A0A5K4F1L5_SCHMA Loading...

Pre-mRNA-processing factor 6

Involved in pre-mRNA splicing as component of the U4/U6-U5 tri-snRNP complex, one of the building blocks of the spliceosome. Enhances dihydrotestosterone-induced transactivation activity of AR, as well as dexamethasone-induced transactivation activity of NR3C1, but does not affect estrogen-induced transactivation.

AlphaFold DB , UniProt , Accession A0A5K4F1L5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 935 aa.

						>A0A5K4F1L5_SCHMA|A0A5K4F1L5
MSVQTLVTKKRKEFIGLPAPLGYAAGIGRGAVAFTTRSDIGPAREANDVSDERHVAPSKRRKEQEEEEEDLNDSNYDEFTGYGGSLCAKDPYEKDDQEADAIYASIDDRMDERRREYREKRFREEIEKYRRERPKIQQQFMDLKRDLASVSESEWNALPEVGDSRNRKQRNPRYERFTPIPDSIIAKGLSDGQTNVSVDVIEQSLGGLTTPFTSQTAQMDIDMKKIGEARTSLMDIKLTQVSDSVSGQTVVDPKGYLTDLQSMIPQHGGDINDMKKARLLLKSVRETNPKHAPAWIASARLEEIAGKLQVARNLILSGCEECPKSEDIWLEAARLVPSEQAKSVVAQAIRHLPQSVRLWVKAADLETEHKAKKVVFKKALEQVPNSVRLWKLAVELEDEDDARLMLSLAVECCPTSVELWLALARLETYEQARVVLNKARESIPTDRQIWFAATRLEEAQGNQNMVQKIVDRGVASLQANMVEINRDQWIKDAEECEKAKSVLTAQAIIKAIIGYGLEEQDKKHTWLSDAENCATSGAIECARAIYAVALAHFPTKKSIWLRAAYFERNHGTRETLEELLRQAVSHCPQAEVLWLMAAKTRWLAGDVPAARSILARAFEANPNSEEIWLAAVKLESENKEYARARRLLDKACASASTARVWMKAARLEWCLGELNKALEMLQKATLTYNQAPKLWLMLSQVYEQLSEENLKPNEAESLKERARNTYREGLNHNPHYTALWLQLARFEERQCNLTKARSILEKARSQNPKTPELWLEAIRLEVRANLKPVADSLISKALQECPTSGCLWAEAIFMTPRAQRKSKSVDALKKCEHDPLVLLAVSKMFWCERLVMKARNWFTRTVKLEPDLGDAWAYFYKFELQHGTEDQQKEVYRRCVTAEPHHGEVWCQISKDPKNWRLKTKDLLKIAAETIVLPN
					

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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	34.3	Very low	40	Very low	239 Å²	239	162.9 Å²	162.9	100%	1.177	83%	0.83	S	S	*	*				0	138.9	0	-76.5	-153.2	-88.2	0	0	108.3
2	S	36.3	Very low	40.8	Very low	112 Å²	112	160.3 Å²	160.3	78%	0.783	81%	0.809	S	S	*	*			trans	61.8	95.6	-169	79.1	0	0	0	0	115
3	V	36.5	Very low	42.1	Very low	124 Å²	124	161.1 Å²	161.1	75%	0.752	81%	0.808	S	S	*	*				58.6	105.7	67.4	-171.7	0	0	0	0	111.8
4	Q	37.7	Very low	43.9	Very low	179 Å²	179	159.7 Å²	159.7	84%	0.836	80%	0.795	S	S	*	*			trans	175	95.2	137	-94.5	162	6.5	0	0	108.4
5	T	40.4	Very low	45	Very low	109 Å²	109	157.1 Å²	157.1	67%	0.669	78%	0.783	S	S	*	*				67.8	118.1	88	59	0	0	0	0	113.6
6	L	40.7	Very low	46.4	Very low	150 Å²	150	152.3 Å²	152.3	79%	0.785	79%	0.785	S	S	*	*			trans	138.3	66.1	148	-70.9	155.2	0	0	0	113.6
7	V	39.8	Very low	47.5	Very low	144 Å²	144	150 Å²	150	87%	0.873	77%	0.774	S	S	*	*			trans	-111.1	71.8	139.5	-176.3	0	0	0	0	107.4
8	T	41.2	Very low	48.4	Very low	112 Å²	112	147.8 Å²	147.8	69%	0.687	77%	0.771	S	S	*	*			trans	-104.4	72.6	159	49.4	0	0	0	0	107.4	K10	T8-K10 PolarHBondContact O-N 3.33Å
9	K	45.1	Very low	49.1	Very low	202 Å²	202	143.7 Å²	143.7	88%	0.878	76%	0.76	S	S	*	*			trans	-74.9	86.6	159	-92.3	-173.2	177.5	179.6	0	107
10	K	43.3	Very low	49.8	Very low	182 Å²	182	141.3 Å²	141.3	79%	0.791	75%	0.753	S	S	*	*			trans	35.7	89	163.9	-65	-176.3	175.3	-172.6	0	112.6	T8 K12	T8-K10 PolarHBondContact O-N 3.33Å; K10-K12 VanDerWaalsContact C-N 3.27Å; K10-K12 PolarHBondContact O-N 3.37Å
11	R	45	Very low	50.4	Low	239 Å²	239	139.9 Å²	139.9	90%	0.902	75%	0.746	S	S	*	*			trans	-42.7	110	142.6	-96	-173.1	179.2	179.8	-0.3	104.3	E13	R11-E13 PolarHBondContact O-N 3.4Å
12	K	49.4	Very low	51.9	Low	131 Å²	131	132.2 Å²	132.2	57%	0.57	73%	0.728	S	S	*	*			trans	-57	114.7	179.5	-71.4	179.4	175.7	-176.6	0	104.5	K10 F14 I15	K10-K12 VanDerWaalsContact C-N 3.27Å; K10-K12 PolarHBondContact O-N 3.37Å; K12-F14 HydrophobicContact CB-CD1 3.78Å; K12-F14 HydrophobicContact CB-CE1 3.48Å; K12-F14 VanDerWaalsContact CB-CE1 3.48Å; K12-F14 HydrophobicContact CB-CZ 4.02Å; K12-F14 HydrophobicContact CD-CE1 3.6Å; K12-F14 HydrophobicContact CD-CZ 3.64Å; K12-F14 HydrophobicContact CG-CE1 4.01Å; K12-F14 HydrophobicContact CG-CZ 4.44Å; K12-F14 PolarHBondContact O-N 3.12Å; K12-I15 HydrophobicContact CB-CD1 4.1Å; K12-I15 HydrophobicContact CB-CG1 4.2Å; K12-I15 HydrophobicContact CD-CD1 4.12Å; K12-I15 PolarHBondContact O-N 3.37Å
13	E	57.4	Low	53.3	Low	171 Å²	171	132.4 Å²	132.4	80%	0.799	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.2	-23	-166	-74.3	163.5	166.2	0	0	112	R11 L17	R11-E13 PolarHBondContact O-N 3.4Å; E13-L17 WeakPolarHBondContact O-CD1 3.45Å; E13-L17 VanDerWaalsContact O-CG 3.22Å; E13-L17 WeakPolarHBondContact O-CG 3.38Å
14	F	67.6	Low	54.7	Low	142 Å²	142	128.8 Å²	128.8	62%	0.623	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-18.1	176.2	72.6	-97.6	0	0	0	116.9	K12 G16	K12-F14 HydrophobicContact CB-CD1 3.78Å; K12-F14 HydrophobicContact CB-CE1 3.48Å; K12-F14 VanDerWaalsContact CB-CE1 3.48Å; K12-F14 HydrophobicContact CB-CZ 4.02Å; K12-F14 HydrophobicContact CD-CE1 3.6Å; K12-F14 HydrophobicContact CD-CZ 3.64Å; K12-F14 HydrophobicContact CG-CE1 4.01Å; K12-F14 HydrophobicContact CG-CZ 4.44Å; K12-F14 PolarHBondContact O-N 3.12Å; F14-G16 PolarHBondContact O-N 3.27Å
15	I	60.5	Low	56	Low	121 Å²	121	123.6 Å²	123.6	62%	0.621	68%	0.683	S	S	*	*	S	Bend	trans	-84.1	107.2	-177.5	-62.8	178.8	0	0	0	109	K12	K12-I15 HydrophobicContact CB-CD1 4.1Å; K12-I15 HydrophobicContact CB-CG1 4.2Å; K12-I15 HydrophobicContact CD-CD1 4.12Å; K12-I15 PolarHBondContact O-N 3.37Å
16	G	67.8	Low	57.2	Low	79 Å²	79	120.5 Å²	120.5	81%	0.814	67%	0.672	S	S	*	*	S	Bend	trans	98.6	-8.7	-176.9	0	0	0	0	0	114.1	F14	F14-G16 PolarHBondContact O-N 3.27Å
17	L	64.2	Low	58.4	Low	114 Å²	114	120.3 Å²	120.3	60%	0.597	67%	0.671	S	S	*	*	S	Bend	trans	-68.4	133.4	157.1	-78.8	172.5	0	0	0	107.5	E13	E13-L17 WeakPolarHBondContact O-CD1 3.45Å; E13-L17 VanDerWaalsContact O-CG 3.22Å; E13-L17 WeakPolarHBondContact O-CG 3.38Å
18	P	64.1	Low	59.7	Low	111 Å²	111	115.6 Å²	115.6	72%	0.721	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-55.5	144.3	165.2	25	-31.6	0	0	0	108.6
19	A	62.3	Low	60.9	Low	69 Å²	69	120 Å²	120	57%	0.57	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-49.6	135.4	174.8	0	0	0	0	0	109.3	L21	A19-L21 PolarHBondContact O-N 2.68Å
20	P	62.2	Low	61.9	Low	95 Å²	95	113.3 Å²	113.3	62%	0.617	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-51.7	132.4	176.4	-22.8	31.3	0	0	0	109.5	G22 Y23	P20-G22 PolarHBondContact O-N 2.89Å; P20-G22 VanDerWaalsContact O-N 3.12Å; P20-Y23 VanDerWaalsContact O-CB 3.29Å; P20-Y23 WeakPolarHBondContact O-CB 3.29Å; P20-Y23 PolarHBondContact O-N 2.93Å
21	L	61.9	Low	62.9	Low	113 Å²	113	107.1 Å²	107.1	59%	0.592	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.1	121.9	178.5	-87.7	102.3	0	0	0	109.7	A19	A19-L21 PolarHBondContact O-N 2.68Å
22	G	66.3	Low	63.7	Low	78 Å²	78	102.1 Å²	102.1	80%	0.804	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	96.3	-1.9	-175.8	0	0	0	0	0	115.7	P20 A24	P20-G22 PolarHBondContact O-N 2.89Å; P20-G22 VanDerWaalsContact O-N 3.12Å; G22-A24 PolarHBondContact O-N 2.66Å
23	Y	65.9	Low	64.3	Low	116 Å²	116	99.9 Å²	99.9	46%	0.455	63%	0.628	S	S	.	*			trans	-81.8	106.1	175.5	-178.6	-100.3	0	0	0	111.8	P20 A25	P20-Y23 VanDerWaalsContact O-CB 3.29Å; P20-Y23 WeakPolarHBondContact O-CB 3.29Å; P20-Y23 PolarHBondContact O-N 2.93Å; Y23-A25 HydrophobicContact CE1-CB 4.04Å
24	A	65.8	Low	64	Low	48 Å²	48	100.4 Å²	100.4	40%	0.397	63%	0.628	S	S	.	*			trans	-91.9	116.2	169.3	0	0	0	0	0	110	G22 G26 I27 G28	G22-A24 PolarHBondContact O-N 2.66Å; A24-G26 VanDerWaalsContact C-N 3.35Å; A24-G26 PolarHBondContact O-N 2.67Å; A24-I27 HydrophobicContact CB-CB 4.2Å; A24-I27 HydrophobicContact CB-CD1 4.43Å; A24-I27 PolarHBondContact O-N 3.18Å; A24-G28 WeakPolarHBondContact O-CA 2.91Å; A24-G28 PolarHBondContact O-N 3.39Å
25	A	64.7	Low	63.4	Low	69 Å²	69	98.8 Å²	98.8	57%	0.57	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	-30	-165	0	0	0	0	0	116.2	Y23 R29	Y23-A25 HydrophobicContact CE1-CB 4.04Å; A25-R29 WeakPolarHBondContact O-CB 3.47Å
26	G	65.6	Low	63.2	Low	44 Å²	44	96.8 Å²	96.8	45%	0.454	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.7	-50	173.7	0	0	0	0	0	112.3	A24 A31	A24-G26 VanDerWaalsContact C-N 3.35Å; A24-G26 PolarHBondContact O-N 2.67Å; G26-A31 WeakPolarHBondContact O-CB 3.31Å; G26-A31 PolarHBondContact O-N 3.41Å
27	I	65.6	Low	62.2	Low	146 Å²	146	104.4 Å²	104.4	75%	0.749	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-45.8	-177.7	-70.7	162.1	0	0	0	111.8	A24 R29 G30	A24-I27 HydrophobicContact CB-CB 4.2Å; A24-I27 HydrophobicContact CB-CD1 4.43Å; A24-I27 PolarHBondContact O-N 3.18Å; I27-R29 PolarHBondContact O-N 2.97Å; I27-G30 PolarHBondContact O-N 3.49Å
28	G	67.4	Low	62.1	Low	46 Å²	46	104.2 Å²	104.2	47%	0.474	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.6	-13.8	179.7	0	0	0	0	0	114.4	A24	A24-G28 WeakPolarHBondContact O-CA 2.91Å; A24-G28 PolarHBondContact O-N 3.39Å
29	R	67.4	Low	61.6	Low	203 Å²	203	104.1 Å²	104.1	77%	0.766	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-8.1	169.2	-172.4	174.7	167.5	-172.1	-5.5	112.5	A25 I27 A31	A25-R29 WeakPolarHBondContact O-CB 3.47Å; I27-R29 PolarHBondContact O-N 2.97Å; R29-A31 HydrophobicContact CB-CB 4.17Å; R29-A31 HydrophobicContact CG-CB 4.23Å; R29-A31 PolarHBondContact O-N 3.01Å
30	G	66.7	Low	60.9	Low	62 Å²	62	107.5 Å²	107.5	64%	0.639	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.1	21.8	-166.9	0	0	0	0	0	112.3	I27 V32	I27-G30 PolarHBondContact O-N 3.49Å; G30-V32 PolarHBondContact O-N 3.39Å
31	A	63.5	Low	60.3	Low	52 Å²	52	106 Å²	106	43%	0.43	64%	0.638	S	S	.	*			trans	-82.5	111	-179.2	0	0	0	0	0	108.5	G26 R29	G26-A31 WeakPolarHBondContact O-CB 3.31Å; G26-A31 PolarHBondContact O-N 3.41Å; R29-A31 HydrophobicContact CB-CB 4.17Å; R29-A31 HydrophobicContact CG-CB 4.23Å; R29-A31 PolarHBondContact O-N 3.01Å
32	V	61.5	Low	59.7	Low	135 Å²	135	107.1 Å²	107.1	82%	0.818	65%	0.652	S	S	*	*			trans	-92.2	127.5	170.1	-175	0	0	0	0	107	G30 F34	G30-V32 PolarHBondContact O-N 3.39Å; V32-F34 PolarHBondContact O-N 3.18Å
33	A	61.5	Low	58	Low	83 Å²	83	107.5 Å²	107.5	69%	0.686	65%	0.648	S	S	*	*			trans	-57.2	137.9	172.9	0	0	0	0	0	109.5	T35	A33-T35 PolarHBondContact O-N 2.92Å
34	F	52.5	Low	56.7	Low	183 Å²	183	111.4 Å²	111.4	80%	0.803	66%	0.662	S	S	*	*			trans	-69.7	101.6	179.5	55.2	-85.2	0	0	0	108.7	V32 T36	V32-F34 PolarHBondContact O-N 3.18Å; F34-T36 HydrophobicContact CD2-CG2 4.11Å; F34-T36 PolarHBondContact O-N 3.37Å
35	T	53.3	Low	55.1	Low	108 Å²	108	115.8 Å²	115.8	66%	0.663	67%	0.674	S	S	*	*			trans	-70.2	118.8	176	53.9	0	0	0	0	109.1	A33	A33-T35 PolarHBondContact O-N 2.92Å
36	T	56.7	Low	53.9	Low	78 Å²	78	116.5 Å²	116.5	48%	0.479	68%	0.68	S	S	.	*			trans	-100.2	162.8	170.3	62.3	0	0	0	0	109.4	F34 S38 D39	F34-T36 HydrophobicContact CD2-CG2 4.11Å; F34-T36 PolarHBondContact O-N 3.37Å; T36-S38 PolarHBondContact O-N 3.44Å; T36-D39 PolarHBondContact N-OD2 3.22Å; T36-D39 PolarHBondContact O-N 3.17Å
37	R	46.7	Very low	52.5	Low	239 Å²	239	121.7 Å²	121.7	90%	0.902	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-10.3	-166.4	-159	173.2	177.7	164.8	-1	114.9
38	S	62.6	Low	51.5	Low	111 Å²	111	121.8 Å²	121.8	78%	0.776	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-15.6	175.8	-45.2	0	0	0	0	113.9	T36	T36-S38 PolarHBondContact O-N 3.44Å
39	D	53.2	Low	50.2	Low	109 Å²	109	126.1 Å²	126.1	58%	0.583	72%	0.717	S	S	*	*	S	Bend	trans	-91.2	1	-174.8	-56.4	-39.5	0	0	0	113.9	T36 G41	T36-D39 PolarHBondContact N-OD2 3.22Å; T36-D39 PolarHBondContact O-N 3.17Å; D39-G41 PolarHBondContact O-N 3.46Å
40	I	47.2	Very low	49	Very low	140 Å²	140	121.1 Å²	121.1	72%	0.718	71%	0.713	S	S	*	*			trans	-99.2	94.4	-168.7	-57	172.8	0	0	0	111.3
41	G	49.8	Very low	47.7	Very low	62 Å²	62	124 Å²	124	64%	0.639	71%	0.713	S	S	*	*			trans	-131.3	166.9	162.7	0	0	0	0	0	110.3	D39 A43	D39-G41 PolarHBondContact O-N 3.46Å; G41-A43 PolarHBondContact O-N 3.3Å
42	P	50	Low	46.6	Very low	137 Å²	137	130.9 Å²	130.9	89%	0.89	74%	0.736	S	S	*	*	S	Bend	trans	-72.4	120.5	-135.5	28.8	-34.4	0	0	0	115.7
43	A	30.9	Very low	45.4	Very low	87 Å²	87	131.7 Å²	131.7	72%	0.719	73%	0.725	S	S	*	*			trans	37.7	121.4	143.6	0	0	0	0	0	118.2	G41	G41-A43 PolarHBondContact O-N 3.3Å
44	R	37.6	Very low	44.3	Very low	197 Å²	197	134.5 Å²	134.5	74%	0.743	72%	0.723	S	S	*	*				165.7	124.9	116.4	-91.3	174.4	119.7	133.6	11.4	110.4
45	E	33.3	Very low	43.6	Very low	140 Å²	140	131.8 Å²	131.8	65%	0.654	72%	0.722	S	S	*	*				75.9	98.1	108.4	-66.8	170	-178.3	0	0	110.4
46	A	38.1	Very low	43	Very low	84 Å²	84	131.5 Å²	131.5	69%	0.694	73%	0.73	S	S	*	*				63.7	109.4	75.7	0	0	0	0	0	111
47	N	36.6	Very low	41.7	Very low	154 Å²	154	132.9 Å²	132.9	82%	0.824	74%	0.74	S	S	*	*			trans	71.3	93.5	179.9	-46.4	-30.2	0	0	0	113
48	D	44.7	Very low	41.1	Very low	148 Å²	148	127.1 Å²	127.1	79%	0.791	74%	0.737	S	S	*	*				-155.2	125.4	111.1	-131.4	-25.3	0	0	0	113.1
49	V	39.6	Very low	39.6	Very low	137 Å²	137	131.4 Å²	131.4	83%	0.83	74%	0.742	S	S	*	*			trans	-126.9	113.7	174.1	-177.7	0	0	0	0	103.5
50	S	43.2	Very low	38.3	Very low	98 Å²	98	137.5 Å²	137.5	69%	0.685	76%	0.757	S	S	*	*			trans	-155	117.5	159.4	45.2	0	0	0	0	108
51	D	38.5	Very low	37.6	Very low	121 Å²	121	142.3 Å²	142.3	65%	0.647	77%	0.765	S	S	*	*				81.9	69.8	62.4	-154.3	31.3	0	0	0	111	R53	D51-R53 IonicContact OD1-CZ 2.75Å; D51-R53 IonicContact OD1-NE 3.99Å; D51-R53 IonicContact OD1-NH2 3.34Å; D51-R53 PolarHBondContact OD1-NH2 2.8Å
52	E	40	Very low	37	Very low	197 Å²	197	149.3 Å²	149.3	92%	0.921	78%	0.778	S	S	*	*			trans	-140.4	105.9	152.9	-106.5	-176.8	-167.6	0	0	110.3
53	R	37.4	Very low	36.2	Very low	153 Å²	153	150.6 Å²	150.6	58%	0.577	77%	0.773	S	S	*	*			trans	-87.4	155.3	170.9	-63.8	167.9	-133.5	-168.7	-1	108.4	D51	D51-R53 IonicContact OD1-CZ 2.75Å; D51-R53 IonicContact OD1-NE 3.99Å; D51-R53 IonicContact OD1-NH2 3.34Å; D51-R53 PolarHBondContact OD1-NH2 2.8Å
54	H	38.4	Very low	36.4	Very low	141 Å²	141	155.1 Å²	155.1	65%	0.653	78%	0.779	S	S	*	*			trans	72.1	114.6	162.3	-52.2	-69.7	0	0	0	114.9
55	V	37.5	Very low	36.3	Very low	126 Å²	126	155 Å²	155	76%	0.764	79%	0.786	S	S	*	*				-170.6	133.6	120.2	150.3	0	0	0	0	105.7	P57	V55-P57 HydrophobicContact CG1-CG 4.18Å; V55-P57 WeakPolarHBondContact O-CD 3.33Å
56	A	41.1	Very low	36.8	Very low	103 Å²	103	157.2 Å²	157.2	85%	0.851	80%	0.797	S	S	*	*			trans	-88.8	125.4	174	0	0	0	0	0	109.1
57	P	30.2	Very low	37.2	Very low	106 Å²	106	161.5 Å²	161.5	69%	0.688	80%	0.803	S	S	*	*			trans	-147.2	114.7	155.4	29.9	-9.4	0	0	0	110.9	V55	V55-P57 HydrophobicContact CG1-CG 4.18Å; V55-P57 WeakPolarHBondContact O-CD 3.33Å
58	S	33.2	Very low	38	Very low	118 Å²	118	162.9 Å²	162.9	83%	0.825	80%	0.804	S	S	*	*				111.1	132.9	86.8	125.7	0	0	0	0	109.1
59	K	31.9	Very low	38.7	Very low	202 Å²	202	163 Å²	163	88%	0.878	80%	0.8	S	S	*	*	S	Bend	trans	-67.1	134.2	-166.4	-77.4	169.7	171.2	173.2	0	112.6
60	R	25.6	Very low	40.1	Very low	237 Å²	237	160.4 Å²	160.4	89%	0.894	78%	0.782	S	S	*	*	S	Bend	trans	86.5	124.9	163.6	-66	-179	167.8	177.9	-4.1	117.6
61	R	32.7	Very low	41.8	Very low	240 Å²	240	160.9 Å²	160.9	91%	0.906	78%	0.776	S	S	*	*			trans	105.3	112.5	163	-61.5	175.3	178.1	-174.9	-1.2	114.1
62	K	36.7	Very low	43.6	Very low	209 Å²	209	159.5 Å²	159.5	91%	0.909	77%	0.768	S	S	*	*			trans	-177	105.4	172.8	-101.2	176.3	-178.1	-167	0	106.2
63	E	32.6	Very low	45.5	Very low	165 Å²	165	156.7 Å²	156.7	77%	0.771	76%	0.76	S	S	*	*			cis	58.5	114.7	28.5	-88.3	174.4	-161.5	0	0	114.8
64	Q	35.1	Very low	47.5	Very low	182 Å²	182	154 Å²	154	85%	0.85	76%	0.764	S	S	*	*			trans	63.2	92	153.5	-64.5	167.7	-2.2	0	0	116.5
65	E	35.7	Very low	49.5	Very low	193 Å²	193	149.3 Å²	149.3	90%	0.902	74%	0.744	S	S	*	*			trans	-100.4	130.3	143.5	-84.6	176.6	175.9	0	0	106.6	E67	E65-E67 PolarHBondContact O-N 2.85Å
66	E	43.4	Very low	51.8	Low	187 Å²	187	149 Å²	149	87%	0.874	73%	0.73	S	S	*	*			trans	-46.8	125.7	-168.1	-67.6	159	156.1	0	0	111.8	E68	E66-E68 PolarHBondContact O-N 3.25Å
67	E	47.7	Very low	53.6	Low	175 Å²	175	147.6 Å²	147.6	82%	0.818	71%	0.708	S	S	*	*			trans	-62.6	87.5	170.4	-70.2	173.8	166.8	0	0	108.1	E65 E69	E65-E67 PolarHBondContact O-N 2.85Å; E67-E69 PolarHBondContact O-N 3.47Å; E67-E69 VanDerWaalsContact O-N 3.13Å
68	E	53.5	Low	56.2	Low	182 Å²	182	151.3 Å²	151.3	85%	0.85	72%	0.716	S	S	*	*			trans	-50.4	117.1	158.2	-83.4	-177.1	153.9	0	0	106.5	E66 D70	E66-E68 PolarHBondContact O-N 3.25Å; E68-D70 PolarHBondContact O-N 3.19Å
69	E	59.5	Low	58.5	Low	151 Å²	151	154.9 Å²	154.9	71%	0.706	72%	0.717	S	S	*	*			trans	-47.4	114	178.3	-72.4	176	171.9	0	0	108.6	E67 L71	E67-E69 PolarHBondContact O-N 3.47Å; E67-E69 VanDerWaalsContact O-N 3.13Å; E69-L71 VanDerWaalsContact C-N 3.25Å; E69-L71 PolarHBondContact O-N 2.88Å
70	D	68.2	Low	60.8	Low	83 Å²	83	150.2 Å²	150.2	44%	0.444	71%	0.706	S	S	.	*			trans	-73.2	85	-174.4	-171.9	10.3	0	0	0	109.2	E68 N72 N75	E68-D70 PolarHBondContact O-N 3.19Å; D70-N72 PolarHBondContact O-N 3.5Å; D70-N72 WeakPolarHBondContact OD1-CB 3.29Å; D70-N72 PolarHBondContact OD1-N 3.11Å; D70-N75 HydrophobicContact CB-CB 4.27Å; D70-N75 WeakPolarHBondContact O-CB 3.47Å; D70-N75 PolarHBondContact O-ND2 3.15Å
71	L	78.8	Confident	63.6	Low	108 Å²	108	140 Å²	140	57%	0.565	68%	0.675	S	S	*	*			trans	-80.3	12.5	177.6	-66.8	172.1	0	0	0	112.5	E69 Y82	E69-L71 VanDerWaalsContact C-N 3.25Å; E69-L71 PolarHBondContact O-N 2.88Å; L71-Y82 VanDerWaalsContact CA-CE1 3.47Å; L71-Y82 HydrophobicContact CB-CE1 4.32Å; L71-Y82 HydrophobicContact CD2-CD2 4.26Å; L71-Y82 HydrophobicContact CD2-CE1 4.05Å; L71-Y82 HydrophobicContact CD2-CE2 3.74Å; L71-Y82 PolarHBondContact O-OH 2.98Å
72	N	76.3	Confident	66.1	Low	92 Å²	92	133.7 Å²	133.7	49%	0.492	65%	0.652	S	S	.	*	S	Bend	trans	-70.2	146	179.9	-165.2	4.2	0	0	0	111.1	D70 S74 N75 Y76	D70-N72 PolarHBondContact O-N 3.5Å; D70-N72 WeakPolarHBondContact OD1-CB 3.29Å; D70-N72 PolarHBondContact OD1-N 3.11Å; N72-S74 PolarHBondContact ND2-OG 3.12Å; N72-S74 VanDerWaalsContact ND2-OG 3.1Å; N72-S74 PolarHBondContact O-N 3.03Å; N72-N75 PolarHBondContact O-N 3.13Å; N72-Y76 PolarHBondContact O-N 3.33Å
73	D	79.9	Confident	67.9	Low	138 Å²	138	125.6 Å²	125.6	74%	0.738	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	-19.7	178.3	-71.9	-9.8	0	0	0	112.5
74	S	79.1	Confident	69.8	Low	96 Å²	96	121.3 Å²	121.3	67%	0.671	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-24.3	174.3	55.4	0	0	0	0	114.5	N72	N72-S74 PolarHBondContact ND2-OG 3.12Å; N72-S74 VanDerWaalsContact ND2-OG 3.1Å; N72-S74 PolarHBondContact O-N 3.03Å
75	N	81.7	Confident	71.7	Confident	43 Å²	43	116.8 Å²	116.8	23%	0.23	62%	0.616	C	S	.	*	T	Hydrogen-bonded Turn	trans	-94.4	-11.4	175.7	-167.3	37.4	0	0	0	111.7	D70 N72 Y82 G83	D70-N75 HydrophobicContact CB-CB 4.27Å; D70-N75 WeakPolarHBondContact O-CB 3.47Å; D70-N75 PolarHBondContact O-ND2 3.15Å; N72-N75 PolarHBondContact O-N 3.13Å; N75-Y82 CarbonylContact O-C 3.51Å; N75-Y82 WeakPolarHBondContact O-CA 3.44Å; N75-G83 PolarHBondContact ND2-O 2.94Å; N75-G83 PolarHBondContact O-N 3.29Å; N75-G83 VanDerWaalsContact OD1-CA 3.28Å; N75-G83 WeakPolarHBondContact OD1-CA 3.33Å; N75-G83 PolarHBondContact OD1-N 2.88Å; N75-G83 PolarHBondContact OD1-O 2.96Å
76	Y	84.2	Confident	73.5	Confident	118 Å²	118	115.3 Å²	115.3	46%	0.463	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.6	127.4	176.4	-173	-102.1	0	0	0	111.2	N72 Y82	N72-Y76 PolarHBondContact O-N 3.33Å; Y76-Y82 HydrophobicContact CD2-CD1 4.11Å; Y76-Y82 HydrophobicContact CD2-CD2 4.05Å; Y76-Y82 AromaticContact CD2-CE1 3.92Å; Y76-Y82 HydrophobicContact CD2-CE1 3.92Å; Y76-Y82 AromaticContact CD2-CE2 3.87Å; Y76-Y82 HydrophobicContact CD2-CE2 3.87Å; Y76-Y82 HydrophobicContact CD2-CG 4.18Å; Y76-Y82 AromaticContact CD2-CZ 3.82Å; Y76-Y82 HydrophobicContact CE2-CE2 4.35Å; Y76-Y82 HydrophobicContact CG-CE1 4.3Å
77	D	79.9	Confident	75.1	Confident	74 Å²	74	110.6 Å²	110.6	40%	0.396	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.1	136.9	168.5	171.1	56.5	0	0	0	109.7	F79 T80 G81	D77-F79 PolarHBondContact O-N 3.49Å; D77-F79 VanDerWaalsContact O-N 3.17Å; D77-F79 PolarHBondContact OD2-N 3.07Å; D77-T80 WeakPolarHBondContact CB-OG1 3.41Å; D77-T80 WeakPolarHBondContact OD2-CB 3.37Å; D77-T80 PolarHBondContact OD2-N 3.14Å; D77-T80 PolarHBondContact OD2-OG1 3.46Å; D77-G81 PolarHBondContact N-O 3.34Å; D77-G81 WeakPolarHBondContact O-CA 3.35Å; D77-G81 PolarHBondContact O-N 3.18Å
78	E	84.4	Confident	76.1	Confident	184 Å²	184	106.1 Å²	106.1	86%	0.86	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-25.6	-174.3	-67.4	179.2	174.3	0	0	113.2
79	F	81.2	Confident	76.8	Confident	193 Å²	193	105.7 Å²	105.7	85%	0.846	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	-40.8	-177.6	-170.6	-98.3	0	0	0	112.9	D77	D77-F79 PolarHBondContact O-N 3.49Å; D77-F79 VanDerWaalsContact O-N 3.17Å; D77-F79 PolarHBondContact OD2-N 3.07Å
80	T	80.4	Confident	77.6	Confident	104 Å²	104	103.9 Å²	103.9	64%	0.638	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	-9.3	-174.9	57.4	0	0	0	0	114.4	D77	D77-T80 WeakPolarHBondContact CB-OG1 3.41Å; D77-T80 WeakPolarHBondContact OD2-CB 3.37Å; D77-T80 PolarHBondContact OD2-N 3.14Å; D77-T80 PolarHBondContact OD2-OG1 3.46Å
81	G	85.4	Confident	77.8	Confident	23 Å²	23	105 Å²	105	24%	0.237	60%	0.595	C	S	.	*	E	Extended strand (participates in β ladder)	trans	81.3	-148	-176.8	0	0	0	0	0	111.6	D77	D77-G81 PolarHBondContact N-O 3.34Å; D77-G81 WeakPolarHBondContact O-CA 3.35Å; D77-G81 PolarHBondContact O-N 3.18Å
82	Y	83.6	Confident	77.9	Confident	108 Å²	108	106.8 Å²	106.8	42%	0.424	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73	134	174.5	-74	-75.4	0	0	0	111	L71 N75 Y76	L71-Y82 VanDerWaalsContact CA-CE1 3.47Å; L71-Y82 HydrophobicContact CB-CE1 4.32Å; L71-Y82 HydrophobicContact CD2-CD2 4.26Å; L71-Y82 HydrophobicContact CD2-CE1 4.05Å; L71-Y82 HydrophobicContact CD2-CE2 3.74Å; L71-Y82 PolarHBondContact O-OH 2.98Å; N75-Y82 CarbonylContact O-C 3.51Å; N75-Y82 WeakPolarHBondContact O-CA 3.44Å; Y76-Y82 HydrophobicContact CD2-CD1 4.11Å; Y76-Y82 HydrophobicContact CD2-CD2 4.05Å; Y76-Y82 AromaticContact CD2-CE1 3.92Å; Y76-Y82 HydrophobicContact CD2-CE1 3.92Å; Y76-Y82 AromaticContact CD2-CE2 3.87Å; Y76-Y82 HydrophobicContact CD2-CE2 3.87Å; Y76-Y82 HydrophobicContact CD2-CG 4.18Å; Y76-Y82 AromaticContact CD2-CZ 3.82Å; Y76-Y82 HydrophobicContact CE2-CE2 4.35Å; Y76-Y82 HydrophobicContact CG-CE1 4.3Å
83	G	75.8	Confident	78.2	Confident	39 Å²	39	108.3 Å²	108.3	40%	0.402	60%	0.599	S	S	.	*	S	Bend	trans	-64.7	132.4	172.3	0	0	0	0	0	111.3	N75	N75-G83 PolarHBondContact ND2-O 2.94Å; N75-G83 PolarHBondContact O-N 3.29Å; N75-G83 VanDerWaalsContact OD1-CA 3.28Å; N75-G83 WeakPolarHBondContact OD1-CA 3.33Å; N75-G83 PolarHBondContact OD1-N 2.88Å; N75-G83 PolarHBondContact OD1-O 2.96Å
