V1148-F1181 HydrophobicContact CG1-CD2 3.93Å; V1148-F1181 HydrophobicContact CG1-CE1 3.91Å; V1148-F1181 HydrophobicContact CG1-CE2 4.29Å; V1148-F1181 HydrophobicContact CG1-CG 3.54Å; V1148-F1181 HydrophobicContact CG1-CZ 4.28Å; V1148-F1181 HydrophobicContact CG2-CD2 3.55Å; V1148-F1181 HydrophobicContact CG2-CE1 4.48Å; V1148-F1181 HydrophobicContact CG2-CE2 3.53Å; V1148-F1181 HydrophobicContact CG2-CG 4.08Å; V1148-F1181 HydrophobicContact CG2-CZ 4.01Å; V1152-F1181 HydrophobicContact CG2-CB 4.4Å; E1177-F1181 PolarHBondContact O-N 3.44Å; E1177-F1181 WeakPolarHBondContact OE2-CD2 3.22Å; E1177-F1181 WeakPolarHBondContact OE2-CE2 3.26Å
1182	T	86.9	Confident	90.3	Very high	3 Å²	3	51.3 Å²	51.3	2%	0.018	25%	0.249	C	C	.	.			trans	-129.3	172	-176.2	75	0	0	0	0	111.6	K1116 I1151 V1152 E1155 I1178 L1184	K1116-T1182 PolarHBondContact NZ-O 2.98Å; I1151-T1182 HydrophobicContact CB-CG2 4.4Å; I1151-T1182 HydrophobicContact CG1-CG2 3.86Å; I1151-T1182 HydrophobicContact CG2-CG2 3.8Å; V1152-T1182 HydrophobicContact CG2-CG2 4.03Å; E1155-T1182 HydrophobicContact CB-CG2 4.49Å; E1155-T1182 VanDerWaalsContact OE2-CB 3.23Å; E1155-T1182 WeakPolarHBondContact OE2-CB 3.36Å; E1155-T1182 WeakPolarHBondContact OE2-CG2 3.42Å; I1178-T1182 WeakPolarHBondContact CG2-OG1 3.44Å; I1178-T1182 WeakPolarHBondContact O-CA 3.48Å; I1178-T1182 WeakPolarHBondContact O-CB 3.42Å; I1178-T1182 PolarHBondContact O-N 3.24Å; I1178-T1182 PolarHBondContact O-OG1 3.4Å; T1182-L1184 PolarHBondContact OG1-N 3.48Å
1183	N	84.4	Confident	90	Very high	123 Å²	123	47.6 Å²	47.6	66%	0.658	23%	0.226	S	C	*	.			trans	-98.7	6.8	170	-67.3	-36.5	0	0	0	112.9	K1116 E1155	K1116-N1183 VanDerWaalsContact CE-OD1 3.28Å; K1116-N1183 WeakPolarHBondContact CE-OD1 3.34Å; E1155-N1183 PolarHBondContact OE1-N 3.25Å
1184	L	90.9	Very high	89.8	Confident	20 Å²	20	46.6 Å²	46.6	11%	0.105	22%	0.221	C	C	.	.			trans	-69.4	146.5	178.9	-59.3	-176.2	0	0	0	111.6	I1151 E1155 T1160 I1178 T1182 P1186 D1208 V1209	I1151-L1184 HydrophobicContact CD1-CD1 4Å; I1151-L1184 HydrophobicContact CG1-CD1 4.22Å; E1155-L1184 HydrophobicContact CB-CD1 3.93Å; E1155-L1184 HydrophobicContact CB-CD2 4.41Å; E1155-L1184 HydrophobicContact CB-CG 4.14Å; E1155-L1184 HydrophobicContact CG-CD1 4.45Å; E1155-L1184 HydrophobicContact CG-CD2 4.1Å; E1155-L1184 HydrophobicContact CG-CG 4.12Å; T1160-L1184 HydrophobicContact CG2-CD1 4.19Å; T1160-L1184 HydrophobicContact CG2-CD2 3.97Å; I1178-L1184 HydrophobicContact CG2-CB 3.99Å; T1182-L1184 PolarHBondContact OG1-N 3.48Å; L1184-P1186 WeakPolarHBondContact O-CD 2.96Å; L1184-D1208 HydrophobicContact CB-CB 4.16Å; L1184-D1208 HydrophobicContact CD2-CB 3.92Å; L1184-V1209 HydrophobicContact CB-CG2 4.02Å; L1184-V1209 HydrophobicContact CD1-CG2 3.79Å
1185	R	92.6	Very high	89.1	Confident	91 Å²	91	51.2 Å²	51.2	34%	0.343	26%	0.259	S	S	.	.			trans	-97.8	104.8	-179.5	-61	166.6	-64.1	166.4	7.5	110.4	D1205 L1206 Y1207 D1208 V1209	R1185-D1205 PolarHBondContact NH1-O 3.25Å; R1185-D1205 PolarHBondContact NH2-O 2.95Å; R1185-D1205 IonicContact NH2-OD1 2.69Å; R1185-D1205 PolarHBondContact NH2-OD1 3.21Å; R1185-L1206 WeakPolarHBondContact CD-O 3.46Å; R1185-L1206 PolarHBondContact NE-O 3.22Å; R1185-L1206 PolarHBondContact NH1-O 3.46Å; R1185-Y1207 HydrophobicContact CB-CD1 4.4Å; R1185-Y1207 WeakPolarHBondContact O-CA 3.49Å; R1185-D1208 VanDerWaalsContact CB-OD2 3.31Å; R1185-D1208 WeakPolarHBondContact CB-OD2 3.46Å; R1185-D1208 WeakPolarHBondContact CG-OD2 3.36Å; R1185-D1208 IonicContact CZ-OD1 2.67Å; R1185-D1208 IonicContact CZ-OD2 3.32Å; R1185-D1208 PolarHBondContact N-OD2 3.3Å; R1185-D1208 IonicContact NE-OD1 2.72Å; R1185-D1208 IonicContact NE-OD2 3.5Å; R1185-D1208 PolarHBondContact NE-OD2 2.9Å; R1185-D1208 IonicContact NH2-OD1 3.7Å; R1185-D1208 PolarHBondContact NH2-OD1 2.85Å; R1185-D1208 IonicContact NH2-OD2 2.71Å; R1185-D1208 PolarHBondContact O-N 3.31Å; R1185-V1209 PolarHBondContact O-N 2.84Å
1186	P	95.2	Very high	88.7	Confident	11 Å²	11	51.4 Å²	51.4	7%	0.071	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	146.2	-179.7	32.5	-35.9	0	0	0	113.2	E1175 I1178 K1179 L1184 V1209 I1211	E1175-P1186 HydrophobicContact CB-CG 4.49Å; E1175-P1186 HydrophobicContact CG-CB 4.09Å; E1175-P1186 HydrophobicContact CG-CG 3.58Å; I1178-P1186 HydrophobicContact CB-CB 4.45Å; I1178-P1186 HydrophobicContact CB-CG 4.37Å; I1178-P1186 HydrophobicContact CD1-CB 3.88Å; I1178-P1186 HydrophobicContact CG2-CB 4.19Å; I1178-P1186 HydrophobicContact CG2-CG 4.11Å; K1179-P1186 HydrophobicContact CD-CG 4.48Å; K1179-P1186 HydrophobicContact CG-CG 4.11Å; L1184-P1186 WeakPolarHBondContact O-CD 2.96Å; P1186-V1209 CarbonylContact C-O 3.57Å; P1186-V1209 WeakPolarHBondContact CA-O 3.37Å; P1186-I1211 HydrophobicContact CB-CD1 4.04Å
1187	L	95.1	Very high	88.7	Confident	5 Å²	5	44.1 Å²	44.1	3%	0.026	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	117.9	169.6	174.9	63.7	0	0	0	110.5	L1189 V1193 Y1207 V1209 V1210 I1211	L1187-L1189 HydrophobicContact CD2-CD2 4.28Å; L1187-L1189 HydrophobicContact CG-CD2 4.48Å; L1187-V1193 HydrophobicContact CD1-CG1 4.34Å; L1187-Y1207 HydrophobicContact CB-CD1 3.62Å; L1187-Y1207 HydrophobicContact CB-CD2 3.99Å; L1187-Y1207 HydrophobicContact CB-CE1 3.96Å; L1187-Y1207 HydrophobicContact CB-CE2 4.34Å; L1187-Y1207 HydrophobicContact CB-CG 3.61Å; L1187-Y1207 HydrophobicContact CD1-CE1 4.17Å; L1187-Y1207 HydrophobicContact CD1-CE2 4.07Å; L1187-Y1207 HydrophobicContact CD2-CD2 3.76Å; L1187-Y1207 HydrophobicContact CD2-CE2 3.93Å; L1187-Y1207 HydrophobicContact CD2-CG 4.25Å; L1187-Y1207 HydrophobicContact CG-CD2 4.3Å; L1187-Y1207 HydrophobicContact CG-CE2 4.34Å; L1187-Y1207 HydrophobicContact CG-CG 4.41Å; L1187-V1209 PolarHBondContact N-O 3.42Å; L1187-V1210 HydrophobicContact CB-CG1 4.11Å; L1187-V1210 HydrophobicContact CD2-CG1 4.09Å; L1187-V1210 HydrophobicContact CG-CG1 4.37Å; L1187-V1210 CarbonylContact O-C 3.58Å; L1187-V1210 VanDerWaalsContact O-CA 3.31Å; L1187-V1210 WeakPolarHBondContact O-CA 3.37Å; L1187-I1211 PolarHBondContact O-N 3.26Å
1188	I	96.2	Very high	88.4	Confident	30 Å²	30	42.7 Å²	42.7	15%	0.154	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	124.7	169.4	-61.4	175.7	0	0	0	109.1	K1171 V1172 E1175 T1190 I1211	K1171-I1188 HydrophobicContact CB-CD1 4.21Å; K1171-I1188 HydrophobicContact CB-CG2 4.23Å; K1171-I1188 HydrophobicContact CD-CG2 3.96Å; V1172-I1188 HydrophobicContact CG2-CD1 4.34Å; E1175-I1188 HydrophobicContact CB-CD1 4.15Å; E1175-I1188 HydrophobicContact CB-CG1 4.47Å; I1188-T1190 HydrophobicContact CG2-CG2 4.18Å; I1188-T1190 PolarHBondContact O-N 3.29Å; I1188-I1211 HydrophobicContact CG1-CB 4.31Å; I1188-I1211 HydrophobicContact CG1-CD1 4.05Å
1189	L	94	Very high	87.9	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	26%	0.256	C	S	.	.			trans	-73.1	113.4	174.9	-62.9	-171.8	0	0	0	110.4	L1187 V1193 Y1197 V1210 I1211 C1212 Y1220 F1221	L1187-L1189 HydrophobicContact CD2-CD2 4.28Å; L1187-L1189 HydrophobicContact CG-CD2 4.48Å; L1189-V1193 HydrophobicContact CD2-CG2 4.11Å; L1189-Y1197 HydrophobicContact CD1-CD2 4.4Å; L1189-Y1197 HydrophobicContact CD1-CE2 4.43Å; L1189-Y1197 HydrophobicContact CD2-CD2 3.7Å; L1189-Y1197 HydrophobicContact CD2-CE2 4.49Å; L1189-Y1197 HydrophobicContact CD2-CG 3.76Å; L1189-V1210 HydrophobicContact CD2-CB 4.26Å; L1189-V1210 HydrophobicContact CD2-CG1 3.92Å; L1189-V1210 HydrophobicContact CG-CB 4.28Å; L1189-V1210 HydrophobicContact CG-CG1 4.47Å; L1189-I1211 PolarHBondContact N-O 3Å; L1189-C1212 HydrophobicContact CD1-CB 4.04Å; L1189-Y1220 HydrophobicContact CB-CD1 4.35Å; L1189-Y1220 HydrophobicContact CB-CD2 4.19Å; L1189-Y1220 HydrophobicContact CB-CE1 4Å; L1189-Y1220 HydrophobicContact CB-CE2 3.83Å; L1189-Y1220 HydrophobicContact CB-CG 4.45Å; L1189-Y1220 HydrophobicContact CD1-CD1 4.02Å; L1189-Y1220 HydrophobicContact CD1-CD2 4.03Å; L1189-Y1220 HydrophobicContact CD1-CG 3.78Å; L1189-F1221 HydrophobicContact CD1-CE2 4.3Å; L1189-F1221 HydrophobicContact CD1-CZ 3.82Å
1190	T	90.4	Very high	87.8	Confident	26 Å²	26	45.7 Å²	45.7	16%	0.16	24%	0.243	C	C	.	.			trans	-121.3	168.6	174.5	56.9	0	0	0	0	110.5	P351 N352 I1188 S1192 V1193 N1194 Y1220	P351-T1190 WeakPolarHBondContact O-CG2 3.16Å; N352-T1190 WeakPolarHBondContact CA-OG1 3.39Å; I1188-T1190 HydrophobicContact CG2-CG2 4.18Å; I1188-T1190 PolarHBondContact O-N 3.29Å; T1190-S1192 PolarHBondContact O-N 3Å; T1190-S1192 VanDerWaalsContact O-N 3.09Å; T1190-S1192 PolarHBondContact OG1-OG 3.07Å; T1190-V1193 WeakPolarHBondContact O-CG2 3.29Å; T1190-V1193 PolarHBondContact O-N 3.1Å; T1190-N1194 PolarHBondContact O-N 3.23Å; T1190-Y1220 VanDerWaalsContact CA-OH 3.27Å; T1190-Y1220 WeakPolarHBondContact CA-OH 3.46Å; T1190-Y1220 PolarHBondContact N-OH 3.13Å; T1190-Y1220 PolarHBondContact O-OH 3.34Å
1191	D	85.5	Confident	87.8	Confident	116 Å²	116	41.8 Å²	41.8	62%	0.62	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-30	-173.3	-77.4	23.4	0	0	0	113.7	N1194 K1219 Y1220	D1191-N1194 VanDerWaalsContact O-CB 3.28Å; D1191-N1194 WeakPolarHBondContact O-CB 3.38Å; D1191-K1219 IonicContact OD1-NZ 2.8Å; D1191-K1219 PolarHBondContact OD1-NZ 3.47Å; D1191-K1219 IonicContact OD2-NZ 3.11Å; D1191-K1219 PolarHBondContact OD2-NZ 3.38Å; D1191-Y1220 PolarHBondContact N-OH 3.31Å
1192	S	81.6	Confident	87.5	Confident	33 Å²	33	42.9 Å²	42.9	23%	0.231	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-32.8	-178.6	60.1	0	0	0	0	116.9	N352 T1190	N352-S1192 WeakPolarHBondContact CA-OG 3.19Å; N352-S1192 WeakPolarHBondContact CB-OG 3.44Å; N352-S1192 WeakPolarHBondContact ND2-CB 3.41Å; N352-S1192 PolarHBondContact O-OG 2.92Å; N352-S1192 WeakPolarHBondContact OD1-CB 3.38Å; N352-S1192 PolarHBondContact OD1-OG 3.49Å; N352-S1192 VanDerWaalsContact OD1-OG 3.13Å; T1190-S1192 PolarHBondContact O-N 3Å; T1190-S1192 VanDerWaalsContact O-N 3.09Å; T1190-S1192 PolarHBondContact OG1-OG 3.07Å
1193	V	85.1	Confident	87	Confident	8 Å²	8	50.4 Å²	50.4	5%	0.048	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-87.4	-3.7	-179.3	-61.2	0	0	0	0	109.6	N352 L1187 L1189 T1190 A1195 T1196 Y1197	N352-V1193 WeakPolarHBondContact O-CG1 3.28Å; L1187-V1193 HydrophobicContact CD1-CG1 4.34Å; L1189-V1193 HydrophobicContact CD2-CG2 4.11Å; T1190-V1193 WeakPolarHBondContact O-CG2 3.29Å; T1190-V1193 PolarHBondContact O-N 3.1Å; V1193-A1195 PolarHBondContact O-N 3.22Å; V1193-A1195 VanDerWaalsContact O-N 3.13Å; V1193-T1196 PolarHBondContact O-N 3.09Å; V1193-Y1197 VanDerWaalsContact O-CB 3.26Å; V1193-Y1197 WeakPolarHBondContact O-CB 3.36Å; V1193-Y1197 WeakPolarHBondContact O-CD1 3.34Å; V1193-Y1197 PolarHBondContact O-N 2.86Å
1194	N	85	Confident	86.5	Confident	34 Å²	34	49 Å²	49	18%	0.182	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-54.7	-34.2	179	-169.8	18.3	0	0	0	113.3	T1190 D1191 Y1220	T1190-N1194 PolarHBondContact O-N 3.23Å; D1191-N1194 VanDerWaalsContact O-CB 3.28Å; D1191-N1194 WeakPolarHBondContact O-CB 3.38Å; N1194-Y1220 HydrophobicContact CB-CD1 4.22Å; N1194-Y1220 HydrophobicContact CB-CE1 3.69Å; N1194-Y1220 WeakPolarHBondContact OD1-CD1 3.49Å
1195	A	81.8	Confident	86.1	Confident	97 Å²	97	52.9 Å²	52.9	80%	0.802	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-85.5	-20.3	177.7	0	0	0	0	0	113.8	V1193	V1193-A1195 PolarHBondContact O-N 3.22Å; V1193-A1195 VanDerWaalsContact O-N 3.13Å
1196	T	86.4	Confident	85.6	Confident	54 Å²	54	52 Å²	52	33%	0.331	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	-18.5	-167.1	55.7	0	0	0	0	114.6	V1193 G1198 Y1199 H1200	V1193-T1196 PolarHBondContact O-N 3.09Å; T1196-G1198 VanDerWaalsContact C-N 3.34Å; T1196-G1198 PolarHBondContact O-N 2.66Å; T1196-Y1199 WeakPolarHBondContact O-CA 3.42Å; T1196-Y1199 WeakPolarHBondContact O-CB 3.39Å; T1196-Y1199 PolarHBondContact O-N 2.91Å; T1196-H1200 PolarHBondContact O-N 2.99Å; T1196-H1200 PolarHBondContact OG1-CE1 2.87Å
1197	Y	88.3	Confident	85.4	Confident	2 Å²	2	54 Å²	54	1%	0.008	29%	0.288	C	S	.	.	H	α-helix	trans	-59.3	-42.9	-173.3	82	-76.4	0	0	0	112.1	L1189 V1193 Y1199 H1200 L1201 Y1220 F1221 E1240	L1189-Y1197 HydrophobicContact CD1-CD2 4.4Å; L1189-Y1197 HydrophobicContact CD1-CE2 4.43Å; L1189-Y1197 HydrophobicContact CD2-CD2 3.7Å; L1189-Y1197 HydrophobicContact CD2-CE2 4.49Å; L1189-Y1197 HydrophobicContact CD2-CG 3.76Å; V1193-Y1197 VanDerWaalsContact O-CB 3.26Å; V1193-Y1197 WeakPolarHBondContact O-CB 3.36Å; V1193-Y1197 WeakPolarHBondContact O-CD1 3.34Å; V1193-Y1197 PolarHBondContact O-N 2.86Å; Y1197-Y1199 VanDerWaalsContact C-N 3.27Å; Y1197-Y1199 PolarHBondContact O-N 3.43Å; Y1197-H1200 PolarHBondContact O-N 3.46Å; Y1197-H1200 VanDerWaalsContact O-N 3.13Å; Y1197-L1201 HydrophobicContact CD2-CD1 3.55Å; Y1197-L1201 HydrophobicContact CE2-CD1 4.09Å; Y1197-L1201 WeakPolarHBondContact O-CB 3.32Å; Y1197-L1201 WeakPolarHBondContact O-CD1 3.43Å; Y1197-L1201 WeakPolarHBondContact O-CG 3.49Å; Y1197-L1201 PolarHBondContact O-N 3.45Å; Y1197-Y1220 HydrophobicContact CD1-CD1 4.49Å; Y1197-Y1220 HydrophobicContact CE1-CD1 4.19Å; Y1197-Y1220 PolarHBondContact OH-O 3.04Å; Y1197-F1221 HydrophobicContact CE2-CE1 4.15Å; Y1197-E1240 HydrophobicContact CE1-CG 4.44Å; Y1197-E1240 HydrophobicContact CE2-CB 4.11Å; Y1197-E1240 HydrophobicContact CE2-CG 4.1Å; Y1197-E1240 WeakPolarHBondContact OH-CB 3.41Å
1198	G	84.7	Confident	85.4	Confident	8 Å²	8	54.9 Å²	54.9	8%	0.082	29%	0.293	C	S	.	.	H	α-helix	trans	-59.5	-38.2	176.4	0	0	0	0	0	112.5	T1196 T1202	T1196-G1198 VanDerWaalsContact C-N 3.34Å; T1196-G1198 PolarHBondContact O-N 2.66Å; G1198-T1202 WeakPolarHBondContact O-CB 3.41Å; G1198-T1202 WeakPolarHBondContact O-CG2 3.46Å; G1198-T1202 PolarHBondContact O-N 2.84Å; G1198-T1202 PolarHBondContact O-OG1 3.31Å
1199	Y	84.3	Confident	85.4	Confident	130 Å²	130	53.4 Å²	53.4	51%	0.51	29%	0.285	S	S	.	.	H	α-helix	trans	-70.1	-41.1	174.3	-177.5	-100.5	0	0	0	111.9	T1196 Y1197 L1201 T1202 K1203 M1204	T1196-Y1199 WeakPolarHBondContact O-CA 3.42Å; T1196-Y1199 WeakPolarHBondContact O-CB 3.39Å; T1196-Y1199 PolarHBondContact O-N 2.91Å; Y1197-Y1199 VanDerWaalsContact C-N 3.27Å; Y1197-Y1199 PolarHBondContact O-N 3.43Å; Y1199-L1201 PolarHBondContact O-N 2.92Å; Y1199-T1202 PolarHBondContact O-N 3.43Å; Y1199-K1203 HydrophobicContact CD2-CB 3.56Å; Y1199-K1203 HydrophobicContact CD2-CG 3.57Å; Y1199-K1203 HydrophobicContact CE2-CB 3.37Å; Y1199-K1203 HydrophobicContact CE2-CG 3.6Å; Y1199-K1203 HydrophobicContact CG-CB 4.2Å; Y1199-K1203 PolarHBondContact O-N 3.49Å; Y1199-M1204 HydrophobicContact CD1-CG 3.85Å; Y1199-M1204 HydrophobicContact CD1-SD 3.93Å; Y1199-M1204 HydrophobicContact CE1-CE 3.75Å; Y1199-M1204 HydrophobicContact CE1-CG 3.39Å; Y1199-M1204 HydrophobicContact CE1-SD 3.54Å; Y1199-M1204 VanDerWaalsContact CE1-SD 3.54Å; Y1199-M1204 PolarHBondContact O-N 3.29Å
1200	H	85	Confident	85.5	Confident	37 Å²	37	53.4 Å²	53.4	17%	0.171	29%	0.285	C	S	.	.	H	α-helix	trans	-66	-36	177.1	-60.9	163.7	0	0	0	113.4	T1196 Y1197 D1205 L1206 Y1207	T1196-H1200 PolarHBondContact O-N 2.99Å; T1196-H1200 PolarHBondContact OG1-CE1 2.87Å; Y1197-H1200 PolarHBondContact O-N 3.46Å; Y1197-H1200 VanDerWaalsContact O-N 3.13Å; H1200-D1205 PolarHBondContact O-N 3.48Å; H1200-L1206 HydrophobicContact CB-CD1 4.37Å; H1200-L1206 PolarHBondContact O-N 2.9Å; H1200-Y1207 HydrophobicContact CB-CD2 3.79Å; H1200-Y1207 HydrophobicContact CB-CE2 3.92Å
1201	L	82.6	Confident	85.9	Confident	13 Å²	13	52.1 Å²	52.1	7%	0.068	28%	0.277	C	S	.	.	H	α-helix	trans	-70.8	-31.3	176.5	-87.2	153.1	0	0	0	113.2	P1161 Y1197 Y1199 V1210	P1161-L1201 HydrophobicContact CB-CD2 3.36Å; P1161-L1201 HydrophobicContact CG-CD2 3.86Å; Y1197-L1201 HydrophobicContact CD2-CD1 3.55Å; Y1197-L1201 HydrophobicContact CE2-CD1 4.09Å; Y1197-L1201 WeakPolarHBondContact O-CB 3.32Å; Y1197-L1201 WeakPolarHBondContact O-CD1 3.43Å; Y1197-L1201 WeakPolarHBondContact O-CG 3.49Å; Y1197-L1201 PolarHBondContact O-N 3.45Å; Y1199-L1201 PolarHBondContact O-N 2.92Å; L1201-V1210 HydrophobicContact CD1-CG1 3.64Å; L1201-V1210 HydrophobicContact CD1-CG2 4.35Å; L1201-V1210 HydrophobicContact CD2-CG1 4.06Å; L1201-V1210 HydrophobicContact CG-CG1 4.07Å
1202	T	80.9	Confident	86.4	Confident	58 Å²	58	46.6 Å²	46.6	36%	0.356	25%	0.248	S	C	.	.	H	α-helix	trans	-108.7	-61.3	-171.7	53.2	0	0	0	0	113.4	G1198 Y1199 I1243	G1198-T1202 WeakPolarHBondContact O-CB 3.41Å; G1198-T1202 WeakPolarHBondContact O-CG2 3.46Å; G1198-T1202 PolarHBondContact O-N 2.84Å; G1198-T1202 PolarHBondContact O-OG1 3.31Å; Y1199-T1202 PolarHBondContact O-N 3.43Å; T1202-I1243 HydrophobicContact CG2-CB 4.23Å; T1202-I1243 HydrophobicContact CG2-CD1 3.35Å; T1202-I1243 HydrophobicContact CG2-CG1 3.76Å; T1202-I1243 HydrophobicContact CG2-CG2 3.55Å
1203	K	77	Confident	87.1	Confident	161 Å²	161	45.8 Å²	45.8	70%	0.7	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-35	-167.6	-66.2	-63.1	-174.6	-178.1	0	112.4	Y1199	Y1199-K1203 HydrophobicContact CD2-CB 3.56Å; Y1199-K1203 HydrophobicContact CD2-CG 3.57Å; Y1199-K1203 HydrophobicContact CE2-CB 3.37Å; Y1199-K1203 HydrophobicContact CE2-CG 3.6Å; Y1199-K1203 HydrophobicContact CG-CB 4.2Å; Y1199-K1203 PolarHBondContact O-N 3.49Å
1204	M	73.5	Confident	87.6	Confident	95 Å²	95	45.5 Å²	45.5	47%	0.468	24%	0.239	S	C	.	.	S	Bend	trans	-96.5	-13.5	179.6	-61	-171.1	132.7	0	0	113.7	Y1199 L1206	Y1199-M1204 HydrophobicContact CD1-CG 3.85Å; Y1199-M1204 HydrophobicContact CD1-SD 3.93Å; Y1199-M1204 HydrophobicContact CE1-CE 3.75Å; Y1199-M1204 HydrophobicContact CE1-CG 3.39Å; Y1199-M1204 HydrophobicContact CE1-SD 3.54Å; Y1199-M1204 VanDerWaalsContact CE1-SD 3.54Å; Y1199-M1204 PolarHBondContact O-N 3.29Å; M1204-L1206 VanDerWaalsContact C-N 3.28Å; M1204-L1206 HydrophobicContact CB-CD1 3.78Å; M1204-L1206 HydrophobicContact CB-CD2 4.37Å; M1204-L1206 HydrophobicContact CB-CG 3.58Å; M1204-L1206 HydrophobicContact CG-CD1 4.43Å; M1204-L1206 PolarHBondContact O-N 3.27Å; M1204-L1206 HydrophobicContact SD-CD1 3.76Å
1205	D	82.6	Confident	88	Confident	101 Å²	101	49 Å²	49	54%	0.54	25%	0.254	S	S	.	.			trans	46.9	51.3	-177.6	-172.3	17.2	0	0	0	111.9	R1185 H1200	R1185-D1205 PolarHBondContact NH1-O 3.25Å; R1185-D1205 PolarHBondContact NH2-O 2.95Å; R1185-D1205 IonicContact NH2-OD1 2.69Å; R1185-D1205 PolarHBondContact NH2-OD1 3.21Å; H1200-D1205 PolarHBondContact O-N 3.48Å
1206	L	82.1	Confident	88.5	Confident	72 Å²	72	45.5 Å²	45.5	38%	0.377	22%	0.224	S	C	.	.			trans	-94.5	-23.3	-175.7	-67.3	176.1	0	0	0	113.5	R1185 H1200 M1204	R1185-L1206 WeakPolarHBondContact CD-O 3.46Å; R1185-L1206 PolarHBondContact NE-O 3.22Å; R1185-L1206 PolarHBondContact NH1-O 3.46Å; H1200-L1206 HydrophobicContact CB-CD1 4.37Å; H1200-L1206 PolarHBondContact O-N 2.9Å; M1204-L1206 VanDerWaalsContact C-N 3.28Å; M1204-L1206 HydrophobicContact CB-CD1 3.78Å; M1204-L1206 HydrophobicContact CB-CD2 4.37Å; M1204-L1206 HydrophobicContact CB-CG 3.58Å; M1204-L1206 HydrophobicContact CG-CD1 4.43Å; M1204-L1206 PolarHBondContact O-N 3.27Å; M1204-L1206 HydrophobicContact SD-CD1 3.76Å
1207	Y	91.5	Very high	88.9	Confident	54 Å²	54	43 Å²	43	21%	0.212	21%	0.208	C	C	.	.			trans	-139.3	140.3	-171.7	-57.5	-75	0	0	0	111.2	R1185 L1187 H1200	R1185-Y1207 HydrophobicContact CB-CD1 4.4Å; R1185-Y1207 WeakPolarHBondContact O-CA 3.49Å; L1187-Y1207 HydrophobicContact CB-CD1 3.62Å; L1187-Y1207 HydrophobicContact CB-CD2 3.99Å; L1187-Y1207 HydrophobicContact CB-CE1 3.96Å; L1187-Y1207 HydrophobicContact CB-CE2 4.34Å; L1187-Y1207 HydrophobicContact CB-CG 3.61Å; L1187-Y1207 HydrophobicContact CD1-CE1 4.17Å; L1187-Y1207 HydrophobicContact CD1-CE2 4.07Å; L1187-Y1207 HydrophobicContact CD2-CD2 3.76Å; L1187-Y1207 HydrophobicContact CD2-CE2 3.93Å; L1187-Y1207 HydrophobicContact CD2-CG 4.25Å; L1187-Y1207 HydrophobicContact CG-CD2 4.3Å; L1187-Y1207 HydrophobicContact CG-CE2 4.34Å; L1187-Y1207 HydrophobicContact CG-CG 4.41Å; H1200-Y1207 HydrophobicContact CB-CD2 3.79Å; H1200-Y1207 HydrophobicContact CB-CE2 3.92Å
1208	D	94.3	Very high	89	Confident	22 Å²	22	43.6 Å²	43.6	12%	0.118	21%	0.214	C	C	.	.	S	Bend	trans	-103.8	-21.2	-178.8	-48.8	-62.7	0	0	0	111.6	T1160 P1161 C1162 L1184 R1185	T1160-D1208 WeakPolarHBondContact CB-O 3.41Å; T1160-D1208 HydrophobicContact CG2-CB 3.94Å; P1161-D1208 CarbonylContact C-O 3.56Å; P1161-D1208 VanDerWaalsContact CA-O 3.27Å; P1161-D1208 WeakPolarHBondContact CA-O 3.42Å; C1162-D1208 PolarHBondContact N-O 2.92Å; L1184-D1208 HydrophobicContact CB-CB 4.16Å; L1184-D1208 HydrophobicContact CD2-CB 3.92Å; R1185-D1208 VanDerWaalsContact CB-OD2 3.31Å; R1185-D1208 WeakPolarHBondContact CB-OD2 3.46Å; R1185-D1208 WeakPolarHBondContact CG-OD2 3.36Å; R1185-D1208 IonicContact CZ-OD1 2.67Å; R1185-D1208 IonicContact CZ-OD2 3.32Å; R1185-D1208 PolarHBondContact N-OD2 3.3Å; R1185-D1208 IonicContact NE-OD1 2.72Å; R1185-D1208 IonicContact NE-OD2 3.5Å; R1185-D1208 PolarHBondContact NE-OD2 2.9Å; R1185-D1208 IonicContact NH2-OD1 3.7Å; R1185-D1208 PolarHBondContact NH2-OD1 2.85Å; R1185-D1208 IonicContact NH2-OD2 2.71Å; R1185-D1208 PolarHBondContact O-N 3.31Å