84	G	72.6	Confident	78.4	Confident	74 Å²	74	109.1 Å²	109.1	76%	0.763	60%	0.596	S	S	*	*	S	Bend	trans	131.8	141.5	-178.5	0	0	0	0	0	112.1
85	S	73.7	Confident	78.8	Confident	88 Å²	88	109 Å²	109	62%	0.615	59%	0.589	S	S	*	*			trans	-81.9	126.8	175.9	163.8	0	0	0	0	110.2	C87 A88	S85-C87 PolarHBondContact OG-N 3.47Å; S85-A88 PolarHBondContact OG-N 2.96Å
86	L	75.1	Confident	79.1	Confident	162 Å²	162	110 Å²	110	85%	0.848	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-67.4	-34.4	174.4	-173.8	64.7	0	0	0	112.6
87	C	75.7	Confident	79.1	Confident	87 Å²	87	110.1 Å²	110.1	59%	0.588	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-88.2	-1	-170.6	-49.7	0	0	0	0	114.2	S85 K89 D90	S85-C87 PolarHBondContact OG-N 3.47Å; C87-K89 PolarHBondContact O-N 3.38Å; C87-D90 PolarHBondContact O-N 3.05Å
88	A	69.6	Low	79.5	Confident	82 Å²	82	112.5 Å²	112.5	68%	0.678	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-70.1	-14	-173.4	0	0	0	0	0	114.3	S85	S85-A88 PolarHBondContact OG-N 2.96Å
89	K	68.6	Low	79.7	Confident	173 Å²	173	105.5 Å²	105.5	75%	0.752	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-84.2	-14.7	178.2	-75.6	-179.5	178.6	172.6	0	113.5	C87	C87-K89 PolarHBondContact O-N 3.38Å
90	D	75	Confident	80	Confident	113 Å²	113	100.2 Å²	100.2	60%	0.604	56%	0.562	S	S	*	*	S	Bend	trans	-77.9	147.7	-174.5	-66.1	-30.6	0	0	0	111.4	C87 Y92	C87-D90 PolarHBondContact O-N 3.05Å; D90-Y92 PolarHBondContact O-N 3.1Å; D90-Y92 VanDerWaalsContact O-N 3.12Å
91	P	72.9	Confident	80.3	Confident	106 Å²	106	98.2 Å²	98.2	69%	0.688	56%	0.556	S	S	*	*			trans	-59.4	115.7	177	-18	29.9	0	0	0	110.6	E93	P91-E93 PolarHBondContact O-N 2.98Å
92	Y	81.1	Confident	80.7	Confident	146 Å²	146	102 Å²	102	57%	0.573	57%	0.569	S	S	*	*			trans	-85.2	102.4	179.3	-163.6	-104.8	0	0	0	110	D90 D96 Q97 D100	D90-Y92 PolarHBondContact O-N 3.1Å; D90-Y92 VanDerWaalsContact O-N 3.12Å; Y92-D96 HydrophobicContact CD2-CB 3.94Å; Y92-D96 HydrophobicContact CE2-CB 3.89Å; Y92-D96 HydrophobicContact CG-CB 4.44Å; Y92-Q97 HydrophobicContact CE1-CB 3.86Å; Y92-Q97 HydrophobicContact CE1-CG 4.28Å; Y92-D100 WeakPolarHBondContact CE2-OD2 3.48Å; Y92-D100 PolarHBondContact OH-OD2 3.21Å
93	E	82.4	Confident	81	Confident	123 Å²	123	104.1 Å²	104.1	58%	0.575	58%	0.577	S	S	*	*			trans	-89	176.6	-177.8	-67.4	-169.3	-164.8	0	0	111.9	P91 D95 D96 Q97	P91-E93 PolarHBondContact O-N 2.98Å; E93-D95 VanDerWaalsContact C-N 3.35Å; E93-D95 WeakPolarHBondContact CB-OD1 3.23Å; E93-D96 PolarHBondContact N-OD2 2.85Å; E93-D96 PolarHBondContact O-N 2.95Å; E93-Q97 PolarHBondContact O-N 3.04Å
94	K	83.7	Confident	81.6	Confident	155 Å²	155	104.5 Å²	104.5	67%	0.674	58%	0.577	S	S	*	*	H	α-helix	trans	-73.3	-31.2	-173.4	-169.9	176.6	178.1	-178.6	0	112.3	E98	K94-E98 PolarHBondContact O-N 3.3Å
95	D	88.1	Confident	82.4	Confident	95 Å²	95	104.2 Å²	104.2	51%	0.508	56%	0.563	S	S	.	*	H	α-helix	trans	-70.7	-37.4	173.1	53.5	-20.8	0	0	0	112.2	E93 Q97 E98 A99	E93-D95 VanDerWaalsContact C-N 3.35Å; E93-D95 WeakPolarHBondContact CB-OD1 3.23Å; D95-Q97 VanDerWaalsContact C-N 3.27Å; D95-Q97 PolarHBondContact O-N 3.18Å; D95-E98 PolarHBondContact O-N 3.32Å; D95-A99 WeakPolarHBondContact O-CB 3.47Å; D95-A99 PolarHBondContact O-N 3.44Å
96	D	87.8	Confident	83.1	Confident	62 Å²	62	104 Å²	104	33%	0.332	55%	0.554	S	S	.	*	H	α-helix	trans	-57.5	-43.7	170.8	-61.6	-49.4	0	0	0	110.9	Y92 E93 E98 A99 D100	Y92-D96 HydrophobicContact CD2-CB 3.94Å; Y92-D96 HydrophobicContact CE2-CB 3.89Å; Y92-D96 HydrophobicContact CG-CB 4.44Å; E93-D96 PolarHBondContact N-OD2 2.85Å; E93-D96 PolarHBondContact O-N 2.95Å; D96-E98 PolarHBondContact O-N 2.88Å; D96-A99 PolarHBondContact O-N 3.49Å; D96-D100 WeakPolarHBondContact O-CB 3.27Å; D96-D100 PolarHBondContact O-N 3Å
97	Q	83.6	Confident	83.7	Confident	121 Å²	121	101.4 Å²	101.4	57%	0.565	54%	0.542	S	S	*	.	H	α-helix	trans	-63.6	-38.9	176.7	-169.4	178.5	19.2	0	0	113.2	Y92 E93 D95 A101	Y92-Q97 HydrophobicContact CE1-CB 3.86Å; Y92-Q97 HydrophobicContact CE1-CG 4.28Å; E93-Q97 PolarHBondContact O-N 3.04Å; D95-Q97 VanDerWaalsContact C-N 3.27Å; D95-Q97 PolarHBondContact O-N 3.18Å; Q97-A101 WeakPolarHBondContact O-CB 3.22Å; Q97-A101 PolarHBondContact O-N 3.01Å
98	E	88.8	Confident	84.2	Confident	124 Å²	124	100.9 Å²	100.9	58%	0.579	53%	0.533	S	S	*	.	H	α-helix	trans	-70.5	-38.6	176.5	-73.7	179.3	-171.4	0	0	111.6	K94 D95 D96 A101 I102	K94-E98 PolarHBondContact O-N 3.3Å; D95-E98 PolarHBondContact O-N 3.32Å; D96-E98 PolarHBondContact O-N 2.88Å; E98-A101 PolarHBondContact O-N 3.12Å; E98-I102 WeakPolarHBondContact O-CG1 3.48Å; E98-I102 PolarHBondContact O-N 3.25Å
99	A	88.1	Confident	85	Confident	37 Å²	37	106 Å²	106	31%	0.306	54%	0.535	S	S	.	.	H	α-helix	trans	-64.2	-49	176.1	0	0	0	0	0	111.5	D95 D96 A101 I102 Y103	D95-A99 WeakPolarHBondContact O-CB 3.47Å; D95-A99 PolarHBondContact O-N 3.44Å; D96-A99 PolarHBondContact O-N 3.49Å; A99-A101 VanDerWaalsContact C-N 3.26Å; A99-A101 PolarHBondContact O-N 3.12Å; A99-I102 WeakPolarHBondContact O-CB 3.3Å; A99-I102 PolarHBondContact O-N 3.48Å; A99-Y103 HydrophobicContact CB-CD2 4.47Å; A99-Y103 HydrophobicContact CB-CE2 4.34Å; A99-Y103 WeakPolarHBondContact O-CD2 3.48Å; A99-Y103 PolarHBondContact O-N 3.27Å
100	D	87.8	Confident	85.7	Confident	83 Å²	83	102.7 Å²	102.7	44%	0.444	52%	0.523	S	S	.	.	H	α-helix	trans	-59.5	-37.2	177	-79.1	-14.2	0	0	0	111.9	Y92 D96 I102 Y103 A104	Y92-D100 WeakPolarHBondContact CE2-OD2 3.48Å; Y92-D100 PolarHBondContact OH-OD2 3.21Å; D96-D100 WeakPolarHBondContact O-CB 3.27Å; D96-D100 PolarHBondContact O-N 3Å; D100-I102 VanDerWaalsContact C-N 3.33Å; D100-I102 PolarHBondContact O-N 3.47Å; D100-Y103 PolarHBondContact O-N 3.11Å; D100-A104 VanDerWaalsContact O-CB 3.22Å; D100-A104 WeakPolarHBondContact O-CB 3.44Å; D100-A104 PolarHBondContact O-N 2.89Å
101	A	88.1	Confident	86.1	Confident	62 Å²	62	100.7 Å²	100.7	51%	0.512	51%	0.512	S	S	.	.	H	α-helix	trans	-63.9	-37.3	175.1	0	0	0	0	0	112.5	Q97 E98 A99 S105	Q97-A101 WeakPolarHBondContact O-CB 3.22Å; Q97-A101 PolarHBondContact O-N 3.01Å; E98-A101 PolarHBondContact O-N 3.12Å; A99-A101 VanDerWaalsContact C-N 3.26Å; A99-A101 PolarHBondContact O-N 3.12Å; A101-S105 WeakPolarHBondContact O-CB 3.21Å; A101-S105 PolarHBondContact O-N 2.96Å; A101-S105 VanDerWaalsContact O-N 3.14Å
102	I	92	Very high	86.6	Confident	103 Å²	103	101.5 Å²	101.5	53%	0.528	51%	0.507	S	S	.	.	H	α-helix	trans	-69.7	-48.2	175.4	-67	167.7	0	0	0	110.4	E98 A99 D100 A104 S105 I106	E98-I102 WeakPolarHBondContact O-CG1 3.48Å; E98-I102 PolarHBondContact O-N 3.25Å; A99-I102 WeakPolarHBondContact O-CB 3.3Å; A99-I102 PolarHBondContact O-N 3.48Å; D100-I102 VanDerWaalsContact C-N 3.33Å; D100-I102 PolarHBondContact O-N 3.47Å; I102-A104 PolarHBondContact O-N 3.43Å; I102-S105 WeakPolarHBondContact O-CB 3.45Å; I102-S105 PolarHBondContact O-N 2.94Å; I102-S105 VanDerWaalsContact O-N 3.12Å; I102-S105 PolarHBondContact O-OG 3Å; I102-I106 HydrophobicContact CG2-CD1 4.2Å; I102-I106 WeakPolarHBondContact O-CG1 3.5Å; I102-I106 PolarHBondContact O-N 2.89Å; I102-I106 VanDerWaalsContact O-N 3.08Å
103	Y	90.3	Very high	86.5	Confident	151 Å²	151	103.9 Å²	103.9	59%	0.592	52%	0.515	S	S	*	.	H	α-helix	trans	-61.9	-43.2	179.4	-73.4	-64.4	0	0	0	112	A99 D100 S105 I106 D107	A99-Y103 HydrophobicContact CB-CD2 4.47Å; A99-Y103 HydrophobicContact CB-CE2 4.34Å; A99-Y103 WeakPolarHBondContact O-CD2 3.48Å; A99-Y103 PolarHBondContact O-N 3.27Å; D100-Y103 PolarHBondContact O-N 3.11Å; Y103-S105 VanDerWaalsContact C-N 3.27Å; Y103-S105 PolarHBondContact O-N 2.85Å; Y103-I106 WeakPolarHBondContact O-CB 3.45Å; Y103-I106 PolarHBondContact O-N 3.25Å; Y103-D107 PolarHBondContact O-N 2.9Å
104	A	89.1	Confident	86.4	Confident	48 Å²	48	106.9 Å²	106.9	40%	0.397	52%	0.521	S	S	.	.	H	α-helix	trans	-58.6	-39.1	173.3	0	0	0	0	0	112.1	D100 I102 I106 D107 D108	D100-A104 VanDerWaalsContact O-CB 3.22Å; D100-A104 WeakPolarHBondContact O-CB 3.44Å; D100-A104 PolarHBondContact O-N 2.89Å; I102-A104 PolarHBondContact O-N 3.43Å; A104-I106 VanDerWaalsContact C-N 3.3Å; A104-I106 PolarHBondContact O-N 3.33Å; A104-D107 PolarHBondContact O-N 2.79Å; A104-D108 WeakPolarHBondContact O-CB 3.26Å; A104-D108 PolarHBondContact O-N 3.4Å
105	S	88.1	Confident	86.4	Confident	67 Å²	67	103.5 Å²	103.5	47%	0.469	50%	0.504	S	S	.	.	H	α-helix	trans	-66.2	-31.7	176.5	81.9	0	0	0	0	113.3	A101 I102 Y103 R109	A101-S105 WeakPolarHBondContact O-CB 3.21Å; A101-S105 PolarHBondContact O-N 2.96Å; A101-S105 VanDerWaalsContact O-N 3.14Å; I102-S105 WeakPolarHBondContact O-CB 3.45Å; I102-S105 PolarHBondContact O-N 2.94Å; I102-S105 VanDerWaalsContact O-N 3.12Å; I102-S105 PolarHBondContact O-OG 3Å; Y103-S105 VanDerWaalsContact C-N 3.27Å; Y103-S105 PolarHBondContact O-N 2.85Å; S105-R109 WeakPolarHBondContact O-CB 3.48Å; S105-R109 PolarHBondContact O-N 2.96Å
106	I	89.6	Confident	86.2	Confident	84 Å²	84	107.2 Å²	107.2	43%	0.431	52%	0.518	S	S	.	.	H	α-helix	trans	-71.2	-45.7	175.1	-66.9	168.7	0	0	0	109.4	I102 Y103 A104 R109 M110	I102-I106 HydrophobicContact CG2-CD1 4.2Å; I102-I106 WeakPolarHBondContact O-CG1 3.5Å; I102-I106 PolarHBondContact O-N 2.89Å; I102-I106 VanDerWaalsContact O-N 3.08Å; Y103-I106 WeakPolarHBondContact O-CB 3.45Å; Y103-I106 PolarHBondContact O-N 3.25Å; A104-I106 VanDerWaalsContact C-N 3.3Å; A104-I106 PolarHBondContact O-N 3.33Å; I106-R109 WeakPolarHBondContact O-CB 3.45Å; I106-R109 PolarHBondContact O-N 3.46Å; I106-M110 HydrophobicContact CG2-CG 4.48Å; I106-M110 VanDerWaalsContact O-CG 3.28Å; I106-M110 WeakPolarHBondContact O-CG 3.42Å; I106-M110 PolarHBondContact O-N 3.29Å
107	D	86.4	Confident	86	Confident	108 Å²	108	111.9 Å²	111.9	58%	0.578	53%	0.532	S	S	*	.	H	α-helix	trans	-64.3	-43.9	179.2	-73	-14.9	0	0	0	112	Y103 A104 R109 M110 D111	Y103-D107 PolarHBondContact O-N 2.9Å; A104-D107 PolarHBondContact O-N 2.79Å; D107-R109 VanDerWaalsContact C-N 3.29Å; D107-R109 PolarHBondContact O-N 3.35Å; D107-M110 PolarHBondContact O-N 2.91Å; D107-M110 VanDerWaalsContact O-N 3.12Å; D107-D111 PolarHBondContact O-N 3.26Å
108	D	86.9	Confident	86.1	Confident	76 Å²	76	111.5 Å²	111.5	41%	0.406	53%	0.526	S	S	.	.	H	α-helix	trans	-58.2	-41.4	174	-91.8	-40.8	0	0	0	111.9	A104 D111 E112 R115	A104-D108 WeakPolarHBondContact O-CB 3.26Å; A104-D108 PolarHBondContact O-N 3.4Å; D108-D111 PolarHBondContact O-N 3.18Å; D108-E112 PolarHBondContact O-N 2.92Å; D108-R115 IonicContact OD1-CZ 2.84Å; D108-R115 IonicContact OD1-NH1 2.72Å; D108-R115 IonicContact OD1-NH2 3.05Å; D108-R115 PolarHBondContact OD1-NH2 2.89Å
109	R	87.1	Confident	86	Confident	190 Å²	190	109.5 Å²	109.5	72%	0.717	52%	0.516	S	S	*	.	H	α-helix	trans	-68.7	-34.7	176.8	-176	177.1	-176.4	140	2.8	112.5	S105 I106 D107 D111	S105-R109 WeakPolarHBondContact O-CB 3.48Å; S105-R109 PolarHBondContact O-N 2.96Å; I106-R109 WeakPolarHBondContact O-CB 3.45Å; I106-R109 PolarHBondContact O-N 3.46Å; D107-R109 VanDerWaalsContact C-N 3.29Å; D107-R109 PolarHBondContact O-N 3.35Å; R109-D111 VanDerWaalsContact C-N 3.3Å
110	M	83.2	Confident	86	Confident	102 Å²	102	114 Å²	114	50%	0.502	53%	0.529	S	S	.	.	H	α-helix	trans	-68	-35.1	174.6	-70.3	-61.5	-76.9	0	0	111	I106 D107	I106-M110 HydrophobicContact CG2-CG 4.48Å; I106-M110 VanDerWaalsContact O-CG 3.28Å; I106-M110 WeakPolarHBondContact O-CG 3.42Å; I106-M110 PolarHBondContact O-N 3.29Å; D107-M110 PolarHBondContact O-N 2.91Å; D107-M110 VanDerWaalsContact O-N 3.12Å
111	D	83.9	Confident	86	Confident	72 Å²	72	116.8 Å²	116.8	39%	0.385	53%	0.533	S	S	.	.	H	α-helix	trans	-76.2	-26.8	179.8	-99.8	-4.3	0	0	0	114.8	D107 D108 R109 R113 R114 R115 R118	D107-D111 PolarHBondContact O-N 3.26Å; D108-D111 PolarHBondContact O-N 3.18Å; R109-D111 VanDerWaalsContact C-N 3.3Å; D111-R113 PolarHBondContact O-N 2.81Å; D111-R113 VanDerWaalsContact O-N 3.1Å; D111-R114 PolarHBondContact O-N 3.13Å; D111-R115 WeakPolarHBondContact O-CB 3.43Å; D111-R115 PolarHBondContact O-N 2.83Å; D111-R115 VanDerWaalsContact O-N 3.14Å; D111-R118 VanDerWaalsContact CG-NH1 3.29Å; D111-R118 PolarHBondContact O-NH2 2.8Å; D111-R118 IonicContact OD1-CZ 2.93Å; D111-R118 IonicContact OD1-NH1 3.49Å; D111-R118 PolarHBondContact OD1-NH1 3.44Å; D111-R118 IonicContact OD1-NH2 2.69Å; D111-R118 PolarHBondContact OD1-NH2 2.95Å; D111-R118 IonicContact OD2-NH1 3.57Å; D111-R118 PolarHBondContact OD2-NH1 3.02Å
112	E	82.9	Confident	85.8	Confident	122 Å²	122	120.2 Å²	120.2	57%	0.57	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-52.1	-32.4	178	-90.3	174.1	160	0	0	114.2	D108 R114 R115	D108-E112 PolarHBondContact O-N 2.92Å; E112-R114 PolarHBondContact O-N 2.87Å; E112-R115 PolarHBondContact O-N 2.78Å
113	R	79.3	Confident	85.6	Confident	197 Å²	197	122.9 Å²	122.9	74%	0.743	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-55.9	-28.4	-175.9	-63.2	-177.4	-173.5	176	4.3	114.7	D111	D111-R113 PolarHBondContact O-N 2.81Å; D111-R113 VanDerWaalsContact O-N 3.1Å
114	R	79.9	Confident	85.5	Confident	185 Å²	185	120.8 Å²	120.8	70%	0.698	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-136.5	14	178.3	-74.5	-174.6	177.8	-178.8	-0.2	112.2	D111 E112 E116 Y117 R118	D111-R114 PolarHBondContact O-N 3.13Å; E112-R114 PolarHBondContact O-N 2.87Å; R114-E116 PolarHBondContact O-N 3.18Å; R114-Y117 PolarHBondContact O-N 2.91Å; R114-R118 WeakPolarHBondContact O-CB 3.29Å; R114-R118 PolarHBondContact O-N 3.36Å
115	R	83.9	Confident	85.4	Confident	84 Å²	84	123.9 Å²	123.9	32%	0.317	54%	0.542	S	S	.	.	H	α-helix	trans	-53.8	-55.1	-172.6	-168.1	176.4	-146.8	155	17.9	111.2	D108 D111 E112 Y117 R118 E119	D108-R115 IonicContact OD1-CZ 2.84Å; D108-R115 IonicContact OD1-NH1 2.72Å; D108-R115 IonicContact OD1-NH2 3.05Å; D108-R115 PolarHBondContact OD1-NH2 2.89Å; D111-R115 WeakPolarHBondContact O-CB 3.43Å; D111-R115 PolarHBondContact O-N 2.83Å; D111-R115 VanDerWaalsContact O-N 3.14Å; E112-R115 PolarHBondContact O-N 2.78Å; R115-Y117 PolarHBondContact O-N 2.79Å; R115-R118 PolarHBondContact O-N 3.37Å; R115-E119 HydrophobicContact CG-CG 4.2Å; R115-E119 WeakPolarHBondContact CG-OE1 3.33Å; R115-E119 IonicContact NE-OE1 3.34Å; R115-E119 PolarHBondContact NE-OE1 3.38Å; R115-E119 WeakPolarHBondContact O-CB 3.08Å; R115-E119 VanDerWaalsContact O-CG 3.26Å; R115-E119 WeakPolarHBondContact O-CG 3.42Å; R115-E119 PolarHBondContact O-N 2.89Å
116	E	83.8	Confident	85.2	Confident	173 Å²	173	123.1 Å²	123.1	81%	0.808	53%	0.532	S	S	*	.	H	α-helix	trans	-57.7	-47.1	179.7	-75.7	-169.4	150.1	0	0	113.3	R114 K120	R114-E116 PolarHBondContact O-N 3.18Å; E116-K120 WeakPolarHBondContact O-CB 3.35Å; E116-K120 PolarHBondContact O-N 3.27Å
117	Y	83.5	Confident	85.1	Confident	160 Å²	160	123.7 Å²	123.7	63%	0.627	53%	0.533	S	S	*	.	H	α-helix	trans	-69.6	-44.5	-178.7	179	-97.4	0	0	0	112.4	R114 R115 K120 R121	R114-Y117 PolarHBondContact O-N 2.91Å; R115-Y117 PolarHBondContact O-N 2.79Å; Y117-K120 PolarHBondContact O-N 3.24Å; Y117-R121 WeakPolarHBondContact O-CB 3.44Å; Y117-R121 PolarHBondContact O-N 2.77Å
118	R	86.2	Confident	85.2	Confident	113 Å²	113	124.8 Å²	124.8	43%	0.426	53%	0.533	S	S	.	.	H	α-helix	trans	-65.9	-48.1	-178.8	-165.6	-161.9	-39	176.8	6.2	110.3	D111 R114 R115 R121 F122	D111-R118 VanDerWaalsContact CG-NH1 3.29Å; D111-R118 PolarHBondContact O-NH2 2.8Å; D111-R118 IonicContact OD1-CZ 2.93Å; D111-R118 IonicContact OD1-NH1 3.49Å; D111-R118 PolarHBondContact OD1-NH1 3.44Å; D111-R118 IonicContact OD1-NH2 2.69Å; D111-R118 PolarHBondContact OD1-NH2 2.95Å; D111-R118 IonicContact OD2-NH1 3.57Å; D111-R118 PolarHBondContact OD2-NH1 3.02Å; R114-R118 WeakPolarHBondContact O-CB 3.29Å; R114-R118 PolarHBondContact O-N 3.36Å; R115-R118 PolarHBondContact O-N 3.37Å; R118-R121 PolarHBondContact O-N 3.37Å; R118-F122 WeakPolarHBondContact O-CB 3.36Å; R118-F122 PolarHBondContact O-N 3.03Å
119	E	86.8	Confident	85	Confident	83 Å²	83	127.9 Å²	127.9	39%	0.388	54%	0.54	S	S	.	.	H	α-helix	trans	-65.3	-39.9	176.7	-70.8	-177.3	-173.6	0	0	111.4	R115 R123	R115-E119 HydrophobicContact CG-CG 4.2Å; R115-E119 WeakPolarHBondContact CG-OE1 3.33Å; R115-E119 IonicContact NE-OE1 3.34Å; R115-E119 PolarHBondContact NE-OE1 3.38Å; R115-E119 WeakPolarHBondContact O-CB 3.08Å; R115-E119 VanDerWaalsContact O-CG 3.26Å; R115-E119 WeakPolarHBondContact O-CG 3.42Å; R115-E119 PolarHBondContact O-N 2.89Å; E119-R123 WeakPolarHBondContact O-CA 3.44Å; E119-R123 WeakPolarHBondContact O-CB 3.47Å; E119-R123 PolarHBondContact O-N 3.22Å
120	K	87.1	Confident	84.9	Confident	132 Å²	132	125.4 Å²	125.4	57%	0.574	53%	0.53	S	S	*	.	H	α-helix	trans	-64.7	-47.3	176.4	-172.9	176.3	-179.6	-179.1	0	111.7	E116 Y117 R123 E124	E116-K120 WeakPolarHBondContact O-CB 3.35Å; E116-K120 PolarHBondContact O-N 3.27Å; Y117-K120 PolarHBondContact O-N 3.24Å; K120-R123 PolarHBondContact O-N 3.04Å; K120-E124 WeakPolarHBondContact CE-OE1 3.46Å; K120-E124 WeakPolarHBondContact O-CB 3.38Å; K120-E124 WeakPolarHBondContact O-CG 3.45Å; K120-E124 PolarHBondContact O-N 2.95Å
121	R	87	Confident	84.9	Confident	141 Å²	141	128.7 Å²	128.7	53%	0.532	54%	0.537	S	S	.	.	H	α-helix	trans	-64.5	-46.3	177.8	-168.9	-168.7	176.9	-168.2	-1	111.5	Y117 R118 R123 E124 E125	Y117-R121 WeakPolarHBondContact O-CB 3.44Å; Y117-R121 PolarHBondContact O-N 2.77Å; R118-R121 PolarHBondContact O-N 3.37Å; R121-R123 VanDerWaalsContact C-N 3.29Å; R121-R123 PolarHBondContact O-N 3.04Å; R121-E124 PolarHBondContact O-N 3.44Å; R121-E125 VanDerWaalsContact O-CB 3.25Å; R121-E125 WeakPolarHBondContact O-CB 3.39Å; R121-E125 PolarHBondContact O-N 2.81Å
122	F	84.7	Confident	84.9	Confident	134 Å²	134	132.2 Å²	132.2	59%	0.588	55%	0.551	S	S	*	*	H	α-helix	trans	-62.2	-38.8	177.3	-175.6	-110.3	0	0	0	111.4	R118 I126	R118-F122 WeakPolarHBondContact O-CB 3.36Å; R118-F122 PolarHBondContact O-N 3.03Å; F122-I126 HydrophobicContact CD1-CD1 3.67Å; F122-I126 HydrophobicContact CD2-CD1 4.16Å; F122-I126 HydrophobicContact CD2-CG1 4.48Å; F122-I126 HydrophobicContact CE1-CD1 3.21Å; F122-I126 HydrophobicContact CE1-CG1 4.4Å; F122-I126 HydrophobicContact CE2-CD1 3.74Å; F122-I126 HydrophobicContact CE2-CG1 4.32Å; F122-I126 HydrophobicContact CG-CD1 4.15Å; F122-I126 HydrophobicContact CZ-CD1 3.27Å; F122-I126 HydrophobicContact CZ-CG1 4.31Å; F122-I126 VanDerWaalsContact O-CB 3.27Å; F122-I126 WeakPolarHBondContact O-CB 3.37Å; F122-I126 VanDerWaalsContact O-CG1 3.31Å; F122-I126 WeakPolarHBondContact O-CG1 3.25Å; F122-I126 PolarHBondContact O-N 3.21Å
123	R	87.3	Confident	85	Confident	158 Å²	158	135 Å²	135	60%	0.596	56%	0.557	S	S	*	*	H	α-helix	trans	-63.9	-48.7	173.3	-171.7	-178.6	-54.9	172.5	5.2	111.2	E119 K120 R121 E125 E127	E119-R123 WeakPolarHBondContact O-CA 3.44Å; E119-R123 WeakPolarHBondContact O-CB 3.47Å; E119-R123 PolarHBondContact O-N 3.22Å; K120-R123 PolarHBondContact O-N 3.04Å; R121-R123 VanDerWaalsContact C-N 3.29Å; R121-R123 PolarHBondContact O-N 3.04Å; R123-E125 VanDerWaalsContact C-N 3.34Å; R123-E125 PolarHBondContact O-N 3.03Å; R123-E127 WeakPolarHBondContact O-CB 3.48Å; R123-E127 PolarHBondContact O-N 3.47Å
124	E	88.7	Confident	85.2	Confident	107 Å²	107	127.9 Å²	127.9	50%	0.5	54%	0.536	S	S	.	.	H	α-helix	trans	-62.6	-39	177.2	-75.9	175.4	-171.2	0	0	112.2	K120 R121 E127 K128	K120-E124 WeakPolarHBondContact CE-OE1 3.46Å; K120-E124 WeakPolarHBondContact O-CB 3.38Å; K120-E124 WeakPolarHBondContact O-CG 3.45Å; K120-E124 PolarHBondContact O-N 2.95Å; R121-E124 PolarHBondContact O-N 3.44Å; E124-E127 PolarHBondContact O-N 3.21Å; E124-K128 WeakPolarHBondContact O-CB 3.45Å; E124-K128 PolarHBondContact O-N 2.84Å
125	E	86.3	Confident	85.3	Confident	114 Å²	114	125.2 Å²	125.2	53%	0.533	53%	0.529	S	S	.	.	H	α-helix	trans	-74.3	-41.8	-179.2	-166.8	159.8	-146.3	0	0	111.8	R121 R123 E127 K128 Y129	R121-E125 VanDerWaalsContact O-CB 3.25Å; R121-E125 WeakPolarHBondContact O-CB 3.39Å; R121-E125 PolarHBondContact O-N 2.81Å; R123-E125 VanDerWaalsContact C-N 3.34Å; R123-E125 PolarHBondContact O-N 3.03Å; E125-E127 VanDerWaalsContact C-N 3.34Å; E125-K128 PolarHBondContact O-N 2.87Å; E125-Y129 WeakPolarHBondContact O-CB 3.36Å; E125-Y129 PolarHBondContact O-N 2.84Å
126	I	85.9	Confident	85.1	Confident	50 Å²	50	127.2 Å²	127.2	26%	0.256	55%	0.545	S	S	.	.	H	α-helix	trans	-64.8	-40.5	170.5	-74.8	-179.6	0	0	0	110.9	F122 Y129 R130	F122-I126 HydrophobicContact CD1-CD1 3.67Å; F122-I126 HydrophobicContact CD2-CD1 4.16Å; F122-I126 HydrophobicContact CD2-CG1 4.48Å; F122-I126 HydrophobicContact CE1-CD1 3.21Å; F122-I126 HydrophobicContact CE1-CG1 4.4Å; F122-I126 HydrophobicContact CE2-CD1 3.74Å; F122-I126 HydrophobicContact CE2-CG1 4.32Å; F122-I126 HydrophobicContact CG-CD1 4.15Å; F122-I126 HydrophobicContact CZ-CD1 3.27Å; F122-I126 HydrophobicContact CZ-CG1 4.31Å; F122-I126 VanDerWaalsContact O-CB 3.27Å; F122-I126 WeakPolarHBondContact O-CB 3.37Å; F122-I126 VanDerWaalsContact O-CG1 3.31Å; F122-I126 WeakPolarHBondContact O-CG1 3.25Å; F122-I126 PolarHBondContact O-N 3.21Å; I126-Y129 PolarHBondContact O-N 3.34Å; I126-R130 HydrophobicContact CG2-CG 4.15Å; I126-R130 VanDerWaalsContact O-CB 3.25Å; I126-R130 WeakPolarHBondContact O-CB 3.13Å; I126-R130 VanDerWaalsContact O-CG 3.24Å; I126-R130 WeakPolarHBondContact O-CG 3.48Å; I126-R130 PolarHBondContact O-N 2.77Å
127	E	86.4	Confident	85.1	Confident	97 Å²	97	125.4 Å²	125.4	45%	0.453	54%	0.537	S	S	.	.	H	α-helix	trans	-65.5	-43.2	178.5	-165.9	-171	158.9	0	0	110.5	R123 E124 E125 R130 R131	R123-E127 WeakPolarHBondContact O-CB 3.48Å; R123-E127 PolarHBondContact O-N 3.47Å; E124-E127 PolarHBondContact O-N 3.21Å; E125-E127 VanDerWaalsContact C-N 3.34Å; E127-R130 PolarHBondContact O-N 3.22Å; E127-R131 WeakPolarHBondContact O-CB 3.16Å; E127-R131 PolarHBondContact O-N 3.19Å; E127-R131 IonicContact OE1-CZ 3.4Å; E127-R131 IonicContact OE1-NE 2.89Å; E127-R131 IonicContact OE1-NH2 2.67Å; E127-R131 PolarHBondContact OE1-NH2 2.69Å; E127-R131 IonicContact OE2-NH2 3.88Å
128	K	88.1	Confident	85.1	Confident	130 Å²	130	120.3 Å²	120.3	57%	0.565	52%	0.518	S	S	*	.	H	α-helix	trans	-65.2	-42.3	174.4	-165.1	177.5	-178.5	-174.6	0	111.7	E124 E125 R131 E132	E124-K128 WeakPolarHBondContact O-CB 3.45Å; E124-K128 PolarHBondContact O-N 2.84Å; E125-K128 PolarHBondContact O-N 2.87Å; K128-R131 WeakPolarHBondContact O-CB 3.4Å; K128-R131 PolarHBondContact O-N 2.88Å; K128-E132 PolarHBondContact O-N 3.06Å