1209	V	96.6	Very high	89.3	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	130.6	-176.9	-173.3	0	0	0	0	109.9	I1151 C1162 V1164 I1178 L1184 R1185 P1186 L1187 I1211	I1151-V1209 HydrophobicContact CD1-CG2 4.03Å; C1162-V1209 HydrophobicContact CB-CG1 4.35Å; C1162-V1209 HydrophobicContact CB-CG2 4.29Å; C1162-V1209 CarbonylContact O-C 3.59Å; C1162-V1209 WeakPolarHBondContact O-CA 3.43Å; V1164-V1209 HydrophobicContact CG2-CG1 3.64Å; I1178-V1209 HydrophobicContact CD1-CB 4.42Å; I1178-V1209 HydrophobicContact CD1-CG1 3.96Å; L1184-V1209 HydrophobicContact CB-CG2 4.02Å; L1184-V1209 HydrophobicContact CD1-CG2 3.79Å; R1185-V1209 PolarHBondContact O-N 2.84Å; P1186-V1209 CarbonylContact C-O 3.57Å; P1186-V1209 WeakPolarHBondContact CA-O 3.37Å; L1187-V1209 PolarHBondContact N-O 3.42Å; V1209-I1211 HydrophobicContact CG1-CG1 4.47Å
1210	V	96.4	Very high	89.7	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	134.5	169.3	-81.8	0	0	0	0	111.3	C1162 L1163 V1164 L1187 L1189 L1201 L1244	C1162-V1210 PolarHBondContact O-N 3.03Å; L1163-V1210 CarbonylContact C-O 3.56Å; L1163-V1210 WeakPolarHBondContact CA-O 3.31Å; L1163-V1210 HydrophobicContact CB-CG2 4.27Å; L1163-V1210 HydrophobicContact CD1-CG2 3.87Å; V1164-V1210 PolarHBondContact N-O 3.19Å; L1187-V1210 HydrophobicContact CB-CG1 4.11Å; L1187-V1210 HydrophobicContact CD2-CG1 4.09Å; L1187-V1210 HydrophobicContact CG-CG1 4.37Å; L1187-V1210 CarbonylContact O-C 3.58Å; L1187-V1210 VanDerWaalsContact O-CA 3.31Å; L1187-V1210 WeakPolarHBondContact O-CA 3.37Å; L1189-V1210 HydrophobicContact CD2-CB 4.26Å; L1189-V1210 HydrophobicContact CD2-CG1 3.92Å; L1189-V1210 HydrophobicContact CG-CB 4.28Å; L1189-V1210 HydrophobicContact CG-CG1 4.47Å; L1201-V1210 HydrophobicContact CD1-CG1 3.64Å; L1201-V1210 HydrophobicContact CD1-CG2 4.35Å; L1201-V1210 HydrophobicContact CD2-CG1 4.06Å; L1201-V1210 HydrophobicContact CG-CG1 4.07Å; V1210-L1244 HydrophobicContact CG2-CD2 3.87Å
1211	I	97.9	Very high	90.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	119.2	-176.3	-52.6	166.6	0	0	0	109.1	V1164 K1171 W1174 E1175 I1178 P1186 L1187 I1188 L1189 V1209	V1164-I1211 HydrophobicContact CB-CG1 4.21Å; V1164-I1211 HydrophobicContact CB-CG2 4.43Å; V1164-I1211 HydrophobicContact CG1-CG2 4.29Å; V1164-I1211 WeakPolarHBondContact O-CA 3.39Å; K1171-I1211 HydrophobicContact CB-CG2 4.1Å; K1171-I1211 HydrophobicContact CG-CG2 4.06Å; W1174-I1211 HydrophobicContact CB-CD1 3.95Å; W1174-I1211 HydrophobicContact CB-CG2 4.35Å; E1175-I1211 HydrophobicContact CB-CD1 4.1Å; I1178-I1211 HydrophobicContact CD1-CD1 3.95Å; I1178-I1211 HydrophobicContact CD1-CG1 4.41Å; P1186-I1211 HydrophobicContact CB-CD1 4.04Å; L1187-I1211 PolarHBondContact O-N 3.26Å; I1188-I1211 HydrophobicContact CG1-CB 4.31Å; I1188-I1211 HydrophobicContact CG1-CD1 4.05Å; L1189-I1211 PolarHBondContact N-O 3Å; V1209-I1211 HydrophobicContact CG1-CG1 4.47Å
1212	C	96.6	Very high	90.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	146.2	-177.6	-166.8	0	0	0	0	110.9	L1163 V1164 I1165 C1166 L1189 F1221	L1163-C1212 HydrophobicContact CD1-CB 3.99Å; V1164-C1212 PolarHBondContact O-N 3.37Å; I1165-C1212 VanDerWaalsContact CA-O 3.32Å; I1165-C1212 WeakPolarHBondContact CA-O 3.32Å; C1166-C1212 PolarHBondContact N-O 3.29Å; L1189-C1212 HydrophobicContact CD1-CB 4.04Å; C1212-F1221 HydrophobicContact CB-CE2 4.29Å
1213	N	96.1	Very high	90.8	Very high	15 Å²	15	41 Å²	41	8%	0.08	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	152.1	169.3	65.5	-62.8	0	0	0	112.6	C1166 A1168 K1171 E1215 S1216	C1166-N1213 WeakPolarHBondContact O-CA 3.25Å; A1168-N1213 HydrophobicContact CB-CB 4.07Å; K1171-N1213 HydrophobicContact CD-CB 4.18Å; N1213-E1215 PolarHBondContact ND2-OE2 3.01Å; N1213-E1215 PolarHBondContact O-N 3.11Å; N1213-E1215 VanDerWaalsContact O-N 3.14Å; N1213-S1216 PolarHBondContact ND2-OG 2.96Å; N1213-S1216 PolarHBondContact O-N 2.91Å; N1213-S1216 WeakPolarHBondContact OD1-CB 3.45Å; N1213-S1216 PolarHBondContact OD1-OG 3.18Å
1214	Y	95.3	Very high	91.2	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.008	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-48.7	-41.2	-178.7	-77.5	-86.8	0	0	0	114.2	I1165 S1216 L1217 I1249 D1250 E1251 R1254 V1255 Q1262 I1266	I1165-Y1214 HydrophobicContact CG2-CD1 3.91Å; I1165-Y1214 HydrophobicContact CG2-CD2 4.15Å; I1165-Y1214 HydrophobicContact CG2-CE1 3.85Å; I1165-Y1214 HydrophobicContact CG2-CE2 4.1Å; I1165-Y1214 HydrophobicContact CG2-CG 4.06Å; Y1214-S1216 VanDerWaalsContact C-N 3.27Å; Y1214-S1216 PolarHBondContact O-N 3.36Å; Y1214-L1217 HydrophobicContact CD1-CD1 4.49Å; Y1214-L1217 WeakPolarHBondContact O-CD1 3.26Å; Y1214-L1217 WeakPolarHBondContact O-CG 3.37Å; Y1214-I1249 HydrophobicContact CE1-CG2 4.36Å; Y1214-I1249 WeakPolarHBondContact OH-CG2 3.36Å; Y1214-D1250 VanDerWaalsContact CE2-O 3.29Å; Y1214-D1250 WeakPolarHBondContact CE2-O 3.31Å; Y1214-D1250 PolarHBondContact OH-O 3.45Å; Y1214-E1251 PolarHBondContact OH-O 3.34Å; Y1214-R1254 HydrophobicContact CE1-CB 4.1Å; Y1214-V1255 HydrophobicContact CD1-CG1 4.4Å; Y1214-V1255 HydrophobicContact CE1-CG1 3.77Å; Y1214-Q1262 PolarHBondContact O-NE2 3.04Å; Y1214-I1266 HydrophobicContact CD1-CD1 3.92Å; Y1214-I1266 HydrophobicContact CE1-CD1 3.73Å
1215	E	93.2	Very high	91.3	Very high	107 Å²	107	34.2 Å²	34.2	50%	0.5	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-70.5	-23.5	-176.7	-57.8	73.6	-158.7	0	0	112.7	N1213 R1254	N1213-E1215 PolarHBondContact ND2-OE2 3.01Å; N1213-E1215 PolarHBondContact O-N 3.11Å; N1213-E1215 VanDerWaalsContact O-N 3.14Å; E1215-R1254 IonicContact OE1-NH1 2.74Å
1216	S	93.9	Very high	90.6	Very high	24 Å²	24	30.5 Å²	30.5	17%	0.168	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-96.9	-4.6	-175.2	-53.7	0	0	0	0	113.8	N1213 Y1214 A1218 K1219 Y1220	N1213-S1216 PolarHBondContact ND2-OG 2.96Å; N1213-S1216 PolarHBondContact O-N 2.91Å; N1213-S1216 WeakPolarHBondContact OD1-CB 3.45Å; N1213-S1216 PolarHBondContact OD1-OG 3.18Å; Y1214-S1216 VanDerWaalsContact C-N 3.27Å; Y1214-S1216 PolarHBondContact O-N 3.36Å; S1216-A1218 VanDerWaalsContact C-N 3.29Å; S1216-A1218 PolarHBondContact O-N 3.11Å; S1216-K1219 VanDerWaalsContact O-CB 3.27Å; S1216-K1219 WeakPolarHBondContact O-CB 3.13Å; S1216-K1219 PolarHBondContact O-N 3.26Å; S1216-Y1220 VanDerWaalsContact O-CD2 3.25Å; S1216-Y1220 WeakPolarHBondContact O-CD2 3.38Å; S1216-Y1220 PolarHBondContact O-N 2.93Å
1217	L	93.5	Very high	90	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-54.1	-43.5	-175.4	-70	169	0	0	0	113.3	I1165 Y1214 K1219 Y1220 F1221 I1265 I1266 I1269	I1165-L1217 HydrophobicContact CD1-CD1 4.44Å; I1165-L1217 HydrophobicContact CD1-CD2 3.74Å; I1165-L1217 HydrophobicContact CG1-CD2 4.01Å; I1165-L1217 HydrophobicContact CG2-CD1 4.13Å; I1165-L1217 HydrophobicContact CG2-CD2 4.15Å; I1165-L1217 HydrophobicContact CG2-CG 4.49Å; Y1214-L1217 HydrophobicContact CD1-CD1 4.49Å; Y1214-L1217 WeakPolarHBondContact O-CD1 3.26Å; Y1214-L1217 WeakPolarHBondContact O-CG 3.37Å; L1217-K1219 VanDerWaalsContact C-N 3.28Å; L1217-K1219 PolarHBondContact O-N 3.47Å; L1217-Y1220 PolarHBondContact O-N 3.35Å; L1217-F1221 HydrophobicContact CD2-CD2 4.01Å; L1217-F1221 HydrophobicContact CD2-CE2 4.03Å; L1217-F1221 WeakPolarHBondContact O-CB 3.37Å; L1217-F1221 WeakPolarHBondContact O-CD2 3.23Å; L1217-F1221 PolarHBondContact O-N 2.78Å; L1217-I1265 HydrophobicContact CB-CG2 3.87Å; L1217-I1266 HydrophobicContact CD1-CD1 3.65Å; L1217-I1266 HydrophobicContact CD1-CG1 3.57Å; L1217-I1269 HydrophobicContact CD2-CD1 4.29Å
1218	A	91.3	Very high	89.2	Confident	15 Å²	15	41.6 Å²	41.6	12%	0.124	22%	0.217	C	C	.	.	H	α-helix	trans	-66	-32.4	179.7	0	0	0	0	0	113.2	S1216 V1222 I1265	S1216-A1218 VanDerWaalsContact C-N 3.29Å; S1216-A1218 PolarHBondContact O-N 3.11Å; A1218-V1222 HydrophobicContact CB-CG2 4.48Å; A1218-V1222 WeakPolarHBondContact O-CB 3.37Å; A1218-V1222 PolarHBondContact O-N 2.69Å; A1218-I1265 HydrophobicContact CB-CD1 3.6Å
1219	K	90.9	Very high	88	Confident	79 Å²	79	45.1 Å²	45.1	34%	0.343	24%	0.241	S	C	.	.	H	α-helix	trans	-64.9	-43.3	-179.7	178.6	-178.2	-173.1	159	0	111.4	D1191 S1216 L1217 R1238	D1191-K1219 IonicContact OD1-NZ 2.8Å; D1191-K1219 PolarHBondContact OD1-NZ 3.47Å; D1191-K1219 IonicContact OD2-NZ 3.11Å; D1191-K1219 PolarHBondContact OD2-NZ 3.38Å; S1216-K1219 VanDerWaalsContact O-CB 3.27Å; S1216-K1219 WeakPolarHBondContact O-CB 3.13Å; S1216-K1219 PolarHBondContact O-N 3.26Å; L1217-K1219 VanDerWaalsContact C-N 3.28Å; L1217-K1219 PolarHBondContact O-N 3.47Å; K1219-R1238 PolarHBondContact O-NH2 3.01Å
1220	Y	91.8	Very high	86.9	Confident	1 Å²	1	47.4 Å²	47.4	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-88.4	-35.2	-174.4	-66	-71.2	0	0	0	113.4	L1189 T1190 D1191 N1194 Y1197 S1216 L1217 R1238	L1189-Y1220 HydrophobicContact CB-CD1 4.35Å; L1189-Y1220 HydrophobicContact CB-CD2 4.19Å; L1189-Y1220 HydrophobicContact CB-CE1 4Å; L1189-Y1220 HydrophobicContact CB-CE2 3.83Å; L1189-Y1220 HydrophobicContact CB-CG 4.45Å; L1189-Y1220 HydrophobicContact CD1-CD1 4.02Å; L1189-Y1220 HydrophobicContact CD1-CD2 4.03Å; L1189-Y1220 HydrophobicContact CD1-CG 3.78Å; T1190-Y1220 VanDerWaalsContact CA-OH 3.27Å; T1190-Y1220 WeakPolarHBondContact CA-OH 3.46Å; T1190-Y1220 PolarHBondContact N-OH 3.13Å; T1190-Y1220 PolarHBondContact O-OH 3.34Å; D1191-Y1220 PolarHBondContact N-OH 3.31Å; N1194-Y1220 HydrophobicContact CB-CD1 4.22Å; N1194-Y1220 HydrophobicContact CB-CE1 3.69Å; N1194-Y1220 WeakPolarHBondContact OD1-CD1 3.49Å; Y1197-Y1220 HydrophobicContact CD1-CD1 4.49Å; Y1197-Y1220 HydrophobicContact CE1-CD1 4.19Å; Y1197-Y1220 PolarHBondContact OH-O 3.04Å; S1216-Y1220 VanDerWaalsContact O-CD2 3.25Å; S1216-Y1220 WeakPolarHBondContact O-CD2 3.38Å; S1216-Y1220 PolarHBondContact O-N 2.93Å; L1217-Y1220 PolarHBondContact O-N 3.35Å; Y1220-R1238 WeakPolarHBondContact O-CD 3.41Å; Y1220-R1238 PolarHBondContact O-NE 3.19Å
1221	F	93.6	Very high	86.1	Confident	1 Å²	1	53 Å²	53	0%	0.004	28%	0.278	C	S	.	.	H	α-helix	trans	-114.4	-6.9	-167.1	-56.9	-65.4	0	0	0	114.8	L1163 L1189 Y1197 C1212 L1217 F1237 R1238 V1241 L1244 I1269	L1163-F1221 HydrophobicContact CD1-CE2 3.99Å; L1163-F1221 HydrophobicContact CD1-CZ 3.63Å; L1163-F1221 HydrophobicContact CD2-CE1 4.38Å; L1163-F1221 HydrophobicContact CD2-CE2 3.86Å; L1163-F1221 HydrophobicContact CD2-CZ 3.78Å; L1163-F1221 HydrophobicContact CG-CZ 4.35Å; L1189-F1221 HydrophobicContact CD1-CE2 4.3Å; L1189-F1221 HydrophobicContact CD1-CZ 3.82Å; Y1197-F1221 HydrophobicContact CE2-CE1 4.15Å; C1212-F1221 HydrophobicContact CB-CE2 4.29Å; L1217-F1221 HydrophobicContact CD2-CD2 4.01Å; L1217-F1221 HydrophobicContact CD2-CE2 4.03Å; L1217-F1221 WeakPolarHBondContact O-CB 3.37Å; L1217-F1221 WeakPolarHBondContact O-CD2 3.23Å; L1217-F1221 PolarHBondContact O-N 2.78Å; F1221-F1237 CarbonylContact O-C 3.53Å; F1221-F1237 VanDerWaalsContact O-CA 3.26Å; F1221-F1237 WeakPolarHBondContact O-CA 3.45Å; F1221-F1237 WeakPolarHBondContact O-CD1 3.2Å; F1221-R1238 PolarHBondContact O-N 3.48Å; F1221-V1241 HydrophobicContact CB-CG2 3.85Å; F1221-V1241 HydrophobicContact CD1-CG2 3.83Å; F1221-V1241 HydrophobicContact CG-CG2 4.23Å; F1221-L1244 HydrophobicContact CE1-CD1 4.23Å; F1221-I1269 HydrophobicContact CB-CD1 3.82Å; F1221-I1269 HydrophobicContact CB-CG1 4.26Å; F1221-I1269 HydrophobicContact CD2-CD1 3.72Å; F1221-I1269 HydrophobicContact CG-CD1 3.82Å; F1221-I1269 HydrophobicContact CG-CG1 4.49Å