129	Y	84.3	Confident	84.9	Confident	141 Å²	141	119.9 Å²	119.9	55%	0.553	52%	0.521	S	S	*	.	H	α-helix	trans	-65.9	-41.8	177	-177.4	-98.8	0	0	0	112.1	E125 I126 R131 E132 R133	E125-Y129 WeakPolarHBondContact O-CB 3.36Å; E125-Y129 PolarHBondContact O-N 2.84Å; I126-Y129 PolarHBondContact O-N 3.34Å; Y129-R131 VanDerWaalsContact C-N 3.29Å; Y129-R131 PolarHBondContact O-N 3.49Å; Y129-E132 PolarHBondContact O-N 2.85Å; Y129-R133 CarbonylContact O-C 3.46Å; Y129-R133 WeakPolarHBondContact O-CA 3.3Å; Y129-R133 PolarHBondContact O-N 3.12Å
130	R	85	Confident	84.7	Confident	138 Å²	138	121 Å²	121	52%	0.521	53%	0.525	S	S	.	.	H	α-helix	trans	-68.7	-28.4	174.4	-73.1	178.9	-176.7	-177.5	4.6	112	I126 E127 P134	I126-R130 HydrophobicContact CG2-CG 4.15Å; I126-R130 VanDerWaalsContact O-CB 3.25Å; I126-R130 WeakPolarHBondContact O-CB 3.13Å; I126-R130 VanDerWaalsContact O-CG 3.24Å; I126-R130 WeakPolarHBondContact O-CG 3.48Å; I126-R130 PolarHBondContact O-N 2.77Å; E127-R130 PolarHBondContact O-N 3.22Å; R130-P134 WeakPolarHBondContact O-CB 3.38Å; R130-P134 WeakPolarHBondContact O-CD 3.38Å
131	R	83	Confident	84.7	Confident	172 Å²	172	120.4 Å²	120.4	65%	0.649	53%	0.526	S	S	*	.	H	α-helix	trans	-70.8	-42.5	170.5	-104.8	-174.9	-92.4	142.6	-9	112.6	E127 K128 Y129	E127-R131 WeakPolarHBondContact O-CB 3.16Å; E127-R131 PolarHBondContact O-N 3.19Å; E127-R131 IonicContact OE1-CZ 3.4Å; E127-R131 IonicContact OE1-NE 2.89Å; E127-R131 IonicContact OE1-NH2 2.67Å; E127-R131 PolarHBondContact OE1-NH2 2.69Å; E127-R131 IonicContact OE2-NH2 3.88Å; K128-R131 WeakPolarHBondContact O-CB 3.4Å; K128-R131 PolarHBondContact O-N 2.88Å; Y129-R131 VanDerWaalsContact C-N 3.29Å; Y129-R131 PolarHBondContact O-N 3.49Å
132	E	83.8	Confident	84.6	Confident	146 Å²	146	118.4 Å²	118.4	68%	0.682	53%	0.526	S	S	*	.	H	α-helix	trans	-78.1	-40.5	179.6	-83.1	-171.4	168.9	0	0	113.5	K128 Y129	K128-E132 PolarHBondContact O-N 3.06Å; Y129-E132 PolarHBondContact O-N 2.85Å
133	R	85.1	Confident	84.6	Confident	181 Å²	181	116.5 Å²	116.5	68%	0.683	52%	0.521	S	S	*	.	S	Bend	trans	-141.4	74.7	-175.1	-64.8	-168	177.9	-160.5	0.2	111.2	Y129	Y129-R133 CarbonylContact O-C 3.46Å; Y129-R133 WeakPolarHBondContact O-CA 3.3Å; Y129-R133 PolarHBondContact O-N 3.12Å
134	P	82.6	Confident	84.6	Confident	46 Å²	46	116.6 Å²	116.6	30%	0.299	53%	0.526	S	S	.	.			trans	-60.9	142.6	173.5	11.5	-11.5	0	0	0	110.5	R130 Q138 Q139	R130-P134 WeakPolarHBondContact O-CB 3.38Å; R130-P134 WeakPolarHBondContact O-CD 3.38Å; P134-Q138 HydrophobicContact CB-CB 4.27Å; P134-Q139 HydrophobicContact CB-CG 3.99Å; P134-Q139 HydrophobicContact CG-CG 3.97Å; P134-Q139 PolarHBondContact O-NE2 2.9Å
135	K	82	Confident	84.6	Confident	130 Å²	130	121.5 Å²	121.5	57%	0.565	54%	0.54	S	S	*	.			trans	-59.6	150.5	175.9	-71.9	-172.5	177.1	-174.8	0	109.7	Q137 Q138 Q139	K135-Q137 VanDerWaalsContact C-N 3.28Å; K135-Q137 HydrophobicContact CB-CG 4.05Å; K135-Q137 PolarHBondContact O-N 2.7Å; K135-Q138 HydrophobicContact CB-CB 4.46Å; K135-Q138 HydrophobicContact CB-CG 4.22Å; K135-Q138 WeakPolarHBondContact O-CA 3.36Å; K135-Q138 WeakPolarHBondContact O-CB 3.4Å; K135-Q138 PolarHBondContact O-N 3.16Å; K135-Q139 PolarHBondContact O-N 2.75Å
136	I	80.3	Confident	84.5	Confident	126 Å²	126	121.2 Å²	121.2	65%	0.646	54%	0.542	S	S	*	.	H	α-helix	trans	-48.7	-50.7	179.3	-62.2	171	0	0	0	110.7	Q138 Q139 F140	I136-Q138 VanDerWaalsContact C-N 3.27Å; I136-Q138 PolarHBondContact O-N 3.14Å; I136-Q139 WeakPolarHBondContact O-CB 3.45Å; I136-Q139 PolarHBondContact O-N 3.36Å; I136-F140 HydrophobicContact CG2-CD2 3.85Å; I136-F140 HydrophobicContact CG2-CE2 3.79Å; I136-F140 WeakPolarHBondContact O-CD2 3.47Å; I136-F140 PolarHBondContact O-N 3.21Å
137	Q	83.2	Confident	84.4	Confident	135 Å²	135	122.9 Å²	122.9	63%	0.631	55%	0.551	S	S	*	*	H	α-helix	trans	-58.6	-29.8	175.5	54.3	175	-29.4	0	0	115.2	K135 F140 M141	K135-Q137 VanDerWaalsContact C-N 3.28Å; K135-Q137 HydrophobicContact CB-CG 4.05Å; K135-Q137 PolarHBondContact O-N 2.7Å; Q137-F140 CarbonylContact O-C 3.19Å; Q137-M141 WeakPolarHBondContact O-CG 3.16Å; Q137-M141 PolarHBondContact O-N 3.4Å; Q137-M141 VanDerWaalsContact O-N 3.12Å
138	Q	83.5	Confident	84.5	Confident	53 Å²	53	122.4 Å²	122.4	25%	0.248	56%	0.564	C	S	.	*	H	α-helix	trans	-77.8	-31.8	175.7	-69.2	173.8	-21	0	0	112	P134 K135 I136 F140 M141	P134-Q138 HydrophobicContact CB-CB 4.27Å; K135-Q138 HydrophobicContact CB-CB 4.46Å; K135-Q138 HydrophobicContact CB-CG 4.22Å; K135-Q138 WeakPolarHBondContact O-CA 3.36Å; K135-Q138 WeakPolarHBondContact O-CB 3.4Å; K135-Q138 PolarHBondContact O-N 3.16Å; I136-Q138 VanDerWaalsContact C-N 3.27Å; I136-Q138 PolarHBondContact O-N 3.14Å; Q138-F140 PolarHBondContact O-N 3.24Å; Q138-M141 HydrophobicContact CB-CE 4.23Å; Q138-M141 HydrophobicContact CG-CE 4.16Å; Q138-M141 PolarHBondContact O-N 2.96Å
139	Q	81.5	Confident	84.4	Confident	103 Å²	103	121.1 Å²	121.1	48%	0.481	57%	0.571	S	S	.	*	H	α-helix	trans	-66.5	-24.1	172.2	-60.6	172.4	7.8	0	0	112.2	P134 K135 I136	P134-Q139 HydrophobicContact CB-CG 3.99Å; P134-Q139 HydrophobicContact CG-CG 3.97Å; P134-Q139 PolarHBondContact O-NE2 2.9Å; K135-Q139 PolarHBondContact O-N 2.75Å; I136-Q139 WeakPolarHBondContact O-CB 3.45Å; I136-Q139 PolarHBondContact O-N 3.36Å
140	F	84.1	Confident	84.4	Confident	108 Å²	108	117 Å²	117	47%	0.474	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109	10.2	178.5	-67.1	-75.8	0	0	0	113.2	I136 Q137 Q138 D142 L143 K144	I136-F140 HydrophobicContact CG2-CD2 3.85Å; I136-F140 HydrophobicContact CG2-CE2 3.79Å; I136-F140 WeakPolarHBondContact O-CD2 3.47Å; I136-F140 PolarHBondContact O-N 3.21Å; Q137-F140 CarbonylContact O-C 3.19Å; Q138-F140 PolarHBondContact O-N 3.24Å; F140-D142 VanDerWaalsContact C-N 3.34Å; F140-D142 PolarHBondContact O-N 3.5Å; F140-L143 HydrophobicContact CD1-CD1 3.58Å; F140-L143 HydrophobicContact CE1-CD1 4.04Å; F140-L143 PolarHBondContact O-N 3.01Å; F140-K144 VanDerWaalsContact O-CB 3.23Å; F140-K144 WeakPolarHBondContact O-CB 3.4Å; F140-K144 PolarHBondContact O-N 3.24Å
141	M	86.7	Confident	84.6	Confident	118 Å²	118	112.5 Å²	112.5	58%	0.581	55%	0.55	S	S	*	*	H	α-helix	trans	-65.5	-38.2	-175.9	-103	-165.8	-43	0	0	112.5	Q137 Q138 R145	Q137-M141 WeakPolarHBondContact O-CG 3.16Å; Q137-M141 PolarHBondContact O-N 3.4Å; Q137-M141 VanDerWaalsContact O-N 3.12Å; Q138-M141 HydrophobicContact CB-CE 4.23Å; Q138-M141 HydrophobicContact CG-CE 4.16Å; Q138-M141 PolarHBondContact O-N 2.96Å; M141-R145 WeakPolarHBondContact O-CB 3.49Å; M141-R145 PolarHBondContact O-N 3.37Å
142	D	84.6	Confident	84.8	Confident	100 Å²	100	111.6 Å²	111.6	54%	0.535	55%	0.553	S	S	.	*	H	α-helix	trans	-61.5	-53.5	171.8	51.6	-8.6	0	0	0	110.9	F140 K144 R145 D146	F140-D142 VanDerWaalsContact C-N 3.34Å; F140-D142 PolarHBondContact O-N 3.5Å; D142-K144 VanDerWaalsContact C-N 3.3Å; D142-K144 PolarHBondContact O-N 3.22Å; D142-R145 WeakPolarHBondContact O-CB 3.44Å; D142-R145 PolarHBondContact O-N 2.81Å; D142-D146 PolarHBondContact O-N 3.44Å
143	L	84.4	Confident	84.9	Confident	93 Å²	93	108.8 Å²	108.8	49%	0.487	55%	0.549	S	S	.	.	H	α-helix	trans	-61.5	-36.5	178.2	-70.9	170.9	0	0	0	112.7	F140 D146 L147	F140-L143 HydrophobicContact CD1-CD1 3.58Å; F140-L143 HydrophobicContact CE1-CD1 4.04Å; F140-L143 PolarHBondContact O-N 3.01Å; L143-D146 PolarHBondContact O-N 3.13Å; L143-L147 WeakPolarHBondContact O-CB 3.5Å; L143-L147 PolarHBondContact O-N 3.3Å
144	K	87.6	Confident	85	Confident	160 Å²	160	105.3 Å²	105.3	70%	0.696	54%	0.541	S	S	*	.	H	α-helix	trans	-68.4	-35.2	175.4	-173.5	174.5	-179.5	178.8	0	111.8	F140 D142 L147	F140-K144 VanDerWaalsContact O-CB 3.23Å; F140-K144 WeakPolarHBondContact O-CB 3.4Å; F140-K144 PolarHBondContact O-N 3.24Å; D142-K144 VanDerWaalsContact C-N 3.3Å; D142-K144 PolarHBondContact O-N 3.22Å; K144-L147 WeakPolarHBondContact O-CB 3.34Å; K144-L147 PolarHBondContact O-N 3.25Å
145	R	87.3	Confident	85.2	Confident	211 Å²	211	109.4 Å²	109.4	80%	0.796	55%	0.551	S	S	*	*	H	α-helix	trans	-70.3	-35.5	176	-159.2	175.6	-178.5	173.4	-0.5	111	M141 D142 A148	M141-R145 WeakPolarHBondContact O-CB 3.49Å; M141-R145 PolarHBondContact O-N 3.37Å; D142-R145 WeakPolarHBondContact O-CB 3.44Å; D142-R145 PolarHBondContact O-N 2.81Å; R145-A148 WeakPolarHBondContact O-CB 3.33Å; R145-A148 PolarHBondContact O-N 3.16Å
146	D	85.9	Confident	85.2	Confident	107 Å²	107	109.7 Å²	109.7	57%	0.572	56%	0.558	S	S	*	*	H	α-helix	trans	-69.6	-35.6	173.9	-70.8	-10.3	0	0	0	112.4	D142 L143 A148 S149	D142-D146 PolarHBondContact O-N 3.44Å; L143-D146 PolarHBondContact O-N 3.13Å; D146-A148 PolarHBondContact O-N 3.47Å; D146-A148 VanDerWaalsContact O-N 3.11Å; D146-S149 WeakPolarHBondContact O-CB 3.41Å; D146-S149 PolarHBondContact O-N 3.48Å; D146-S149 PolarHBondContact O-OG 3.16Å
147	L	83.8	Confident	85.3	Confident	85 Å²	85	107.2 Å²	107.2	45%	0.445	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-58.4	-22.3	174.4	-109.1	141.6	0	0	0	113.8	L143 K144 S149 V150 W155	L143-L147 WeakPolarHBondContact O-CB 3.5Å; L143-L147 PolarHBondContact O-N 3.3Å; K144-L147 WeakPolarHBondContact O-CB 3.34Å; K144-L147 PolarHBondContact O-N 3.25Å; L147-S149 PolarHBondContact O-N 3.26Å; L147-V150 PolarHBondContact O-N 2.92Å; L147-W155 HydrophobicContact CD2-CH2 3.76Å; L147-W155 HydrophobicContact CD2-CZ2 3.38Å
148	A	87.1	Confident	85.1	Confident	88 Å²	88	106.1 Å²	106.1	73%	0.727	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-69.6	-14.4	175	0	0	0	0	0	113.6	R145 D146	R145-A148 WeakPolarHBondContact O-CB 3.33Å; R145-A148 PolarHBondContact O-N 3.16Å; D146-A148 PolarHBondContact O-N 3.47Å; D146-A148 VanDerWaalsContact O-N 3.11Å
149	S	86.2	Confident	84.8	Confident	102 Å²	102	109.4 Å²	109.4	71%	0.713	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-82.2	-16.2	175.9	68.1	0	0	0	0	113.8	D146 L147 S151	D146-S149 WeakPolarHBondContact O-CB 3.41Å; D146-S149 PolarHBondContact O-N 3.48Å; D146-S149 PolarHBondContact O-OG 3.16Å; L147-S149 PolarHBondContact O-N 3.26Å; S149-S151 PolarHBondContact O-N 3.08Å
150	V	85.4	Confident	84.4	Confident	56 Å²	56	113.4 Å²	113.4	34%	0.339	60%	0.599	S	S	.	*	S	Bend	trans	-71	123.3	-179.7	179.9	0	0	0	0	109.6	L147 E154 W155	L147-V150 PolarHBondContact O-N 2.92Å; V150-E154 HydrophobicContact CG1-CB 3.65Å; V150-W155 HydrophobicContact CG1-CG 4.41Å
151	S	88.4	Confident	83.4	Confident	43 Å²	43	115.1 Å²	115.1	30%	0.301	62%	0.618	S	S	.	*			trans	-69	154	-178.7	64.2	0	0	0	0	111.9	S149 S153 E154 W155	S149-S151 PolarHBondContact O-N 3.08Å; S151-S153 PolarHBondContact O-N 3.32Å; S151-S153 PolarHBondContact OG-OG 3.37Å; S151-E154 PolarHBondContact N-OE2 3.46Å; S151-E154 PolarHBondContact O-N 2.95Å; S151-E154 VanDerWaalsContact OG-CD 3.27Å; S151-E154 VanDerWaalsContact OG-CG 3.27Å; S151-E154 WeakPolarHBondContact OG-CG 3.43Å; S151-E154 PolarHBondContact OG-N 3.45Å; S151-E154 PolarHBondContact OG-OE2 3.44Å; S151-W155 PolarHBondContact O-N 3.47Å; S151-W155 VanDerWaalsContact O-N 3.1Å
152	E	87.7	Confident	81.9	Confident	153 Å²	153	112.4 Å²	112.4	72%	0.715	62%	0.621	S	S	*	*	H	α-helix	trans	-60.8	-28.5	175.3	-162.7	175	-173.1	0	0	111.9	W155 N156	E152-W155 PolarHBondContact O-N 3.02Å; E152-N156 PolarHBondContact O-N 3.3Å; E152-N156 VanDerWaalsContact O-N 3.07Å; E152-N156 PolarHBondContact O-ND2 2.83Å
153	S	85.7	Confident	80.3	Confident	86 Å²	86	113.8 Å²	113.8	60%	0.601	63%	0.628	S	S	*	*	H	α-helix	trans	-64.5	-37.7	172.1	40.8	0	0	0	0	113.2	S151 N156 A157	S151-S153 PolarHBondContact O-N 3.32Å; S151-S153 PolarHBondContact OG-OG 3.37Å; S153-N156 PolarHBondContact O-N 3.34Å; S153-A157 WeakPolarHBondContact O-CB 3.3Å; S153-A157 PolarHBondContact O-N 3.49Å
154	E	86.8	Confident	78.8	Confident	109 Å²	109	114.4 Å²	114.4	51%	0.509	64%	0.64	S	S	.	*	H	α-helix	trans	-73.1	-36.9	176.9	-72.5	162.6	148.4	0	0	111.2	V150 S151 N156 A157 L158	V150-E154 HydrophobicContact CG1-CB 3.65Å; S151-E154 PolarHBondContact N-OE2 3.46Å; S151-E154 PolarHBondContact O-N 2.95Å; S151-E154 VanDerWaalsContact OG-CD 3.27Å; S151-E154 VanDerWaalsContact OG-CG 3.27Å; S151-E154 WeakPolarHBondContact OG-CG 3.43Å; S151-E154 PolarHBondContact OG-N 3.45Å; S151-E154 PolarHBondContact OG-OE2 3.44Å; E154-N156 VanDerWaalsContact C-N 3.3Å; E154-N156 PolarHBondContact O-N 3.26Å; E154-A157 PolarHBondContact O-N 3.44Å; E154-A157 VanDerWaalsContact O-N 3.09Å; E154-L158 PolarHBondContact O-N 3.06Å
155	W	86.1	Confident	77	Confident	132 Å²	132	117.4 Å²	117.4	50%	0.5	65%	0.647	S	S	.	*	H	α-helix	trans	-58.3	-41.4	171.7	-82.7	106.6	0	0	0	112.5	L147 V150 S151 E152 A157 L158	L147-W155 HydrophobicContact CD2-CH2 3.76Å; L147-W155 HydrophobicContact CD2-CZ2 3.38Å; V150-W155 HydrophobicContact CG1-CG 4.41Å; S151-W155 PolarHBondContact O-N 3.47Å; S151-W155 VanDerWaalsContact O-N 3.1Å; E152-W155 PolarHBondContact O-N 3.02Å; W155-A157 VanDerWaalsContact C-N 3.27Å; W155-A157 PolarHBondContact O-N 2.85Å; W155-L158 HydrophobicContact CE3-CD1 3.57Å; W155-L158 HydrophobicContact CZ3-CD1 3.87Å
156	N	83.4	Confident	75.3	Confident	135 Å²	135	112.1 Å²	112.1	72%	0.722	63%	0.634	S	S	*	*	H	α-helix	trans	-73.5	-17.6	177.3	-71.6	-42.3	0	0	0	113.6	E152 S153 E154	E152-N156 PolarHBondContact O-N 3.3Å; E152-N156 VanDerWaalsContact O-N 3.07Å; E152-N156 PolarHBondContact O-ND2 2.83Å; S153-N156 PolarHBondContact O-N 3.34Å; E154-N156 VanDerWaalsContact C-N 3.3Å; E154-N156 PolarHBondContact O-N 3.26Å
157	A	82.8	Confident	73.8	Confident	75 Å²	75	117.9 Å²	117.9	62%	0.62	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	7.1	-179.1	0	0	0	0	0	113.8	S153 E154 W155 P159	S153-A157 WeakPolarHBondContact O-CB 3.3Å; S153-A157 PolarHBondContact O-N 3.49Å; E154-A157 PolarHBondContact O-N 3.44Å; E154-A157 VanDerWaalsContact O-N 3.09Å; W155-A157 VanDerWaalsContact C-N 3.27Å; W155-A157 PolarHBondContact O-N 2.85Å; A157-P159 WeakPolarHBondContact O-CD 3.45Å
158	L	77.7	Confident	72.4	Confident	112 Å²	112	123.8 Å²	123.8	59%	0.586	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-61.3	121.7	175.6	-77	168.4	0	0	0	110.9	E154 W155 E160	E154-L158 PolarHBondContact O-N 3.06Å; W155-L158 HydrophobicContact CE3-CD1 3.57Å; W155-L158 HydrophobicContact CZ3-CD1 3.87Å; L158-E160 PolarHBondContact O-N 3.46Å
159	P	77.2	Confident	71	Confident	121 Å²	121	126.7 Å²	126.7	79%	0.786	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-65.9	133.2	177.2	-17.8	30	0	0	0	111.6	A157	A157-P159 WeakPolarHBondContact O-CD 3.45Å
160	E	72.7	Confident	69.2	Low	188 Å²	188	132.4 Å²	132.4	88%	0.879	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-65.7	156.7	163.7	-78.5	-167	161.7	0	0	110.6	L158 G162	L158-E160 PolarHBondContact O-N 3.46Å; E160-G162 PolarHBondContact O-N 2.93Å
161	V	64.5	Low	67.6	Low	144 Å²	144	137 Å²	137	87%	0.873	70%	0.697	S	S	*	*			trans	-68.4	75.3	177.9	-71.5	0	0	0	0	112	D163	V161-D163 PolarHBondContact O-N 3.44Å
162	G	55.2	Low	65.9	Low	61 Å²	61	140.3 Å²	140.3	63%	0.629	72%	0.718	S	S	*	*			trans	-70.3	122.4	176.3	0	0	0	0	0	113.3	E160 S164	E160-G162 PolarHBondContact O-N 2.93Å; G162-S164 PolarHBondContact O-N 3.38Å
163	D	50.8	Low	64	Low	128 Å²	128	142.5 Å²	142.5	68%	0.684	72%	0.72	S	S	*	*	S	Bend	trans	49.3	29.1	154.3	-77.9	-9.5	0	0	0	120.9	V161	V161-D163 PolarHBondContact O-N 3.44Å
164	S	52.4	Low	62.3	Low	107 Å²	107	150.3 Å²	150.3	75%	0.748	74%	0.738	S	S	*	*	S	Bend	trans	-95.1	6.2	175.4	48.6	0	0	0	0	115.9	G162	G162-S164 PolarHBondContact O-N 3.38Å
165	R	50.7	Low	60.5	Low	223 Å²	223	151.6 Å²	151.6	84%	0.842	74%	0.744	S	S	*	*			trans	-140	81.5	168.9	-79	175	98.1	171.2	5.1	112.4	R167	R165-R167 PolarHBondContact O-N 2.92Å
166	N	50.7	Low	58.6	Low	99 Å²	99	156.9 Å²	156.9	53%	0.529	76%	0.764	S	S	.	*			trans	-66.6	50	176.2	-91.2	-34.8	0	0	0	115.5
167	R	53.7	Low	57.3	Low	228 Å²	228	160.7 Å²	160.7	86%	0.86	77%	0.774	S	S	*	*	S	Bend	trans	-88	-12.4	177.3	-142.5	176.4	-177.8	179.2	1.2	113.6	R165	R165-R167 PolarHBondContact O-N 2.92Å
168	K	55.6	Low	56.5	Low	209 Å²	209	162.6 Å²	162.6	91%	0.909	78%	0.778	S	S	*	*	S	Bend	trans	-103.4	-16.2	-177.9	-98.9	179.9	176.1	175.3	0	115.8
169	Q	56.8	Low	56.1	Low	150 Å²	150	163.2 Å²	163.2	70%	0.701	79%	0.789	S	S	*	*	S	Bend	trans	-86.3	-7	179.1	-70.6	-171.9	7.5	0	0	114.3	N171	Q169-N171 PolarHBondContact O-N 3.4Å
170	R	49	Very low	55.4	Low	221 Å²	221	162.5 Å²	162.5	83%	0.834	78%	0.777	S	S	*	*			trans	-92.9	58.2	174.1	-79.6	-174.2	156.8	-165.5	-3.5	112.3	P172	R170-P172 WeakPolarHBondContact O-CD 3.5Å
171	N	51.2	Low	55.4	Low	153 Å²	153	157.1 Å²	157.1	82%	0.818	76%	0.759	S	S	*	*			trans	-107.2	90.9	161.5	-137.4	18.7	0	0	0	108.1	Q169 R173	Q169-N171 PolarHBondContact O-N 3.4Å; N171-R173 PolarHBondContact O-N 2.99Å
172	P	53.7	Low	55.7	Low	113 Å²	113	156.5 Å²	156.5	73%	0.734	75%	0.751	S	S	*	*			trans	-77.1	111.3	179	-3.6	22.8	0	0	0	109.2	R170	R170-P172 WeakPolarHBondContact O-CD 3.5Å
173	R	47.1	Very low	56.4	Low	199 Å²	199	157.3 Å²	157.3	75%	0.751	75%	0.746	S	S	*	*			trans	23.4	104.9	150.5	-67.6	177.6	177.2	-167.1	7.6	117.5	N171 E175	N171-R173 PolarHBondContact O-N 2.99Å; R173-E175 HydrophobicContact CB-CB 4.16Å; R173-E175 HydrophobicContact CB-CG 4.1Å; R173-E175 VanDerWaalsContact CD-OE2 3.29Å; R173-E175 WeakPolarHBondContact CD-OE2 3.39Å; R173-E175 HydrophobicContact CG-CG 4.39Å; R173-E175 IonicContact CZ-OE2 3.69Å; R173-E175 IonicContact NE-OE2 3.74Å; R173-E175 IonicContact NH1-OE2 2.82Å; R173-E175 PolarHBondContact NH1-OE2 3.48Å; R173-E175 PolarHBondContact O-N 3.47Å
174	Y	49.5	Very low	57	Low	250 Å²	250	155.7 Å²	155.7	98%	0.98	74%	0.737	S	S	*	*			trans	-68.3	82.7	145.8	-101.4	-94.5	0	0	0	108.3
175	E	50.9	Low	57.6	Low	135 Å²	135	155 Å²	155	63%	0.631	72%	0.724	S	S	*	*			trans	-140.6	105.9	175.2	-69.8	-177.3	173.4	0	0	110.5	R173	R173-E175 HydrophobicContact CB-CB 4.16Å; R173-E175 HydrophobicContact CB-CG 4.1Å; R173-E175 VanDerWaalsContact CD-OE2 3.29Å; R173-E175 WeakPolarHBondContact CD-OE2 3.39Å; R173-E175 HydrophobicContact CG-CG 4.39Å; R173-E175 IonicContact CZ-OE2 3.69Å; R173-E175 IonicContact NE-OE2 3.74Å; R173-E175 IonicContact NH1-OE2 2.82Å; R173-E175 PolarHBondContact NH1-OE2 3.48Å; R173-E175 PolarHBondContact O-N 3.47Å
176	R	45	Very low	58.3	Low	244 Å²	244	147.3 Å²	147.3	92%	0.921	71%	0.708	S	S	*	*			trans	28.2	109.8	166.7	-79	178.3	172.4	169.1	-2.6	119.6	T178	R176-T178 PolarHBondContact O-N 3.03Å
177	F	56.4	Low	59	Low	214 Å²	214	149.2 Å²	149.2	94%	0.939	71%	0.711	S	S	*	*			trans	-76.3	113.9	160.6	-72	-86.7	0	0	0	111.3
178	T	66.4	Low	59.2	Low	115 Å²	115	140.4 Å²	140.4	71%	0.706	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-93.6	139.1	153.5	49.1	0	0	0	0	108.3	R176 I180	R176-T178 PolarHBondContact O-N 3.03Å; T178-I180 PolarHBondContact O-N 3.32Å
179	P	69.8	Low	59.5	Low	125 Å²	125	137.4 Å²	137.4	81%	0.812	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-57.5	130	175.3	21.6	-29.6	0	0	0	110.1
180	I	62.4	Low	59.6	Low	107 Å²	107	134.5 Å²	134.5	55%	0.549	68%	0.681	S	S	.	*	P	Polyproline II helix	trans	-68.3	126.6	177.3	-61.5	170	0	0	0	107.1	T178 I184	T178-I180 PolarHBondContact O-N 3.32Å; I180-I184 HydrophobicContact CG2-CB 3.5Å; I180-I184 HydrophobicContact CG2-CD1 3.9Å; I180-I184 HydrophobicContact CG2-CG1 4.24Å; I180-I184 HydrophobicContact CG2-CG2 3.6Å
181	P	72.5	Confident	59.9	Low	74 Å²	74	127.2 Å²	127.2	48%	0.481	66%	0.658	S	S	.	*	P	Polyproline II helix	trans	-61.2	143.6	177.5	22.6	-31.9	0	0	0	110.9	S183 I184	P181-S183 PolarHBondContact O-N 2.94Å; P181-I184 HydrophobicContact CG-CD1 3.99Å; P181-I184 HydrophobicContact CG-CG1 4.34Å; P181-I184 PolarHBondContact O-N 3.48Å
182	D	70.4	Confident	60	Low	132 Å²	132	123.1 Å²	123.1	71%	0.706	65%	0.653	S	S	*	*	H	α-helix	trans	-54.1	-20.9	-178.5	-66.8	-17.9	0	0	0	113.4	I184 I185 A186	D182-I184 VanDerWaalsContact C-N 3.29Å; D182-I184 PolarHBondContact O-N 2.65Å; D182-I185 PolarHBondContact O-N 3.09Å; D182-A186 WeakPolarHBondContact O-CB 3.41Å; D182-A186 PolarHBondContact O-N 3.05Å
183	S	70.5	Confident	59.8	Low	77 Å²	77	126.7 Å²	126.7	54%	0.538	66%	0.66	S	S	.	*	H	α-helix	trans	-63	-29.8	173.6	57.2	0	0	0	0	113.8	P181 K187	P181-S183 PolarHBondContact O-N 2.94Å; S183-K187 WeakPolarHBondContact O-CB 3.44Å; S183-K187 PolarHBondContact O-N 3.46Å
184	I	63.7	Low	59.7	Low	95 Å²	95	121 Å²	121	49%	0.487	65%	0.647	S	S	.	*	H	α-helix	trans	-83	-27.1	175.6	-65.2	171.6	0	0	0	110.7	I180 P181 D182 G188	I180-I184 HydrophobicContact CG2-CB 3.5Å; I180-I184 HydrophobicContact CG2-CD1 3.9Å; I180-I184 HydrophobicContact CG2-CG1 4.24Å; I180-I184 HydrophobicContact CG2-CG2 3.6Å; P181-I184 HydrophobicContact CG-CD1 3.99Å; P181-I184 HydrophobicContact CG-CG1 4.34Å; P181-I184 PolarHBondContact O-N 3.48Å; D182-I184 VanDerWaalsContact C-N 3.29Å; D182-I184 PolarHBondContact O-N 2.65Å; I184-G188 WeakPolarHBondContact O-CA 3.17Å; I184-G188 PolarHBondContact O-N 3.05Å
185	I	64.6	Low	59.1	Low	92 Å²	92	115.6 Å²	115.6	47%	0.472	64%	0.635	S	S	.	*	H	α-helix	trans	-71.8	-40.8	170.6	-62.4	173.7	0	0	0	109.6	D182 G188 L189	D182-I185 PolarHBondContact O-N 3.09Å; I185-G188 PolarHBondContact O-N 3.36Å; I185-L189 HydrophobicContact CG2-CD1 3.96Å; I185-L189 WeakPolarHBondContact O-CB 3.41Å; I185-L189 WeakPolarHBondContact O-CD1 3.24Å; I185-L189 PolarHBondContact O-N 3.29Å
186	A	64.7	Low	58.6	Low	61 Å²	61	115.8 Å²	115.8	50%	0.504	65%	0.645	S	S	.	*	H	α-helix	trans	-65.7	-39.4	172.1	0	0	0	0	0	112.2	D182 S190	D182-A186 WeakPolarHBondContact O-CB 3.41Å; D182-A186 PolarHBondContact O-N 3.05Å; A186-S190 WeakPolarHBondContact O-CB 3.33Å; A186-S190 PolarHBondContact O-N 3.06Å
187	K	64.9	Low	58.4	Low	139 Å²	139	108.5 Å²	108.5	60%	0.604	63%	0.632	S	S	*	*	H	α-helix	trans	-68.3	-40.1	171.2	-109.9	-179.1	172.9	-176.9	0	112.2	S183 S190 D191	S183-K187 WeakPolarHBondContact O-CB 3.44Å; S183-K187 PolarHBondContact O-N 3.46Å; K187-S190 CarbonylContact O-C 3.42Å; K187-S190 WeakPolarHBondContact O-CA 3.43Å; K187-S190 WeakPolarHBondContact O-CB 3.48Å; K187-S190 PolarHBondContact O-N 3.18Å; K187-S190 VanDerWaalsContact O-N 3.13Å; K187-D191 WeakPolarHBondContact O-CA 3.28Å; K187-D191 WeakPolarHBondContact O-CB 3.42Å; K187-D191 VanDerWaalsContact O-CG 3.27Å; K187-D191 PolarHBondContact O-N 3.42Å
188	G	58.8	Low	57.5	Low	43 Å²	43	101.2 Å²	101.2	44%	0.443	61%	0.605	S	S	.	*	H	α-helix	trans	-71.3	-28.4	179.2	0	0	0	0	0	114.2	I184 I185 S190 G192	I184-G188 WeakPolarHBondContact O-CA 3.17Å; I184-G188 PolarHBondContact O-N 3.05Å; I185-G188 PolarHBondContact O-N 3.36Å; G188-S190 VanDerWaalsContact C-N 3.35Å; G188-G192 PolarHBondContact O-N 3.32Å
189	L	61	Low	56.3	Low	146 Å²	146	100.7 Å²	100.7	76%	0.764	60%	0.597	S	S	*	*	H	α-helix	trans	-73.4	-27.3	168.1	-83.3	154.5	0	0	0	112.2	I185	I185-L189 HydrophobicContact CG2-CD1 3.96Å; I185-L189 WeakPolarHBondContact O-CB 3.41Å; I185-L189 WeakPolarHBondContact O-CD1 3.24Å; I185-L189 PolarHBondContact O-N 3.29Å
190	S	59.2	Low	55.5	Low	90 Å²	90	100.3 Å²	100.3	63%	0.629	59%	0.593	S	S	*	*	H	α-helix	trans	-84.8	-28.1	171.2	-178.9	0	0	0	0	113.1	A186 K187 G188	A186-S190 WeakPolarHBondContact O-CB 3.33Å; A186-S190 PolarHBondContact O-N 3.06Å; K187-S190 CarbonylContact O-C 3.42Å; K187-S190 WeakPolarHBondContact O-CA 3.43Å; K187-S190 WeakPolarHBondContact O-CB 3.48Å; K187-S190 PolarHBondContact O-N 3.18Å; K187-S190 VanDerWaalsContact O-N 3.13Å; G188-S190 VanDerWaalsContact C-N 3.35Å
191	D	55	Low	55	Low	67 Å²	67	100.7 Å²	100.7	36%	0.358	60%	0.595	S	S	.	*	S	Bend	trans	-102.4	7	-174.8	-75.4	-18	0	0	0	111.6	K187 Q193 T194	K187-D191 WeakPolarHBondContact O-CA 3.28Å; K187-D191 WeakPolarHBondContact O-CB 3.42Å; K187-D191 VanDerWaalsContact O-CG 3.27Å; K187-D191 PolarHBondContact O-N 3.42Å; D191-Q193 CarbonylContact O-C 3.35Å; D191-Q193 PolarHBondContact O-N 3.16Å; D191-T194 HydrophobicContact CB-CG2 3.42Å; D191-T194 VanDerWaalsContact CB-CG2 3.42Å; D191-T194 WeakPolarHBondContact O-CB 3.39Å; D191-T194 PolarHBondContact O-N 2.75Å; D191-T194 PolarHBondContact O-OG1 3.5Å; D191-T194 VanDerWaalsContact OD1-CG2 3.24Å; D191-T194 WeakPolarHBondContact OD1-CG2 3.01Å
192	G	53.7	Low	54.1	Low	68 Å²	68	103.1 Å²	103.1	70%	0.701	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-4.7	162.8	0	0	0	0	0	113.3	G188	G188-G192 PolarHBondContact O-N 3.32Å
193	Q	50	Low	53.4	Low	187 Å²	187	104.4 Å²	104.4	87%	0.874	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.3	65	156.4	-72.4	-177.6	-15.9	0	0	110.2	D191	D191-Q193 CarbonylContact O-C 3.35Å; D191-Q193 PolarHBondContact O-N 3.16Å
194	T	44.2	Very low	52.7	Low	81 Å²	81	104.8 Å²	104.8	50%	0.497	60%	0.604	S	S	.	*			trans	-114.4	112.5	165.7	45.2	0	0	0	0	111.2	D191	D191-T194 HydrophobicContact CB-CG2 3.42Å; D191-T194 VanDerWaalsContact CB-CG2 3.42Å; D191-T194 WeakPolarHBondContact O-CB 3.39Å; D191-T194 PolarHBondContact O-N 2.75Å; D191-T194 PolarHBondContact O-OG1 3.5Å; D191-T194 VanDerWaalsContact OD1-CG2 3.24Å; D191-T194 WeakPolarHBondContact OD1-CG2 3.01Å
195	N	36.2	Very low	51.9	Low	135 Å²	135	106 Å²	106	72%	0.722	61%	0.611	S	S	*	*			trans	51.6	84.4	147.4	-58.9	-15.4	0	0	0	117.5
196	V	41.3	Very low	50.7	Low	139 Å²	139	105.6 Å²	105.6	84%	0.842	63%	0.629	S	S	*	*				-93.9	72.5	123.9	-170.1	0	0	0	0	106.6	V198	V196-V198 VanDerWaalsContact C-N 3.28Å; V196-V198 HydrophobicContact CG1-CG2 3.79Å; V196-V198 PolarHBondContact O-N 3.27Å; V196-V198 VanDerWaalsContact O-N 3.08Å
197	S	39.7	Very low	49.8	Very low	92 Å²	92	106.1 Å²	106.1	64%	0.643	64%	0.641	S	S	*	*			trans	-64.5	100.3	153	49.4	0	0	0	0	105.8
198	V	38	Very low	48.5	Very low	60 Å²	60	106.3 Å²	106.3	36%	0.364	65%	0.648	S	S	.	*			trans	-82.7	121.4	148.8	-172.7	0	0	0	0	104.4	V196 V200 E202 Q203	V196-V198 VanDerWaalsContact C-N 3.28Å; V196-V198 HydrophobicContact CG1-CG2 3.79Å; V196-V198 PolarHBondContact O-N 3.27Å; V196-V198 VanDerWaalsContact O-N 3.08Å; V198-V200 PolarHBondContact O-N 3Å; V198-E202 HydrophobicContact CG1-CB 3.76Å; V198-Q203 HydrophobicContact CB-CG 4.3Å; V198-Q203 HydrophobicContact CG1-CG 3.87Å
199	D	41.4	Very low	47.5	Very low	104 Å²	104	111.2 Å²	111.2	56%	0.556	67%	0.669	S	S	*	*			trans	-49.9	137.8	179.4	-113.7	-35.9	0	0	0	110	I201 E202 Q203	D199-I201 PolarHBondContact O-N 3.43Å; D199-E202 HydrophobicContact CB-CB 4.19Å; D199-E202 HydrophobicContact CB-CG 4.1Å; D199-E202 WeakPolarHBondContact O-CA 3.17Å; D199-E202 PolarHBondContact O-N 3.01Å; D199-Q203 PolarHBondContact O-N 3.36Å; D199-Q203 VanDerWaalsContact O-N 3.15Å
200	V	53.3	Low	46.6	Very low	118 Å²	118	109.7 Å²	109.7	72%	0.715	67%	0.666	S	S	*	*	H	α-helix	trans	-58.6	-19.3	174.7	176.5	0	0	0	0	110.9	V198 S204	V198-V200 PolarHBondContact O-N 3Å; V200-S204 WeakPolarHBondContact O-CB 3.49Å; V200-S204 PolarHBondContact O-N 3.39Å; V200-S204 PolarHBondContact O-OG 3.03Å
201	I	51.8	Low	45.7	Very low	114 Å²	114	111 Å²	111	59%	0.585	67%	0.672	S	S	*	*	H	α-helix	trans	-77.9	-36.1	172.5	-60.9	174.3	0	0	0	111.6	D199 S204 L205	D199-I201 PolarHBondContact O-N 3.43Å; I201-S204 PolarHBondContact O-N 3.37Å; I201-L205 HydrophobicContact CG2-CD1 4.17Å; I201-L205 WeakPolarHBondContact O-CB 3.21Å; I201-L205 PolarHBondContact O-N 2.99Å
202	E	52.7	Low	44.7	Very low	126 Å²	126	117.3 Å²	117.3	59%	0.589	70%	0.697	S	S	*	*	H	α-helix	trans	-77.5	-21	177.4	-75.5	-173.3	154	0	0	113.7	V198 D199	V198-E202 HydrophobicContact CG1-CB 3.76Å; D199-E202 HydrophobicContact CB-CB 4.19Å; D199-E202 HydrophobicContact CB-CG 4.1Å; D199-E202 WeakPolarHBondContact O-CA 3.17Å; D199-E202 PolarHBondContact O-N 3.01Å
203	Q	57.6	Low	43.7	Very low	158 Å²	158	118.8 Å²	118.8	74%	0.738	69%	0.693	S	S	*	*	H	α-helix	trans	-88.4	-18.3	171.1	-78.8	-174.5	-20	0	0	114.1	V198 D199	V198-Q203 HydrophobicContact CB-CG 4.3Å; V198-Q203 HydrophobicContact CG1-CG 3.87Å; D199-Q203 PolarHBondContact O-N 3.36Å; D199-Q203 VanDerWaalsContact O-N 3.15Å
204	S	55.4	Low	43.1	Very low	85 Å²	85	115.7 Å²	115.7	59%	0.594	69%	0.692	S	S	*	*	H	α-helix	trans	-103.5	-17.5	177.9	62.7	0	0	0	0	114.1	V200 I201	V200-S204 WeakPolarHBondContact O-CB 3.49Å; V200-S204 PolarHBondContact O-N 3.39Å; V200-S204 PolarHBondContact O-OG 3.03Å; I201-S204 PolarHBondContact O-N 3.37Å
205	L	45.8	Very low	43	Very low	121 Å²	121	120.1 Å²	120.1	63%	0.634	71%	0.707	S	S	*	*	S	Bend	trans	-126.7	96.4	171.7	-73.5	105.7	0	0	0	110	I201	I201-L205 HydrophobicContact CG2-CD1 4.17Å; I201-L205 WeakPolarHBondContact O-CB 3.21Å; I201-L205 PolarHBondContact O-N 2.99Å
206	G	41	Very low	43.1	Very low	83 Å²	83	120 Å²	120	86%	0.856	71%	0.711	S	S	*	*			trans	-62.8	137.3	176.4	0	0	0	0	0	113.2
207	G	45.6	Very low	42.8	Very low	72 Å²	72	118 Å²	118	74%	0.742	71%	0.709	S	S	*	*			trans	136.2	123.2	153	0	0	0	0	0	116.8
208	L	37.2	Very low	42.9	Very low	144 Å²	144	122.6 Å²	122.6	75%	0.754	72%	0.72	S	S	*	*			trans	-144	74.6	142.7	-112.7	159	0	0	0	108.9	T210	L208-T210 HydrophobicContact CD2-CG2 3.44Å; L208-T210 VanDerWaalsContact CD2-CG2 3.44Å
209	T	37.4	Very low	43.2	Very low	146 Å²	146	128.8 Å²	128.8	90%	0.896	75%	0.747	S	S	*	*			trans	-112.5	101.8	137.6	45.6	0	0	0	0	106.4
210	T	41.7	Very low	43.6	Very low	114 Å²	114	131.3 Å²	131.3	70%	0.699	76%	0.761	S	S	*	*			trans	-74.4	166	175.7	24.7	0	0	0	0	111.9	L208	L208-T210 HydrophobicContact CD2-CG2 3.44Å; L208-T210 VanDerWaalsContact CD2-CG2 3.44Å
211	P	40	Very low	43.9	Very low	116 Å²	116	132.2 Å²	132.2	75%	0.753	76%	0.76	S	S	*	*				-102.4	158.4	-126.2	39	-36.9	0	0	0	114.5
212	F	34.1	Very low	44.7	Very low	200 Å²	200	130.3 Å²	130.3	88%	0.877	75%	0.751	S	S	*	*			trans	-148.1	136.3	144.7	-157.5	-107.1	0	0	0	112.7
213	T	34.1	Very low	45.6	Very low	100 Å²	100	131.6 Å²	131.6	61%	0.613	76%	0.759	S	S	*	*			trans	-58.6	141.5	-178.1	40.1	0	0	0	0	115.3
214	S	35.7	Very low	46.4	Very low	122 Å²	122	131.6 Å²	131.6	85%	0.853	76%	0.757	S	S	*	*			trans	-145.2	90.9	143.4	62.2	0	0	0	0	109.3
215	Q	42.3	Very low	47.3	Very low	174 Å²	174	134.1 Å²	134.1	81%	0.813	76%	0.757	S	S	*	*			trans	-67.6	148.4	158.5	-78.1	179	-18.6	0	0	109.1
216	T	38	Very low	48.8	Very low	131 Å²	131	132.6 Å²	132.6	80%	0.804	75%	0.748	S	S	*	*	S	Bend	trans	68.7	102.3	159.2	53	0	0	0	0	119
217	A	35.5	Very low	50.8	Low	97 Å²	97	130.1 Å²	130.1	80%	0.802	72%	0.723	S	S	*	*				54.3	89.5	128	0	0	0	0	0	117.4
218	Q	42.7	Very low	52.7	Low	189 Å²	189	132.8 Å²	132.8	88%	0.883	72%	0.716	S	S	*	*				-153.6	148.9	125.5	-104.9	164.8	1	0	0	108.5	D220	Q218-D220 PolarHBondContact O-N 3.25Å
219	M	43	Very low	54.9	Low	190 Å²	190	128.6 Å²	128.6	94%	0.936	70%	0.702	S	S	*	*			trans	-71.7	82.6	-155.5	-59.9	-178	73.7	0	0	113.8
220	D	50.4	Low	57.2	Low	158 Å²	158	130.6 Å²	130.6	85%	0.845	69%	0.693	S	S	*	*			trans	-112.7	121	170.6	-81.9	-23.8	0	0	0	111.9	Q218 D222	Q218-D220 PolarHBondContact O-N 3.25Å; D220-D222 PolarHBondContact O-N 3.42Å
221	I	59.8	Low	59.3	Low	136 Å²	136	129.1 Å²	129.1	70%	0.697	69%	0.685	S	S	*	*			trans	-71.4	107.9	176.9	-62	166.6	0	0	0	108	M223 I226	I221-M223 PolarHBondContact O-N 3.03Å; I221-I226 HydrophobicContact CG2-CD1 3.59Å
222	D	67.8	Low	61.5	Low	75 Å²	75	126.5 Å²	126.5	40%	0.401	67%	0.669	S	S	.	*			trans	-68.4	92.7	175.5	-173.2	-6.8	0	0	0	110.6	D220 K224 K225 I226	D220-D222 PolarHBondContact O-N 3.42Å; D222-K224 PolarHBondContact O-N 2.85Å; D222-K224 WeakPolarHBondContact OD1-CB 3.43Å; D222-K224 PolarHBondContact OD1-N 3.49Å; D222-K225 HydrophobicContact CB-CB 4.23Å; D222-K225 HydrophobicContact CB-CD 4.29Å; D222-K225 HydrophobicContact CB-CG 4.39Å; D222-K225 PolarHBondContact O-N 3.43Å; D222-K225 VanDerWaalsContact O-N 3.11Å; D222-K225 PolarHBondContact OD1-N 3.33Å; D222-K225 WeakPolarHBondContact OD2-CD 3.44Å; D222-K225 WeakPolarHBondContact OD2-CE 3.37Å; D222-K225 VanDerWaalsContact OD2-CG 3.31Å; D222-K225 WeakPolarHBondContact OD2-CG 3.37Å; D222-I226 PolarHBondContact O-N 3.41Å; D222-I226 VanDerWaalsContact O-N 3.12Å
223	M	72	Confident	64.1	Low	153 Å²	153	121.6 Å²	121.6	75%	0.754	65%	0.651	S	S	*	*	H	α-helix	trans	-61.3	-21.1	177.7	-70.9	-137.3	-58.4	0	0	112.9	I221 G227	I221-M223 PolarHBondContact O-N 3.03Å; M223-G227 PolarHBondContact O-N 3.42Å
224	K	74.9	Confident	66.7	Low	157 Å²	157	122 Å²	122	68%	0.683	65%	0.647	S	S	*	*	H	α-helix	trans	-71.9	-42	173.8	-68.8	-176.6	177.8	177.9	0	110.6	D222 I226 G227 E228	D222-K224 PolarHBondContact O-N 2.85Å; D222-K224 WeakPolarHBondContact OD1-CB 3.43Å; D222-K224 PolarHBondContact OD1-N 3.49Å; K224-I226 PolarHBondContact O-N 3.22Å; K224-G227 CarbonylContact O-C 3.59Å; K224-G227 WeakPolarHBondContact O-CA 3.33Å; K224-G227 PolarHBondContact O-N 3.21Å; K224-G227 VanDerWaalsContact O-N 3.16Å; K224-E228 WeakPolarHBondContact O-CB 3.38Å; K224-E228 VanDerWaalsContact O-CG 3.28Å; K224-E228 WeakPolarHBondContact O-CG 3.34Å; K224-E228 PolarHBondContact O-N 2.89Å
225	K	74.7	Confident	69.2	Low	139 Å²	139	120.8 Å²	120.8	60%	0.604	63%	0.632	S	S	*	*	H	α-helix	trans	-65.7	-37.7	173.5	-76.5	178.5	-174.1	174.8	0	112.9	D222 G227 A229	D222-K225 HydrophobicContact CB-CB 4.23Å; D222-K225 HydrophobicContact CB-CD 4.29Å; D222-K225 HydrophobicContact CB-CG 4.39Å; D222-K225 PolarHBondContact O-N 3.43Å; D222-K225 VanDerWaalsContact O-N 3.11Å; D222-K225 PolarHBondContact OD1-N 3.33Å; D222-K225 WeakPolarHBondContact OD2-CD 3.44Å; D222-K225 WeakPolarHBondContact OD2-CE 3.37Å; D222-K225 VanDerWaalsContact OD2-CG 3.31Å; D222-K225 WeakPolarHBondContact OD2-CG 3.37Å; K225-G227 VanDerWaalsContact C-N 3.34Å; K225-A229 WeakPolarHBondContact O-CB 3.13Å; K225-A229 PolarHBondContact O-N 3.33Å
226	I	77.4	Confident	71.4	Confident	88 Å²	88	116.8 Å²	116.8	45%	0.451	62%	0.615	S	S	.	*	H	α-helix	trans	-65.8	-39	171.3	-79.5	177	0	0	0	111.1	I221 D222 K224 R230	I221-I226 HydrophobicContact CG2-CD1 3.59Å; D222-I226 PolarHBondContact O-N 3.41Å; D222-I226 VanDerWaalsContact O-N 3.12Å; K224-I226 PolarHBondContact O-N 3.22Å; I226-R230 WeakPolarHBondContact O-CB 3.4Å; I226-R230 PolarHBondContact O-N 2.99Å
227	G	83.1	Confident	73.7	Confident	31 Å²	31	116.7 Å²	116.7	32%	0.32	60%	0.603	S	S	.	*	H	α-helix	trans	-62.6	-51.4	174.7	0	0	0	0	0	112	M223 K224 K225 A229 R230 T231	M223-G227 PolarHBondContact O-N 3.42Å; K224-G227 CarbonylContact O-C 3.59Å; K224-G227 WeakPolarHBondContact O-CA 3.33Å; K224-G227 PolarHBondContact O-N 3.21Å; K224-G227 VanDerWaalsContact O-N 3.16Å; K225-G227 VanDerWaalsContact C-N 3.34Å; G227-A229 PolarHBondContact O-N 2.87Å; G227-R230 PolarHBondContact O-N 2.88Å; G227-T231 WeakPolarHBondContact O-CB 3.48Å; G227-T231 PolarHBondContact O-N 3.4Å; G227-T231 PolarHBondContact O-OG1 2.96Å
228	E	85.1	Confident	76.2	Confident	129 Å²	129	116.7 Å²	116.7	60%	0.603	59%	0.589	S	S	*	*	H	α-helix	trans	-62.5	-40	176.7	-72.1	168.6	-173.7	0	0	111.8	K224 T231 S232	K224-E228 WeakPolarHBondContact O-CB 3.38Å; K224-E228 VanDerWaalsContact O-CG 3.28Å; K224-E228 WeakPolarHBondContact O-CG 3.34Å; K224-E228 PolarHBondContact O-N 2.89Å; E228-T231 PolarHBondContact O-N 3.42Å; E228-S232 WeakPolarHBondContact O-CB 3.31Å; E228-S232 PolarHBondContact O-N 3.33Å; E228-S232 PolarHBondContact O-OG 2.9Å
229	A	82.3	Confident	78.3	Confident	56 Å²	56	110.7 Å²	110.7	46%	0.463	57%	0.566	S	S	.	*	H	α-helix	trans	-67.8	-34.6	174.4	0	0	0	0	0	112.7	K225 G227 S232 L233	K225-A229 WeakPolarHBondContact O-CB 3.13Å; K225-A229 PolarHBondContact O-N 3.33Å; G227-A229 PolarHBondContact O-N 2.87Å; A229-S232 WeakPolarHBondContact CA-OG 3.22Å; A229-S232 PolarHBondContact O-OG 3.21Å; A229-L233 VanDerWaalsContact O-CB 3.28Å; A229-L233 WeakPolarHBondContact O-CB 3.37Å; A229-L233 PolarHBondContact O-N 2.87Å
230	R	85.6	Confident	80.3	Confident	187 Å²	187	107.5 Å²	107.5	71%	0.706	55%	0.548	S	S	*	.	H	α-helix	trans	-71.6	-41.1	172	-89	-177.7	152.5	167.8	-4.7	112	I226 G227 L233 M234	I226-R230 WeakPolarHBondContact O-CB 3.4Å; I226-R230 PolarHBondContact O-N 2.99Å; G227-R230 PolarHBondContact O-N 2.88Å; R230-L233 PolarHBondContact O-N 2.92Å; R230-M234 WeakPolarHBondContact O-CB 3.28Å; R230-M234 PolarHBondContact O-N 3.28Å
231	T	86.5	Confident	81.9	Confident	84 Å²	84	104.5 Å²	104.5	52%	0.515	54%	0.535	S	S	.	.	H	α-helix	trans	-64.6	-41.4	176.8	-54.4	0	0	0	0	110.4	G227 E228 M234 D235	G227-T231 WeakPolarHBondContact O-CB 3.48Å; G227-T231 PolarHBondContact O-N 3.4Å; G227-T231 PolarHBondContact O-OG1 2.96Å; E228-T231 PolarHBondContact O-N 3.42Å; T231-M234 WeakPolarHBondContact O-CB 3.34Å; T231-M234 PolarHBondContact O-N 2.8Å; T231-D235 WeakPolarHBondContact O-CB 3.47Å; T231-D235 PolarHBondContact O-N 3.18Å
232	S	87.2	Confident	83	Confident	61 Å²	61	99.9 Å²	99.9	43%	0.427	52%	0.515	S	S	.	.	H	α-helix	trans	-68.4	-38.8	174.7	66.7	0	0	0	0	112.5	E228 A229 M234 D235 I236	E228-S232 WeakPolarHBondContact O-CB 3.31Å; E228-S232 PolarHBondContact O-N 3.33Å; E228-S232 PolarHBondContact O-OG 2.9Å; A229-S232 WeakPolarHBondContact CA-OG 3.22Å; A229-S232 PolarHBondContact O-OG 3.21Å; S232-M234 VanDerWaalsContact C-N 3.31Å; S232-M234 PolarHBondContact O-N 2.83Å; S232-D235 PolarHBondContact O-N 3.23Å; S232-I236 WeakPolarHBondContact O-CB 3.21Å; S232-I236 VanDerWaalsContact O-CG1 3.23Å; S232-I236 WeakPolarHBondContact O-CG1 3.37Å; S232-I236 PolarHBondContact O-N 3.03Å
233	L	88.2	Confident	83.7	Confident	96 Å²	96	102.9 Å²	102.9	50%	0.503	53%	0.532	S	S	.	.	H	α-helix	trans	-64.1	-37.4	172.7	-177.1	65.6	0	0	0	112	A229 R230 K237	A229-L233 VanDerWaalsContact O-CB 3.28Å; A229-L233 WeakPolarHBondContact O-CB 3.37Å; A229-L233 PolarHBondContact O-N 2.87Å; R230-L233 PolarHBondContact O-N 2.92Å; L233-K237 WeakPolarHBondContact O-CG 3.4Å; L233-K237 PolarHBondContact O-N 2.88Å
234	M	87.6	Confident	84.1	Confident	108 Å²	108	100.4 Å²	100.4	53%	0.532	53%	0.529	S	S	.	.	H	α-helix	trans	-65.4	-45.7	173.7	-175.7	-178.2	78.2	0	0	110.7	R230 T231 S232 I236 K237 L238	R230-M234 WeakPolarHBondContact O-CB 3.28Å; R230-M234 PolarHBondContact O-N 3.28Å; T231-M234 WeakPolarHBondContact O-CB 3.34Å; T231-M234 PolarHBondContact O-N 2.8Å; S232-M234 VanDerWaalsContact C-N 3.31Å; S232-M234 PolarHBondContact O-N 2.83Å; M234-I236 VanDerWaalsContact C-N 3.32Å; M234-I236 PolarHBondContact O-N 3.38Å; M234-K237 CarbonylContact O-C 3.47Å; M234-K237 PolarHBondContact O-N 3.38Å; M234-K237 VanDerWaalsContact O-N 3.1Å; M234-L238 HydrophobicContact CE-CD1 4.29Å; M234-L238 HydrophobicContact CG-CD1 4.11Å; M234-L238 HydrophobicContact CG-CG 4.38Å; M234-L238 WeakPolarHBondContact O-CG 3.29Å; M234-L238 PolarHBondContact O-N 3.34Å
235	D	88.5	Confident	84.4	Confident	98 Å²	98	96.5 Å²	96.5	52%	0.524	52%	0.518	S	S	.	.	H	α-helix	trans	-61.5	-40.9	178.2	-156.7	31.7	0	0	0	111	T231 S232 K237 L238 T239	T231-D235 WeakPolarHBondContact O-CB 3.47Å; T231-D235 PolarHBondContact O-N 3.18Å; S232-D235 PolarHBondContact O-N 3.23Å; D235-K237 VanDerWaalsContact C-N 3.34Å; D235-K237 PolarHBondContact O-N 3.32Å; D235-L238 PolarHBondContact O-N 3.45Å; D235-T239 WeakPolarHBondContact O-CG2 3.25Å; D235-T239 PolarHBondContact O-N 2.8Å; D235-T239 PolarHBondContact O-OG1 3.44Å; D235-T239 VanDerWaalsContact O-OG1 3.1Å
236	I	88.3	Confident	84.5	Confident	89 Å²	89	95.4 Å²	95.4	46%	0.456	53%	0.528	S	S	.	.	H	α-helix	trans	-61.8	-39.7	172.8	-68.8	164.1	0	0	0	112	S232 M234 T239 Q240	S232-I236 WeakPolarHBondContact O-CB 3.21Å; S232-I236 VanDerWaalsContact O-CG1 3.23Å; S232-I236 WeakPolarHBondContact O-CG1 3.37Å; S232-I236 PolarHBondContact O-N 3.03Å; M234-I236 VanDerWaalsContact C-N 3.32Å; M234-I236 PolarHBondContact O-N 3.38Å; I236-T239 WeakPolarHBondContact CA-OG1 3.38Å; I236-T239 PolarHBondContact O-OG1 3.49Å; I236-Q240 WeakPolarHBondContact O-CG 3.48Å; I236-Q240 PolarHBondContact O-N 3.09Å
237	K	88	Confident	84.8	Confident	129 Å²	129	94.9 Å²	94.9	56%	0.561	54%	0.544	S	S	*	.	H	α-helix	trans	-70	-38.2	175.8	-76.2	-173.8	176.8	-173.3	0	111.7	L233 M234 D235 Q240 V241	L233-K237 WeakPolarHBondContact O-CG 3.4Å; L233-K237 PolarHBondContact O-N 2.88Å; M234-K237 CarbonylContact O-C 3.47Å; M234-K237 PolarHBondContact O-N 3.38Å; M234-K237 VanDerWaalsContact O-N 3.1Å; D235-K237 VanDerWaalsContact C-N 3.34Å; D235-K237 PolarHBondContact O-N 3.32Å; K237-Q240 PolarHBondContact O-N 2.89Å; K237-V241 WeakPolarHBondContact O-CG2 3.39Å; K237-V241 PolarHBondContact O-N 3.37Å; K237-V241 VanDerWaalsContact O-N 3.08Å
238	L	87.4	Confident	84.6	Confident	98 Å²	98	98.7 Å²	98.7	51%	0.513	55%	0.554	S	S	.	*	H	α-helix	trans	-67.2	-39.7	176	-72.2	174.7	0	0	0	111.1	M234 D235 V241 S242	M234-L238 HydrophobicContact CE-CD1 4.29Å; M234-L238 HydrophobicContact CG-CD1 4.11Å; M234-L238 HydrophobicContact CG-CG 4.38Å; M234-L238 WeakPolarHBondContact O-CG 3.29Å; M234-L238 PolarHBondContact O-N 3.34Å; D235-L238 PolarHBondContact O-N 3.45Å; L238-V241 PolarHBondContact O-N 3.08Å; L238-S242 VanDerWaalsContact O-CB 3.23Å; L238-S242 WeakPolarHBondContact O-CB 3.38Å; L238-S242 PolarHBondContact O-N 3.3Å
239	T	85.6	Confident	84.6	Confident	63 Å²	63	99 Å²	99	39%	0.387	57%	0.565	S	S	.	*	H	α-helix	trans	-67.5	-40.1	174.8	54	0	0	0	0	111.8	D235 I236 V241 S242 D243	D235-T239 WeakPolarHBondContact O-CG2 3.25Å; D235-T239 PolarHBondContact O-N 2.8Å; D235-T239 PolarHBondContact O-OG1 3.44Å; D235-T239 VanDerWaalsContact O-OG1 3.1Å; I236-T239 WeakPolarHBondContact CA-OG1 3.38Å; I236-T239 PolarHBondContact O-OG1 3.49Å; T239-V241 VanDerWaalsContact C-N 3.29Å; T239-V241 PolarHBondContact O-N 2.89Å; T239-S242 CarbonylContact O-C 3.4Å; T239-S242 WeakPolarHBondContact O-CB 3.37Å; T239-S242 PolarHBondContact O-N 3.12Å; T239-S242 VanDerWaalsContact O-N 3.09Å; T239-D243 WeakPolarHBondContact O-CB 3.41Å; T239-D243 VanDerWaalsContact O-CG 3.23Å; T239-D243 PolarHBondContact O-N 3.49Å
240	Q	86.4	Confident	84.7	Confident	122 Å²	122	102.6 Å²	102.6	57%	0.57	58%	0.581	S	S	*	*	H	α-helix	trans	-59.6	-38.5	172.2	-79.1	-179	-9	0	0	113	I236 K237 S244	I236-Q240 WeakPolarHBondContact O-CG 3.48Å; I236-Q240 PolarHBondContact O-N 3.09Å; K237-Q240 PolarHBondContact O-N 2.89Å; Q240-S244 PolarHBondContact O-OG 3.11Å
241	V	84.3	Confident	84.7	Confident	95 Å²	95	98.1 Å²	98.1	58%	0.576	57%	0.574	S	S	*	*	H	α-helix	trans	-70.4	-41.4	173.1	174.6	0	0	0	0	110.6	K237 L238 T239 S244 V245	K237-V241 WeakPolarHBondContact O-CG2 3.39Å; K237-V241 PolarHBondContact O-N 3.37Å; K237-V241 VanDerWaalsContact O-N 3.08Å; L238-V241 PolarHBondContact O-N 3.08Å; T239-V241 VanDerWaalsContact C-N 3.29Å; T239-V241 PolarHBondContact O-N 2.89Å; V241-S244 WeakPolarHBondContact O-CB 3.31Å; V241-S244 PolarHBondContact O-N 3.32Å; V241-S244 VanDerWaalsContact O-N 3.15Å; V241-V245 WeakPolarHBondContact O-CG2 3.32Å; V241-V245 PolarHBondContact O-N 3.29Å
242	S	83	Confident	84.9	Confident	39 Å²	39	98.8 Å²	98.8	27%	0.273	57%	0.574	S	S	.	*	H	α-helix	trans	-64.5	-39	179.9	-165.4	0	0	0	0	112.7	L238 T239 S244 V245 Q248	L238-S242 VanDerWaalsContact O-CB 3.23Å; L238-S242 WeakPolarHBondContact O-CB 3.38Å; L238-S242 PolarHBondContact O-N 3.3Å; T239-S242 CarbonylContact O-C 3.4Å; T239-S242 WeakPolarHBondContact O-CB 3.37Å; T239-S242 PolarHBondContact O-N 3.12Å; T239-S242 VanDerWaalsContact O-N 3.09Å; S242-S244 PolarHBondContact O-N 3.35Å; S242-V245 WeakPolarHBondContact O-CA 3.32Å; S242-V245 WeakPolarHBondContact O-CB 3.4Å; S242-V245 PolarHBondContact O-N 3.27Å; S242-Q248 PolarHBondContact OG-NE2 3.45Å; S242-Q248 PolarHBondContact OG-OE1 2.92Å; S242-Q248 VanDerWaalsContact OG-OE1 3.07Å
243	D	81.3	Confident	85.1	Confident	139 Å²	139	100.2 Å²	100.2	74%	0.743	58%	0.582	S	S	*	*	H	α-helix	trans	-62.6	-25.6	175.9	-73.2	-11.7	0	0	0	111.7	T239	T239-D243 WeakPolarHBondContact O-CB 3.41Å; T239-D243 VanDerWaalsContact O-CG 3.23Å; T239-D243 PolarHBondContact O-N 3.49Å
244	S	81.1	Confident	85.1	Confident	100 Å²	100	103.1 Å²	103.1	70%	0.699	59%	0.591	S	S	*	*	H	α-helix	trans	-82.1	-16.2	174.3	-53	0	0	0	0	112.8	Q240 V241 S242 S246	Q240-S244 PolarHBondContact O-OG 3.11Å; V241-S244 WeakPolarHBondContact O-CB 3.31Å; V241-S244 PolarHBondContact O-N 3.32Å; V241-S244 VanDerWaalsContact O-N 3.15Å; S242-S244 PolarHBondContact O-N 3.35Å; S244-S246 PolarHBondContact O-N 3.08Å
245	V	81	Confident	85.3	Confident	75 Å²	75	99.1 Å²	99.1	46%	0.455	58%	0.577	S	S	.	*			trans	-89.3	88.9	176.8	-177.7	0	0	0	0	108.9	V241 S242 Q248	V241-V245 WeakPolarHBondContact O-CG2 3.32Å; V241-V245 PolarHBondContact O-N 3.29Å; S242-V245 WeakPolarHBondContact O-CA 3.32Å; S242-V245 WeakPolarHBondContact O-CB 3.4Å; S242-V245 PolarHBondContact O-N 3.27Å; V245-Q248 HydrophobicContact CG1-CG 4.08Å
246	S	77.7	Confident	85.4	Confident	116 Å²	116	100.7 Å²	100.7	81%	0.811	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	148.7	168.3	66.1	0	0	0	0	111	S244	S244-S246 PolarHBondContact O-N 3.08Å
247	G	82.7	Confident	85.6	Confident	77 Å²	77	101.8 Å²	101.8	79%	0.794	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	96.5	6.2	-179.6	0	0	0	0	0	115.6	T249	G247-T249 PolarHBondContact O-N 2.86Å
248	Q	79.6	Confident	85.7	Confident	111 Å²	111	99.3 Å²	99.3	52%	0.519	58%	0.579	S	S	.	*			trans	-69.5	120.8	167.1	-63.4	-177	0.9	0	0	109.8	S242 V245	S242-Q248 PolarHBondContact OG-NE2 3.45Å; S242-Q248 PolarHBondContact OG-OE1 2.92Å; S242-Q248 VanDerWaalsContact OG-OE1 3.07Å; V245-Q248 HydrophobicContact CG1-CG 4.08Å