1222	V	91.4	Very high	85.2	Confident	13 Å²	13	55.3 Å²	55.3	8%	0.079	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	127.6	-178.3	-176.7	0	0	0	0	110.7	A1218 S1224 L1225 F1235 F1237 I1265	A1218-V1222 HydrophobicContact CB-CG2 4.48Å; A1218-V1222 WeakPolarHBondContact O-CB 3.37Å; A1218-V1222 PolarHBondContact O-N 2.69Å; V1222-S1224 WeakPolarHBondContact CG1-O 3.44Å; V1222-L1225 HydrophobicContact CG1-CD2 4.04Å; V1222-F1235 HydrophobicContact CG1-CD1 4.25Å; V1222-F1235 HydrophobicContact CG2-CD1 4.34Å; V1222-F1237 HydrophobicContact CG2-CD1 4.27Å; V1222-F1237 HydrophobicContact CG2-CE1 4.13Å; V1222-I1265 HydrophobicContact CG2-CD1 3.98Å; V1222-I1265 HydrophobicContact CG2-CG1 3.94Å; V1222-I1265 HydrophobicContact CG2-CG2 4.11Å
1223	V	88.3	Confident	84.6	Confident	97 Å²	97	63.6 Å²	63.6	59%	0.588	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	-48.8	172.5	179.6	0	0	0	0	110.2	I1236 R1238	V1223-I1236 HydrophobicContact CB-CB 4.22Å; V1223-I1236 HydrophobicContact CB-CG2 3.92Å; V1223-I1236 HydrophobicContact CG1-CG2 4.46Å; V1223-I1236 HydrophobicContact CG2-CG2 4.17Å; V1223-I1236 PolarHBondContact N-O 2.97Å; V1223-R1238 HydrophobicContact CG2-CB 4.34Å; V1223-R1238 HydrophobicContact CG2-CG 3.77Å
1224	S	84.9	Confident	83.9	Confident	54 Å²	54	65 Å²	65	38%	0.378	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	136.6	-178.7	-176.3	0	0	0	0	111.1	V1222 I1236	V1222-S1224 WeakPolarHBondContact CG1-O 3.44Å; S1224-I1236 PolarHBondContact O-N 3.32Å; S1224-I1236 VanDerWaalsContact O-N 3.13Å
1225	L	75.1	Confident	83.4	Confident	61 Å²	61	65.7 Å²	65.7	32%	0.319	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	105.5	164	-53.6	167.3	0	0	0	105.3	V1222 L1230 F1235	V1222-L1225 HydrophobicContact CG1-CD2 4.04Å; L1225-L1230 HydrophobicContact CB-CD2 3.93Å; L1225-F1235 HydrophobicContact CD2-CD1 3.86Å; L1225-F1235 HydrophobicContact CD2-CE1 3.4Å; L1225-F1235 VanDerWaalsContact CD2-CE1 3.4Å; L1225-F1235 HydrophobicContact CD2-CZ 4.18Å
1226	G	68.5	Low	83.1	Confident	22 Å²	22	65.2 Å²	65.2	23%	0.227	34%	0.336	C	S	.	.			trans	-60.7	-176.5	179.9	0	0	0	0	0	113.8	N1234	G1226-N1234 VanDerWaalsContact CA-O 3.29Å; G1226-N1234 WeakPolarHBondContact CA-O 3.18Å; G1226-N1234 PolarHBondContact N-O 3.48Å
1227	E	69.6	Low	83	Confident	170 Å²	170	66.2 Å²	66.2	79%	0.794	34%	0.338	S	S	*	.	S	Bend	trans	-57	148.9	-173.4	-65.4	-176.4	171.5	0	0	113.4	P1229 N1234	E1227-P1229 CarbonylContact O-C 3.54Å; E1227-P1229 VanDerWaalsContact O-O 3.14Å; E1227-N1234 PolarHBondContact O-ND2 2.95Å; E1227-N1234 VanDerWaalsContact O-ND2 3.13Å
1228	K	73.4	Confident	82.9	Confident	190 Å²	190	69.3 Å²	69.3	83%	0.826	35%	0.349	S	S	*	.	S	Bend	trans	-69.7	141.5	172.9	-68.5	-173.8	-178.6	178.9	0	109.7
1229	P	70.5	Confident	82.7	Confident	96 Å²	96	74.6 Å²	74.6	62%	0.623	38%	0.376	S	S	*	.	S	Bend	cis	-73.6	140	0.6	29.8	-34.3	0	0	0	112.5	E1227 K1231 N1234	E1227-P1229 CarbonylContact O-C 3.54Å; E1227-P1229 VanDerWaalsContact O-O 3.14Å; P1229-K1231 PolarHBondContact O-N 3.48Å; P1229-N1234 PolarHBondContact O-ND2 3.07Å
1230	L	72.2	Confident	82.5	Confident	48 Å²	48	73.1 Å²	73.1	25%	0.251	37%	0.37	S	S	.	.			trans	-66	88.2	-179.3	-67	169.5	0	0	0	110.8	L1225 F1235 K1264	L1225-L1230 HydrophobicContact CB-CD2 3.93Å; L1230-F1235 HydrophobicContact CB-CE2 4.21Å; L1230-F1235 HydrophobicContact CB-CZ 4.33Å; L1230-F1235 HydrophobicContact CD2-CZ 4.46Å; L1230-K1264 WeakPolarHBondContact O-CD 3.45Å; L1230-K1264 WeakPolarHBondContact O-CE 3.28Å; L1230-K1264 PolarHBondContact O-NZ 3.3Å
1231	K	79.8	Confident	82.4	Confident	117 Å²	117	73.4 Å²	73.4	51%	0.509	37%	0.371	S	S	.	.			trans	-92	147.3	170.4	-65.5	-174	177.8	-172.9	0	109.5	P1229 K1233 N1234 F1235	P1229-K1231 PolarHBondContact O-N 3.48Å; K1231-K1233 HydrophobicContact CB-CG 4.14Å; K1231-K1233 PolarHBondContact O-N 2.88Å; K1231-N1234 VanDerWaalsContact O-CB 3.3Å; K1231-N1234 WeakPolarHBondContact O-CB 3.3Å; K1231-N1234 PolarHBondContact O-N 3.43Å; K1231-F1235 VanDerWaalsContact O-CD2 3.28Å; K1231-F1235 WeakPolarHBondContact O-CD2 3.42Å
1232	L	80.2	Confident	82.3	Confident	48 Å²	48	79.5 Å²	79.5	25%	0.251	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-51.9	-42.1	-177.9	-176.7	57.1	0	0	0	112.8	N1234 F1235 F1237 K1264 M1267	L1232-N1234 PolarHBondContact O-N 3.04Å; L1232-F1235 WeakPolarHBondContact O-CB 3.39Å; L1232-F1235 PolarHBondContact O-N 2.92Å; L1232-F1237 HydrophobicContact CD1-CE2 4.39Å; L1232-F1237 HydrophobicContact CD1-CZ 4.41Å; L1232-K1264 WeakPolarHBondContact CD1-O 3.47Å; L1232-M1267 HydrophobicContact CD2-CB 4.19Å
1233	K	83	Confident	82.2	Confident	174 Å²	174	82 Å²	82	76%	0.757	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-59.5	-15.6	176.9	71.1	177.9	-173	168.9	0	115.3	K1231	K1231-K1233 HydrophobicContact CB-CG 4.14Å; K1231-K1233 PolarHBondContact O-N 2.88Å
1234	N	81.7	Confident	82.4	Confident	46 Å²	46	77.6 Å²	77.6	25%	0.246	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-92.4	-7.5	179.7	-60.6	-2.3	0	0	0	112	G1226 E1227 P1229 K1231 L1232	G1226-N1234 VanDerWaalsContact CA-O 3.29Å; G1226-N1234 WeakPolarHBondContact CA-O 3.18Å; G1226-N1234 PolarHBondContact N-O 3.48Å; E1227-N1234 PolarHBondContact O-ND2 2.95Å; E1227-N1234 VanDerWaalsContact O-ND2 3.13Å; P1229-N1234 PolarHBondContact O-ND2 3.07Å; K1231-N1234 VanDerWaalsContact O-CB 3.3Å; K1231-N1234 WeakPolarHBondContact O-CB 3.3Å; K1231-N1234 PolarHBondContact O-N 3.43Å; L1232-N1234 PolarHBondContact O-N 3.04Å
1235	F	84.3	Confident	82.9	Confident	15 Å²	15	80.5 Å²	80.5	7%	0.066	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	125.9	178.4	-72.5	-112	0	0	0	109.3	V1222 L1225 L1230 K1231 L1232 F1237 K1264 I1265	V1222-F1235 HydrophobicContact CG1-CD1 4.25Å; V1222-F1235 HydrophobicContact CG2-CD1 4.34Å; L1225-F1235 HydrophobicContact CD2-CD1 3.86Å; L1225-F1235 HydrophobicContact CD2-CE1 3.4Å; L1225-F1235 VanDerWaalsContact CD2-CE1 3.4Å; L1225-F1235 HydrophobicContact CD2-CZ 4.18Å; L1230-F1235 HydrophobicContact CB-CE2 4.21Å; L1230-F1235 HydrophobicContact CB-CZ 4.33Å; L1230-F1235 HydrophobicContact CD2-CZ 4.46Å; K1231-F1235 VanDerWaalsContact O-CD2 3.28Å; K1231-F1235 WeakPolarHBondContact O-CD2 3.42Å; L1232-F1235 WeakPolarHBondContact O-CB 3.39Å; L1232-F1235 PolarHBondContact O-N 2.92Å; F1235-F1237 HydrophobicContact CB-CD2 4.28Å; F1235-F1237 HydrophobicContact CB-CE2 3.66Å; F1235-F1237 HydrophobicContact CB-CZ 4.07Å; F1235-K1264 HydrophobicContact CE2-CB 4.3Å; F1235-K1264 HydrophobicContact CE2-CD 4.36Å; F1235-K1264 HydrophobicContact CZ-CB 4.11Å; F1235-K1264 HydrophobicContact CZ-CD 4.43Å; F1235-I1265 HydrophobicContact CD1-CG1 3.93Å; F1235-I1265 HydrophobicContact CE1-CD1 4.21Å; F1235-I1265 HydrophobicContact CE1-CG1 3.61Å
1236	I	88.2	Confident	84	Confident	98 Å²	98	77.6 Å²	77.6	50%	0.503	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	109.8	170.7	-57	178.1	0	0	0	106.7	V1223 S1224	V1223-I1236 HydrophobicContact CB-CB 4.22Å; V1223-I1236 HydrophobicContact CB-CG2 3.92Å; V1223-I1236 HydrophobicContact CG1-CG2 4.46Å; V1223-I1236 HydrophobicContact CG2-CG2 4.17Å; V1223-I1236 PolarHBondContact N-O 2.97Å; S1224-I1236 PolarHBondContact O-N 3.32Å; S1224-I1236 VanDerWaalsContact O-N 3.13Å
1237	F	91.6	Very high	85.4	Confident	44 Å²	44	76.5 Å²	76.5	19%	0.193	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	155.9	177	-70.6	-87.8	0	0	0	111	F1221 V1222 L1232 F1235 V1241 I1265 I1269	F1221-F1237 CarbonylContact O-C 3.53Å; F1221-F1237 VanDerWaalsContact O-CA 3.26Å; F1221-F1237 WeakPolarHBondContact O-CA 3.45Å; F1221-F1237 WeakPolarHBondContact O-CD1 3.2Å; V1222-F1237 HydrophobicContact CG2-CD1 4.27Å; V1222-F1237 HydrophobicContact CG2-CE1 4.13Å; L1232-F1237 HydrophobicContact CD1-CE2 4.39Å; L1232-F1237 HydrophobicContact CD1-CZ 4.41Å; F1235-F1237 HydrophobicContact CB-CD2 4.28Å; F1235-F1237 HydrophobicContact CB-CE2 3.66Å; F1235-F1237 HydrophobicContact CB-CZ 4.07Å; F1237-V1241 HydrophobicContact CB-CB 4.43Å; F1237-V1241 HydrophobicContact CB-CG2 4.11Å; F1237-V1241 HydrophobicContact CD1-CG2 4.06Å; F1237-V1241 HydrophobicContact CG-CG2 4.49Å; F1237-I1265 HydrophobicContact CE1-CG2 4.15Å; F1237-I1269 HydrophobicContact CD1-CG1 4.2Å; F1237-I1269 HydrophobicContact CE1-CG1 3.9Å
1238	R	90	Very high	86.8	Confident	67 Å²	67	68.4 Å²	68.4	25%	0.253	33%	0.332	S	S	.	.			trans	-79	153.8	171.5	-48.8	-163.7	-179.7	-168.2	4.5	110.9	K1219 Y1220 F1221 V1223 E1240 V1241	K1219-R1238 PolarHBondContact O-NH2 3.01Å; Y1220-R1238 WeakPolarHBondContact O-CD 3.41Å; Y1220-R1238 PolarHBondContact O-NE 3.19Å; F1221-R1238 PolarHBondContact O-N 3.48Å; V1223-R1238 HydrophobicContact CG2-CB 4.34Å; V1223-R1238 HydrophobicContact CG2-CG 3.77Å; R1238-E1240 WeakPolarHBondContact CB-OE2 3.46Å; R1238-E1240 PolarHBondContact O-N 3.47Å; R1238-E1240 VanDerWaalsContact O-N 3.08Å; R1238-V1241 WeakPolarHBondContact O-CB 3.38Å; R1238-V1241 WeakPolarHBondContact O-CG2 3.45Å; R1238-V1241 PolarHBondContact O-N 3.39Å
1239	N	87.8	Confident	87.9	Confident	126 Å²	126	59.4 Å²	59.4	67%	0.674	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-24.4	-179.5	-62.6	-5.1	0	0	0	113	V1241 D1242	N1239-V1241 PolarHBondContact O-N 2.75Å; N1239-D1242 PolarHBondContact O-N 2.95Å; N1239-D1242 VanDerWaalsContact O-N 3.08Å
1240	E	86.3	Confident	89.2	Confident	48 Å²	48	55.3 Å²	55.3	22%	0.224	27%	0.265	C	S	.	.	H	α-helix	trans	-58.4	-25.8	175	-67.5	84.8	169.1	0	0	113.1	Y1197 R1238 D1242 I1243	Y1197-E1240 HydrophobicContact CE1-CG 4.44Å; Y1197-E1240 HydrophobicContact CE2-CB 4.11Å; Y1197-E1240 HydrophobicContact CE2-CG 4.1Å; Y1197-E1240 WeakPolarHBondContact OH-CB 3.41Å; R1238-E1240 WeakPolarHBondContact CB-OE2 3.46Å; R1238-E1240 PolarHBondContact O-N 3.47Å; R1238-E1240 VanDerWaalsContact O-N 3.08Å; E1240-D1242 VanDerWaalsContact C-N 3.31Å; E1240-D1242 PolarHBondContact O-N 2.95Å; E1240-I1243 PolarHBondContact O-N 2.83Å
1241	V	91.1	Very high	90.2	Very high	6 Å²	6	55.9 Å²	55.9	4%	0.036	27%	0.267	C	S	.	.	H	α-helix	trans	-64.6	-37.2	176	175.9	0	0	0	0	111.2	F1221 F1237 R1238 N1239 I1243 L1244 I1269 K1273	F1221-V1241 HydrophobicContact CB-CG2 3.85Å; F1221-V1241 HydrophobicContact CD1-CG2 3.83Å; F1221-V1241 HydrophobicContact CG-CG2 4.23Å; F1237-V1241 HydrophobicContact CB-CB 4.43Å; F1237-V1241 HydrophobicContact CB-CG2 4.11Å; F1237-V1241 HydrophobicContact CD1-CG2 4.06Å; F1237-V1241 HydrophobicContact CG-CG2 4.49Å; R1238-V1241 WeakPolarHBondContact O-CB 3.38Å; R1238-V1241 WeakPolarHBondContact O-CG2 3.45Å; R1238-V1241 PolarHBondContact O-N 3.39Å; N1239-V1241 PolarHBondContact O-N 2.75Å; V1241-I1243 PolarHBondContact O-N 3.46Å; V1241-L1244 PolarHBondContact O-N 3.25Å; V1241-I1269 HydrophobicContact CG1-CB 4.4Å; V1241-I1269 HydrophobicContact CG1-CG1 4.34Å; V1241-I1269 HydrophobicContact CG1-CG2 4.42Å; V1241-I1269 HydrophobicContact CG2-CG1 4.24Å; V1241-K1273 WeakPolarHBondContact O-CE 3.24Å; V1241-K1273 PolarHBondContact O-NZ 3.4Å
1242	D	90.2	Very high	90.8	Very high	130 Å²	130	50.3 Å²	50.3	70%	0.695	24%	0.242	S	C	*	.	H	α-helix	trans	-70.8	-22.1	-176.1	-61.9	-28.7	0	0	0	112.7	N1239 E1240	N1239-D1242 PolarHBondContact O-N 2.95Å; N1239-D1242 VanDerWaalsContact O-N 3.08Å; E1240-D1242 VanDerWaalsContact C-N 3.31Å; E1240-D1242 PolarHBondContact O-N 2.95Å
1243	I	89.8	Confident	91.1	Very high	64 Å²	64	49 Å²	49	33%	0.328	24%	0.238	S	C	.	.	H	α-helix	trans	-80.7	-31.4	-178.3	-68.9	144.3	0	0	0	112.2	P1161 T1202 E1240 V1241 K1245	P1161-I1243 HydrophobicContact CG-CG2 4.21Å; T1202-I1243 HydrophobicContact CG2-CB 4.23Å; T1202-I1243 HydrophobicContact CG2-CD1 3.35Å; T1202-I1243 HydrophobicContact CG2-CG1 3.76Å; T1202-I1243 HydrophobicContact CG2-CG2 3.55Å; E1240-I1243 PolarHBondContact O-N 2.83Å; V1241-I1243 PolarHBondContact O-N 3.46Å; I1243-K1245 PolarHBondContact O-N 3.03Å
1244	L	93.3	Very high	91.4	Very high	6 Å²	6	46.3 Å²	46.3	3%	0.031	22%	0.224	C	C	.	.			trans	-64.3	129.3	-178.7	-66.9	168.3	0	0	0	109.8	P1161 L1163 V1210 F1221 V1241 K1273	P1161-L1244 HydrophobicContact CB-CD2 4.27Å; P1161-L1244 CarbonylContact O-C 3.59Å; P1161-L1244 WeakPolarHBondContact O-CA 3.41Å; L1163-L1244 HydrophobicContact CB-CD1 3.76Å; L1163-L1244 HydrophobicContact CB-CD2 3.96Å; L1163-L1244 HydrophobicContact CB-CG 4.44Å; L1163-L1244 HydrophobicContact CD2-CD1 3.92Å; L1163-L1244 HydrophobicContact CG-CD1 4.41Å; V1210-L1244 HydrophobicContact CG2-CD2 3.87Å; F1221-L1244 HydrophobicContact CE1-CD1 4.23Å; V1241-L1244 PolarHBondContact O-N 3.25Å; L1244-K1273 WeakPolarHBondContact O-CD 3.37Å; L1244-K1273 WeakPolarHBondContact O-CE 3.46Å; L1244-K1273 PolarHBondContact O-NZ 3.1Å
1245	K	95.3	Very high	91.7	Very high	114 Å²	114	44.1 Å²	44.1	50%	0.496	21%	0.212	S	C	.	.			trans	-93.9	-24.2	179.3	-61.7	-170.7	-166.1	147.4	0	113.5	T1160 P1161 I1243	T1160-K1245 WeakPolarHBondContact O-CD 3.38Å; T1160-K1245 WeakPolarHBondContact O-CE 3.4Å; T1160-K1245 PolarHBondContact O-NZ 2.94Å; P1161-K1245 PolarHBondContact O-N 3.48Å; I1243-K1245 PolarHBondContact O-N 3.03Å
1246	S	97.4	Very high	91.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	158.5	-177.8	61.5	0	0	0	0	112.9	A1159 C1162 L1163 Y1275	A1159-S1246 WeakPolarHBondContact O-CB 3.48Å; A1159-S1246 PolarHBondContact O-OG 3.32Å; C1162-S1246 WeakPolarHBondContact CA-OG 3.23Å; C1162-S1246 WeakPolarHBondContact CB-OG 3.43Å; C1162-S1246 PolarHBondContact SG-OG 3.46Å; L1163-S1246 PolarHBondContact N-O 3.45Å; S1246-Y1275 CarbonylContact C-O 3.53Å; S1246-Y1275 WeakPolarHBondContact CA-O 3.32Å
1247	V	98	Very high	91.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	131.3	177.9	-171.7	0	0	0	0	109.9	L1163 I1165 I1249 I1269 K1273 Y1275 I1276 Y1277	L1163-V1247 CarbonylContact O-C 3.6Å; L1163-V1247 VanDerWaalsContact O-CA 3.3Å; L1163-V1247 WeakPolarHBondContact O-CA 3.4Å; I1165-V1247 HydrophobicContact CD1-CG1 4.1Å; I1165-V1247 HydrophobicContact CG1-CG1 4.49Å; V1247-I1249 HydrophobicContact CG1-CD1 4.41Å; V1247-I1249 HydrophobicContact CG1-CG1 3.93Å; V1247-I1269 HydrophobicContact CG2-CG2 4.14Å; V1247-K1273 HydrophobicContact CG2-CG 4.29Å; V1247-Y1275 PolarHBondContact N-O 3.31Å; V1247-I1276 CarbonylContact O-C 3.56Å; V1247-I1276 VanDerWaalsContact O-CA 3.31Å; V1247-I1276 WeakPolarHBondContact O-CA 3.36Å; V1247-Y1277 PolarHBondContact O-N 3.19Å
1248	I	98.2	Very high	91.3	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.5	169.2	-58.4	176.4	0	0	0	108.3	I1154 L1163 V1164 I1165 W1174 Y1277 L1279	I1154-I1248 HydrophobicContact CG1-CD1 3.86Å; I1154-I1248 HydrophobicContact CG1-CG1 4.21Å; L1163-I1248 PolarHBondContact O-N 3.43Å; V1164-I1248 CarbonylContact C-O 3.54Å; V1164-I1248 WeakPolarHBondContact CA-O 3.36Å; V1164-I1248 HydrophobicContact CG2-CB 4.29Å; V1164-I1248 HydrophobicContact CG2-CD1 4.33Å; I1165-I1248 PolarHBondContact N-O 2.89Å; W1174-I1248 HydrophobicContact CH2-CD1 4.36Å; W1174-I1248 HydrophobicContact CH2-CG2 3.71Å; W1174-I1248 HydrophobicContact CZ2-CG2 4.15Å; W1174-I1248 HydrophobicContact CZ3-CD1 4.29Å; I1248-Y1277 CarbonylContact C-O 3.53Å; I1248-Y1277 VanDerWaalsContact CA-O 3.31Å; I1248-Y1277 WeakPolarHBondContact CA-O 3.49Å; I1248-Y1277 HydrophobicContact CG1-CD2 4.27Å; I1248-L1279 HydrophobicContact CG2-CD1 3.75Å; I1248-L1279 HydrophobicContact CG2-CD2 4.48Å; I1248-L1279 HydrophobicContact CG2-CG 3.97Å
1249	I	97.5	Very high	91	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	98.8	-177.4	-55.1	166.3	0	0	0	108.1	I1165 Y1214 V1247 V1255 I1266 I1276 Y1277 E1278 L1279 I1297	I1165-I1249 HydrophobicContact CD1-CG1 4.4Å; Y1214-I1249 HydrophobicContact CE1-CG2 4.36Å; Y1214-I1249 WeakPolarHBondContact OH-CG2 3.36Å; V1247-I1249 HydrophobicContact CG1-CD1 4.41Å; V1247-I1249 HydrophobicContact CG1-CG1 3.93Å; I1249-V1255 HydrophobicContact CG2-CG2 4.45Å; I1249-I1266 HydrophobicContact CD1-CG2 3.51Å; I1249-I1266 HydrophobicContact CG1-CG2 4.36Å; I1249-I1276 HydrophobicContact CD1-CG2 4.45Å; I1249-Y1277 PolarHBondContact N-O 3.32Å; I1249-E1278 HydrophobicContact CB-CG 4.27Å; I1249-E1278 HydrophobicContact CD1-CG 4.07Å; I1249-E1278 CarbonylContact O-C 3.53Å; I1249-L1279 PolarHBondContact O-N 3.34Å; I1249-I1297 HydrophobicContact CD1-CG2 3.62Å
1250	D	96.8	Very high	91	Very high	10 Å²	10	43.4 Å²	43.4	5%	0.053	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	142	-179.3	-168.9	24.3	0	0	0	111.4	I1165 C1166 L1170 W1174 Y1214	I1165-D1250 PolarHBondContact O-N 3.04Å; C1166-D1250 HydrophobicContact CB-CB 3.85Å; L1170-D1250 WeakPolarHBondContact CD1-OD2 3.36Å; W1174-D1250 HydrophobicContact CZ2-CB 3.91Å; W1174-D1250 PolarHBondContact NE1-OD2 2.88Å; Y1214-D1250 VanDerWaalsContact CE2-O 3.29Å; Y1214-D1250 WeakPolarHBondContact CE2-O 3.31Å; Y1214-D1250 PolarHBondContact OH-O 3.45Å
1251	E	93.2	Very high	91.1	Very high	61 Å²	61	46.8 Å²	46.8	29%	0.285	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	49.6	-168.5	-64.9	-63.3	156.5	0	0	112.6	P1167 Y1214 A1253 R1254 L1279	P1167-E1251 HydrophobicContact CG-CB 4.02Å; P1167-E1251 HydrophobicContact CG-CG 3.81Å; Y1214-E1251 PolarHBondContact OH-O 3.34Å; E1251-A1253 PolarHBondContact O-N 3.45Å; E1251-R1254 WeakPolarHBondContact O-CB 3.29Å; E1251-R1254 WeakPolarHBondContact O-CG 3.42Å; E1251-R1254 PolarHBondContact O-N 3.31Å; E1251-L1279 WeakPolarHBondContact CA-O 3.27Å; E1251-L1279 PolarHBondContact N-O 3.25Å
1252	S	92.7	Very high	91.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-60.7	-12.3	-174.7	73.9	0	0	0	0	114.2	R1254 V1255 L1279 Q1294	S1252-R1254 PolarHBondContact O-N 3.49Å; S1252-V1255 WeakPolarHBondContact O-CG2 3.39Å; S1252-V1255 PolarHBondContact O-N 2.99Å; S1252-L1279 PolarHBondContact N-O 3.1Å; S1252-Q1294 PolarHBondContact O-NE2 3.26Å; S1252-Q1294 PolarHBondContact OG-NE2 3.13Å
1253	A	87.8	Confident	91.1	Very high	20 Å²	20	43.1 Å²	43.1	17%	0.165	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-56.5	-20.1	168	0	0	0	0	0	113.1	E1251 V1255 K1256 V1285	E1251-A1253 PolarHBondContact O-N 3.45Å; A1253-V1255 VanDerWaalsContact C-N 3.27Å; A1253-V1255 PolarHBondContact O-N 3.08Å; A1253-K1256 WeakPolarHBondContact O-CG 3.48Å; A1253-V1285 HydrophobicContact CB-CG2 4.22Å
1254	R	88.4	Confident	91.1	Very high	118 Å²	118	42.2 Å²	42.2	45%	0.445	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-68.1	-20.6	173	-69.8	-173.3	175.1	-140.6	-1.5	114	Y1214 E1215 E1251 S1252	Y1214-R1254 HydrophobicContact CE1-CB 4.1Å; E1215-R1254 IonicContact OE1-NH1 2.74Å; E1251-R1254 WeakPolarHBondContact O-CB 3.29Å; E1251-R1254 WeakPolarHBondContact O-CG 3.42Å; E1251-R1254 PolarHBondContact O-N 3.31Å; S1252-R1254 PolarHBondContact O-N 3.49Å
1255	V	88.4	Confident	91.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-107	30.1	-178.9	-66.2	0	0	0	0	113.2	Y1214 I1249 S1252 A1253 I1266 C1293 Q1294 I1297	Y1214-V1255 HydrophobicContact CD1-CG1 4.4Å; Y1214-V1255 HydrophobicContact CE1-CG1 3.77Å; I1249-V1255 HydrophobicContact CG2-CG2 4.45Å; S1252-V1255 WeakPolarHBondContact O-CG2 3.39Å; S1252-V1255 PolarHBondContact O-N 2.99Å; A1253-V1255 VanDerWaalsContact C-N 3.27Å; A1253-V1255 PolarHBondContact O-N 3.08Å; V1255-I1266 HydrophobicContact CG1-CD1 3.41Å; V1255-I1266 VanDerWaalsContact CG1-CD1 3.41Å; V1255-C1293 VanDerWaalsContact O-CB 3.24Å; V1255-C1293 WeakPolarHBondContact O-CB 3.19Å; V1255-C1293 PolarHBondContact O-SG 3.47Å; V1255-Q1294 HydrophobicContact CG2-CG 4.47Å; V1255-I1297 HydrophobicContact CB-CD1 3.88Å; V1255-I1297 HydrophobicContact CG2-CD1 3.67Å
1256	K	85.3	Confident	91.1	Very high	73 Å²	73	36.7 Å²	36.7	32%	0.317	18%	0.18	S	C	.	.			trans	-72.4	-24.3	178.5	65	-177.2	179.2	179.8	0	115	A1253 V1285 D1290 C1293	A1253-K1256 WeakPolarHBondContact O-CG 3.48Å; K1256-V1285 HydrophobicContact CD-CG2 4.24Å; K1256-D1290 HydrophobicContact CB-CB 4.25Å; K1256-C1293 VanDerWaalsContact O-CB 3.27Å; K1256-C1293 WeakPolarHBondContact O-CB 3.19Å
1257	D	85.7	Confident	90.9	Very high	68 Å²	68	38.2 Å²	38.2	36%	0.364	19%	0.187	S	C	.	.			trans	-102.5	113.9	-176.9	178.1	-3.4	0	0	0	111.2	T1259 T1260 S1263	D1257-T1259 PolarHBondContact O-N 3.36Å; D1257-T1259 VanDerWaalsContact OD1-CB 3.28Å; D1257-T1259 WeakPolarHBondContact OD1-CB 3.5Å; D1257-T1259 WeakPolarHBondContact OD1-CG2 3.02Å; D1257-T1259 PolarHBondContact OD1-N 3.34Å; D1257-T1259 PolarHBondContact OD1-OG1 3.04Å; D1257-T1259 PolarHBondContact OD2-OG1 3.37Å; D1257-T1260 HydrophobicContact CB-CG2 3.74Å; D1257-T1260 PolarHBondContact O-N 3.47Å; D1257-T1260 PolarHBondContact O-OG1 3.35Å; D1257-T1260 VanDerWaalsContact O-OG1 3.11Å; D1257-S1263 WeakPolarHBondContact O-CB 3.41Å; D1257-S1263 PolarHBondContact O-OG 2.71Å
1258	P	83.7	Confident	90.7	Very high	55 Å²	55	38.5 Å²	38.5	36%	0.357	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-12.8	-177.7	31.3	-35.9	0	0	0	113.2	T1260 K1264 M1267 C1293	P1258-T1260 VanDerWaalsContact C-N 3.32Å; P1258-K1264 WeakPolarHBondContact O-CE 3.26Å; P1258-M1267 HydrophobicContact CB-CE 3.99Å; P1258-C1293 HydrophobicContact CB-CB 4.26Å