249	T	85.1	Confident	85.8	Confident	136 Å²	136	99.2 Å²	99.2	83%	0.834	58%	0.578	S	S	*	*			trans	-93.3	111.9	177.7	57.2	0	0	0	0	109.9	G247	G247-T249 PolarHBondContact O-N 2.86Å
250	V	83.3	Confident	86	Confident	131 Å²	131	99.7 Å²	99.7	79%	0.794	58%	0.578	S	S	*	*			trans	-118.9	119.5	168.7	178.8	0	0	0	0	107.1
251	V	85.8	Confident	86.1	Confident	94 Å²	94	100.9 Å²	100.9	57%	0.57	58%	0.584	S	S	*	*			trans	-80.4	138.9	173.8	177.4	0	0	0	0	108.5	P253 Y256	V251-P253 WeakPolarHBondContact O-CD 3.28Å; V251-P253 VanDerWaalsContact O-N 3.14Å; V251-Y256 HydrophobicContact CG1-CD2 3.73Å; V251-Y256 HydrophobicContact CG1-CG 3.99Å
252	D	90.1	Very high	86.2	Confident	97 Å²	97	100.6 Å²	100.6	52%	0.519	59%	0.586	S	S	.	*			trans	-62.8	111.9	170.1	172.9	20.8	0	0	0	109.3	K254 G255 Y256	D252-K254 PolarHBondContact O-N 3.22Å; D252-K254 WeakPolarHBondContact OD1-CB 3.41Å; D252-K254 PolarHBondContact OD1-N 3.48Å; D252-G255 PolarHBondContact O-N 3.42Å; D252-G255 PolarHBondContact OD2-N 3.19Å; D252-Y256 WeakPolarHBondContact O-CB 3.24Å; D252-Y256 PolarHBondContact O-N 3.21Å
253	P	91.1	Very high	86.1	Confident	92 Å²	92	105 Å²	105	60%	0.597	60%	0.604	S	S	*	*	H	α-helix	trans	-60.4	-30	-178.2	25.4	-34.3	0	0	0	111.6	V251 L257	V251-P253 WeakPolarHBondContact O-CD 3.28Å; V251-P253 VanDerWaalsContact O-N 3.14Å; P253-L257 VanDerWaalsContact O-CB 3.3Å; P253-L257 WeakPolarHBondContact O-CB 3.38Å; P253-L257 WeakPolarHBondContact O-CG 3.36Å; P253-L257 PolarHBondContact O-N 3.41Å
254	K	89.8	Confident	86	Confident	157 Å²	157	103.6 Å²	103.6	68%	0.683	60%	0.595	S	S	*	*	H	α-helix	trans	-72.3	-47.4	178.5	-173	-177.5	177.5	-176.2	0	111.5	D252 L257 T258	D252-K254 PolarHBondContact O-N 3.22Å; D252-K254 WeakPolarHBondContact OD1-CB 3.41Å; D252-K254 PolarHBondContact OD1-N 3.48Å; K254-L257 PolarHBondContact O-N 3.31Å; K254-T258 WeakPolarHBondContact O-CB 3.37Å; K254-T258 PolarHBondContact O-N 2.84Å; K254-T258 PolarHBondContact O-OG1 2.96Å
255	G	90.5	Very high	85.4	Confident	23 Å²	23	103.4 Å²	103.4	24%	0.237	59%	0.592	C	S	.	*	H	α-helix	trans	-57.3	-49	173.4	0	0	0	0	0	111.7	D252 L257 T258 D259	D252-G255 PolarHBondContact O-N 3.42Å; D252-G255 PolarHBondContact OD2-N 3.19Å; G255-L257 PolarHBondContact O-N 2.9Å; G255-T258 WeakPolarHBondContact O-CB 3.35Å; G255-T258 PolarHBondContact O-N 2.87Å; G255-T258 VanDerWaalsContact O-N 3.1Å; G255-D259 PolarHBondContact O-N 3.48Å
256	Y	91.6	Very high	85.1	Confident	132 Å²	132	108.6 Å²	108.6	52%	0.518	61%	0.611	S	S	.	*	H	α-helix	trans	-63.4	-41.1	-179.9	-162.8	-99.6	0	0	0	113.1	V251 D252 T258 D259 L260	V251-Y256 HydrophobicContact CG1-CD2 3.73Å; V251-Y256 HydrophobicContact CG1-CG 3.99Å; D252-Y256 WeakPolarHBondContact O-CB 3.24Å; D252-Y256 PolarHBondContact O-N 3.21Å; Y256-T258 VanDerWaalsContact C-N 3.33Å; Y256-D259 PolarHBondContact O-N 2.91Å; Y256-L260 HydrophobicContact CD1-CD1 3.76Å; Y256-L260 HydrophobicContact CD1-CG 4.11Å; Y256-L260 HydrophobicContact CE1-CD1 3.61Å; Y256-L260 HydrophobicContact CE1-CD2 4.38Å; Y256-L260 HydrophobicContact CE1-CG 3.97Å; Y256-L260 WeakPolarHBondContact O-CB 3.43Å; Y256-L260 WeakPolarHBondContact O-CG 3Å; Y256-L260 PolarHBondContact O-N 3.45Å
257	L	91.5	Very high	84.7	Confident	112 Å²	112	110.9 Å²	110.9	59%	0.586	61%	0.609	S	S	*	*	H	α-helix	trans	-66.7	-34.7	174	-73.1	174	0	0	0	112.2	P253 K254 G255 L260 Q261	P253-L257 VanDerWaalsContact O-CB 3.3Å; P253-L257 WeakPolarHBondContact O-CB 3.38Å; P253-L257 WeakPolarHBondContact O-CG 3.36Å; P253-L257 PolarHBondContact O-N 3.41Å; K254-L257 PolarHBondContact O-N 3.31Å; G255-L257 PolarHBondContact O-N 2.9Å; L257-L260 HydrophobicContact CD2-CD1 4.43Å; L257-L260 PolarHBondContact O-N 3.29Å; L257-Q261 WeakPolarHBondContact O-CB 3.34Å; L257-Q261 PolarHBondContact O-N 3.32Å
258	T	90.5	Very high	83.8	Confident	77 Å²	77	109.6 Å²	109.6	47%	0.472	60%	0.595	S	S	.	*	H	α-helix	trans	-66	-41.2	174.9	-54.6	0	0	0	0	111	K254 G255 Y256 Q261 S262	K254-T258 WeakPolarHBondContact O-CB 3.37Å; K254-T258 PolarHBondContact O-N 2.84Å; K254-T258 PolarHBondContact O-OG1 2.96Å; G255-T258 WeakPolarHBondContact O-CB 3.35Å; G255-T258 PolarHBondContact O-N 2.87Å; G255-T258 VanDerWaalsContact O-N 3.1Å; Y256-T258 VanDerWaalsContact C-N 3.33Å; T258-Q261 PolarHBondContact O-N 3.46Å; T258-S262 PolarHBondContact O-N 3.19Å
259	D	90.7	Very high	83.4	Confident	95 Å²	95	106.4 Å²	106.4	51%	0.508	59%	0.592	S	S	.	*	H	α-helix	trans	-69.9	-39.2	176.7	-69.6	-20	0	0	0	112	G255 Y256 Q261 S262 M263	G255-D259 PolarHBondContact O-N 3.48Å; Y256-D259 PolarHBondContact O-N 2.91Å; D259-Q261 VanDerWaalsContact C-N 3.3Å; D259-Q261 PolarHBondContact O-N 2.94Å; D259-S262 WeakPolarHBondContact CA-OG 3.31Å; D259-S262 PolarHBondContact O-N 3.41Å; D259-S262 PolarHBondContact O-OG 2.92Å; D259-M263 WeakPolarHBondContact O-CG 3.3Å; D259-M263 PolarHBondContact O-N 2.88Å
260	L	89.3	Confident	83.1	Confident	74 Å²	74	104.4 Å²	104.4	39%	0.387	58%	0.576	S	S	.	*	H	α-helix	trans	-60.9	-41.4	170.5	-75.6	178.6	0	0	0	111.3	Y256 L257 S262 M263 I264	Y256-L260 HydrophobicContact CD1-CD1 3.76Å; Y256-L260 HydrophobicContact CD1-CG 4.11Å; Y256-L260 HydrophobicContact CE1-CD1 3.61Å; Y256-L260 HydrophobicContact CE1-CD2 4.38Å; Y256-L260 HydrophobicContact CE1-CG 3.97Å; Y256-L260 WeakPolarHBondContact O-CB 3.43Å; Y256-L260 WeakPolarHBondContact O-CG 3Å; Y256-L260 PolarHBondContact O-N 3.45Å; L257-L260 HydrophobicContact CD2-CD1 4.43Å; L257-L260 PolarHBondContact O-N 3.29Å; L260-S262 VanDerWaalsContact C-N 3.33Å; L260-S262 PolarHBondContact O-N 2.72Å; L260-M263 HydrophobicContact CD2-CE 3.86Å; L260-M263 PolarHBondContact O-N 2.8Å; L260-I264 WeakPolarHBondContact O-CG1 3.29Å; L260-I264 PolarHBondContact O-N 3.27Å
261	Q	87.5	Confident	83.1	Confident	146 Å²	146	102.9 Å²	102.9	68%	0.682	56%	0.563	S	S	*	*	H	α-helix	trans	-66.9	-33.5	177.2	-171.3	171.6	1.7	0	0	112.4	L257 T258 D259 I264	L257-Q261 WeakPolarHBondContact O-CB 3.34Å; L257-Q261 PolarHBondContact O-N 3.32Å; T258-Q261 PolarHBondContact O-N 3.46Å; D259-Q261 VanDerWaalsContact C-N 3.3Å; D259-Q261 PolarHBondContact O-N 2.94Å; Q261-I264 HydrophobicContact CG-CD1 4.44Å
262	S	86	Confident	83.1	Confident	90 Å²	90	103.3 Å²	103.3	63%	0.629	56%	0.562	S	S	*	*	H	α-helix	trans	-73.9	-25.5	176.5	74.2	0	0	0	0	113.1	T258 D259 L260	T258-S262 PolarHBondContact O-N 3.19Å; D259-S262 WeakPolarHBondContact CA-OG 3.31Å; D259-S262 PolarHBondContact O-N 3.41Å; D259-S262 PolarHBondContact O-OG 2.92Å; L260-S262 VanDerWaalsContact C-N 3.33Å; L260-S262 PolarHBondContact O-N 2.72Å
263	M	82.3	Confident	83	Confident	131 Å²	131	103.5 Å²	103.5	65%	0.645	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-8.8	175.6	-71.3	-167.7	-67.8	0	0	114.7	D259 L260 P265	D259-M263 WeakPolarHBondContact O-CG 3.3Å; D259-M263 PolarHBondContact O-N 2.88Å; L260-M263 HydrophobicContact CD2-CE 3.86Å; L260-M263 PolarHBondContact O-N 2.8Å; M263-P265 VanDerWaalsContact O-CD 3.25Å; M263-P265 WeakPolarHBondContact O-CD 3.3Å
264	I	78.4	Confident	82.7	Confident	109 Å²	109	100.2 Å²	100.2	56%	0.559	54%	0.54	S	S	*	.	S	Bend	trans	-63.1	118.9	178	-62.6	172.9	0	0	0	108.8	L260 Q261 Q266	L260-I264 WeakPolarHBondContact O-CG1 3.29Å; L260-I264 PolarHBondContact O-N 3.27Å; Q261-I264 HydrophobicContact CG-CD1 4.44Å; I264-Q266 PolarHBondContact O-N 3.08Å
265	P	69.3	Low	82.6	Confident	96 Å²	96	98.2 Å²	98.2	62%	0.623	53%	0.531	S	S	*	.			trans	-62.6	115.2	176.5	-17.8	30.2	0	0	0	109.6	M263 H267 G268	M263-P265 VanDerWaalsContact O-CD 3.25Å; M263-P265 WeakPolarHBondContact O-CD 3.3Å; P265-H267 PolarHBondContact O-N 2.76Å; P265-G268 PolarHBondContact O-N 2.9Å
266	Q	73.4	Confident	82.6	Confident	185 Å²	185	104.5 Å²	104.5	86%	0.864	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-16.7	174.6	-68	-175.8	-8	0	0	112.7	I264	I264-Q266 PolarHBondContact O-N 3.08Å
267	H	69.2	Low	82.6	Confident	164 Å²	164	99.7 Å²	99.7	76%	0.759	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.3	20.7	-177	-62.4	86.7	0	0	0	113.7	P265 G269	P265-H267 PolarHBondContact O-N 2.76Å; H267-G269 PolarHBondContact O-N 3.05Å; H267-G269 VanDerWaalsContact O-N 3.15Å
268	G	65.9	Low	82.7	Confident	50 Å²	50	97.1 Å²	97.1	52%	0.515	52%	0.522	S	S	.	.			trans	-69.4	107.1	172.7	0	0	0	0	0	110.5	P265	P265-G268 PolarHBondContact O-N 2.9Å
269	G	69.2	Low	82.7	Confident	44 Å²	44	99.3 Å²	99.3	45%	0.454	53%	0.53	S	S	.	.			trans	-62.7	170	173.7	0	0	0	0	0	112.4	H267 I271	H267-G269 PolarHBondContact O-N 3.05Å; H267-G269 VanDerWaalsContact O-N 3.15Å; G269-I271 PolarHBondContact O-N 2.86Å; G269-I271 VanDerWaalsContact O-N 3.14Å
270	D	80.2	Confident	82.8	Confident	93 Å²	93	99.9 Å²	99.9	50%	0.497	53%	0.532	S	S	.	.			trans	-56.5	123.3	175.3	-173.1	-29	0	0	0	109.6	N272 D273 M274	D270-N272 PolarHBondContact O-N 3.17Å; D270-N272 VanDerWaalsContact O-N 3.13Å; D270-N272 PolarHBondContact OD1-N 3.45Å; D270-D273 HydrophobicContact CB-CB 4.17Å; D270-D273 PolarHBondContact O-N 3.05Å; D270-M274 WeakPolarHBondContact O-CG 3.25Å; D270-M274 PolarHBondContact O-N 2.72Å
271	I	83	Confident	83	Confident	100 Å²	100	97.9 Å²	97.9	51%	0.513	52%	0.522	S	S	.	.	H	α-helix	trans	-54.9	-32.8	-178	-174.2	58.3	0	0	0	112.5	G269 K275	G269-I271 PolarHBondContact O-N 2.86Å; G269-I271 VanDerWaalsContact O-N 3.14Å; I271-K275 VanDerWaalsContact O-CG 3.3Å; I271-K275 WeakPolarHBondContact O-CG 3.47Å; I271-K275 PolarHBondContact O-N 2.78Å
272	N	85.3	Confident	83.3	Confident	103 Å²	103	95.4 Å²	95.4	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-73.7	-42.7	177.9	-76.7	-30.6	0	0	0	111.5	D270 M274 K275 K276	D270-N272 PolarHBondContact O-N 3.17Å; D270-N272 VanDerWaalsContact O-N 3.13Å; D270-N272 PolarHBondContact OD1-N 3.45Å; N272-M274 VanDerWaalsContact C-N 3.32Å; N272-M274 PolarHBondContact O-N 2.84Å; N272-K275 WeakPolarHBondContact O-CB 3.08Å; N272-K275 PolarHBondContact O-N 2.92Å; N272-K276 WeakPolarHBondContact O-CB 3.4Å; N272-K276 PolarHBondContact O-N 3.34Å
273	D	87.5	Confident	83.6	Confident	100 Å²	100	93.5 Å²	93.5	54%	0.535	50%	0.496	S	S	.	.	H	α-helix	trans	-65.9	-37.3	174.8	-74.3	-23.6	0	0	0	111.4	D270 K275 K276 A277	D270-D273 HydrophobicContact CB-CB 4.17Å; D270-D273 PolarHBondContact O-N 3.05Å; D273-K275 VanDerWaalsContact C-N 3.33Å; D273-K275 PolarHBondContact O-N 3.08Å; D273-K276 PolarHBondContact O-N 3.42Å; D273-A277 VanDerWaalsContact O-CB 3.25Å; D273-A277 WeakPolarHBondContact O-CB 3.32Å; D273-A277 PolarHBondContact O-N 2.93Å
274	M	85.3	Confident	84.1	Confident	23 Å²	23	89.3 Å²	89.3	11%	0.113	48%	0.477	C	S	.	.	H	α-helix	trans	-62.7	-39.4	172.7	-68.9	176.4	74.9	0	0	112	D270 N272 R278 A305	D270-M274 WeakPolarHBondContact O-CG 3.25Å; D270-M274 PolarHBondContact O-N 2.72Å; N272-M274 VanDerWaalsContact C-N 3.32Å; N272-M274 PolarHBondContact O-N 2.84Å; M274-R278 VanDerWaalsContact O-CB 3.26Å; M274-R278 WeakPolarHBondContact O-CB 3.49Å; M274-R278 PolarHBondContact O-N 3.28Å; M274-A305 VanDerWaalsContact CE-CA 3.47Å; M274-A305 HydrophobicContact CE-CB 3.46Å; M274-A305 VanDerWaalsContact CE-CB 3.46Å
275	K	88.7	Confident	84.7	Confident	115 Å²	115	86.1 Å²	86.1	50%	0.5	46%	0.458	S	S	.	.	H	α-helix	trans	-66.3	-41.4	173.7	-76	172.6	-177.4	175.5	0	111.6	I271 N272 D273 R278 L279	I271-K275 VanDerWaalsContact O-CG 3.3Å; I271-K275 WeakPolarHBondContact O-CG 3.47Å; I271-K275 PolarHBondContact O-N 2.78Å; N272-K275 WeakPolarHBondContact O-CB 3.08Å; N272-K275 PolarHBondContact O-N 2.92Å; D273-K275 VanDerWaalsContact C-N 3.33Å; D273-K275 PolarHBondContact O-N 3.08Å; K275-R278 WeakPolarHBondContact O-CB 3.48Å; K275-R278 PolarHBondContact O-N 2.71Å; K275-L279 PolarHBondContact O-N 3.08Å
276	K	90.4	Very high	85.8	Confident	155 Å²	155	87.3 Å²	87.3	67%	0.674	46%	0.456	S	S	*	.	H	α-helix	trans	-65.6	-43.9	177.7	-162.3	179	-177.6	-176.8	0	111.3	N272 D273 R278 L279 L280	N272-K276 WeakPolarHBondContact O-CB 3.4Å; N272-K276 PolarHBondContact O-N 3.34Å; D273-K276 PolarHBondContact O-N 3.42Å; K276-R278 VanDerWaalsContact C-N 3.33Å; K276-R278 PolarHBondContact O-N 2.94Å; K276-L279 PolarHBondContact O-N 3.36Å; K276-L280 WeakPolarHBondContact O-CB 3.13Å; K276-L280 PolarHBondContact O-N 3.4Å
277	A	91.7	Very high	86.7	Confident	31 Å²	31	83.1 Å²	83.1	26%	0.256	44%	0.443	S	S	.	.	H	α-helix	trans	-62.1	-39.8	172.8	0	0	0	0	0	111.5	D273 L279 L280 L281 L301	D273-A277 VanDerWaalsContact O-CB 3.25Å; D273-A277 WeakPolarHBondContact O-CB 3.32Å; D273-A277 PolarHBondContact O-N 2.93Å; A277-L279 VanDerWaalsContact C-N 3.34Å; A277-L279 PolarHBondContact O-N 3.27Å; A277-L280 PolarHBondContact O-N 3Å; A277-L281 WeakPolarHBondContact O-CB 3.19Å; A277-L281 VanDerWaalsContact O-CG 3.31Å; A277-L281 WeakPolarHBondContact O-CG 3.5Å; A277-L281 PolarHBondContact O-N 3.42Å; A277-L301 HydrophobicContact CB-CD1 4.2Å; A277-L301 HydrophobicContact CB-CD2 3.78Å
278	R	92.1	Very high	87.7	Confident	58 Å²	58	79.5 Å²	79.5	22%	0.219	43%	0.429	C	S	.	.	H	α-helix	trans	-61.7	-42.8	175.5	-177	-175.7	-73.7	115.5	1.6	111.5	M274 K275 K276 K282 L301 E302	M274-R278 VanDerWaalsContact O-CB 3.26Å; M274-R278 WeakPolarHBondContact O-CB 3.49Å; M274-R278 PolarHBondContact O-N 3.28Å; K275-R278 WeakPolarHBondContact O-CB 3.48Å; K275-R278 PolarHBondContact O-N 2.71Å; K276-R278 VanDerWaalsContact C-N 3.33Å; K276-R278 PolarHBondContact O-N 2.94Å; R278-K282 WeakPolarHBondContact O-CB 3.39Å; R278-K282 PolarHBondContact O-N 3.16Å; R278-L301 HydrophobicContact CB-CD2 4.03Å; R278-E302 WeakPolarHBondContact CD-OE1 3.46Å; R278-E302 WeakPolarHBondContact CG-OE1 3.47Å; R278-E302 IonicContact CZ-OE1 2.77Å; R278-E302 IonicContact CZ-OE2 2.7Å; R278-E302 IonicContact NE-OE1 2.72Å; R278-E302 PolarHBondContact NE-OE1 2.69Å; R278-E302 IonicContact NE-OE2 2.81Å; R278-E302 PolarHBondContact NE-OE2 2.9Å; R278-E302 IonicContact NH2-OE1 3.53Å; R278-E302 IonicContact NH2-OE2 3.43Å; R278-E302 PolarHBondContact NH2-OE2 2.87Å
279	L	92.1	Very high	88.9	Confident	124 Å²	124	79.6 Å²	79.6	65%	0.649	42%	0.421	S	S	*	.	H	α-helix	trans	-65.7	-45.3	175.6	-177	65.7	0	0	0	111.5	K275 K276 A277 K282 S283	K275-L279 PolarHBondContact O-N 3.08Å; K276-L279 PolarHBondContact O-N 3.36Å; A277-L279 VanDerWaalsContact C-N 3.34Å; A277-L279 PolarHBondContact O-N 3.27Å; L279-K282 WeakPolarHBondContact O-CB 3.29Å; L279-K282 PolarHBondContact O-N 3.35Å; L279-S283 PolarHBondContact O-N 2.93Å
280	L	91.6	Very high	89.8	Confident	106 Å²	106	86.5 Å²	86.5	56%	0.555	44%	0.438	S	S	*	.	H	α-helix	trans	-58.9	-54.5	177.5	179.4	66.4	0	0	0	110.8	K276 A277 K282 S283 V284	K276-L280 WeakPolarHBondContact O-CB 3.13Å; K276-L280 PolarHBondContact O-N 3.4Å; A277-L280 PolarHBondContact O-N 3Å; L280-K282 VanDerWaalsContact C-N 3.25Å; L280-K282 PolarHBondContact O-N 3.08Å; L280-S283 WeakPolarHBondContact O-CA 3.46Å; L280-S283 PolarHBondContact O-N 3.45Å; L280-S283 PolarHBondContact O-OG 3.05Å; L280-V284 WeakPolarHBondContact O-CG2 3.47Å; L280-V284 PolarHBondContact O-N 3.28Å
281	L	93.2	Very high	90.4	Very high	32 Å²	32	86.4 Å²	86.4	17%	0.168	43%	0.434	C	S	.	.	H	α-helix	trans	-66.2	-29.4	-178.5	-65.7	179.6	0	0	0	112.4	A277 V284 R285 A297 S298 L301	A277-L281 WeakPolarHBondContact O-CB 3.19Å; A277-L281 VanDerWaalsContact O-CG 3.31Å; A277-L281 WeakPolarHBondContact O-CG 3.5Å; A277-L281 PolarHBondContact O-N 3.42Å; L281-V284 PolarHBondContact O-N 2.83Å; L281-R285 WeakPolarHBondContact O-CG 3.37Å; L281-R285 PolarHBondContact O-N 2.95Å; L281-A297 HydrophobicContact CD1-CB 4.11Å; L281-A297 HydrophobicContact CD2-CB 3.91Å; L281-S298 WeakPolarHBondContact CB-OG 3.3Å; L281-L301 HydrophobicContact CD1-CB 3.97Å; L281-L301 HydrophobicContact CD1-CD2 3.76Å; L281-L301 HydrophobicContact CD1-CG 4.44Å
282	K	93.6	Very high	90.7	Very high	94 Å²	94	82 Å²	82	41%	0.409	41%	0.413	S	S	.	.	H	α-helix	trans	-61.4	-48.2	167.6	178.3	174.7	178.7	-172.8	0	111.9	R278 L279 L280 V284 R285 E286	R278-K282 WeakPolarHBondContact O-CB 3.39Å; R278-K282 PolarHBondContact O-N 3.16Å; L279-K282 WeakPolarHBondContact O-CB 3.29Å; L279-K282 PolarHBondContact O-N 3.35Å; L280-K282 VanDerWaalsContact C-N 3.25Å; L280-K282 PolarHBondContact O-N 3.08Å; K282-V284 VanDerWaalsContact C-N 3.32Å; K282-V284 PolarHBondContact O-N 3.39Å; K282-R285 VanDerWaalsContact CA-CZ 3.46Å; K282-R285 WeakPolarHBondContact O-CG 3.33Å; K282-R285 PolarHBondContact O-N 3.35Å; K282-E286 WeakPolarHBondContact CE-OE1 3.27Å; K282-E286 WeakPolarHBondContact CG-OE1 3.05Å; K282-E286 IonicContact NZ-OE1 3.49Å; K282-E286 WeakPolarHBondContact O-CB 3.28Å; K282-E286 WeakPolarHBondContact O-CG 3.45Å; K282-E286 PolarHBondContact O-N 3.34Å; K282-E286 VanDerWaalsContact O-N 3.15Å
283	S	93.3	Very high	91.1	Very high	51 Å²	51	80.4 Å²	80.4	36%	0.357	41%	0.408	S	S	.	.	H	α-helix	trans	-61.9	-41.5	176.5	69.6	0	0	0	0	111.7	L279 L280 R285 E286 T287	L279-S283 PolarHBondContact O-N 2.93Å; L280-S283 WeakPolarHBondContact O-CA 3.46Å; L280-S283 PolarHBondContact O-N 3.45Å; L280-S283 PolarHBondContact O-OG 3.05Å; S283-R285 PolarHBondContact O-N 3.47Å; S283-E286 PolarHBondContact O-N 2.79Å; S283-T287 WeakPolarHBondContact O-CG2 3.4Å; S283-T287 PolarHBondContact O-N 3.39Å; S283-T287 PolarHBondContact O-OG1 3.07Å
284	V	92.9	Very high	91.3	Very high	42 Å²	42	75.8 Å²	75.8	26%	0.255	38%	0.384	S	S	.	.	H	α-helix	trans	-62.8	-45.3	-179	176.5	0	0	0	0	112	L280 L281 K282 T287 N288 A294	L280-V284 WeakPolarHBondContact O-CG2 3.47Å; L280-V284 PolarHBondContact O-N 3.28Å; L281-V284 PolarHBondContact O-N 2.83Å; K282-V284 VanDerWaalsContact C-N 3.32Å; K282-V284 PolarHBondContact O-N 3.39Å; V284-T287 PolarHBondContact O-OG1 3.39Å; V284-T287 VanDerWaalsContact O-OG1 3.04Å; V284-N288 PolarHBondContact O-N 2.9Å; V284-A294 HydrophobicContact CG1-CB 3.71Å
285	R	91.3	Very high	91.8	Very high	43 Å²	43	75.9 Å²	75.9	16%	0.162	38%	0.383	C	S	.	.	H	α-helix	trans	-68.7	-33.8	178.5	68.9	178	177.3	-112	7.1	112.7	L281 K282 S283 N288 P289 A294 W295	L281-R285 WeakPolarHBondContact O-CG 3.37Å; L281-R285 PolarHBondContact O-N 2.95Å; K282-R285 VanDerWaalsContact CA-CZ 3.46Å; K282-R285 WeakPolarHBondContact O-CG 3.33Å; K282-R285 PolarHBondContact O-N 3.35Å; S283-R285 PolarHBondContact O-N 3.47Å; R285-N288 CarbonylContact O-C 3.56Å; R285-P289 WeakPolarHBondContact O-CA 3.36Å; R285-A294 HydrophobicContact CB-CB 4.19Å; R285-W295 HydrophobicContact CB-CD2 4.38Å; R285-W295 HydrophobicContact CB-CZ2 4.32Å
286	E	91.7	Very high	92	Very high	121 Å²	121	71.2 Å²	71.2	57%	0.565	36%	0.363	S	S	*	.	H	α-helix	trans	-73.5	-40	178.7	-74.6	173.6	-177.3	0	0	111.3	K282 S283	K282-E286 WeakPolarHBondContact CE-OE1 3.27Å; K282-E286 WeakPolarHBondContact CG-OE1 3.05Å; K282-E286 IonicContact NZ-OE1 3.49Å; K282-E286 WeakPolarHBondContact O-CB 3.28Å; K282-E286 WeakPolarHBondContact O-CG 3.45Å; K282-E286 PolarHBondContact O-N 3.34Å; K282-E286 VanDerWaalsContact O-N 3.15Å; S283-E286 PolarHBondContact O-N 2.79Å
287	T	92.9	Very high	92.1	Very high	97 Å²	97	65.6 Å²	65.6	60%	0.595	35%	0.346	S	S	*	.	H	α-helix	trans	-70.9	-33.9	175.7	55.5	0	0	0	0	112.5	S283 V284	S283-T287 WeakPolarHBondContact O-CG2 3.4Å; S283-T287 PolarHBondContact O-N 3.39Å; S283-T287 PolarHBondContact O-OG1 3.07Å; V284-T287 PolarHBondContact O-OG1 3.39Å; V284-T287 VanDerWaalsContact O-OG1 3.04Å
288	N	90.2	Very high	92.1	Very high	87 Å²	87	64.3 Å²	64.3	47%	0.465	34%	0.335	S	S	.	.			trans	-130.2	74.9	-175.9	-59.7	-56	0	0	0	111.7	V284 R285 K290 H291	V284-N288 PolarHBondContact O-N 2.9Å; R285-N288 CarbonylContact O-C 3.56Å; N288-K290 PolarHBondContact O-N 2.74Å; N288-H291 HydrophobicContact CB-CB 3.77Å; N288-H291 WeakPolarHBondContact O-CB 3.3Å; N288-H291 PolarHBondContact O-N 2.76Å
289	P	90.3	Very high	92.2	Very high	53 Å²	53	61.6 Å²	61.6	34%	0.344	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-32.7	-179.1	-26	35.4	0	0	0	113.6	R285 H291 W295 C322	R285-P289 WeakPolarHBondContact O-CA 3.36Å; P289-H291 PolarHBondContact O-N 3.14Å; P289-W295 PolarHBondContact O-NE1 3.46Å; P289-C322 PolarHBondContact O-SG 3.05Å
290	K	88.9	Confident	92.2	Very high	189 Å²	189	61.4 Å²	61.4	82%	0.822	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	2.5	179.6	-63.4	-177.2	179.7	176.3	0	114.4	N288 A292 C322	N288-K290 PolarHBondContact O-N 2.74Å; K290-A292 PolarHBondContact O-N 3.41Å; K290-C322 VanDerWaalsContact CA-SG 3.6Å; K290-C322 PolarHBondContact O-SG 2.85Å
291	H	91.7	Very high	92.1	Very high	90 Å²	90	57.5 Å²	57.5	42%	0.417	30%	0.295	S	S	.	.			trans	-94.1	95.9	-178.4	-171.3	54.4	0	0	0	111.2	N288 P289 A294	N288-H291 HydrophobicContact CB-CB 3.77Å; N288-H291 WeakPolarHBondContact O-CB 3.3Å; N288-H291 PolarHBondContact O-N 2.76Å; P289-H291 PolarHBondContact O-N 3.14Å; H291-A294 HydrophobicContact CB-CB 4.38Å; H291-A294 VanDerWaalsContact O-CB 3.27Å; H291-A294 WeakPolarHBondContact O-CB 3.39Å; H291-A294 PolarHBondContact O-N 3.31Å
292	A	90.7	Very high	91.9	Very high	7 Å²	7	56.6 Å²	56.6	6%	0.058	29%	0.29	C	S	.	.	H	α-helix	trans	-54.5	-42.2	-177.8	0	0	0	0	0	115.1	K290 A294 W295 I296 C322 S325 I328	K290-A292 PolarHBondContact O-N 3.41Å; A292-A294 PolarHBondContact O-N 3.08Å; A292-W295 PolarHBondContact O-N 3.24Å; A292-I296 WeakPolarHBondContact O-CG1 3.27Å; A292-I296 PolarHBondContact O-N 2.81Å; A292-I296 VanDerWaalsContact O-N 3.12Å; A292-C322 HydrophobicContact CB-CB 4.14Å; A292-S325 VanDerWaalsContact CB-CB 3.42Å; A292-S325 WeakPolarHBondContact CB-OG 3.28Å; A292-I328 HydrophobicContact CB-CB 4.3Å; A292-I328 HydrophobicContact CB-CD1 4.4Å
293	P	92.8	Very high	91.7	Very high	70 Å²	70	55 Å²	55	46%	0.455	28%	0.284	S	S	.	.	H	α-helix	trans	-58.8	-28.1	175.6	-26.2	35.1	0	0	0	114.6	I296 A297	P293-I296 PolarHBondContact O-N 3.43Å; P293-A297 VanDerWaalsContact O-CB 3.23Å; P293-A297 WeakPolarHBondContact O-CB 3.39Å; P293-A297 PolarHBondContact O-N 3.16Å
294	A	93	Very high	91.4	Very high	3 Å²	3	57.7 Å²	57.7	3%	0.025	29%	0.293	C	S	.	.	H	α-helix	trans	-62.8	-45.2	176.6	0	0	0	0	0	111.7	V284 R285 H291 A292 S298	V284-A294 HydrophobicContact CG1-CB 3.71Å; R285-A294 HydrophobicContact CB-CB 4.19Å; H291-A294 HydrophobicContact CB-CB 4.38Å; H291-A294 VanDerWaalsContact O-CB 3.27Å; H291-A294 WeakPolarHBondContact O-CB 3.39Å; H291-A294 PolarHBondContact O-N 3.31Å; A292-A294 PolarHBondContact O-N 3.08Å; A294-S298 WeakPolarHBondContact O-CB 3.32Å; A294-S298 PolarHBondContact O-N 3.31Å; A294-S298 PolarHBondContact O-OG 3.12Å