1259	T	83.4	Confident	90.6	Very high	95 Å²	95	38.5 Å²	38.5	58%	0.583	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-24.9	178.9	73.5	0	0	0	0	112.2	D1257 K1264	D1257-T1259 PolarHBondContact O-N 3.36Å; D1257-T1259 VanDerWaalsContact OD1-CB 3.28Å; D1257-T1259 WeakPolarHBondContact OD1-CB 3.5Å; D1257-T1259 WeakPolarHBondContact OD1-CG2 3.02Å; D1257-T1259 PolarHBondContact OD1-N 3.34Å; D1257-T1259 PolarHBondContact OD1-OG1 3.04Å; D1257-T1259 PolarHBondContact OD2-OG1 3.37Å; T1259-K1264 PolarHBondContact O-NZ 3.49Å; T1259-K1264 VanDerWaalsContact O-NZ 3.12Å
1260	T	87.9	Confident	90.5	Very high	43 Å²	43	38.8 Å²	38.8	26%	0.264	19%	0.192	S	C	.	.	S	Bend	trans	-68.3	149.8	-175	75.5	0	0	0	0	112.1	D1257 P1258 Q1262 S1263 K1264	D1257-T1260 HydrophobicContact CB-CG2 3.74Å; D1257-T1260 PolarHBondContact O-N 3.47Å; D1257-T1260 PolarHBondContact O-OG1 3.35Å; D1257-T1260 VanDerWaalsContact O-OG1 3.11Å; P1258-T1260 VanDerWaalsContact C-N 3.32Å; T1260-Q1262 VanDerWaalsContact C-N 3.28Å; T1260-Q1262 PolarHBondContact O-N 2.7Å; T1260-S1263 WeakPolarHBondContact OG1-CB 3.14Å; T1260-S1263 PolarHBondContact OG1-N 3.4Å; T1260-S1263 VanDerWaalsContact OG1-N 3.17Å; T1260-S1263 PolarHBondContact OG1-OG 3.37Å; T1260-K1264 WeakPolarHBondContact O-CG 3.38Å; T1260-K1264 PolarHBondContact O-N 3.47Å
1261	R	88	Confident	90.2	Very high	119 Å²	119	44.4 Å²	44.4	45%	0.449	22%	0.218	S	C	.	.	H	α-helix	trans	-61.6	-38.3	176.1	179.7	179.6	173.6	-172	-0.4	111.6	I1265	R1261-I1265 HydrophobicContact CG-CD1 3.8Å; R1261-I1265 HydrophobicContact CG-CG1 4.49Å; R1261-I1265 VanDerWaalsContact O-CG1 3.24Å; R1261-I1265 WeakPolarHBondContact O-CG1 3.4Å; R1261-I1265 PolarHBondContact O-N 3.49Å; R1261-I1265 VanDerWaalsContact O-N 3.09Å
1262	Q	91.2	Very high	90.1	Very high	60 Å²	60	45.1 Å²	45.1	28%	0.28	24%	0.242	S	C	.	.	H	α-helix	trans	-65.1	-50.3	-178.7	-72.4	175.6	-18	0	0	111.3	Y1214 T1260 K1264 I1265 I1266	Y1214-Q1262 PolarHBondContact O-NE2 3.04Å; T1260-Q1262 VanDerWaalsContact C-N 3.28Å; T1260-Q1262 PolarHBondContact O-N 2.7Å; Q1262-K1264 VanDerWaalsContact C-N 3.32Å; Q1262-K1264 PolarHBondContact O-N 3.1Å; Q1262-I1265 PolarHBondContact O-N 2.85Å; Q1262-I1265 VanDerWaalsContact O-N 3.16Å; Q1262-I1266 WeakPolarHBondContact O-CG1 3.22Å; Q1262-I1266 PolarHBondContact O-N 3.28Å
1263	S	91.2	Very high	90.2	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-57.6	-43.4	177.5	-60.2	0	0	0	0	112.2	D1257 T1260 I1265 I1266 M1267	D1257-S1263 WeakPolarHBondContact O-CB 3.41Å; D1257-S1263 PolarHBondContact O-OG 2.71Å; T1260-S1263 WeakPolarHBondContact OG1-CB 3.14Å; T1260-S1263 PolarHBondContact OG1-N 3.4Å; T1260-S1263 VanDerWaalsContact OG1-N 3.17Å; T1260-S1263 PolarHBondContact OG1-OG 3.37Å; S1263-I1265 PolarHBondContact O-N 3.43Å; S1263-I1266 PolarHBondContact O-N 3.26Å; S1263-M1267 VanDerWaalsContact O-CG 3.32Å; S1263-M1267 WeakPolarHBondContact O-CG 3.38Å; S1263-M1267 PolarHBondContact O-N 3.25Å
1264	K	90.7	Very high	90.5	Very high	45 Å²	45	49.6 Å²	49.6	20%	0.196	26%	0.259	C	S	.	.	H	α-helix	trans	-62.4	-42.3	176.9	-71.1	171.5	-178.2	167.1	0	112.7	L1230 L1232 F1235 P1258 T1259 T1260 Q1262 G1268	L1230-K1264 WeakPolarHBondContact O-CD 3.45Å; L1230-K1264 WeakPolarHBondContact O-CE 3.28Å; L1230-K1264 PolarHBondContact O-NZ 3.3Å; L1232-K1264 WeakPolarHBondContact CD1-O 3.47Å; F1235-K1264 HydrophobicContact CE2-CB 4.3Å; F1235-K1264 HydrophobicContact CE2-CD 4.36Å; F1235-K1264 HydrophobicContact CZ-CB 4.11Å; F1235-K1264 HydrophobicContact CZ-CD 4.43Å; P1258-K1264 WeakPolarHBondContact O-CE 3.26Å; T1259-K1264 PolarHBondContact O-NZ 3.49Å; T1259-K1264 VanDerWaalsContact O-NZ 3.12Å; T1260-K1264 WeakPolarHBondContact O-CG 3.38Å; T1260-K1264 PolarHBondContact O-N 3.47Å; Q1262-K1264 VanDerWaalsContact C-N 3.32Å; Q1262-K1264 PolarHBondContact O-N 3.1Å; K1264-G1268 PolarHBondContact O-N 2.97Å; K1264-G1268 VanDerWaalsContact O-N 3.11Å
1265	I	93.3	Very high	90.9	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.015	24%	0.243	C	C	.	.	H	α-helix	trans	-64.6	-44.3	178.1	-69.4	169.8	0	0	0	110.3	L1217 A1218 V1222 F1235 F1237 R1261 Q1262 S1263 G1268 I1269	L1217-I1265 HydrophobicContact CB-CG2 3.87Å; A1218-I1265 HydrophobicContact CB-CD1 3.6Å; V1222-I1265 HydrophobicContact CG2-CD1 3.98Å; V1222-I1265 HydrophobicContact CG2-CG1 3.94Å; V1222-I1265 HydrophobicContact CG2-CG2 4.11Å; F1235-I1265 HydrophobicContact CD1-CG1 3.93Å; F1235-I1265 HydrophobicContact CE1-CD1 4.21Å; F1235-I1265 HydrophobicContact CE1-CG1 3.61Å; F1237-I1265 HydrophobicContact CE1-CG2 4.15Å; R1261-I1265 HydrophobicContact CG-CD1 3.8Å; R1261-I1265 HydrophobicContact CG-CG1 4.49Å; R1261-I1265 VanDerWaalsContact O-CG1 3.24Å; R1261-I1265 WeakPolarHBondContact O-CG1 3.4Å; R1261-I1265 PolarHBondContact O-N 3.49Å; R1261-I1265 VanDerWaalsContact O-N 3.09Å; Q1262-I1265 PolarHBondContact O-N 2.85Å; Q1262-I1265 VanDerWaalsContact O-N 3.16Å; S1263-I1265 PolarHBondContact O-N 3.43Å; I1265-G1268 PolarHBondContact O-N 3.32Å; I1265-I1269 HydrophobicContact CG2-CD1 3.73Å; I1265-I1269 HydrophobicContact CG2-CG1 4.38Å; I1265-I1269 WeakPolarHBondContact O-CG1 3.35Å; I1265-I1269 PolarHBondContact O-N 2.93Å
1266	I	95.1	Very high	91.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.2	-44.4	179.3	-69.5	171.3	0	0	0	111.2	I1165 Y1214 L1217 I1249 V1255 Q1262 S1263 G1268 I1269 C1270 I1297	I1165-I1266 HydrophobicContact CD1-CD1 4.24Å; I1165-I1266 HydrophobicContact CD1-CG1 3.93Å; I1165-I1266 HydrophobicContact CG2-CD1 4.38Å; Y1214-I1266 HydrophobicContact CD1-CD1 3.92Å; Y1214-I1266 HydrophobicContact CE1-CD1 3.73Å; L1217-I1266 HydrophobicContact CD1-CD1 3.65Å; L1217-I1266 HydrophobicContact CD1-CG1 3.57Å; I1249-I1266 HydrophobicContact CD1-CG2 3.51Å; I1249-I1266 HydrophobicContact CG1-CG2 4.36Å; V1255-I1266 HydrophobicContact CG1-CD1 3.41Å; V1255-I1266 VanDerWaalsContact CG1-CD1 3.41Å; Q1262-I1266 WeakPolarHBondContact O-CG1 3.22Å; Q1262-I1266 PolarHBondContact O-N 3.28Å; S1263-I1266 PolarHBondContact O-N 3.26Å; I1266-G1268 VanDerWaalsContact C-N 3.26Å; I1266-G1268 PolarHBondContact O-N 3.41Å; I1266-I1269 PolarHBondContact O-N 3.22Å; I1266-C1270 WeakPolarHBondContact O-CB 3.31Å; I1266-C1270 PolarHBondContact O-N 3.01Å; I1266-C1270 PolarHBondContact O-SG 3.45Å; I1266-I1297 HydrophobicContact CG2-CD1 3.86Å; I1266-I1297 HydrophobicContact CG2-CG1 4.18Å; I1266-I1297 HydrophobicContact CG2-CG2 3.95Å
1267	M	93.3	Very high	92	Very high	33 Å²	33	41.9 Å²	41.9	16%	0.163	23%	0.228	C	C	.	.	H	α-helix	trans	-53.9	-44.8	172.8	-75.4	178.1	-162	0	0	111.6	L1232 P1258 S1263 C1270 Q1271 C1293 A1296 I1297	L1232-M1267 HydrophobicContact CD2-CB 4.19Å; P1258-M1267 HydrophobicContact CB-CE 3.99Å; S1263-M1267 VanDerWaalsContact O-CG 3.32Å; S1263-M1267 WeakPolarHBondContact O-CG 3.38Å; S1263-M1267 PolarHBondContact O-N 3.25Å; M1267-C1270 PolarHBondContact O-N 2.94Å; M1267-Q1271 WeakPolarHBondContact O-CG 3.48Å; M1267-Q1271 PolarHBondContact O-N 3.28Å; M1267-C1293 HydrophobicContact CE-CB 4.36Å; M1267-C1293 WeakPolarHBondContact CE-SG 3.41Å; M1267-A1296 HydrophobicContact CE-CB 4.23Å; M1267-I1297 HydrophobicContact CB-CG1 4.49Å; M1267-I1297 HydrophobicContact CE-CG1 4.46Å; M1267-I1297 HydrophobicContact CG-CD1 4.48Å; M1267-I1297 HydrophobicContact CG-CG1 3.53Å
1268	G	92.8	Very high	92.5	Very high	6 Å²	6	38.6 Å²	38.6	6%	0.062	21%	0.211	C	C	.	.	H	α-helix	trans	-67.5	-39.9	178.3	0	0	0	0	0	113.8	K1264 I1265 I1266 C1270 Q1271	K1264-G1268 PolarHBondContact O-N 2.97Å; K1264-G1268 VanDerWaalsContact O-N 3.11Å; I1265-G1268 PolarHBondContact O-N 3.32Å; I1266-G1268 VanDerWaalsContact C-N 3.26Å; I1266-G1268 PolarHBondContact O-N 3.41Å; G1268-C1270 VanDerWaalsContact C-N 3.29Å; G1268-C1270 PolarHBondContact O-N 3.47Å; G1268-Q1271 PolarHBondContact O-N 2.97Å
1269	I	95.2	Very high	93.1	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.6	-34.8	177.1	-69.1	168.4	0	0	0	112.1	L1163 L1217 F1221 F1237 V1241 V1247 I1265 I1266 Q1271 K1273	L1163-I1269 HydrophobicContact CD2-CD1 4.41Å; L1163-I1269 HydrophobicContact CD2-CG2 3.82Å; L1217-I1269 HydrophobicContact CD2-CD1 4.29Å; F1221-I1269 HydrophobicContact CB-CD1 3.82Å; F1221-I1269 HydrophobicContact CB-CG1 4.26Å; F1221-I1269 HydrophobicContact CD2-CD1 3.72Å; F1221-I1269 HydrophobicContact CG-CD1 3.82Å; F1221-I1269 HydrophobicContact CG-CG1 4.49Å; F1237-I1269 HydrophobicContact CD1-CG1 4.2Å; F1237-I1269 HydrophobicContact CE1-CG1 3.9Å; V1241-I1269 HydrophobicContact CG1-CB 4.4Å; V1241-I1269 HydrophobicContact CG1-CG1 4.34Å; V1241-I1269 HydrophobicContact CG1-CG2 4.42Å; V1241-I1269 HydrophobicContact CG2-CG1 4.24Å; V1247-I1269 HydrophobicContact CG2-CG2 4.14Å; I1265-I1269 HydrophobicContact CG2-CD1 3.73Å; I1265-I1269 HydrophobicContact CG2-CG1 4.38Å; I1265-I1269 WeakPolarHBondContact O-CG1 3.35Å; I1265-I1269 PolarHBondContact O-N 2.93Å; I1266-I1269 PolarHBondContact O-N 3.22Å; I1269-Q1271 VanDerWaalsContact C-N 3.32Å; I1269-K1273 PolarHBondContact O-NZ 3.29Å
1270	C	95.7	Very high	93.4	Very high	6 Å²	6	31.5 Å²	31.5	4%	0.041	17%	0.166	C	C	.	.	H	α-helix	trans	-79	-12.9	-177.7	-67.3	0	0	0	0	113.5	I1266 M1267 G1268 G1272 K1273 I1276 I1297	I1266-C1270 WeakPolarHBondContact O-CB 3.31Å; I1266-C1270 PolarHBondContact O-N 3.01Å; I1266-C1270 PolarHBondContact O-SG 3.45Å; M1267-C1270 PolarHBondContact O-N 2.94Å; G1268-C1270 VanDerWaalsContact C-N 3.29Å; G1268-C1270 PolarHBondContact O-N 3.47Å; C1270-G1272 PolarHBondContact O-N 2.96Å; C1270-K1273 PolarHBondContact O-N 2.75Å; C1270-I1276 HydrophobicContact CB-CD1 3.85Å; C1270-I1297 HydrophobicContact CB-CG2 4.27Å
1271	Q	91.3	Very high	93.2	Very high	128 Å²	128	30.2 Å²	30.2	60%	0.598	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	130.9	177.2	-73	-176.7	-1.9	0	0	111.1	M1267 G1268 I1269 K1273	M1267-Q1271 WeakPolarHBondContact O-CG 3.48Å; M1267-Q1271 PolarHBondContact O-N 3.28Å; G1268-Q1271 PolarHBondContact O-N 2.97Å; I1269-Q1271 VanDerWaalsContact C-N 3.32Å; Q1271-K1273 VanDerWaalsContact C-N 3.27Å; Q1271-K1273 PolarHBondContact O-N 3.26Å
1272	G	90.9	Very high	93	Very high	76 Å²	76	28.5 Å²	28.5	78%	0.784	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.7	-1.1	178.3	0	0	0	0	0	115.9	C1270	C1270-G1272 PolarHBondContact O-N 2.96Å