295	W	94.6	Very high	91	Very high	26 Å²	26	57.2 Å²	57.2	10%	0.098	29%	0.294	C	S	.	.	H	α-helix	trans	-67.1	-44.4	178.1	-64.2	102.5	0	0	0	111.2	R285 P289 A292 S298 A299 L314 G318 E321 I328	R285-W295 HydrophobicContact CB-CD2 4.38Å; R285-W295 HydrophobicContact CB-CZ2 4.32Å; P289-W295 PolarHBondContact O-NE1 3.46Å; A292-W295 PolarHBondContact O-N 3.24Å; W295-S298 PolarHBondContact O-N 3.45Å; W295-A299 WeakPolarHBondContact O-CB 3.5Å; W295-A299 PolarHBondContact O-N 3.3Å; W295-L314 HydrophobicContact CE3-CD1 3.96Å; W295-L314 HydrophobicContact CE3-CG 4.07Å; W295-L314 VanDerWaalsContact CE3-O 3.3Å; W295-L314 HydrophobicContact CZ3-CD1 3.69Å; W295-L314 HydrophobicContact CZ3-CG 4.29Å; W295-G318 VanDerWaalsContact CD2-CA 3.45Å; W295-E321 HydrophobicContact CZ2-CB 4.34Å; W295-E321 HydrophobicContact CZ2-CG 3.98Å; W295-I328 HydrophobicContact CB-CD1 3.63Å; W295-I328 HydrophobicContact CG-CD1 4.05Å
296	I	93.3	Very high	90.6	Very high	16 Å²	16	58 Å²	58	8%	0.082	32%	0.315	C	S	.	.	H	α-helix	trans	-60	-50.1	176.7	-65.2	167.8	0	0	0	110.8	A292 P293 S298 A299 R300 I315 D327 I328 E331	A292-I296 WeakPolarHBondContact O-CG1 3.27Å; A292-I296 PolarHBondContact O-N 2.81Å; A292-I296 VanDerWaalsContact O-N 3.12Å; P293-I296 PolarHBondContact O-N 3.43Å; I296-S298 VanDerWaalsContact C-N 3.3Å; I296-S298 PolarHBondContact O-N 2.81Å; I296-A299 PolarHBondContact O-N 3.2Å; I296-R300 HydrophobicContact CG2-CG 4.39Å; I296-R300 WeakPolarHBondContact O-CB 3.44Å; I296-R300 WeakPolarHBondContact O-CG 3.37Å; I296-R300 PolarHBondContact O-N 3.29Å; I296-I315 HydrophobicContact CG1-CD1 4.18Å; I296-D327 HydrophobicContact CD1-CB 3.74Å; I296-I328 HydrophobicContact CD1-CB 4.49Å; I296-I328 HydrophobicContact CG1-CB 4.48Å; I296-I328 HydrophobicContact CG1-CG1 4.4Å; I296-E331 HydrophobicContact CD1-CG 4.45Å; I296-E331 HydrophobicContact CG1-CB 4.38Å; I296-E331 HydrophobicContact CG1-CG 4.17Å; I296-E331 HydrophobicContact CG2-CG 3.89Å
297	A	92.3	Very high	90.3	Very high	37 Å²	37	57.2 Å²	57.2	31%	0.306	31%	0.31	S	S	.	.	H	α-helix	trans	-61.4	-41.8	179.1	0	0	0	0	0	111.3	L281 P293 L301	L281-A297 HydrophobicContact CD1-CB 4.11Å; L281-A297 HydrophobicContact CD2-CB 3.91Å; P293-A297 VanDerWaalsContact O-CB 3.23Å; P293-A297 WeakPolarHBondContact O-CB 3.39Å; P293-A297 PolarHBondContact O-N 3.16Å; A297-L301 WeakPolarHBondContact O-CB 3.32Å; A297-L301 PolarHBondContact O-N 3.44Å
298	S	92.4	Very high	90.2	Very high	4 Å²	4	56.3 Å²	56.3	3%	0.028	30%	0.301	C	S	.	.	H	α-helix	trans	-64.9	-42.6	178.1	-55.3	0	0	0	0	112	L281 A294 W295 I296 L301 E302	L281-S298 WeakPolarHBondContact CB-OG 3.3Å; A294-S298 WeakPolarHBondContact O-CB 3.32Å; A294-S298 PolarHBondContact O-N 3.31Å; A294-S298 PolarHBondContact O-OG 3.12Å; W295-S298 PolarHBondContact O-N 3.45Å; I296-S298 VanDerWaalsContact C-N 3.3Å; I296-S298 PolarHBondContact O-N 2.81Å; S298-L301 PolarHBondContact O-N 3.39Å; S298-E302 PolarHBondContact O-N 3.43Å
299	A	93.1	Very high	90.3	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.008	30%	0.302	C	S	.	.	H	α-helix	trans	-66.4	-44.1	178.7	0	0	0	0	0	111.4	W295 I296 L301 E302 E303 A311 I315 L335	W295-A299 WeakPolarHBondContact O-CB 3.5Å; W295-A299 PolarHBondContact O-N 3.3Å; I296-A299 PolarHBondContact O-N 3.2Å; A299-L301 VanDerWaalsContact C-N 3.32Å; A299-L301 PolarHBondContact O-N 3.2Å; A299-E302 PolarHBondContact O-N 3.03Å; A299-E303 PolarHBondContact O-N 2.86Å; A299-A311 HydrophobicContact CB-CB 4.43Å; A299-A311 VanDerWaalsContact O-CB 3.25Å; A299-A311 WeakPolarHBondContact O-CB 3.33Å; A299-I315 HydrophobicContact CB-CB 4.07Å; A299-I315 HydrophobicContact CB-CD1 4.02Å; A299-L335 HydrophobicContact CB-CD1 3.81Å
300	R	91.7	Very high	90.3	Very high	120 Å²	120	58.1 Å²	58.1	45%	0.453	31%	0.307	S	S	.	.	H	α-helix	trans	-62.1	-37.5	174.8	-72.6	178.7	177.4	176.8	-0.5	112.4	I296 E303 I304 E331	I296-R300 HydrophobicContact CG2-CG 4.39Å; I296-R300 WeakPolarHBondContact O-CB 3.44Å; I296-R300 WeakPolarHBondContact O-CG 3.37Å; I296-R300 PolarHBondContact O-N 3.29Å; R300-E303 WeakPolarHBondContact O-CB 3.29Å; R300-E303 PolarHBondContact O-N 3.1Å; R300-I304 VanDerWaalsContact O-CG1 3.29Å; R300-I304 WeakPolarHBondContact O-CG1 3.39Å; R300-I304 PolarHBondContact O-N 3.43Å; R300-E331 IonicContact CZ-OE1 3.19Å; R300-E331 IonicContact NE-OE1 3.83Å; R300-E331 PolarHBondContact NE-OE1 3Å; R300-E331 IonicContact NE-OE2 2.65Å; R300-E331 IonicContact NH2-OE1 2.86Å; R300-E331 PolarHBondContact NH2-OE1 3.49Å
301	L	90.7	Very high	90.5	Very high	24 Å²	24	49.1 Å²	49.1	13%	0.126	27%	0.268	C	S	.	.	H	α-helix	trans	-63.4	-42.4	175.8	-177.7	68.7	0	0	0	111.7	A277 R278 L281 A297 S298 A299 I304 A305	A277-L301 HydrophobicContact CB-CD1 4.2Å; A277-L301 HydrophobicContact CB-CD2 3.78Å; R278-L301 HydrophobicContact CB-CD2 4.03Å; L281-L301 HydrophobicContact CD1-CB 3.97Å; L281-L301 HydrophobicContact CD1-CD2 3.76Å; L281-L301 HydrophobicContact CD1-CG 4.44Å; A297-L301 WeakPolarHBondContact O-CB 3.32Å; A297-L301 PolarHBondContact O-N 3.44Å; S298-L301 PolarHBondContact O-N 3.39Å; A299-L301 VanDerWaalsContact C-N 3.32Å; A299-L301 PolarHBondContact O-N 3.2Å; L301-I304 PolarHBondContact O-N 3.07Å; L301-A305 WeakPolarHBondContact O-CB 3.43Å; L301-A305 PolarHBondContact O-N 3.22Å
302	E	89.7	Confident	90.6	Very high	13 Å²	13	47.9 Å²	47.9	6%	0.061	26%	0.26	C	S	.	.	H	α-helix	trans	-72.2	-30	178	-64.2	-61.4	174.5	0	0	112.6	R278 S298 A299 A305 G306 K307 V310 A311	R278-E302 WeakPolarHBondContact CD-OE1 3.46Å; R278-E302 WeakPolarHBondContact CG-OE1 3.47Å; R278-E302 IonicContact CZ-OE1 2.77Å; R278-E302 IonicContact CZ-OE2 2.7Å; R278-E302 IonicContact NE-OE1 2.72Å; R278-E302 PolarHBondContact NE-OE1 2.69Å; R278-E302 IonicContact NE-OE2 2.81Å; R278-E302 PolarHBondContact NE-OE2 2.9Å; R278-E302 IonicContact NH2-OE1 3.53Å; R278-E302 IonicContact NH2-OE2 3.43Å; R278-E302 PolarHBondContact NH2-OE2 2.87Å; S298-E302 PolarHBondContact O-N 3.43Å; A299-E302 PolarHBondContact O-N 3.03Å; E302-A305 CarbonylContact O-C 3.6Å; E302-A305 PolarHBondContact O-N 3.41Å; E302-G306 PolarHBondContact O-N 3.49Å; E302-K307 HydrophobicContact CB-CB 4.44Å; E302-K307 CarbonylContact O-C 3.58Å; E302-K307 WeakPolarHBondContact O-CA 3.25Å; E302-K307 PolarHBondContact O-N 3.49Å; E302-V310 HydrophobicContact CG-CG1 4.08Å; E302-A311 HydrophobicContact CB-CB 3.97Å
303	E	89	Confident	90.7	Very high	60 Å²	60	51.7 Å²	51.7	28%	0.28	28%	0.279	S	S	.	.	H	α-helix	trans	-61.2	-49.7	169	175.8	-178.2	-165	0	0	111.4	A299 R300 A305 G306 L308 R334 L335	A299-E303 PolarHBondContact O-N 2.86Å; R300-E303 WeakPolarHBondContact O-CB 3.29Å; R300-E303 PolarHBondContact O-N 3.1Å; E303-A305 PolarHBondContact O-N 3.47Å; E303-G306 WeakPolarHBondContact O-CA 3.36Å; E303-G306 PolarHBondContact O-N 3.49Å; E303-L308 HydrophobicContact CB-CD2 4.28Å; E303-L308 HydrophobicContact CG-CD2 3.87Å; E303-R334 IonicContact OE1-CZ 3.65Å; E303-R334 IonicContact OE1-NH1 2.65Å; E303-R334 PolarHBondContact OE1-NH1 3.13Å; E303-R334 IonicContact OE1-NH2 2.56Å; E303-R334 IonicContact OE2-CZ 2.7Å; E303-R334 IonicContact OE2-NH1 3.37Å; E303-R334 PolarHBondContact OE2-NH1 2.99Å; E303-R334 IonicContact OE2-NH2 3.59Å; E303-R334 PolarHBondContact OE2-NH2 2.87Å; E303-L335 HydrophobicContact CB-CD2 4.45Å; E303-L335 HydrophobicContact CG-CD2 4.45Å
304	I	86.7	Confident	90.7	Very high	109 Å²	109	49.5 Å²	49.5	56%	0.559	26%	0.263	S	S	*	.	H	α-helix	trans	-61.7	-32.9	176.3	-65.3	163.5	0	0	0	110.8	R300 L301 G306	R300-I304 VanDerWaalsContact O-CG1 3.29Å; R300-I304 WeakPolarHBondContact O-CG1 3.39Å; R300-I304 PolarHBondContact O-N 3.43Å; L301-I304 PolarHBondContact O-N 3.07Å; I304-G306 PolarHBondContact O-N 3.09Å
305	A	84.3	Confident	90.7	Very high	31 Å²	31	49.3 Å²	49.3	26%	0.256	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-1.4	173.6	0	0	0	0	0	114.7	M274 L301 E302 E303 K307	M274-A305 VanDerWaalsContact CE-CA 3.47Å; M274-A305 HydrophobicContact CE-CB 3.46Å; M274-A305 VanDerWaalsContact CE-CB 3.46Å; L301-A305 WeakPolarHBondContact O-CB 3.43Å; L301-A305 PolarHBondContact O-N 3.22Å; E302-A305 CarbonylContact O-C 3.6Å; E302-A305 PolarHBondContact O-N 3.41Å; E303-A305 PolarHBondContact O-N 3.47Å; A305-K307 PolarHBondContact O-N 3.26Å
306	G	82.7	Confident	90.5	Very high	60 Å²	60	50.9 Å²	50.9	62%	0.619	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	3	-177.5	0	0	0	0	0	114.5	E302 E303 I304 L308	E302-G306 PolarHBondContact O-N 3.49Å; E303-G306 WeakPolarHBondContact O-CA 3.36Å; E303-G306 PolarHBondContact O-N 3.49Å; I304-G306 PolarHBondContact O-N 3.09Å; G306-L308 VanDerWaalsContact C-N 3.34Å; G306-L308 PolarHBondContact O-N 3.33Å
307	K	86	Confident	90.3	Very high	105 Å²	105	52.8 Å²	52.8	46%	0.457	29%	0.287	S	S	.	.			trans	-92.4	61.3	-178.7	-62.8	-176.4	-175	177.1	0	111.4	E302 A305 Q309 V310 A311	E302-K307 HydrophobicContact CB-CB 4.44Å; E302-K307 CarbonylContact O-C 3.58Å; E302-K307 WeakPolarHBondContact O-CA 3.25Å; E302-K307 PolarHBondContact O-N 3.49Å; A305-K307 PolarHBondContact O-N 3.26Å; K307-Q309 VanDerWaalsContact C-N 3.29Å; K307-Q309 PolarHBondContact O-N 3.28Å; K307-V310 HydrophobicContact CB-CB 4.18Å; K307-V310 HydrophobicContact CB-CG2 4.13Å; K307-V310 PolarHBondContact O-N 2.97Å; K307-V310 VanDerWaalsContact O-N 3.07Å; K307-A311 PolarHBondContact O-N 3.33Å; K307-A311 VanDerWaalsContact O-N 3.08Å
308	L	89.9	Confident	90.3	Very high	78 Å²	78	51 Å²	51	41%	0.408	27%	0.272	S	S	.	.	H	α-helix	trans	-55.3	-38.9	-175.4	-67.3	176	0	0	0	113.8	E303 G306 V310 A311 R312	E303-L308 HydrophobicContact CB-CD2 4.28Å; E303-L308 HydrophobicContact CG-CD2 3.87Å; G306-L308 VanDerWaalsContact C-N 3.34Å; G306-L308 PolarHBondContact O-N 3.33Å; L308-V310 VanDerWaalsContact C-N 3.34Å; L308-V310 PolarHBondContact O-N 3.01Å; L308-A311 WeakPolarHBondContact O-CB 3.11Å; L308-A311 PolarHBondContact O-N 3.1Å; L308-R312 VanDerWaalsContact O-CG 3.32Å; L308-R312 WeakPolarHBondContact O-CG 3.44Å; L308-R312 PolarHBondContact O-N 3.34Å
309	Q	91.7	Very high	90.1	Very high	105 Å²	105	51 Å²	51	49%	0.491	27%	0.271	S	S	.	.	H	α-helix	trans	-67.7	-36.2	-179.4	-167.8	58.1	35.5	0	0	112.3	K307 R312 N313	K307-Q309 VanDerWaalsContact C-N 3.29Å; K307-Q309 PolarHBondContact O-N 3.28Å; Q309-R312 PolarHBondContact O-N 2.87Å; Q309-N313 PolarHBondContact NE2-OD1 3.43Å; Q309-N313 VanDerWaalsContact NE2-OD1 3.16Å; Q309-N313 PolarHBondContact O-N 2.77Å; Q309-N313 VanDerWaalsContact O-N 3.1Å; Q309-N313 PolarHBondContact O-OD1 3.22Å
310	V	92.2	Very high	89.9	Confident	72 Å²	72	58.5 Å²	58.5	44%	0.436	31%	0.307	S	S	.	.	H	α-helix	trans	-67.1	-42.2	174.7	-177.8	0	0	0	0	109.7	E302 K307 L308 R312 N313 L314	E302-V310 HydrophobicContact CG-CG1 4.08Å; K307-V310 HydrophobicContact CB-CB 4.18Å; K307-V310 HydrophobicContact CB-CG2 4.13Å; K307-V310 PolarHBondContact O-N 2.97Å; K307-V310 VanDerWaalsContact O-N 3.07Å; L308-V310 VanDerWaalsContact C-N 3.34Å; L308-V310 PolarHBondContact O-N 3.01Å; V310-R312 VanDerWaalsContact C-N 3.34Å; V310-R312 PolarHBondContact O-N 3.29Å; V310-N313 PolarHBondContact O-N 2.87Å; V310-L314 VanDerWaalsContact O-CB 3.29Å; V310-L314 WeakPolarHBondContact O-CB 3.28Å; V310-L314 PolarHBondContact O-N 3.2Å
311	A	92.7	Very high	89.8	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-58.3	-44.2	175.2	0	0	0	0	0	112.3	A299 E302 K307 L308 L314 I315 L335	A299-A311 HydrophobicContact CB-CB 4.43Å; A299-A311 VanDerWaalsContact O-CB 3.25Å; A299-A311 WeakPolarHBondContact O-CB 3.33Å; E302-A311 HydrophobicContact CB-CB 3.97Å; K307-A311 PolarHBondContact O-N 3.33Å; K307-A311 VanDerWaalsContact O-N 3.08Å; L308-A311 WeakPolarHBondContact O-CB 3.11Å; L308-A311 PolarHBondContact O-N 3.1Å; A311-L314 PolarHBondContact O-N 3.43Å; A311-I315 PolarHBondContact O-N 3.44Å; A311-L335 HydrophobicContact CB-CD1 4.43Å
312	R	93.5	Very high	89.7	Confident	65 Å²	65	56.9 Å²	56.9	25%	0.245	30%	0.304	C	S	.	.	H	α-helix	trans	-62.6	-47.3	178	-73.1	169.7	-175	160.1	1.1	112.7	L308 Q309 V310 L314 I315 L316 L335	L308-R312 VanDerWaalsContact O-CG 3.32Å; L308-R312 WeakPolarHBondContact O-CG 3.44Å; L308-R312 PolarHBondContact O-N 3.34Å; Q309-R312 PolarHBondContact O-N 2.87Å; V310-R312 VanDerWaalsContact C-N 3.34Å; V310-R312 PolarHBondContact O-N 3.29Å; R312-L314 VanDerWaalsContact C-N 3.26Å; R312-L314 PolarHBondContact O-N 3.17Å; R312-I315 WeakPolarHBondContact O-CG2 3.45Å; R312-I315 PolarHBondContact O-N 2.84Å; R312-L316 VanDerWaalsContact O-CG 3.31Å; R312-L316 WeakPolarHBondContact O-CG 3.4Å; R312-L316 PolarHBondContact O-N 2.89Å; R312-L316 VanDerWaalsContact O-N 3.09Å; R312-L335 HydrophobicContact CG-CB 4.31Å; R312-L335 WeakPolarHBondContact CG-O 3.47Å; R312-L335 PolarHBondContact NE-O 2.81Å
313	N	92.4	Very high	89.6	Confident	87 Å²	87	58.2 Å²	58.2	47%	0.465	31%	0.314	S	S	.	.	H	α-helix	trans	-63.3	-40.2	178.8	-66.6	-1.5	0	0	0	110.4	Q309 V310 L316 S317	Q309-N313 PolarHBondContact NE2-OD1 3.43Å; Q309-N313 VanDerWaalsContact NE2-OD1 3.16Å; Q309-N313 PolarHBondContact O-N 2.77Å; Q309-N313 VanDerWaalsContact O-N 3.1Å; Q309-N313 PolarHBondContact O-OD1 3.22Å; V310-N313 PolarHBondContact O-N 2.87Å; N313-L316 PolarHBondContact O-N 2.7Å; N313-S317 PolarHBondContact O-N 2.77Å; N313-S317 PolarHBondContact O-OG 2.84Å
314	L	92.8	Very high	89.4	Confident	23 Å²	23	64.3 Å²	64.3	12%	0.12	34%	0.339	C	S	.	.	H	α-helix	trans	-67.2	-39.6	-178.5	-164.4	67	0	0	0	112.8	W295 V310 A311 R312 G318	W295-L314 HydrophobicContact CE3-CD1 3.96Å; W295-L314 HydrophobicContact CE3-CG 4.07Å; W295-L314 VanDerWaalsContact CE3-O 3.3Å; W295-L314 HydrophobicContact CZ3-CD1 3.69Å; W295-L314 HydrophobicContact CZ3-CG 4.29Å; V310-L314 VanDerWaalsContact O-CB 3.29Å; V310-L314 WeakPolarHBondContact O-CB 3.28Å; V310-L314 PolarHBondContact O-N 3.2Å; A311-L314 PolarHBondContact O-N 3.43Å; R312-L314 VanDerWaalsContact C-N 3.26Å; R312-L314 PolarHBondContact O-N 3.17Å; L314-G318 PolarHBondContact O-N 3.42Å
315	I	92.7	Very high	89.6	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-72	-35.7	177.6	-157.2	69.5	0	0	0	111.7	I296 A299 A311 R312 G318 C319 I328 E331 A332 L335	I296-I315 HydrophobicContact CG1-CD1 4.18Å; A299-I315 HydrophobicContact CB-CB 4.07Å; A299-I315 HydrophobicContact CB-CD1 4.02Å; A311-I315 PolarHBondContact O-N 3.44Å; R312-I315 WeakPolarHBondContact O-CG2 3.45Å; R312-I315 PolarHBondContact O-N 2.84Å; I315-G318 CarbonylContact O-C 3.53Å; I315-G318 WeakPolarHBondContact O-CA 3.45Å; I315-G318 PolarHBondContact O-N 3.19Å; I315-C319 PolarHBondContact O-N 3.4Å; I315-C319 PolarHBondContact O-SG 3.15Å; I315-I328 HydrophobicContact CD1-CD1 4.48Å; I315-I328 HydrophobicContact CD1-CG1 3.75Å; I315-I328 HydrophobicContact CG1-CG1 4.28Å; I315-E331 HydrophobicContact CD1-CB 4.06Å; I315-E331 HydrophobicContact CG1-CB 4.26Å; I315-A332 HydrophobicContact CG1-CB 3.92Å; I315-A332 HydrophobicContact CG2-CB 3.96Å; I315-L335 HydrophobicContact CB-CD1 4.11Å; I315-L335 HydrophobicContact CG1-CD1 4.39Å; I315-L335 HydrophobicContact CG2-CB 4.41Å; I315-L335 HydrophobicContact CG2-CD1 3.96Å
316	L	91	Very high	89.9	Confident	59 Å²	59	62.1 Å²	62.1	31%	0.309	33%	0.325	S	S	.	.	H	α-helix	trans	-64.9	-45.3	175.6	-72.1	172.8	0	0	0	111.8	R312 N313 G318 C319 E320 V336 V344	R312-L316 VanDerWaalsContact O-CG 3.31Å; R312-L316 WeakPolarHBondContact O-CG 3.4Å; R312-L316 PolarHBondContact O-N 2.89Å; R312-L316 VanDerWaalsContact O-N 3.09Å; N313-L316 PolarHBondContact O-N 2.7Å; L316-G318 VanDerWaalsContact C-N 3.25Å; L316-G318 PolarHBondContact O-N 3.3Å; L316-C319 WeakPolarHBondContact O-CB 3.34Å; L316-C319 PolarHBondContact O-N 2.72Å; L316-C319 VanDerWaalsContact O-N 3.15Å; L316-E320 PolarHBondContact O-N 3.37Å; L316-V336 HydrophobicContact CD2-CG2 4.32Å; L316-V336 HydrophobicContact CG-CG2 4.48Å; L316-V344 HydrophobicContact CD2-CG2 3.93Å
317	S	89.9	Confident	90.3	Very high	56 Å²	56	62.7 Å²	62.7	39%	0.392	31%	0.314	S	S	.	.	H	α-helix	trans	-60.4	-38.8	171.4	-60.4	0	0	0	0	111.7	N313 C319 E320 E321	N313-S317 PolarHBondContact O-N 2.77Å; N313-S317 PolarHBondContact O-OG 2.84Å; S317-C319 VanDerWaalsContact C-N 3.33Å; S317-C319 PolarHBondContact O-N 2.72Å; S317-E320 PolarHBondContact O-N 3.26Å; S317-E321 WeakPolarHBondContact O-CG 3.35Å; S317-E321 PolarHBondContact O-N 3.13Å
318	G	90.8	Very high	90.6	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.1	-39.3	174.6	0	0	0	0	0	113.1	W295 L314 I315 L316 E320 E321 C322 I328	W295-G318 VanDerWaalsContact CD2-CA 3.45Å; L314-G318 PolarHBondContact O-N 3.42Å; I315-G318 CarbonylContact O-C 3.53Å; I315-G318 WeakPolarHBondContact O-CA 3.45Å; I315-G318 PolarHBondContact O-N 3.19Å; L316-G318 VanDerWaalsContact C-N 3.25Å; L316-G318 PolarHBondContact O-N 3.3Å; G318-E320 VanDerWaalsContact C-N 3.32Å; G318-E320 PolarHBondContact O-N 2.9Å; G318-E321 PolarHBondContact O-N 3.14Å; G318-C322 WeakPolarHBondContact O-CB 3.41Å; G318-C322 PolarHBondContact O-N 3.41Å; G318-I328 VanDerWaalsContact O-CD1 3.26Å; G318-I328 WeakPolarHBondContact O-CD1 3.4Å
319	C	88.9	Confident	90.8	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.014	27%	0.274	C	S	.	.	H	α-helix	trans	-62.7	-36.4	177	-71.3	0	0	0	0	112.9	I315 L316 S317 C322 W329 A332	I315-C319 PolarHBondContact O-N 3.4Å; I315-C319 PolarHBondContact O-SG 3.15Å; L316-C319 WeakPolarHBondContact O-CB 3.34Å; L316-C319 PolarHBondContact O-N 2.72Å; L316-C319 VanDerWaalsContact O-N 3.15Å; S317-C319 VanDerWaalsContact C-N 3.33Å; S317-C319 PolarHBondContact O-N 2.72Å; C319-C322 CarbonylContact O-C 3.59Å; C319-W329 HydrophobicContact CB-CD2 4.2Å; C319-W329 HydrophobicContact CB-CE3 3.9Å; C319-W329 HydrophobicContact CB-CH2 3.65Å; C319-W329 HydrophobicContact CB-CZ2 3.95Å; C319-W329 HydrophobicContact CB-CZ3 3.63Å; C319-A332 WeakPolarHBondContact SG-CB 2.98Å
320	E	89.5	Confident	90.8	Very high	160 Å²	160	50.9 Å²	50.9	75%	0.748	26%	0.258	S	S	*	.	H	α-helix	trans	-68	-41	176.4	-66.3	177.1	173.8	0	0	111.7	L316 S317 G318	L316-E320 PolarHBondContact O-N 3.37Å; S317-E320 PolarHBondContact O-N 3.26Å; G318-E320 VanDerWaalsContact C-N 3.32Å; G318-E320 PolarHBondContact O-N 2.9Å
321	E	89.1	Confident	90.6	Very high	103 Å²	103	48.6 Å²	48.6	48%	0.481	24%	0.243	S	C	.	.	H	α-helix	trans	-74.3	-34	178.9	-67.6	-64.9	162.1	0	0	113	W295 S317 G318 P323	W295-E321 HydrophobicContact CZ2-CB 4.34Å; W295-E321 HydrophobicContact CZ2-CG 3.98Å; S317-E321 WeakPolarHBondContact O-CG 3.35Å; S317-E321 PolarHBondContact O-N 3.13Å; G318-E321 PolarHBondContact O-N 3.14Å; E321-P323 VanDerWaalsContact O-CD 3.29Å; E321-P323 WeakPolarHBondContact O-CD 3.32Å
322	C	87.8	Confident	90.6	Very high	7 Å²	7	48.6 Å²	48.6	5%	0.047	24%	0.243	C	C	.	.			trans	-119.1	60.3	-175.5	-66.1	0	0	0	0	113.1	P289 K290 A292 G318 C319 K324 S325 I328	P289-C322 PolarHBondContact O-SG 3.05Å; K290-C322 VanDerWaalsContact CA-SG 3.6Å; K290-C322 PolarHBondContact O-SG 2.85Å; A292-C322 HydrophobicContact CB-CB 4.14Å; G318-C322 WeakPolarHBondContact O-CB 3.41Å; G318-C322 PolarHBondContact O-N 3.41Å; C319-C322 CarbonylContact O-C 3.59Å; C322-K324 PolarHBondContact O-N 3.33Å; C322-K324 VanDerWaalsContact O-N 3.14Å; C322-S325 PolarHBondContact O-N 3.13Å; C322-I328 HydrophobicContact CB-CD1 4.08Å; C322-I328 HydrophobicContact CB-CG2 4.39Å
323	P	87.9	Confident	90.5	Very high	40 Å²	40	45.7 Å²	45.7	26%	0.26	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-23.2	-173.7	26.5	-35.1	0	0	0	113.5	E321 W329 H351	E321-P323 VanDerWaalsContact O-CD 3.29Å; E321-P323 WeakPolarHBondContact O-CD 3.32Å; P323-W329 PolarHBondContact O-NE1 3.24Å; P323-W329 VanDerWaalsContact O-NE1 3.1Å; P323-H351 HydrophobicContact CB-CB 4.48Å
324	K	85.5	Confident	90.5	Very high	188 Å²	188	46.5 Å²	46.5	82%	0.817	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-9.4	-176.9	-63.1	-172.4	178.9	-174.7	0	114.5	C322	C322-K324 PolarHBondContact O-N 3.33Å; C322-K324 VanDerWaalsContact O-N 3.14Å
325	S	89.9	Confident	90.4	Very high	30 Å²	30	46 Å²	46	21%	0.21	23%	0.227	C	C	.	.			trans	-91.8	126.7	-178.7	-179.5	0	0	0	0	110.2	A292 C322 I328	A292-S325 VanDerWaalsContact CB-CB 3.42Å; A292-S325 WeakPolarHBondContact CB-OG 3.28Å; C322-S325 PolarHBondContact O-N 3.13Å; S325-I328 WeakPolarHBondContact O-CG2 3.29Å
326	E	90.7	Very high	90.2	Very high	65 Å²	65	46.5 Å²	46.5	30%	0.304	23%	0.23	S	C	.	.	H	α-helix	trans	-72.9	-32.8	175.9	50.1	175.2	-178.4	0	0	113.1	I328 W329 L330 L352 S355 R357	E326-I328 PolarHBondContact O-N 3.43Å; E326-W329 PolarHBondContact O-N 3.41Å; E326-L330 WeakPolarHBondContact O-CG 3.2Å; E326-L330 PolarHBondContact O-N 3.14Å; E326-L330 VanDerWaalsContact O-N 3.11Å; E326-L352 HydrophobicContact CB-CD1 4.11Å; E326-S355 PolarHBondContact OE2-OG 3.25Å; E326-R357 VanDerWaalsContact CG-NH2 3.32Å; E326-R357 IonicContact OE1-CZ 3.83Å; E326-R357 IonicContact OE1-NE 2.68Å; E326-R357 PolarHBondContact OE1-NE 3.3Å; E326-R357 IonicContact OE1-NH2 2.56Å; E326-R357 PolarHBondContact OE1-NH2 3.07Å; E326-R357 IonicContact OE2-CZ 3.89Å; E326-R357 IonicContact OE2-NE 3.6Å; E326-R357 PolarHBondContact OE2-NE 2.96Å; E326-R357 IonicContact OE2-NH2 3.09Å
327	D	91.8	Very high	90.1	Very high	71 Å²	71	46.3 Å²	46.3	38%	0.38	23%	0.232	S	C	.	.	H	α-helix	trans	-67.4	-35.7	-174.6	-68.1	-43	0	0	0	112.7	I296 L330 E331 R357	I296-D327 HydrophobicContact CD1-CB 3.74Å; D327-L330 PolarHBondContact O-N 2.94Å; D327-E331 PolarHBondContact O-N 3.27Å; D327-R357 IonicContact OD1-CZ 3.9Å; D327-R357 IonicContact OD1-NH1 3.29Å; D327-R357 PolarHBondContact OD1-NH1 3.06Å; D327-R357 IonicContact OD1-NH2 3.46Å; D327-R357 PolarHBondContact OD1-NH2 3.19Å; D327-R357 IonicContact OD2-NH2 3.64Å
328	I	92.1	Very high	89.7	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-67.8	-39.1	179.8	-161.2	161.3	0	0	0	111.6	A292 W295 I296 I315 G318 C322 S325 E326 E331 A332	A292-I328 HydrophobicContact CB-CB 4.3Å; A292-I328 HydrophobicContact CB-CD1 4.4Å; W295-I328 HydrophobicContact CB-CD1 3.63Å; W295-I328 HydrophobicContact CG-CD1 4.05Å; I296-I328 HydrophobicContact CD1-CB 4.49Å; I296-I328 HydrophobicContact CG1-CB 4.48Å; I296-I328 HydrophobicContact CG1-CG1 4.4Å; I315-I328 HydrophobicContact CD1-CD1 4.48Å; I315-I328 HydrophobicContact CD1-CG1 3.75Å; I315-I328 HydrophobicContact CG1-CG1 4.28Å; G318-I328 VanDerWaalsContact O-CD1 3.26Å; G318-I328 WeakPolarHBondContact O-CD1 3.4Å; C322-I328 HydrophobicContact CB-CD1 4.08Å; C322-I328 HydrophobicContact CB-CG2 4.39Å; S325-I328 WeakPolarHBondContact O-CG2 3.29Å; E326-I328 PolarHBondContact O-N 3.43Å; I328-E331 PolarHBondContact O-N 3.46Å; I328-A332 WeakPolarHBondContact O-CB 3.41Å; I328-A332 PolarHBondContact O-N 3.47Å
329	W	93.2	Very high	89.4	Confident	7 Å²	7	54 Å²	54	3%	0.027	27%	0.27	C	S	.	.	H	α-helix	trans	-66.6	-39.1	175.4	-71.5	118.5	0	0	0	111.9	C319 P323 E326 A332 A333 V344 Q347 A348 H351 L358	C319-W329 HydrophobicContact CB-CD2 4.2Å; C319-W329 HydrophobicContact CB-CE3 3.9Å; C319-W329 HydrophobicContact CB-CH2 3.65Å; C319-W329 HydrophobicContact CB-CZ2 3.95Å; C319-W329 HydrophobicContact CB-CZ3 3.63Å; P323-W329 PolarHBondContact O-NE1 3.24Å; P323-W329 VanDerWaalsContact O-NE1 3.1Å; E326-W329 PolarHBondContact O-N 3.41Å; W329-A332 PolarHBondContact O-N 2.95Å; W329-A333 WeakPolarHBondContact O-CB 3.46Å; W329-A333 PolarHBondContact O-N 3.27Å; W329-V344 HydrophobicContact CE3-CG1 3.79Å; W329-V344 HydrophobicContact CZ3-CG1 4.05Å; W329-Q347 HydrophobicContact CH2-CB 4Å; W329-Q347 HydrophobicContact CZ3-CB 4.01Å; W329-A348 HydrophobicContact CB-CB 3.57Å; W329-A348 HydrophobicContact CD2-CB 3.44Å; W329-A348 VanDerWaalsContact CD2-CB 3.44Å; W329-A348 HydrophobicContact CE3-CB 3.69Å; W329-A348 HydrophobicContact CG-CB 3.38Å; W329-A348 HydrophobicContact CZ3-CB 4.5Å; W329-H351 AromaticContact CZ2-CD2 3.68Å; W329-L358 HydrophobicContact CB-CD2 3.74Å
330	L	92.3	Very high	89.4	Confident	33 Å²	33	59.2 Å²	59.2	17%	0.173	29%	0.294	C	S	.	.	H	α-helix	trans	-65.2	-41.2	175	-71.1	171.8	0	0	0	112	E326 D327 A333 R334 R357 L358 K361	E326-L330 WeakPolarHBondContact O-CG 3.2Å; E326-L330 PolarHBondContact O-N 3.14Å; E326-L330 VanDerWaalsContact O-N 3.11Å; D327-L330 PolarHBondContact O-N 2.94Å; L330-A333 PolarHBondContact O-N 2.81Å; L330-R334 PolarHBondContact O-N 3.49Å; L330-R334 VanDerWaalsContact O-N 3.08Å; L330-R357 HydrophobicContact CD1-CB 3.85Å; L330-R357 VanDerWaalsContact CD1-NH1 3.31Å; L330-R357 HydrophobicContact CD2-CB 4.41Å; L330-L358 HydrophobicContact CD2-CD2 3.88Å; L330-L358 HydrophobicContact CG-CD2 3.97Å; L330-K361 HydrophobicContact CD2-CB 3.81Å; L330-K361 HydrophobicContact CD2-CG 4.09Å
331	E	89.3	Confident	89.3	Confident	25 Å²	25	51.6 Å²	51.6	12%	0.117	26%	0.259	C	S	.	.	H	α-helix	trans	-68.5	-37.9	174.8	-77.2	-64.2	158.8	0	0	112.4	I296 R300 I315 D327 I328 R334 L335	I296-E331 HydrophobicContact CD1-CG 4.45Å; I296-E331 HydrophobicContact CG1-CB 4.38Å; I296-E331 HydrophobicContact CG1-CG 4.17Å; I296-E331 HydrophobicContact CG2-CG 3.89Å; R300-E331 IonicContact CZ-OE1 3.19Å; R300-E331 IonicContact NE-OE1 3.83Å; R300-E331 PolarHBondContact NE-OE1 3Å; R300-E331 IonicContact NE-OE2 2.65Å; R300-E331 IonicContact NH2-OE1 2.86Å; R300-E331 PolarHBondContact NH2-OE1 3.49Å; I315-E331 HydrophobicContact CD1-CB 4.06Å; I315-E331 HydrophobicContact CG1-CB 4.26Å; D327-E331 PolarHBondContact O-N 3.27Å; I328-E331 PolarHBondContact O-N 3.46Å; E331-R334 WeakPolarHBondContact O-CB 3.46Å; E331-R334 PolarHBondContact O-N 2.86Å; E331-R334 VanDerWaalsContact O-N 3.14Å; E331-R334 IonicContact OE1-NE 2.74Å; E331-R334 IonicContact OE2-CZ 3.52Å; E331-R334 IonicContact OE2-NE 2.78Å; E331-R334 PolarHBondContact OE2-NE 3.38Å; E331-R334 IonicContact OE2-NH2 3.79Å; E331-R334 PolarHBondContact OE2-NH2 3.33Å; E331-L335 PolarHBondContact O-N 3.24Å
332	A	91.9	Very high	89.4	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.6	-46.6	172.8	0	0	0	0	0	111.2	I315 C319 I328 W329 R334 L335 V336 V344	I315-A332 HydrophobicContact CG1-CB 3.92Å; I315-A332 HydrophobicContact CG2-CB 3.96Å; C319-A332 WeakPolarHBondContact SG-CB 2.98Å; I328-A332 WeakPolarHBondContact O-CB 3.41Å; I328-A332 PolarHBondContact O-N 3.47Å; W329-A332 PolarHBondContact O-N 2.95Å; A332-R334 PolarHBondContact O-N 2.95Å; A332-L335 PolarHBondContact O-N 3.26Å; A332-V336 VanDerWaalsContact O-CB 3.26Å; A332-V336 WeakPolarHBondContact O-CB 2.93Å; A332-V336 WeakPolarHBondContact O-CG2 3.18Å; A332-V336 PolarHBondContact O-N 3.4Å; A332-V344 HydrophobicContact CB-CG1 3.77Å
333	A	90.8	Very high	89.5	Confident	4 Å²	4	52.5 Å²	52.5	3%	0.033	27%	0.268	C	S	.	.	H	α-helix	trans	-63.9	-19.2	175.7	0	0	0	0	0	113.6	W329 L330 V345 K361	W329-A333 WeakPolarHBondContact O-CB 3.46Å; W329-A333 PolarHBondContact O-N 3.27Å; L330-A333 PolarHBondContact O-N 2.81Å; A333-V345 HydrophobicContact CB-CG2 3.53Å; A333-K361 HydrophobicContact CB-CG 4.13Å
334	R	92.4	Very high	89.6	Confident	104 Å²	104	50.9 Å²	50.9	39%	0.392	26%	0.258	S	S	.	.	H	α-helix	trans	-85.9	-40.9	175	-170.6	-169.2	65.5	81.3	0.9	112.5	E303 L330 E331 A332	E303-R334 IonicContact OE1-CZ 3.65Å; E303-R334 IonicContact OE1-NH1 2.65Å; E303-R334 PolarHBondContact OE1-NH1 3.13Å; E303-R334 IonicContact OE1-NH2 2.56Å; E303-R334 IonicContact OE2-CZ 2.7Å; E303-R334 IonicContact OE2-NH1 3.37Å; E303-R334 PolarHBondContact OE2-NH1 2.99Å; E303-R334 IonicContact OE2-NH2 3.59Å; E303-R334 PolarHBondContact OE2-NH2 2.87Å; L330-R334 PolarHBondContact O-N 3.49Å; L330-R334 VanDerWaalsContact O-N 3.08Å; E331-R334 WeakPolarHBondContact O-CB 3.46Å; E331-R334 PolarHBondContact O-N 2.86Å; E331-R334 VanDerWaalsContact O-N 3.14Å; E331-R334 IonicContact OE1-NE 2.74Å; E331-R334 IonicContact OE2-CZ 3.52Å; E331-R334 IonicContact OE2-NE 2.78Å; E331-R334 PolarHBondContact OE2-NE 3.38Å; E331-R334 IonicContact OE2-NH2 3.79Å; E331-R334 PolarHBondContact OE2-NH2 3.33Å; A332-R334 PolarHBondContact O-N 2.95Å
335	L	90.5	Very high	89.8	Confident	13 Å²	13	42 Å²	42	7%	0.068	22%	0.219	C	C	.	.	H	α-helix	trans	-80	-29.7	-175.5	-74.3	172.8	0	0	0	113.5	A299 E303 A311 R312 I315 E331 A332	A299-L335 HydrophobicContact CB-CD1 3.81Å; E303-L335 HydrophobicContact CB-CD2 4.45Å; E303-L335 HydrophobicContact CG-CD2 4.45Å; A311-L335 HydrophobicContact CB-CD1 4.43Å; R312-L335 HydrophobicContact CG-CB 4.31Å; R312-L335 WeakPolarHBondContact CG-O 3.47Å; R312-L335 PolarHBondContact NE-O 2.81Å; I315-L335 HydrophobicContact CB-CD1 4.11Å; I315-L335 HydrophobicContact CG1-CD1 4.39Å; I315-L335 HydrophobicContact CG2-CB 4.41Å; I315-L335 HydrophobicContact CG2-CD1 3.96Å; E331-L335 PolarHBondContact O-N 3.24Å; A332-L335 PolarHBondContact O-N 3.26Å
336	V	88.7	Confident	89.8	Confident	10 Å²	10	42.8 Å²	42.8	6%	0.061	23%	0.228	C	C	.	.	S	Bend	trans	-81.8	144.8	-177.4	173.6	0	0	0	0	110.5	L316 A332 Q340 V344	L316-V336 HydrophobicContact CD2-CG2 4.32Å; L316-V336 HydrophobicContact CG-CG2 4.48Å; A332-V336 VanDerWaalsContact O-CB 3.26Å; A332-V336 WeakPolarHBondContact O-CB 2.93Å; A332-V336 WeakPolarHBondContact O-CG2 3.18Å; A332-V336 PolarHBondContact O-N 3.4Å; V336-Q340 HydrophobicContact CG1-CB 3.23Å; V336-Q340 HydrophobicContact CG1-CG 4.42Å; V336-V344 HydrophobicContact CG1-CG2 4.46Å
337	P	88.8	Confident	89.8	Confident	55 Å²	55	44.3 Å²	44.3	36%	0.357	23%	0.234	S	C	.	.			trans	-56	151	174	-24.9	35.2	0	0	0	113	E339 Q340 A341	P337-E339 VanDerWaalsContact C-N 3.31Å; P337-E339 PolarHBondContact O-N 2.9Å; P337-E339 VanDerWaalsContact O-N 3.13Å; P337-Q340 PolarHBondContact O-N 3.31Å; P337-A341 PolarHBondContact O-N 3.28Å
338	S	82	Confident	89.8	Confident	73 Å²	73	40.9 Å²	40.9	51%	0.51	22%	0.216	S	C	.	.	H	α-helix	trans	-50.3	-42.9	-172.1	51.8	0	0	0	0	114.8	A341 K342	S338-A341 WeakPolarHBondContact O-CB 3.45Å; S338-A341 PolarHBondContact O-N 2.86Å; S338-K342 PolarHBondContact O-N 3.41Å
339	E	84.6	Confident	89.7	Confident	143 Å²	143	42.2 Å²	42.2	67%	0.668	22%	0.223	S	C	*	.	H	α-helix	trans	-63.2	-43.7	-179.6	-62.2	-53.7	138.9	0	0	112.5	P337	P337-E339 VanDerWaalsContact C-N 3.31Å; P337-E339 PolarHBondContact O-N 2.9Å; P337-E339 VanDerWaalsContact O-N 3.13Å
340	Q	87.8	Confident	89.5	Confident	112 Å²	112	51.9 Å²	51.9	52%	0.523	26%	0.26	S	S	.	.	H	α-helix	trans	-78.2	-27.1	177.7	-70.9	174.2	9.3	0	0	111.3	V336 P337 K342 S343 V344	V336-Q340 HydrophobicContact CG1-CB 3.23Å; V336-Q340 HydrophobicContact CG1-CG 4.42Å; P337-Q340 PolarHBondContact O-N 3.31Å; Q340-K342 PolarHBondContact O-N 2.82Å; Q340-S343 PolarHBondContact O-N 3.3Å; Q340-S343 VanDerWaalsContact O-N 3.16Å; Q340-S343 PolarHBondContact O-OG 3.31Å; Q340-V344 WeakPolarHBondContact O-CG2 3.04Å; Q340-V344 PolarHBondContact O-N 3.38Å; Q340-V344 VanDerWaalsContact O-N 3.09Å
341	A	89.4	Confident	89.3	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.008	28%	0.276	C	S	.	.	H	α-helix	trans	-61.2	-33.9	177.1	0	0	0	0	0	111.8	P337 S338 S343 V344 V345 L365	P337-A341 PolarHBondContact O-N 3.28Å; S338-A341 WeakPolarHBondContact O-CB 3.45Å; S338-A341 PolarHBondContact O-N 2.86Å; A341-S343 PolarHBondContact O-N 2.58Å; A341-V344 PolarHBondContact O-N 3.49Å; A341-V345 WeakPolarHBondContact O-CB 3.26Å; A341-V345 WeakPolarHBondContact O-CG2 3.42Å; A341-V345 PolarHBondContact O-N 2.93Å; A341-L365 HydrophobicContact CB-CD1 3.83Å; A341-L365 HydrophobicContact CB-CD2 3.82Å
342	K	89.5	Confident	89.3	Confident	65 Å²	65	56.1 Å²	56.1	28%	0.283	28%	0.279	S	S	.	.	H	α-helix	trans	-61	-42.1	175	-65	-172.2	-175.2	-167.5	0	112.4	S338 Q340 A346 L365 E366	S338-K342 PolarHBondContact O-N 3.41Å; Q340-K342 PolarHBondContact O-N 2.82Å; K342-A346 WeakPolarHBondContact O-CB 3.41Å; K342-A346 PolarHBondContact O-N 3.34Å; K342-L365 VanDerWaalsContact CE-O 3.23Å; K342-L365 WeakPolarHBondContact CE-O 3.43Å; K342-L365 HydrophobicContact CG-CB 4.24Å; K342-E366 IonicContact NZ-OE1 3.63Å; K342-E366 IonicContact NZ-OE2 2.69Å; K342-E366 PolarHBondContact NZ-OE2 3.48Å
343	S	89.9	Confident	89.1	Confident	63 Å²	63	58.5 Å²	58.5	44%	0.441	30%	0.295	S	S	.	.	H	α-helix	trans	-70.5	-39.3	178.2	69.3	0	0	0	0	111.8	Q340 A341 A346 Q347	Q340-S343 PolarHBondContact O-N 3.3Å; Q340-S343 VanDerWaalsContact O-N 3.16Å; Q340-S343 PolarHBondContact O-OG 3.31Å; A341-S343 PolarHBondContact O-N 2.58Å; S343-A346 PolarHBondContact O-N 3.13Å; S343-Q347 WeakPolarHBondContact O-CG 3.35Å; S343-Q347 PolarHBondContact O-N 3.2Å
344	V	90.7	Very high	89	Confident	6 Å²	6	66 Å²	66	4%	0.036	33%	0.329	C	S	.	.	H	α-helix	trans	-60.4	-46.3	174.1	173.5	0	0	0	0	110.8	L316 W329 A332 V336 Q340 A341 Q347 A348	L316-V344 HydrophobicContact CD2-CG2 3.93Å; W329-V344 HydrophobicContact CE3-CG1 3.79Å; W329-V344 HydrophobicContact CZ3-CG1 4.05Å; A332-V344 HydrophobicContact CB-CG1 3.77Å; V336-V344 HydrophobicContact CG1-CG2 4.46Å; Q340-V344 WeakPolarHBondContact O-CG2 3.04Å; Q340-V344 PolarHBondContact O-N 3.38Å; Q340-V344 VanDerWaalsContact O-N 3.09Å; A341-V344 PolarHBondContact O-N 3.49Å; V344-Q347 WeakPolarHBondContact O-CB 3.14Å; V344-Q347 PolarHBondContact O-N 3.2Å; V344-A348 WeakPolarHBondContact O-CB 3.29Å; V344-A348 PolarHBondContact O-N 2.92Å
345	V	90.1	Very high	88.8	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.018	31%	0.314	C	S	.	.	H	α-helix	trans	-68.4	-36.1	178	175	0	0	0	0	111.7	A333 A341 Q347 A348 I349 K361 A362 L365	A333-V345 HydrophobicContact CB-CG2 3.53Å; A341-V345 WeakPolarHBondContact O-CB 3.26Å; A341-V345 WeakPolarHBondContact O-CG2 3.42Å; A341-V345 PolarHBondContact O-N 2.93Å; V345-Q347 VanDerWaalsContact C-N 3.33Å; V345-Q347 PolarHBondContact O-N 3.41Å; V345-A348 WeakPolarHBondContact O-CB 3.48Å; V345-A348 PolarHBondContact O-N 3.32Å; V345-I349 HydrophobicContact CG1-CD1 3.85Å; V345-I349 HydrophobicContact CG1-CG1 4.32Å; V345-I349 WeakPolarHBondContact O-CG1 3.31Å; V345-I349 PolarHBondContact O-N 3.13Å; V345-K361 HydrophobicContact CG2-CG 4.27Å; V345-A362 HydrophobicContact CG1-CB 3.55Å; V345-L365 HydrophobicContact CB-CD1 4.26Å; V345-L365 HydrophobicContact CG2-CD1 3.62Å
346	A	89.9	Confident	88.9	Confident	46 Å²	46	62.5 Å²	62.5	38%	0.38	32%	0.32	S	S	.	.	H	α-helix	trans	-63.2	-38.5	173.5	0	0	0	0	0	112.4	K342 S343 R350	K342-A346 WeakPolarHBondContact O-CB 3.41Å; K342-A346 PolarHBondContact O-N 3.34Å; S343-A346 PolarHBondContact O-N 3.13Å; A346-R350 WeakPolarHBondContact O-CG 3.45Å; A346-R350 PolarHBondContact O-N 3.46Å
347	Q	90.4	Very high	89	Confident	96 Å²	96	66 Å²	66	45%	0.449	33%	0.333	S	S	.	.	H	α-helix	trans	-65.3	-43.3	171.3	-71.6	175.4	-4	0	0	111.2	W329 S343 V344 V345 I349 R350 H351	W329-Q347 HydrophobicContact CH2-CB 4Å; W329-Q347 HydrophobicContact CZ3-CB 4.01Å; S343-Q347 WeakPolarHBondContact O-CG 3.35Å; S343-Q347 PolarHBondContact O-N 3.2Å; V344-Q347 WeakPolarHBondContact O-CB 3.14Å; V344-Q347 PolarHBondContact O-N 3.2Å; V345-Q347 VanDerWaalsContact C-N 3.33Å; V345-Q347 PolarHBondContact O-N 3.41Å; Q347-I349 PolarHBondContact O-N 2.87Å; Q347-R350 WeakPolarHBondContact O-CB 3.13Å; Q347-R350 PolarHBondContact O-N 3.18Å; Q347-H351 PolarHBondContact O-CD2 3.32Å; Q347-H351 VanDerWaalsContact O-CD2 3.24Å; Q347-H351 PolarHBondContact O-N 3.43Å
348	A	90.7	Very high	89.1	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-58	-46.4	177.4	0	0	0	0	0	112.1	W329 V344 V345 R350 H351 L352 L358	W329-A348 HydrophobicContact CB-CB 3.57Å; W329-A348 HydrophobicContact CD2-CB 3.44Å; W329-A348 VanDerWaalsContact CD2-CB 3.44Å; W329-A348 HydrophobicContact CE3-CB 3.69Å; W329-A348 HydrophobicContact CG-CB 3.38Å; W329-A348 HydrophobicContact CZ3-CB 4.5Å; V344-A348 WeakPolarHBondContact O-CB 3.29Å; V344-A348 PolarHBondContact O-N 2.92Å; V345-A348 WeakPolarHBondContact O-CB 3.48Å; V345-A348 PolarHBondContact O-N 3.32Å; A348-R350 VanDerWaalsContact C-N 3.3Å; A348-R350 PolarHBondContact O-N 2.62Å; A348-H351 PolarHBondContact O-N 3.34Å; A348-H351 VanDerWaalsContact O-N 3.13Å; A348-L352 PolarHBondContact O-N 3.34Å; A348-L358 HydrophobicContact CB-CD1 3.72Å; A348-L358 HydrophobicContact CB-CD2 3.92Å; A348-L358 HydrophobicContact CB-CG 4.41Å
349	I	90	Very high	89.7	Confident	28 Å²	28	61 Å²	61	14%	0.144	30%	0.295	C	S	.	.	H	α-helix	trans	-64	-33.9	179	-69.5	165.4	0	0	0	111.6	V345 Q347 H351 L352 P353 L358 W359 A362	V345-I349 HydrophobicContact CG1-CD1 3.85Å; V345-I349 HydrophobicContact CG1-CG1 4.32Å; V345-I349 WeakPolarHBondContact O-CG1 3.31Å; V345-I349 PolarHBondContact O-N 3.13Å; Q347-I349 PolarHBondContact O-N 2.87Å; I349-H351 VanDerWaalsContact C-N 3.31Å; I349-H351 PolarHBondContact O-N 2.99Å; I349-L352 CarbonylContact O-C 3.56Å; I349-L352 PolarHBondContact O-N 3.41Å; I349-P353 VanDerWaalsContact O-CA 3.32Å; I349-P353 WeakPolarHBondContact O-CA 3.39Å; I349-P353 VanDerWaalsContact O-N 3.11Å; I349-L358 HydrophobicContact CG1-CB 4.25Å; I349-W359 HydrophobicContact CD1-CD2 4.11Å; I349-W359 HydrophobicContact CD1-CE3 3.81Å; I349-W359 HydrophobicContact CD1-CH2 4.26Å; I349-W359 HydrophobicContact CD1-CZ3 3.9Å; I349-W359 HydrophobicContact CG1-CD2 4.43Å; I349-W359 HydrophobicContact CG2-CH2 3.6Å; I349-W359 HydrophobicContact CG2-CZ2 3.32Å; I349-W359 HydrophobicContact CG2-CZ3 4.33Å; I349-A362 HydrophobicContact CD1-CB 3.98Å
350	R	89.5	Confident	90.1	Very high	210 Å²	210	54.5 Å²	54.5	79%	0.792	27%	0.265	S	S	*	.	H	α-helix	trans	-64.1	-36.8	174.4	-72.3	173.9	-178.2	-178.2	0.9	112.2	A346 Q347 A348	A346-R350 WeakPolarHBondContact O-CG 3.45Å; A346-R350 PolarHBondContact O-N 3.46Å; Q347-R350 WeakPolarHBondContact O-CB 3.13Å; Q347-R350 PolarHBondContact O-N 3.18Å; A348-R350 VanDerWaalsContact C-N 3.3Å; A348-R350 PolarHBondContact O-N 2.62Å
351	H	89	Confident	90.1	Very high	109 Å²	109	51.9 Å²	51.9	51%	0.505	25%	0.252	S	S	.	.	H	α-helix	trans	-80.6	-35.7	177.1	-71.8	-66.6	0	0	0	112.8	P323 W329 Q347 A348 I349	P323-H351 HydrophobicContact CB-CB 4.48Å; W329-H351 AromaticContact CZ2-CD2 3.68Å; Q347-H351 PolarHBondContact O-CD2 3.32Å; Q347-H351 VanDerWaalsContact O-CD2 3.24Å; Q347-H351 PolarHBondContact O-N 3.43Å; A348-H351 PolarHBondContact O-N 3.34Å; A348-H351 VanDerWaalsContact O-N 3.13Å; I349-H351 VanDerWaalsContact C-N 3.31Å; I349-H351 PolarHBondContact O-N 2.99Å
352	L	89.3	Confident	90.2	Very high	37 Å²	37	52.5 Å²	52.5	19%	0.194	26%	0.257	C	S	.	.			trans	-132.3	72	-173.6	-66.9	172.4	0	0	0	111.1	E326 A348 I349 Q354 S355 L358	E326-L352 HydrophobicContact CB-CD1 4.11Å; A348-L352 PolarHBondContact O-N 3.34Å; I349-L352 CarbonylContact O-C 3.56Å; I349-L352 PolarHBondContact O-N 3.41Å; L352-Q354 PolarHBondContact O-N 2.79Å; L352-S355 PolarHBondContact O-N 2.85Å; L352-L358 HydrophobicContact CB-CD1 3.9Å; L352-L358 HydrophobicContact CD1-CD1 4.29Å
353	P	87.7	Confident	90.2	Very high	50 Å²	50	49.4 Å²	49.4	33%	0.325	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-24.3	-178.3	25.8	-34.3	0	0	0	113	I349 W359	I349-P353 VanDerWaalsContact O-CA 3.32Å; I349-P353 WeakPolarHBondContact O-CA 3.39Å; I349-P353 VanDerWaalsContact O-N 3.11Å; P353-W359 PolarHBondContact O-NE1 3.2Å
354	Q	87.7	Confident	90.2	Very high	163 Å²	163	51.2 Å²	51.2	76%	0.762	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-7	-178.8	-66.5	-174.2	-17.8	0	0	114.4	L352 V356	L352-Q354 PolarHBondContact O-N 2.79Å; Q354-V356 PolarHBondContact O-N 3.32Å
355	S	89.6	Confident	90.1	Very high	11 Å²	11	52.3 Å²	52.3	8%	0.077	25%	0.254	C	S	.	.			trans	-80.4	109.4	-176.6	179.4	0	0	0	0	111.8	E326 L352 R357 L358 W359	E326-S355 PolarHBondContact OE2-OG 3.25Å; L352-S355 PolarHBondContact O-N 2.85Å; S355-R357 PolarHBondContact O-N 2.74Å; S355-L358 PolarHBondContact O-N 3.49Å; S355-W359 PolarHBondContact O-N 2.78Å
356	V	90.9	Very high	90	Very high	32 Å²	32	54.4 Å²	54.4	19%	0.194	26%	0.264	C	S	.	.	H	α-helix	trans	-57.6	-37.4	174.3	174.4	0	0	0	0	111.8	Q354 L358 W359 V360 V383 R388 L389	Q354-V356 PolarHBondContact O-N 3.32Å; V356-L358 PolarHBondContact O-N 2.83Å; V356-W359 PolarHBondContact O-N 3.14Å; V356-V360 HydrophobicContact CG1-CG2 4.34Å; V356-V360 WeakPolarHBondContact O-CG2 3.44Å; V356-V360 PolarHBondContact O-N 3.03Å; V356-V383 HydrophobicContact CG2-CG1 4.02Å; V356-R388 HydrophobicContact CG1-CB 4.21Å; V356-R388 HydrophobicContact CG1-CG 4.4Å; V356-L389 HydrophobicContact CG1-CD2 3.92Å; V356-L389 HydrophobicContact CG1-CG 3.89Å; V356-L389 HydrophobicContact CG2-CD1 4.46Å; V356-L389 HydrophobicContact CG2-CG 4.48Å
357	R	91.7	Very high	89.8	Confident	84 Å²	84	57.8 Å²	57.8	32%	0.317	28%	0.28	S	S	.	.	H	α-helix	trans	-67	-38.2	-176.1	-63.9	-166.2	-74.6	157.2	-17.5	112.3	E326 D327 L330 S355 V360 K361	E326-R357 VanDerWaalsContact CG-NH2 3.32Å; E326-R357 IonicContact OE1-CZ 3.83Å; E326-R357 IonicContact OE1-NE 2.68Å; E326-R357 PolarHBondContact OE1-NE 3.3Å; E326-R357 IonicContact OE1-NH2 2.56Å; E326-R357 PolarHBondContact OE1-NH2 3.07Å; E326-R357 IonicContact OE2-CZ 3.89Å; E326-R357 IonicContact OE2-NE 3.6Å; E326-R357 PolarHBondContact OE2-NE 2.96Å; E326-R357 IonicContact OE2-NH2 3.09Å; D327-R357 IonicContact OD1-CZ 3.9Å; D327-R357 IonicContact OD1-NH1 3.29Å; D327-R357 PolarHBondContact OD1-NH1 3.06Å; D327-R357 IonicContact OD1-NH2 3.46Å; D327-R357 PolarHBondContact OD1-NH2 3.19Å; D327-R357 IonicContact OD2-NH2 3.64Å; L330-R357 HydrophobicContact CD1-CB 3.85Å; L330-R357 VanDerWaalsContact CD1-NH1 3.31Å; L330-R357 HydrophobicContact CD2-CB 4.41Å; S355-R357 PolarHBondContact O-N 2.74Å; R357-V360 PolarHBondContact O-N 3.34Å; R357-K361 WeakPolarHBondContact O-CB 3.19Å; R357-K361 PolarHBondContact O-N 3.14Å
358	L	91.6	Very high	89.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-66.3	-40.9	176.6	-66.8	177.7	0	0	0	111.6	W329 L330 A348 I349 L352 S355 V356 K361 A362	W329-L358 HydrophobicContact CB-CD2 3.74Å; L330-L358 HydrophobicContact CD2-CD2 3.88Å; L330-L358 HydrophobicContact CG-CD2 3.97Å; A348-L358 HydrophobicContact CB-CD1 3.72Å; A348-L358 HydrophobicContact CB-CD2 3.92Å; A348-L358 HydrophobicContact CB-CG 4.41Å; I349-L358 HydrophobicContact CG1-CB 4.25Å; L352-L358 HydrophobicContact CB-CD1 3.9Å; L352-L358 HydrophobicContact CD1-CD1 4.29Å; S355-L358 PolarHBondContact O-N 3.49Å; V356-L358 PolarHBondContact O-N 2.83Å; L358-K361 PolarHBondContact O-N 3.1Å; L358-A362 WeakPolarHBondContact O-CB 3.38Å; L358-A362 PolarHBondContact O-N 3.19Å
359	W	93.6	Very high	89.7	Confident	21 Å²	21	65 Å²	65	8%	0.08	31%	0.313	C	S	.	.	H	α-helix	trans	-63.5	-42.6	175.1	-74.6	114.4	0	0	0	112.9	I349 P353 S355 V356 A362 A363 V375 K378 A379 Q382 L389	I349-W359 HydrophobicContact CD1-CD2 4.11Å; I349-W359 HydrophobicContact CD1-CE3 3.81Å; I349-W359 HydrophobicContact CD1-CH2 4.26Å; I349-W359 HydrophobicContact CD1-CZ3 3.9Å; I349-W359 HydrophobicContact CG1-CD2 4.43Å; I349-W359 HydrophobicContact CG2-CH2 3.6Å; I349-W359 HydrophobicContact CG2-CZ2 3.32Å; I349-W359 HydrophobicContact CG2-CZ3 4.33Å; P353-W359 PolarHBondContact O-NE1 3.2Å; S355-W359 PolarHBondContact O-N 2.78Å; V356-W359 PolarHBondContact O-N 3.14Å; W359-A362 WeakPolarHBondContact O-CB 3.35Å; W359-A362 PolarHBondContact O-N 3.31Å; W359-A363 PolarHBondContact O-N 2.79Å; W359-V375 HydrophobicContact CE3-CG1 3.96Å; W359-V375 HydrophobicContact CZ3-CG1 4.33Å; W359-K378 HydrophobicContact CH2-CB 4.01Å; W359-K378 HydrophobicContact CZ3-CB 4.01Å; W359-A379 HydrophobicContact CB-CB 3.67Å; W359-A379 HydrophobicContact CD2-CB 3.45Å; W359-A379 VanDerWaalsContact CD2-CB 3.45Å; W359-A379 HydrophobicContact CE3-CB 3.64Å; W359-A379 HydrophobicContact CG-CB 3.47Å; W359-A379 VanDerWaalsContact CG-CB 3.47Å; W359-A379 HydrophobicContact CZ3-CB 4.4Å; W359-Q382 HydrophobicContact CZ2-CB 4.47Å; W359-Q382 HydrophobicContact CZ2-CG 4.02Å; W359-L389 HydrophobicContact CB-CD2 4.08Å
360	V	92.2	Very high	89.7	Confident	7 Å²	7	72 Å²	72	4%	0.042	34%	0.342	C	S	.	.	H	α-helix	trans	-62.4	-45.3	174.1	175.9	0	0	0	0	110.4	V356 R357 A362 A363 D364 L389 L392	V356-V360 HydrophobicContact CG1-CG2 4.34Å; V356-V360 WeakPolarHBondContact O-CG2 3.44Å; V356-V360 PolarHBondContact O-N 3.03Å; R357-V360 PolarHBondContact O-N 3.34Å; V360-A362 VanDerWaalsContact C-N 3.29Å; V360-A362 PolarHBondContact O-N 2.89Å; V360-A363 PolarHBondContact O-N 2.82Å; V360-A363 VanDerWaalsContact O-N 3.16Å; V360-D364 VanDerWaalsContact O-CG 3.3Å; V360-D364 PolarHBondContact O-N 3.32Å; V360-L389 HydrophobicContact CG2-CD2 3.93Å; V360-L392 HydrophobicContact CB-CD1 4.39Å; V360-L392 HydrophobicContact CG1-CD1 3.91Å; V360-L392 HydrophobicContact CG2-CD1 3.58Å
361	K	89.4	Confident	89.8	Confident	58 Å²	58	63.4 Å²	63.4	25%	0.252	32%	0.317	S	S	.	.	H	α-helix	trans	-62.6	-35.9	176.8	-173.4	59.4	175.7	175.1	0	112.3	L330 A333 V345 R357 L358 D364 L365	L330-K361 HydrophobicContact CD2-CB 3.81Å; L330-K361 HydrophobicContact CD2-CG 4.09Å; A333-K361 HydrophobicContact CB-CG 4.13Å; V345-K361 HydrophobicContact CG2-CG 4.27Å; R357-K361 WeakPolarHBondContact O-CB 3.19Å; R357-K361 PolarHBondContact O-N 3.14Å; L358-K361 PolarHBondContact O-N 3.1Å; K361-D364 PolarHBondContact O-N 2.91Å; K361-L365 VanDerWaalsContact O-CG 3.28Å; K361-L365 WeakPolarHBondContact O-CG 3.32Å; K361-L365 PolarHBondContact O-N 2.91Å; K361-L365 VanDerWaalsContact O-N 3.11Å