1273	K	94.9	Very high	92	Very high	14 Å²	14	27.8 Å²	27.8	6%	0.061	17%	0.165	C	C	.	.			trans	-84.7	132	-176.4	-52.5	-47.1	176.3	62.2	0	112	R1135 V1241 L1244 V1247 I1269 C1270 Q1271 I1276	R1135-K1273 VanDerWaalsContact CZ-O 3.22Å; R1135-K1273 PolarHBondContact NE-O 3.36Å; R1135-K1273 PolarHBondContact NH2-O 3.29Å; V1241-K1273 WeakPolarHBondContact O-CE 3.24Å; V1241-K1273 PolarHBondContact O-NZ 3.4Å; L1244-K1273 WeakPolarHBondContact O-CD 3.37Å; L1244-K1273 WeakPolarHBondContact O-CE 3.46Å; L1244-K1273 PolarHBondContact O-NZ 3.1Å; V1247-K1273 HydrophobicContact CG2-CG 4.29Å; I1269-K1273 PolarHBondContact O-NZ 3.29Å; C1270-K1273 PolarHBondContact O-N 2.75Å; Q1271-K1273 VanDerWaalsContact C-N 3.27Å; Q1271-K1273 PolarHBondContact O-N 3.26Å; K1273-I1276 HydrophobicContact CB-CD1 4.39Å; K1273-I1276 HydrophobicContact CB-CG1 4.13Å
1274	E	94.2	Very high	91	Very high	99 Å²	99	31.1 Å²	31.1	46%	0.463	19%	0.185	S	C	.	.	S	Bend	trans	-71.8	-44	-177.2	-173.4	176.1	-173.2	0	0	111	K1134 R1135	K1134-E1274 HydrophobicContact CD-CG 4.06Å; K1134-E1274 IonicContact NZ-OE1 3.37Å; K1134-E1274 PolarHBondContact NZ-OE1 3.4Å; R1135-E1274 WeakPolarHBondContact CG-O 3.47Å
1275	Y	97.6	Very high	89.6	Confident	28 Å²	28	32 Å²	32	11%	0.11	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	119.8	-177.7	-64	-90.2	0	0	0	111.8	K1134 I1154 A1157 A1159 S1246 V1247 Y1277	K1134-Y1275 HydrophobicContact CB-CD1 4.07Å; K1134-Y1275 HydrophobicContact CB-CE1 4.1Å; K1134-Y1275 HydrophobicContact CD-CE1 4.5Å; K1134-Y1275 HydrophobicContact CG-CD1 4.34Å; K1134-Y1275 HydrophobicContact CG-CE1 3.85Å; K1134-Y1275 CarbonylContact O-C 3.19Å; K1134-Y1275 VanDerWaalsContact O-CA 3.24Å; K1134-Y1275 WeakPolarHBondContact O-CA 3.3Å; I1154-Y1275 HydrophobicContact CD1-CG 4.42Å; A1157-Y1275 HydrophobicContact CB-CD1 4.24Å; A1157-Y1275 HydrophobicContact CB-CE1 3.7Å; A1157-Y1275 HydrophobicContact CB-CE2 4.01Å; A1159-Y1275 HydrophobicContact CB-CD2 3.45Å; A1159-Y1275 VanDerWaalsContact CB-CD2 3.45Å; A1159-Y1275 HydrophobicContact CB-CE2 3.93Å; A1159-Y1275 HydrophobicContact CB-CG 3.99Å; S1246-Y1275 CarbonylContact C-O 3.53Å; S1246-Y1275 WeakPolarHBondContact CA-O 3.32Å; V1247-Y1275 PolarHBondContact N-O 3.31Å; Y1275-Y1277 HydrophobicContact CD1-CE1 4.41Å; Y1275-Y1277 WeakPolarHBondContact CD1-OH 3.36Å
1276	I	97.8	Very high	88.6	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	110.6	178.4	-52.9	166.5	0	0	0	108.8	K1134 R1135 C1136 V1247 I1249 C1270 K1273 I1297 L1298	K1134-I1276 PolarHBondContact O-N 3.1Å; R1135-I1276 VanDerWaalsContact CA-O 3.26Å; R1135-I1276 WeakPolarHBondContact CA-O 3.28Å; R1135-I1276 HydrophobicContact CG-CB 4.2Å; R1135-I1276 HydrophobicContact CG-CD1 4.29Å; R1135-I1276 HydrophobicContact CG-CG1 4.3Å; C1136-I1276 PolarHBondContact N-O 3.14Å; V1247-I1276 CarbonylContact O-C 3.56Å; V1247-I1276 VanDerWaalsContact O-CA 3.31Å; V1247-I1276 WeakPolarHBondContact O-CA 3.36Å; I1249-I1276 HydrophobicContact CD1-CG2 4.45Å; C1270-I1276 HydrophobicContact CB-CD1 3.85Å; K1273-I1276 HydrophobicContact CB-CD1 4.39Å; K1273-I1276 HydrophobicContact CB-CG1 4.13Å; I1276-I1297 HydrophobicContact CG2-CG2 4.48Å; I1276-L1298 HydrophobicContact CB-CD2 4.05Å; I1276-L1298 HydrophobicContact CG2-CD2 3.77Å; I1276-L1298 WeakPolarHBondContact O-CD2 3.47Å
1277	Y	97.6	Very high	87.6	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	117.7	-179.8	-56.8	-32.4	0	0	0	110.5	E1130 K1134 A1153 I1154 V1247 I1248 I1249 Y1275	E1130-Y1277 HydrophobicContact CB-CD1 4.5Å; E1130-Y1277 HydrophobicContact CB-CE1 3.92Å; E1130-Y1277 HydrophobicContact CB-CE2 4.28Å; E1130-Y1277 PolarHBondContact O-OH 3.22Å; K1134-Y1277 WeakPolarHBondContact O-CE1 3.5Å; A1153-Y1277 HydrophobicContact CB-CE2 3.82Å; I1154-Y1277 HydrophobicContact CD1-CD2 3.92Å; I1154-Y1277 HydrophobicContact CD1-CE2 3.47Å; I1154-Y1277 VanDerWaalsContact CD1-CE2 3.47Å; I1154-Y1277 HydrophobicContact CG1-CD2 4.07Å; I1154-Y1277 HydrophobicContact CG1-CE2 3.8Å; V1247-Y1277 PolarHBondContact O-N 3.19Å; I1248-Y1277 CarbonylContact C-O 3.53Å; I1248-Y1277 VanDerWaalsContact CA-O 3.31Å; I1248-Y1277 WeakPolarHBondContact CA-O 3.49Å; I1248-Y1277 HydrophobicContact CG1-CD2 4.27Å; I1249-Y1277 PolarHBondContact N-O 3.32Å; Y1275-Y1277 HydrophobicContact CD1-CE1 4.41Å; Y1275-Y1277 WeakPolarHBondContact CD1-OH 3.36Å
1278	E	96.4	Very high	86.7	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	122.9	172.2	-71	-165.4	174.4	0	0	110.1	C1136 I1137 N1138 I1249 Q1294 I1297 L1298	C1136-E1278 PolarHBondContact O-N 2.72Å; I1137-E1278 CarbonylContact C-O 3.53Å; I1137-E1278 VanDerWaalsContact CA-O 3.26Å; I1137-E1278 WeakPolarHBondContact CA-O 3.14Å; I1137-E1278 HydrophobicContact CG1-CB 4.18Å; I1137-E1278 HydrophobicContact CG2-CB 4.47Å; N1138-E1278 PolarHBondContact N-O 3.31Å; I1249-E1278 HydrophobicContact CB-CG 4.27Å; I1249-E1278 HydrophobicContact CD1-CG 4.07Å; I1249-E1278 CarbonylContact O-C 3.53Å; E1278-Q1294 WeakPolarHBondContact OE2-CB 3.29Å; E1278-Q1294 VanDerWaalsContact OE2-CG 3.23Å; E1278-Q1294 WeakPolarHBondContact OE2-CG 3.49Å; E1278-I1297 WeakPolarHBondContact OE1-CB 3.33Å; E1278-I1297 VanDerWaalsContact OE1-CG2 3.32Å; E1278-I1297 WeakPolarHBondContact OE1-CG2 3.33Å; E1278-L1298 HydrophobicContact CG-CD2 4.17Å; E1278-L1298 HydrophobicContact CG-CG 4.49Å
1279	L	95.7	Very high	86	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129.9	-177.1	-39.4	-176.1	0	0	0	109.9	N1138 K1146 S1150 W1174 I1248 I1249 E1251 S1252	N1138-L1279 HydrophobicContact CB-CD2 3.7Å; K1146-L1279 HydrophobicContact CB-CD1 4.5Å; S1150-L1279 WeakPolarHBondContact OG-CD2 3.23Å; W1174-L1279 HydrophobicContact CH2-CD1 3.75Å; W1174-L1279 HydrophobicContact CZ2-CD1 3.72Å; I1248-L1279 HydrophobicContact CG2-CD1 3.75Å; I1248-L1279 HydrophobicContact CG2-CD2 4.48Å; I1248-L1279 HydrophobicContact CG2-CG 3.97Å; I1249-L1279 PolarHBondContact O-N 3.34Å; E1251-L1279 WeakPolarHBondContact CA-O 3.27Å; E1251-L1279 PolarHBondContact N-O 3.25Å; S1252-L1279 PolarHBondContact N-O 3.1Å
1280	T	91	Very high	85	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.006	30%	0.301	C	S	.	.			trans	-160.4	139.5	177.1	177.6	0	0	0	0	110.2	I1137 N1138 G1139 T1282 P1283	I1137-T1280 HydrophobicContact CG2-CG2 3.82Å; N1138-T1280 PolarHBondContact O-N 3.3Å; N1138-T1280 VanDerWaalsContact O-N 3.14Å; G1139-T1280 CarbonylContact C-O 3.58Å; G1139-T1280 WeakPolarHBondContact CA-O 3.33Å; T1280-T1282 VanDerWaalsContact C-N 3.25Å; T1280-T1282 VanDerWaalsContact OG1-C 3.25Å; T1280-T1282 PolarHBondContact OG1-N 3.07Å; T1280-T1282 PolarHBondContact OG1-O 3.37Å; T1280-T1282 VanDerWaalsContact OG1-O 3.1Å; T1280-P1283 HydrophobicContact CG2-CB 3.87Å
1281	G	84.3	Confident	84.4	Confident	16 Å²	16	52.1 Å²	52.1	17%	0.165	31%	0.31	C	S	.	.	S	Bend	trans	-78.7	-10.2	167.8	0	0	0	0	0	113.4
1282	T	83.3	Confident	84.1	Confident	82 Å²	82	46.6 Å²	46.6	50%	0.503	29%	0.287	S	S	.	.			trans	-142.5	82.7	-175.7	49.6	0	0	0	0	110.1	T1280 V1284	T1280-T1282 VanDerWaalsContact C-N 3.25Å; T1280-T1282 VanDerWaalsContact OG1-C 3.25Å; T1280-T1282 PolarHBondContact OG1-N 3.07Å; T1280-T1282 PolarHBondContact OG1-O 3.37Å; T1280-T1282 VanDerWaalsContact OG1-O 3.1Å; T1282-V1284 VanDerWaalsContact C-N 3.3Å; T1282-V1284 PolarHBondContact O-N 3.11Å
1283	P	70.4	Confident	84.1	Confident	45 Å²	45	43.1 Å²	43.1	29%	0.292	25%	0.25	S	C	.	.	S	Bend	trans	-66.8	-27	-173.9	23.8	-32.6	0	0	0	114.2	I1137 T1280 Q1294	I1137-P1283 HydrophobicContact CG2-CB 4.38Å; T1280-P1283 HydrophobicContact CG2-CB 3.87Å; P1283-Q1294 PolarHBondContact O-OE1 3.32Å
1284	V	70.2	Confident	83.9	Confident	71 Å²	71	42.5 Å²	42.5	43%	0.43	25%	0.247	S	C	.	.			trans	-118.8	123.2	174.5	-175	0	0	0	0	108.5	T1282 M1291	T1282-V1284 VanDerWaalsContact C-N 3.3Å; T1282-V1284 PolarHBondContact O-N 3.11Å; V1284-M1291 HydrophobicContact CG2-CG 3.79Å; V1284-M1291 HydrophobicContact CG2-SD 3.49Å; V1284-M1291 WeakPolarHBondContact CG2-SD 3.42Å
1285	V	61.4	Low	83.7	Confident	62 Å²	62	39.1 Å²	39.1	38%	0.376	23%	0.233	S	C	.	.	S	Bend	trans	-87.8	-54	178.5	-172.2	0	0	0	0	110.4	A1253 K1256	A1253-V1285 HydrophobicContact CB-CG2 4.22Å; K1256-V1285 HydrophobicContact CD-CG2 4.24Å
1286	N	71	Confident	83.4	Confident	117 Å²	117	39.5 Å²	39.5	63%	0.626	24%	0.241	S	C	*	.	S	Bend	trans	-137.9	-42.1	-175.3	-65.8	-40.6	0	0	0	114.2	D1290	N1286-D1290 PolarHBondContact N-OD2 3.21Å
1287	H	75	Confident	83.2	Confident	123 Å²	123	39.7 Å²	39.7	57%	0.569	24%	0.242	S	C	*	.			trans	-132.9	150.6	-173.4	-59.7	-58.8	0	0	0	111.8	T1289 D1290	H1287-T1289 WeakPolarHBondContact CB-OG1 3.46Å; H1287-T1289 PolarHBondContact O-N 3.06Å; H1287-T1289 VanDerWaalsContact O-N 3.12Å; H1287-D1290 WeakPolarHBondContact O-CB 3.43Å; H1287-D1290 PolarHBondContact N-OD2 3.25Å; H1287-D1290 PolarHBondContact O-N 3.15Å; H1287-D1290 VanDerWaalsContact O-CG 3.29Å
1288	A	75.1	Confident	83	Confident	88 Å²	88	39.9 Å²	39.9	73%	0.727	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-28	176.1	0	0	0	0	0	112.7	D1290 M1291	A1288-D1290 PolarHBondContact O-N 3.49Å; A1288-M1291 PolarHBondContact O-N 3.47Å
1289	T	77.3	Confident	82.7	Confident	69 Å²	69	42 Å²	42	42%	0.423	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-22.9	174.3	52.8	0	0	0	0	113.3	H1287 M1291 A1292 Y1307	H1287-T1289 WeakPolarHBondContact CB-OG1 3.46Å; H1287-T1289 PolarHBondContact O-N 3.06Å; H1287-T1289 VanDerWaalsContact O-N 3.12Å; T1289-M1291 PolarHBondContact O-N 2.75Å; T1289-A1292 VanDerWaalsContact O-CB 3.3Å; T1289-A1292 WeakPolarHBondContact O-CB 3.45Å; T1289-A1292 PolarHBondContact O-N 3.15Å; T1289-A1292 VanDerWaalsContact O-N 3.08Å; T1289-Y1307 HydrophobicContact CG2-CE2 3.87Å
1290	D	74.4	Confident	82.4	Confident	26 Å²	26	44.7 Å²	44.7	14%	0.139	28%	0.275	C	S	.	.	H	α-helix	trans	-63.1	-25	176.8	-61.9	-19.1	0	0	0	111.4	K1256 N1286 H1287 A1288	K1256-D1290 HydrophobicContact CB-CB 4.25Å; N1286-D1290 PolarHBondContact N-OD2 3.21Å; H1287-D1290 WeakPolarHBondContact O-CB 3.43Å; H1287-D1290 PolarHBondContact N-OD2 3.25Å; H1287-D1290 PolarHBondContact O-N 3.15Å; H1287-D1290 VanDerWaalsContact O-CG 3.29Å; A1288-D1290 PolarHBondContact O-N 3.49Å
1291	M	82.4	Confident	82.1	Confident	49 Å²	49	46 Å²	46	24%	0.241	28%	0.283	C	S	.	.	H	α-helix	trans	-81	-16.2	176.5	-64.7	-169.4	75.2	0	0	113.7	I1137 V1284 A1288 T1289 C1293 Q1294 L1295	I1137-M1291 HydrophobicContact CD1-CE 4.02Å; V1284-M1291 HydrophobicContact CG2-CG 3.79Å; V1284-M1291 HydrophobicContact CG2-SD 3.49Å; V1284-M1291 WeakPolarHBondContact CG2-SD 3.42Å; A1288-M1291 PolarHBondContact O-N 3.47Å; T1289-M1291 PolarHBondContact O-N 2.75Å; M1291-C1293 PolarHBondContact O-N 3.43Å; M1291-Q1294 PolarHBondContact O-N 2.73Å; M1291-L1295 HydrophobicContact CB-CD1 4.42Å; M1291-L1295 WeakPolarHBondContact O-CG 3.4Å; M1291-L1295 PolarHBondContact O-N 3.25Å
1292	A	86.4	Confident	82.2	Confident	12 Å²	12	51.6 Å²	51.6	10%	0.099	31%	0.308	C	S	.	.	H	α-helix	trans	-58.9	-39.5	-174.3	0	0	0	0	0	111.5	T1289 A1296 I1301 Y1307	T1289-A1292 VanDerWaalsContact O-CB 3.3Å; T1289-A1292 WeakPolarHBondContact O-CB 3.45Å; T1289-A1292 PolarHBondContact O-N 3.15Å; T1289-A1292 VanDerWaalsContact O-N 3.08Å; A1292-A1296 WeakPolarHBondContact O-CB 3.17Å; A1292-A1296 PolarHBondContact O-N 3.37Å; A1292-I1301 WeakPolarHBondContact O-CD1 2.86Å; A1292-I1301 HydrophobicContact CB-CD1 4.33Å; A1292-Y1307 HydrophobicContact CB-CD1 4Å; A1292-Y1307 HydrophobicContact CB-CD2 4.04Å; A1292-Y1307 HydrophobicContact CB-CE1 4.39Å; A1292-Y1307 HydrophobicContact CB-CE2 4.43Å; A1292-Y1307 HydrophobicContact CB-CG 3.81Å
1293	C	89.1	Confident	82.3	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.014	31%	0.312	C	S	.	.	H	α-helix	trans	-68.2	-42.5	178.6	-168.6	0	0	0	0	112.5	V1255 K1256 P1258 M1267 M1291 A1296 I1297	V1255-C1293 VanDerWaalsContact O-CB 3.24Å; V1255-C1293 WeakPolarHBondContact O-CB 3.19Å; V1255-C1293 PolarHBondContact O-SG 3.47Å; K1256-C1293 VanDerWaalsContact O-CB 3.27Å; K1256-C1293 WeakPolarHBondContact O-CB 3.19Å; P1258-C1293 HydrophobicContact CB-CB 4.26Å; M1267-C1293 HydrophobicContact CE-CB 4.36Å; M1267-C1293 WeakPolarHBondContact CE-SG 3.41Å; M1291-C1293 PolarHBondContact O-N 3.43Å; C1293-A1296 WeakPolarHBondContact O-CB 3.44Å; C1293-A1296 PolarHBondContact O-N 3.29Å; C1293-I1297 PolarHBondContact O-N 3.3Å; C1293-I1297 WeakPolarHBondContact O-CG1 3.39Å
1294	Q	91.5	Very high	82.7	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-63.1	-45.8	175.5	-71.6	173.2	-50.4	0	0	111.6	I1137 S1252 V1255 E1278 P1283 M1291 A1296 I1297 L1298	I1137-Q1294 HydrophobicContact CD1-CB 4.29Å; S1252-Q1294 PolarHBondContact O-NE2 3.26Å; S1252-Q1294 PolarHBondContact OG-NE2 3.13Å; V1255-Q1294 HydrophobicContact CG2-CG 4.47Å; E1278-Q1294 WeakPolarHBondContact OE2-CB 3.29Å; E1278-Q1294 VanDerWaalsContact OE2-CG 3.23Å; E1278-Q1294 WeakPolarHBondContact OE2-CG 3.49Å; P1283-Q1294 PolarHBondContact O-OE1 3.32Å; M1291-Q1294 PolarHBondContact O-N 2.73Å; Q1294-A1296 VanDerWaalsContact C-N 3.28Å; Q1294-A1296 PolarHBondContact O-N 3Å; Q1294-I1297 PolarHBondContact O-N 3.31Å; Q1294-I1297 VanDerWaalsContact O-N 3.17Å; Q1294-L1298 WeakPolarHBondContact O-CG 3.4Å; Q1294-L1298 PolarHBondContact O-N 3.23Å
1295	L	90.8	Very high	82.9	Confident	29 Å²	29	58.6 Å²	58.6	15%	0.152	35%	0.345	C	S	.	.	H	α-helix	trans	-63.1	-34.4	175	-68.3	174.1	0	0	0	112.4	M1291 G1299 R1300 I1301 F1304	M1291-L1295 HydrophobicContact CB-CD1 4.42Å; M1291-L1295 WeakPolarHBondContact O-CG 3.4Å; M1291-L1295 PolarHBondContact O-N 3.25Å; L1295-G1299 PolarHBondContact O-N 3.37Å; L1295-R1300 PolarHBondContact O-N 3.45Å; L1295-I1301 HydrophobicContact CB-CG1 4.39Å; L1295-I1301 PolarHBondContact O-N 3.07Å; L1295-I1301 HydrophobicContact CB-CB 4.17Å; L1295-F1304 HydrophobicContact CD1-CD2 3.92Å; L1295-F1304 HydrophobicContact CD1-CE2 3.92Å; L1295-F1304 HydrophobicContact CD2-CE2 3.96Å
1296	A	90.6	Very high	83.1	Confident	35 Å²	35	57.5 Å²	57.5	29%	0.289	35%	0.346	S	S	.	.	H	α-helix	trans	-67.7	-41	173.5	0	0	0	0	0	112.1	M1267 A1292 C1293 Q1294 L1298 G1299 I1301	M1267-A1296 HydrophobicContact CE-CB 4.23Å; A1292-A1296 WeakPolarHBondContact O-CB 3.17Å; A1292-A1296 PolarHBondContact O-N 3.37Å; C1293-A1296 WeakPolarHBondContact O-CB 3.44Å; C1293-A1296 PolarHBondContact O-N 3.29Å; Q1294-A1296 VanDerWaalsContact C-N 3.28Å; Q1294-A1296 PolarHBondContact O-N 3Å; A1296-L1298 VanDerWaalsContact C-N 3.33Å; A1296-L1298 PolarHBondContact O-N 3.4Å; A1296-G1299 PolarHBondContact O-N 3Å; A1296-I1301 HydrophobicContact CB-CD1 4.24Å; A1296-I1301 HydrophobicContact CB-CG2 4.46Å
1297	I	93.1	Very high	82.7	Confident	5 Å²	5	58.6 Å²	58.6	3%	0.026	34%	0.342	C	S	.	.	H	α-helix	trans	-61.7	-41.6	175.7	-71.6	164.9	0	0	0	110.9	I1249 V1255 I1266 M1267 C1270 I1276 E1278 C1293 Q1294 G1299	I1249-I1297 HydrophobicContact CD1-CG2 3.62Å; V1255-I1297 HydrophobicContact CB-CD1 3.88Å; V1255-I1297 HydrophobicContact CG2-CD1 3.67Å; I1266-I1297 HydrophobicContact CG2-CD1 3.86Å; I1266-I1297 HydrophobicContact CG2-CG1 4.18Å; I1266-I1297 HydrophobicContact CG2-CG2 3.95Å; M1267-I1297 HydrophobicContact CB-CG1 4.49Å; M1267-I1297 HydrophobicContact CE-CG1 4.46Å; M1267-I1297 HydrophobicContact CG-CD1 4.48Å; M1267-I1297 HydrophobicContact CG-CG1 3.53Å; C1270-I1297 HydrophobicContact CB-CG2 4.27Å; I1276-I1297 HydrophobicContact CG2-CG2 4.48Å; E1278-I1297 WeakPolarHBondContact OE1-CB 3.33Å; E1278-I1297 VanDerWaalsContact OE1-CG2 3.32Å; E1278-I1297 WeakPolarHBondContact OE1-CG2 3.33Å; C1293-I1297 PolarHBondContact O-N 3.3Å; C1293-I1297 WeakPolarHBondContact O-CG1 3.39Å; Q1294-I1297 PolarHBondContact O-N 3.31Å; Q1294-I1297 VanDerWaalsContact O-N 3.17Å; I1297-G1299 PolarHBondContact O-N 3.48Å
1298	L	93.1	Very high	81.8	Confident	4 Å²	4	59.5 Å²	59.5	2%	0.021	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-11.8	173.9	-66.1	177.5	0	0	0	113.6	R1135 I1137 I1276 E1278 Q1294 A1296 R1300	R1135-L1298 HydrophobicContact CB-CD2 4.27Å; R1135-L1298 VanDerWaalsContact CD-O 3.26Å; R1135-L1298 WeakPolarHBondContact CD-O 3.43Å; I1137-L1298 HydrophobicContact CD1-CD1 4.29Å; I1137-L1298 HydrophobicContact CG1-CD1 3.64Å; I1276-L1298 HydrophobicContact CB-CD2 4.05Å; I1276-L1298 HydrophobicContact CG2-CD2 3.77Å; I1276-L1298 WeakPolarHBondContact O-CD2 3.47Å; E1278-L1298 HydrophobicContact CG-CD2 4.17Å; E1278-L1298 HydrophobicContact CG-CG 4.49Å; Q1294-L1298 WeakPolarHBondContact O-CG 3.4Å; Q1294-L1298 PolarHBondContact O-N 3.23Å; A1296-L1298 VanDerWaalsContact C-N 3.33Å; A1296-L1298 PolarHBondContact O-N 3.4Å; L1298-R1300 VanDerWaalsContact C-N 3.26Å; L1298-R1300 HydrophobicContact CB-CB 4.39Å; L1298-R1300 HydrophobicContact CB-CG 4.13Å; L1298-R1300 PolarHBondContact O-N 2.99Å
1299	G	89.9	Confident	82.1	Confident	46 Å²	46	58.1 Å²	58.1	47%	0.474	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	28.3	-173.9	0	0	0	0	0	113.2	L1295 A1296 I1297	L1295-G1299 PolarHBondContact O-N 3.37Å; A1296-G1299 PolarHBondContact O-N 3Å; I1297-G1299 PolarHBondContact O-N 3.48Å
1300	R	89.5	Confident	82.4	Confident	55 Å²	55	57.5 Å²	57.5	21%	0.208	37%	0.366	C	S	.	.			trans	-113	1.6	-177.7	-65.5	-171.9	174.2	-108.6	9.7	113.4	M1133 R1135 L1295 L1298 D1302 E1303	M1133-R1300 PolarHBondContact O-NH2 3.09Å; M1133-R1300 VanDerWaalsContact O-NH2 3.11Å; R1135-R1300 VanDerWaalsContact O-CZ 3.29Å; R1135-R1300 PolarHBondContact O-NE 3.47Å; R1135-R1300 PolarHBondContact O-NH2 3.19Å; L1295-R1300 PolarHBondContact O-N 3.45Å; L1298-R1300 VanDerWaalsContact C-N 3.26Å; L1298-R1300 HydrophobicContact CB-CB 4.39Å; L1298-R1300 HydrophobicContact CB-CG 4.13Å; L1298-R1300 PolarHBondContact O-N 2.99Å; R1300-D1302 PolarHBondContact O-N 3.08Å; R1300-E1303 PolarHBondContact O-N 2.66Å; R1300-E1303 VanDerWaalsContact CG-OE1 3.31Å; R1300-E1303 WeakPolarHBondContact O-CG 3.41Å; R1300-E1303 WeakPolarHBondContact O-CB 3.33Å; R1300-E1303 VanDerWaalsContact O-CB 3.23Å; R1300-E1303 IonicContact NH1-OE2 3.3Å; R1300-E1303 PolarHBondContact NH1-OE1 3.4Å; R1300-E1303 IonicContact NH1-OE1 3.6Å; R1300-E1303 IonicContact NE-OE1 2.7Å; R1300-E1303 IonicContact CZ-OE1 3.54Å; R1300-E1303 WeakPolarHBondContact CG-OE1 3.47Å; R1300-E1303 HydrophobicContact CB-CG 4.33Å
1301	I	86.4	Confident	82.8	Confident	30 Å²	30	59.3 Å²	59.3	15%	0.154	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-61.3	-29.8	-179.5	-160	170.1	0	0	0	113	A1292 L1295 A1296 E1303 F1304 G1306	A1292-I1301 WeakPolarHBondContact O-CD1 2.86Å; A1292-I1301 HydrophobicContact CB-CD1 4.33Å; L1295-I1301 HydrophobicContact CB-CG1 4.39Å; L1295-I1301 PolarHBondContact O-N 3.07Å; L1295-I1301 HydrophobicContact CB-CB 4.17Å; A1296-I1301 HydrophobicContact CB-CD1 4.24Å; A1296-I1301 HydrophobicContact CB-CG2 4.46Å; I1301-E1303 PolarHBondContact O-N 2.94Å; I1301-F1304 PolarHBondContact O-N 2.69Å; I1301-G1306 PolarHBondContact O-N 3.14Å
1302	D	84.6	Confident	82.9	Confident	132 Å²	132	59.9 Å²	59.9	71%	0.706	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-68.6	-22.9	177.5	-64	-27.3	0	0	0	112.3	R1300 F1304 G1305	R1300-D1302 PolarHBondContact O-N 3.08Å; D1302-F1304 PolarHBondContact O-N 3.3Å; D1302-F1304 VanDerWaalsContact O-N 3.15Å; D1302-G1305 PolarHBondContact O-N 3.15Å; D1302-G1305 VanDerWaalsContact O-N 3.13Å
1303	E	85.7	Confident	82.7	Confident	124 Å²	124	62.9 Å²	62.9	58%	0.579	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-62.1	-19.5	171.1	-56.8	178.3	-166.8	0	0	111.5	R1300 I1301	R1300-E1303 PolarHBondContact O-N 2.66Å; R1300-E1303 VanDerWaalsContact CG-OE1 3.31Å; R1300-E1303 WeakPolarHBondContact O-CG 3.41Å; R1300-E1303 WeakPolarHBondContact O-CB 3.33Å; R1300-E1303 VanDerWaalsContact O-CB 3.23Å; R1300-E1303 IonicContact NH1-OE2 3.3Å; R1300-E1303 PolarHBondContact NH1-OE1 3.4Å; R1300-E1303 IonicContact NH1-OE1 3.6Å; R1300-E1303 IonicContact NE-OE1 2.7Å; R1300-E1303 IonicContact CZ-OE1 3.54Å; R1300-E1303 WeakPolarHBondContact CG-OE1 3.47Å; R1300-E1303 HydrophobicContact CB-CG 4.33Å; I1301-E1303 PolarHBondContact O-N 2.94Å
1304	F	79.4	Confident	82.2	Confident	147 Å²	147	66.9 Å²	66.9	65%	0.645	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-109.8	9.4	178.9	-59.2	-88.6	0	0	0	113.6	L1295 I1301 D1302	L1295-F1304 HydrophobicContact CD1-CD2 3.92Å; L1295-F1304 HydrophobicContact CD1-CE2 3.92Å; L1295-F1304 HydrophobicContact CD2-CE2 3.96Å; I1301-F1304 PolarHBondContact O-N 2.69Å; D1302-F1304 PolarHBondContact O-N 3.3Å; D1302-F1304 VanDerWaalsContact O-N 3.15Å
1305	G	73.7	Confident	81.6	Confident	74 Å²	74	71.6 Å²	71.6	76%	0.763	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.5	5.1	179	0	0	0	0	0	116	D1302	D1302-G1305 PolarHBondContact O-N 3.15Å; D1302-G1305 VanDerWaalsContact O-N 3.13Å
1306	G	66.2	Low	80.9	Confident	40 Å²	40	74.9 Å²	74.9	41%	0.412	48%	0.484	S	S	.	.			trans	89.6	167.7	176.4	0	0	0	0	0	115.4	I1301	I1301-G1306 PolarHBondContact O-N 3.14Å
1307	Y	63.7	Low	80	Confident	139 Å²	139	78.3 Å²	78.3	55%	0.545	50%	0.501	S	S	.	.			trans	-133.8	129.1	175	-173.5	-97.8	0	0	0	109.3	T1289 A1292	T1289-Y1307 HydrophobicContact CG2-CE2 3.87Å; A1292-Y1307 HydrophobicContact CB-CD1 4Å; A1292-Y1307 HydrophobicContact CB-CD2 4.04Å; A1292-Y1307 HydrophobicContact CB-CE1 4.39Å; A1292-Y1307 HydrophobicContact CB-CE2 4.43Å; A1292-Y1307 HydrophobicContact CB-CG 3.81Å
1308	G	55.2	Low	78.9	Confident	143 Å²	143	84.9 Å²	84.9	100%	1.474	54%	0.544	S	S	*	.			trans	-76.9	0	-168.8	0	0	0	0	0	116.1

Retrieved 1,308 of 1,308 residues in 235.5 ms (Link to these results)

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