362	A	90.8	Very high	89.9	Confident	13 Å²	13	60.6 Å²	60.6	11%	0.107	30%	0.303	C	S	.	.	H	α-helix	trans	-62.3	-45.8	174.1	0	0	0	0	0	111.3	V345 I349 L358 W359 V360 D364 L365 E366 V375	V345-A362 HydrophobicContact CG1-CB 3.55Å; I349-A362 HydrophobicContact CD1-CB 3.98Å; L358-A362 WeakPolarHBondContact O-CB 3.38Å; L358-A362 PolarHBondContact O-N 3.19Å; W359-A362 WeakPolarHBondContact O-CB 3.35Å; W359-A362 PolarHBondContact O-N 3.31Å; V360-A362 VanDerWaalsContact C-N 3.29Å; V360-A362 PolarHBondContact O-N 2.89Å; A362-D364 VanDerWaalsContact C-N 3.34Å; A362-D364 PolarHBondContact O-N 3.34Å; A362-L365 PolarHBondContact O-N 3.43Å; A362-E366 PolarHBondContact O-N 3.14Å; A362-V375 HydrophobicContact CB-CG1 3.88Å
363	A	89.4	Confident	90	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.008	30%	0.304	C	S	.	.	H	α-helix	trans	-65.3	-37.3	177	0	0	0	0	0	112.1	W359 V360 L365 E366 K372 V375 F376	W359-A363 PolarHBondContact O-N 2.79Å; V360-A363 PolarHBondContact O-N 2.82Å; V360-A363 VanDerWaalsContact O-N 3.16Å; A363-L365 VanDerWaalsContact C-N 3.29Å; A363-L365 PolarHBondContact O-N 3.32Å; A363-E366 PolarHBondContact O-N 3.02Å; A363-K372 VanDerWaalsContact O-CE 3.22Å; A363-K372 WeakPolarHBondContact O-CE 3.39Å; A363-K372 WeakPolarHBondContact O-CG 3.35Å; A363-V375 HydrophobicContact CB-CG1 4.11Å; A363-F376 HydrophobicContact CB-CD2 4.11Å; A363-F376 HydrophobicContact CB-CE1 3.89Å; A363-F376 HydrophobicContact CB-CE2 3.41Å; A363-F376 VanDerWaalsContact CB-CE2 3.41Å; A363-F376 HydrophobicContact CB-CZ 3.28Å
364	D	89.5	Confident	90.2	Very high	101 Å²	101	62.3 Å²	62.3	54%	0.54	31%	0.31	S	S	.	.	H	α-helix	trans	-66.6	-29.3	176.7	-68.9	-22.2	0	0	0	113	V360 K361 A362 E366	V360-D364 VanDerWaalsContact O-CG 3.3Å; V360-D364 PolarHBondContact O-N 3.32Å; K361-D364 PolarHBondContact O-N 2.91Å; A362-D364 VanDerWaalsContact C-N 3.34Å; A362-D364 PolarHBondContact O-N 3.34Å; D364-E366 VanDerWaalsContact C-N 3.3Å
365	L	88.3	Confident	90.4	Very high	29 Å²	29	55.5 Å²	55.5	15%	0.152	28%	0.28	C	S	.	.	H	α-helix	trans	-76.2	-17.1	176.5	-72.2	171.6	0	0	0	113.2	A341 K342 V345 K361 A362 A363	A341-L365 HydrophobicContact CB-CD1 3.83Å; A341-L365 HydrophobicContact CB-CD2 3.82Å; K342-L365 VanDerWaalsContact CE-O 3.23Å; K342-L365 WeakPolarHBondContact CE-O 3.43Å; K342-L365 HydrophobicContact CG-CB 4.24Å; V345-L365 HydrophobicContact CB-CD1 4.26Å; V345-L365 HydrophobicContact CG2-CD1 3.62Å; K361-L365 VanDerWaalsContact O-CG 3.28Å; K361-L365 WeakPolarHBondContact O-CG 3.32Å; K361-L365 PolarHBondContact O-N 2.91Å; K361-L365 VanDerWaalsContact O-N 3.11Å; A362-L365 PolarHBondContact O-N 3.43Å; A363-L365 VanDerWaalsContact C-N 3.29Å; A363-L365 PolarHBondContact O-N 3.32Å
366	E	87.8	Confident	90.5	Very high	47 Å²	47	55.4 Å²	55.4	22%	0.22	28%	0.278	C	S	.	.			trans	-84.4	133.5	174.4	-64.3	-57.1	162.1	0	0	110.9	K342 A362 A363 D364 A371 K372 V375	K342-E366 IonicContact NZ-OE1 3.63Å; K342-E366 IonicContact NZ-OE2 2.69Å; K342-E366 PolarHBondContact NZ-OE2 3.48Å; A362-E366 PolarHBondContact O-N 3.14Å; A363-E366 PolarHBondContact O-N 3.02Å; D364-E366 VanDerWaalsContact C-N 3.3Å; E366-A371 HydrophobicContact CB-CB 4.12Å; E366-A371 HydrophobicContact CG-CB 4.09Å; E366-K372 HydrophobicContact CB-CG 3.99Å; E366-K372 WeakPolarHBondContact O-CE 3.18Å; E366-V375 HydrophobicContact CG-CG2 4.28Å
367	T	86.8	Confident	90.4	Very high	116 Å²	116	59.2 Å²	59.2	71%	0.712	29%	0.292	S	S	*	.			trans	-85	-33	175.8	50.2	0	0	0	0	111.6
368	E	90.1	Very high	90.4	Very high	124 Å²	124	60.7 Å²	60.7	58%	0.579	30%	0.3	S	S	*	.			trans	-82.5	126.8	-174.8	-68.3	-63.2	138.7	0	0	112.6	K370 A371 K372	E368-K370 VanDerWaalsContact C-N 3.29Å; E368-K370 PolarHBondContact O-N 2.98Å; E368-A371 HydrophobicContact CB-CB 3.92Å; E368-A371 WeakPolarHBondContact O-CB 3.43Å; E368-A371 PolarHBondContact O-N 2.87Å; E368-A371 VanDerWaalsContact O-N 3.09Å; E368-K372 PolarHBondContact O-N 2.9Å
369	H	88.4	Confident	90.4	Very high	125 Å²	125	60.7 Å²	60.7	58%	0.579	30%	0.3	S	S	*	.	H	α-helix	trans	-57.9	-39.2	177.5	-74.7	-82.1	0	0	0	112.9	A371 K372 K373	H369-A371 VanDerWaalsContact C-N 3.34Å; H369-A371 PolarHBondContact O-N 3.39Å; H369-K372 WeakPolarHBondContact O-CB 3.47Å; H369-K372 PolarHBondContact O-N 3.35Å; H369-K373 WeakPolarHBondContact O-CG 3.46Å; H369-K373 PolarHBondContact O-N 2.92Å
370	K	90.8	Very high	90.3	Very high	173 Å²	173	60.3 Å²	60.3	75%	0.752	30%	0.3	S	S	*	.	H	α-helix	trans	-62.9	-41.3	177	-66.4	-178.2	-179.4	178.1	0	111.5	E368 K373 V374	E368-K370 VanDerWaalsContact C-N 3.29Å; E368-K370 PolarHBondContact O-N 2.98Å; K370-K373 PolarHBondContact O-N 3.42Å; K370-V374 WeakPolarHBondContact O-CG2 3.34Å; K370-V374 PolarHBondContact O-N 2.9Å; K370-V374 VanDerWaalsContact O-N 3.1Å
371	A	90.4	Very high	90.2	Very high	31 Å²	31	67.2 Å²	67.2	26%	0.256	33%	0.332	S	S	.	.	H	α-helix	trans	-65.8	-42.5	176.8	0	0	0	0	0	110.9	E366 E368 H369 K373 V374 V375	E366-A371 HydrophobicContact CB-CB 4.12Å; E366-A371 HydrophobicContact CG-CB 4.09Å; E368-A371 HydrophobicContact CB-CB 3.92Å; E368-A371 WeakPolarHBondContact O-CB 3.43Å; E368-A371 PolarHBondContact O-N 2.87Å; E368-A371 VanDerWaalsContact O-N 3.09Å; H369-A371 VanDerWaalsContact C-N 3.34Å; H369-A371 PolarHBondContact O-N 3.39Å; A371-K373 PolarHBondContact O-N 3.32Å; A371-V374 PolarHBondContact O-N 3.08Å; A371-V375 WeakPolarHBondContact O-CG2 3.35Å; A371-V375 PolarHBondContact O-N 3.26Å
372	K	92	Very high	90.2	Very high	50 Å²	50	69.1 Å²	69.1	22%	0.217	34%	0.342	C	S	.	.	H	α-helix	trans	-56.4	-48.1	173.3	-67.1	-170.6	-178.1	-168.1	0	112.2	A363 E366 E368 H369 V374 V375 F376 L396	A363-K372 VanDerWaalsContact O-CE 3.22Å; A363-K372 WeakPolarHBondContact O-CE 3.39Å; A363-K372 WeakPolarHBondContact O-CG 3.35Å; E366-K372 HydrophobicContact CB-CG 3.99Å; E366-K372 WeakPolarHBondContact O-CE 3.18Å; E368-K372 PolarHBondContact O-N 2.9Å; H369-K372 WeakPolarHBondContact O-CB 3.47Å; H369-K372 PolarHBondContact O-N 3.35Å; K372-V374 VanDerWaalsContact C-N 3.32Å; K372-V374 PolarHBondContact O-N 3.4Å; K372-V375 PolarHBondContact O-N 3.32Å; K372-V375 VanDerWaalsContact O-N 3.16Å; K372-F376 HydrophobicContact CB-CD2 4.48Å; K372-F376 HydrophobicContact CB-CE2 4.45Å; K372-F376 WeakPolarHBondContact O-CD2 3.06Å; K372-F376 PolarHBondContact O-N 3.11Å; K372-L396 HydrophobicContact CB-CD1 3.87Å
373	K	91.2	Very high	90.1	Very high	47 Å²	47	69 Å²	69	20%	0.204	34%	0.339	C	S	.	.	H	α-helix	trans	-56.6	-45	176.4	-70.6	-176.1	-176.9	-155.3	0	111.7	H369 K370 A371 V375 F376 K377 L396 E397	H369-K373 WeakPolarHBondContact O-CG 3.46Å; H369-K373 PolarHBondContact O-N 2.92Å; K370-K373 PolarHBondContact O-N 3.42Å; A371-K373 PolarHBondContact O-N 3.32Å; K373-V375 PolarHBondContact O-N 3.29Å; K373-F376 PolarHBondContact O-N 2.76Å; K373-K377 WeakPolarHBondContact O-CB 3.45Å; K373-K377 WeakPolarHBondContact O-CG 3.5Å; K373-K377 PolarHBondContact O-N 3.12Å; K373-L396 WeakPolarHBondContact CE-O 3.46Å; K373-L396 HydrophobicContact CG-CB 4.12Å; K373-L396 HydrophobicContact CG-CD1 4.43Å; K373-L396 PolarHBondContact NZ-O 2.9Å; K373-E397 WeakPolarHBondContact CD-OE2 3.34Å; K373-E397 VanDerWaalsContact CE-OE2 3.31Å; K373-E397 WeakPolarHBondContact CE-OE2 3.44Å; K373-E397 IonicContact NZ-OE2 3.91Å; K373-E397 PolarHBondContact NZ-OE2 3.01Å
374	V	92	Very high	90	Very high	75 Å²	75	71.8 Å²	71.8	46%	0.455	36%	0.357	S	S	.	.	H	α-helix	trans	-63.6	-41.6	177.7	173.5	0	0	0	0	111.5	K370 A371 K372 K377 K378	K370-V374 WeakPolarHBondContact O-CG2 3.34Å; K370-V374 PolarHBondContact O-N 2.9Å; K370-V374 VanDerWaalsContact O-N 3.1Å; A371-V374 PolarHBondContact O-N 3.08Å; K372-V374 VanDerWaalsContact C-N 3.32Å; K372-V374 PolarHBondContact O-N 3.4Å; V374-K377 PolarHBondContact O-N 2.97Å; V374-K378 HydrophobicContact CG1-CD 4.33Å; V374-K378 WeakPolarHBondContact O-CG 3.35Å; V374-K378 PolarHBondContact O-N 3.12Å
375	V	91.8	Very high	90	Very high	21 Å²	21	72.6 Å²	72.6	13%	0.127	36%	0.362	C	S	.	.	H	α-helix	trans	-62.4	-46.1	176.2	173.5	0	0	0	0	110.7	W359 A362 A363 E366 A371 K372 K373 K378 A379	W359-V375 HydrophobicContact CE3-CG1 3.96Å; W359-V375 HydrophobicContact CZ3-CG1 4.33Å; A362-V375 HydrophobicContact CB-CG1 3.88Å; A363-V375 HydrophobicContact CB-CG1 4.11Å; E366-V375 HydrophobicContact CG-CG2 4.28Å; A371-V375 WeakPolarHBondContact O-CG2 3.35Å; A371-V375 PolarHBondContact O-N 3.26Å; K372-V375 PolarHBondContact O-N 3.32Å; K372-V375 VanDerWaalsContact O-N 3.16Å; K373-V375 PolarHBondContact O-N 3.29Å; V375-K378 PolarHBondContact O-N 3.44Å; V375-A379 WeakPolarHBondContact O-CB 3.46Å; V375-A379 PolarHBondContact O-N 2.83Å
376	F	91.7	Very high	90	Very high	9 Å²	9	71.7 Å²	71.7	4%	0.039	36%	0.358	C	S	.	.	H	α-helix	trans	-66.8	-38.2	177.9	-75.6	-60.5	0	0	0	113.2	A363 K372 K373 K378 A379 L380 L389 L392 A393 L396	A363-F376 HydrophobicContact CB-CD2 4.11Å; A363-F376 HydrophobicContact CB-CE1 3.89Å; A363-F376 HydrophobicContact CB-CE2 3.41Å; A363-F376 VanDerWaalsContact CB-CE2 3.41Å; A363-F376 HydrophobicContact CB-CZ 3.28Å; K372-F376 HydrophobicContact CB-CD2 4.48Å; K372-F376 HydrophobicContact CB-CE2 4.45Å; K372-F376 WeakPolarHBondContact O-CD2 3.06Å; K372-F376 PolarHBondContact O-N 3.11Å; K373-F376 PolarHBondContact O-N 2.76Å; F376-K378 PolarHBondContact O-N 3.46Å; F376-A379 WeakPolarHBondContact O-CB 3.41Å; F376-A379 PolarHBondContact O-N 2.95Å; F376-A379 VanDerWaalsContact O-N 3.16Å; F376-L380 WeakPolarHBondContact O-CB 3.49Å; F376-L380 WeakPolarHBondContact O-CG 3.41Å; F376-L380 PolarHBondContact O-N 3.47Å; F376-L389 HydrophobicContact CD1-CD2 4.2Å; F376-L389 HydrophobicContact CE1-CD2 4.23Å; F376-L392 HydrophobicContact CD1-CB 4.41Å; F376-L392 HydrophobicContact CE1-CB 3.69Å; F376-L392 HydrophobicContact CE1-CD1 4.03Å; F376-L392 HydrophobicContact CE2-CB 4.29Å; F376-L392 HydrophobicContact CZ-CB 3.62Å; F376-L392 HydrophobicContact CZ-CD1 4.09Å; F376-L392 HydrophobicContact CZ-CG 4.44Å; F376-A393 HydrophobicContact CB-CB 4.06Å; F376-A393 HydrophobicContact CG-CB 4.46Å; F376-L396 HydrophobicContact CD2-CD1 3.43Å; F376-L396 VanDerWaalsContact CD2-CD1 3.43Å; F376-L396 HydrophobicContact CE2-CD1 3.54Å
377	K	89.7	Confident	90.1	Very high	112 Å²	112	71.3 Å²	71.3	49%	0.487	36%	0.359	S	S	.	.	H	α-helix	trans	-61.4	-44.2	173.9	-74.2	177.7	-176.6	-177.8	0	111.5	K373 V374 A379 L380 E381 E397	K373-K377 WeakPolarHBondContact O-CB 3.45Å; K373-K377 WeakPolarHBondContact O-CG 3.5Å; K373-K377 PolarHBondContact O-N 3.12Å; V374-K377 PolarHBondContact O-N 2.97Å; K377-A379 VanDerWaalsContact C-N 3.32Å; K377-A379 PolarHBondContact O-N 3.5Å; K377-L380 PolarHBondContact O-N 3.02Å; K377-E381 PolarHBondContact O-N 2.88Å; K377-E397 VanDerWaalsContact CE-OE1 3.31Å; K377-E397 WeakPolarHBondContact CE-OE1 3.24Å; K377-E397 IonicContact NZ-OE1 3.41Å; K377-E397 PolarHBondContact NZ-OE1 3.28Å
378	K	90.3	Very high	90.2	Very high	114 Å²	114	72.2 Å²	72.2	50%	0.496	35%	0.349	S	S	.	.	H	α-helix	trans	-63.2	-37.9	172.6	-71.9	178	179.7	-178.6	0	112.4	W359 V374 V375 F376 E381 Q382	W359-K378 HydrophobicContact CH2-CB 4.01Å; W359-K378 HydrophobicContact CZ3-CB 4.01Å; V374-K378 HydrophobicContact CG1-CD 4.33Å; V374-K378 WeakPolarHBondContact O-CG 3.35Å; V374-K378 PolarHBondContact O-N 3.12Å; V375-K378 PolarHBondContact O-N 3.44Å; F376-K378 PolarHBondContact O-N 3.46Å; K378-E381 PolarHBondContact O-N 2.89Å; K378-Q382 WeakPolarHBondContact O-CG 3.48Å; K378-Q382 PolarHBondContact O-N 3.22Å
379	A	92.1	Very high	90.3	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-65.9	-42	178	0	0	0	0	0	111.8	W359 V375 F376 K377 Q382 V383 L389	W359-A379 HydrophobicContact CB-CB 3.67Å; W359-A379 HydrophobicContact CD2-CB 3.45Å; W359-A379 VanDerWaalsContact CD2-CB 3.45Å; W359-A379 HydrophobicContact CE3-CB 3.64Å; W359-A379 HydrophobicContact CG-CB 3.47Å; W359-A379 VanDerWaalsContact CG-CB 3.47Å; W359-A379 HydrophobicContact CZ3-CB 4.4Å; V375-A379 WeakPolarHBondContact O-CB 3.46Å; V375-A379 PolarHBondContact O-N 2.83Å; F376-A379 WeakPolarHBondContact O-CB 3.41Å; F376-A379 PolarHBondContact O-N 2.95Å; F376-A379 VanDerWaalsContact O-N 3.16Å; K377-A379 VanDerWaalsContact C-N 3.32Å; K377-A379 PolarHBondContact O-N 3.5Å; A379-Q382 PolarHBondContact O-N 2.9Å; A379-V383 PolarHBondContact O-N 3.45Å; A379-L389 HydrophobicContact CB-CD1 3.65Å; A379-L389 HydrophobicContact CB-CD2 4.22Å
380	L	90.8	Very high	90.5	Very high	14 Å²	14	60.9 Å²	60.9	7%	0.073	30%	0.296	C	S	.	.	H	α-helix	trans	-69.9	-32	177.7	-71.3	173.2	0	0	0	112.8	F376 K377 Q382 V383 P384 L389 W390 A393 M405	F376-L380 WeakPolarHBondContact O-CB 3.49Å; F376-L380 WeakPolarHBondContact O-CG 3.41Å; F376-L380 PolarHBondContact O-N 3.47Å; K377-L380 PolarHBondContact O-N 3.02Å; L380-Q382 VanDerWaalsContact C-N 3.29Å; L380-Q382 PolarHBondContact O-N 3.45Å; L380-V383 CarbonylContact O-C 3.37Å; L380-P384 WeakPolarHBondContact O-CA 3.22Å; L380-L389 HydrophobicContact CD2-CB 3.6Å; L380-L389 HydrophobicContact CG-CB 4.31Å; L380-W390 HydrophobicContact CD1-CD2 4.09Å; L380-W390 HydrophobicContact CD1-CE3 3.74Å; L380-W390 HydrophobicContact CD1-CH2 4.14Å; L380-W390 HydrophobicContact CD1-CZ2 4.45Å; L380-W390 HydrophobicContact CD1-CZ3 3.79Å; L380-W390 HydrophobicContact CD2-CD2 3.61Å; L380-W390 HydrophobicContact CD2-CE3 4.15Å; L380-W390 HydrophobicContact CD2-CG 3.86Å; L380-W390 HydrophobicContact CD2-CZ2 4.08Å; L380-W390 HydrophobicContact CG-CD2 4.5Å; L380-A393 HydrophobicContact CD1-CB 3.82Å; L380-M405 HydrophobicContact CD1-CE 3.62Å
381	E	90	Very high	90.5	Very high	151 Å²	151	55.5 Å²	55.5	71%	0.706	27%	0.272	S	S	*	.	H	α-helix	trans	-62.1	-37.7	171.7	-172.5	-176.5	175.6	0	0	111.6	K377 K378	K377-E381 PolarHBondContact O-N 2.88Å; K378-E381 PolarHBondContact O-N 2.89Å
382	Q	89.4	Confident	90.5	Very high	99 Å²	99	56.1 Å²	56.1	46%	0.463	27%	0.271	S	S	.	.	H	α-helix	trans	-82.9	-37.9	178.2	-63.1	-61.7	-43.3	0	0	112.9	W359 K378 A379 L380	W359-Q382 HydrophobicContact CZ2-CB 4.47Å; W359-Q382 HydrophobicContact CZ2-CG 4.02Å; K378-Q382 WeakPolarHBondContact O-CG 3.48Å; K378-Q382 PolarHBondContact O-N 3.22Å; A379-Q382 PolarHBondContact O-N 2.9Å; L380-Q382 VanDerWaalsContact C-N 3.29Å; L380-Q382 PolarHBondContact O-N 3.45Å
383	V	89.4	Confident	90.4	Very high	10 Å²	10	53.9 Å²	53.9	6%	0.061	26%	0.262	C	S	.	.			trans	-133.9	76.7	-173	-167.2	0	0	0	0	111.2	V356 A379 L380 N385 S386 L389	V356-V383 HydrophobicContact CG2-CG1 4.02Å; A379-V383 PolarHBondContact O-N 3.45Å; L380-V383 CarbonylContact O-C 3.37Å; V383-N385 VanDerWaalsContact C-N 3.32Å; V383-N385 VanDerWaalsContact CG1-OD1 3.23Å; V383-N385 WeakPolarHBondContact CG1-OD1 3.12Å; V383-N385 PolarHBondContact O-N 3.28Å; V383-S386 PolarHBondContact O-OG 3.07Å; V383-S386 VanDerWaalsContact O-OG 3.05Å; V383-L389 HydrophobicContact CB-CD1 4.2Å
384	P	88.2	Confident	90.3	Very high	60 Å²	60	52.8 Å²	52.8	39%	0.39	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-18.2	-176.5	28.9	-35.5	0	0	0	113.7	L380 S386 W390 C412	L380-P384 WeakPolarHBondContact O-CA 3.22Å; P384-S386 VanDerWaalsContact C-N 3.28Å; P384-S386 PolarHBondContact O-N 3.44Å; P384-W390 PolarHBondContact O-NE1 3.19Å; P384-C412 WeakPolarHBondContact O-CB 3.49Å
385	N	88.2	Confident	90.2	Very high	117 Å²	117	56.2 Å²	56.2	63%	0.626	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	8.3	-176.7	65.6	-11.5	0	0	0	114	V383 C413	V383-N385 VanDerWaalsContact C-N 3.32Å; V383-N385 VanDerWaalsContact CG1-OD1 3.23Å; V383-N385 WeakPolarHBondContact CG1-OD1 3.12Å; V383-N385 PolarHBondContact O-N 3.28Å; N385-C413 PolarHBondContact O-SG 3.05Å; N385-C413 VanDerWaalsContact O-SG 3.42Å
386	S	88.7	Confident	90	Very high	11 Å²	11	57.1 Å²	57.1	8%	0.077	27%	0.274	C	S	.	.			trans	-101.2	108	-173.4	66.3	0	0	0	0	112.6	V383 P384 R388 L389 W390	V383-S386 PolarHBondContact O-OG 3.07Å; V383-S386 VanDerWaalsContact O-OG 3.05Å; P384-S386 VanDerWaalsContact C-N 3.28Å; P384-S386 PolarHBondContact O-N 3.44Å; S386-R388 PolarHBondContact O-N 3.44Å; S386-L389 PolarHBondContact O-N 3.13Å; S386-L389 WeakPolarHBondContact OG-CB 3.39Å; S386-L389 WeakPolarHBondContact OG-CD1 3.48Å; S386-L389 WeakPolarHBondContact OG-CG 3.28Å; S386-W390 VanDerWaalsContact O-CD1 3.22Å; S386-W390 PolarHBondContact O-N 2.89Å
387	V	89.8	Confident	89.7	Confident	39 Å²	39	57.9 Å²	57.9	24%	0.236	28%	0.278	C	S	.	.	H	α-helix	trans	-55.3	-37.4	177.7	-178.6	0	0	0	0	112.1	W390 K391 C413 S416 L419	V387-W390 PolarHBondContact O-N 3.48Å; V387-K391 HydrophobicContact CG1-CD 4.33Å; V387-K391 HydrophobicContact CG1-CG 4.47Å; V387-K391 WeakPolarHBondContact O-CG 3.3Å; V387-K391 PolarHBondContact O-N 2.65Å; V387-C413 HydrophobicContact CG2-CB 4.13Å; V387-S416 VanDerWaalsContact CG2-CB 3.44Å; V387-L419 HydrophobicContact CG1-CD1 4.34Å; V387-L419 HydrophobicContact CG1-CG 4.27Å
388	R	90.2	Very high	89.6	Confident	134 Å²	134	58 Å²	58	51%	0.506	28%	0.284	S	S	.	.	H	α-helix	trans	-65	-41.5	-178.5	-177.2	175.5	177.4	177.3	-0.8	112.7	V356 S386 L392	V356-R388 HydrophobicContact CG1-CB 4.21Å; V356-R388 HydrophobicContact CG1-CG 4.4Å; S386-R388 PolarHBondContact O-N 3.44Å; R388-L392 HydrophobicContact CG-CD1 4.2Å; R388-L392 WeakPolarHBondContact O-CG 3.05Å; R388-L392 PolarHBondContact O-N 2.99Å
389	L	91.7	Very high	89.4	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-68.2	-41.8	177.7	-67.1	-175.8	0	0	0	110.5	V356 W359 V360 F376 A379 L380 V383 S386 K391 L392 A393	V356-L389 HydrophobicContact CG1-CD2 3.92Å; V356-L389 HydrophobicContact CG1-CG 3.89Å; V356-L389 HydrophobicContact CG2-CD1 4.46Å; V356-L389 HydrophobicContact CG2-CG 4.48Å; W359-L389 HydrophobicContact CB-CD2 4.08Å; V360-L389 HydrophobicContact CG2-CD2 3.93Å; F376-L389 HydrophobicContact CD1-CD2 4.2Å; F376-L389 HydrophobicContact CE1-CD2 4.23Å; A379-L389 HydrophobicContact CB-CD1 3.65Å; A379-L389 HydrophobicContact CB-CD2 4.22Å; L380-L389 HydrophobicContact CD2-CB 3.6Å; L380-L389 HydrophobicContact CG-CB 4.31Å; V383-L389 HydrophobicContact CB-CD1 4.2Å; S386-L389 PolarHBondContact O-N 3.13Å; S386-L389 WeakPolarHBondContact OG-CB 3.39Å; S386-L389 WeakPolarHBondContact OG-CD1 3.48Å; S386-L389 WeakPolarHBondContact OG-CG 3.28Å; L389-K391 PolarHBondContact O-N 2.74Å; L389-L392 PolarHBondContact O-N 3.04Å; L389-A393 VanDerWaalsContact O-CB 3.23Å; L389-A393 WeakPolarHBondContact O-CB 3.41Å; L389-A393 PolarHBondContact O-N 3.45Å
390	W	93.1	Very high	89.1	Confident	11 Å²	11	65.2 Å²	65.2	4%	0.042	32%	0.323	C	S	.	.	H	α-helix	trans	-58.7	-47.1	176.5	-76.6	113.7	0	0	0	112.2	L380 P384 S386 V387 L392 A393 V394 M405 L408 A409 C412 L419	L380-W390 HydrophobicContact CD1-CD2 4.09Å; L380-W390 HydrophobicContact CD1-CE3 3.74Å; L380-W390 HydrophobicContact CD1-CH2 4.14Å; L380-W390 HydrophobicContact CD1-CZ2 4.45Å; L380-W390 HydrophobicContact CD1-CZ3 3.79Å; L380-W390 HydrophobicContact CD2-CD2 3.61Å; L380-W390 HydrophobicContact CD2-CE3 4.15Å; L380-W390 HydrophobicContact CD2-CG 3.86Å; L380-W390 HydrophobicContact CD2-CZ2 4.08Å; L380-W390 HydrophobicContact CG-CD2 4.5Å; P384-W390 PolarHBondContact O-NE1 3.19Å; S386-W390 VanDerWaalsContact O-CD1 3.22Å; S386-W390 PolarHBondContact O-N 2.89Å; V387-W390 PolarHBondContact O-N 3.48Å; W390-L392 PolarHBondContact O-N 2.86Å; W390-A393 PolarHBondContact O-N 3.23Å; W390-V394 WeakPolarHBondContact O-CB 3.39Å; W390-V394 WeakPolarHBondContact O-CG2 3.44Å; W390-V394 PolarHBondContact O-N 3.44Å; W390-M405 HydrophobicContact CE3-CE 4.01Å; W390-M405 HydrophobicContact CH2-CE 4.47Å; W390-M405 HydrophobicContact CZ3-CB 4.41Å; W390-M405 HydrophobicContact CZ3-CE 3.51Å; W390-M405 WeakPolarHBondContact CZ3-O 3.37Å; W390-M405 HydrophobicContact CZ3-SD 3.98Å; W390-L408 HydrophobicContact CH2-CB 3.91Å; W390-L408 HydrophobicContact CH2-CD2 4.27Å; W390-L408 HydrophobicContact CZ3-CB 4.36Å; W390-A409 HydrophobicContact CB-CB 4.01Å; W390-A409 HydrophobicContact CD2-CB 3.37Å; W390-A409 HydrophobicContact CE3-CB 3.45Å; W390-A409 VanDerWaalsContact CE3-CB 3.45Å; W390-A409 HydrophobicContact CG-CB 3.64Å; W390-A409 HydrophobicContact CZ2-CB 4.5Å; W390-A409 HydrophobicContact CZ3-CB 4.04Å; W390-C412 HydrophobicContact CZ2-CB 4.33Å; W390-L419 HydrophobicContact CB-CD1 4.05Å; W390-L419 HydrophobicContact CB-CD2 4.26Å; W390-L419 HydrophobicContact CG-CD1 4.45Å
391	K	90.2	Very high	89	Confident	60 Å²	60	68.2 Å²	68.2	26%	0.261	34%	0.339	S	S	.	.	H	α-helix	trans	-57.2	-51.9	176.9	-73.6	177.6	-175.2	171.9	0	112.3	V387 L389 A393 V394 E395 E418 L419	V387-K391 HydrophobicContact CG1-CD 4.33Å; V387-K391 HydrophobicContact CG1-CG 4.47Å; V387-K391 WeakPolarHBondContact O-CG 3.3Å; V387-K391 PolarHBondContact O-N 2.65Å; L389-K391 PolarHBondContact O-N 2.74Å; K391-A393 VanDerWaalsContact C-N 3.28Å; K391-A393 PolarHBondContact O-N 3.25Å; K391-V394 PolarHBondContact O-N 2.74Å; K391-E395 WeakPolarHBondContact O-CG 3.42Å; K391-E395 PolarHBondContact O-N 2.79Å; K391-E418 VanDerWaalsContact CE-CD 3.48Å; K391-E418 WeakPolarHBondContact CE-OE2 3.22Å; K391-E418 IonicContact NZ-OE1 3.41Å; K391-E418 PolarHBondContact NZ-OE1 3.17Å; K391-E418 IonicContact NZ-OE2 2.75Å; K391-E418 PolarHBondContact NZ-OE2 3.46Å; K391-L419 HydrophobicContact CG-CD2 3.97Å
392	L	89.4	Confident	89	Confident	44 Å²	44	61.3 Å²	61.3	23%	0.23	31%	0.308	C	S	.	.	H	α-helix	trans	-66.5	-31.4	-178.6	-67.2	171.8	0	0	0	112.5	V360 F376 R388 L389 W390 L396	V360-L392 HydrophobicContact CB-CD1 4.39Å; V360-L392 HydrophobicContact CG1-CD1 3.91Å; V360-L392 HydrophobicContact CG2-CD1 3.58Å; F376-L392 HydrophobicContact CD1-CB 4.41Å; F376-L392 HydrophobicContact CE1-CB 3.69Å; F376-L392 HydrophobicContact CE1-CD1 4.03Å; F376-L392 HydrophobicContact CE2-CB 4.29Å; F376-L392 HydrophobicContact CZ-CB 3.62Å; F376-L392 HydrophobicContact CZ-CD1 4.09Å; F376-L392 HydrophobicContact CZ-CG 4.44Å; R388-L392 HydrophobicContact CG-CD1 4.2Å; R388-L392 WeakPolarHBondContact O-CG 3.05Å; R388-L392 PolarHBondContact O-N 2.99Å; L389-L392 PolarHBondContact O-N 3.04Å; W390-L392 PolarHBondContact O-N 2.86Å; L392-L396 WeakPolarHBondContact O-CG 3.46Å
393	A	90.4	Very high	88.9	Confident	4 Å²	4	60.3 Å²	60.3	3%	0.033	30%	0.3	C	S	.	.	H	α-helix	trans	-69.2	-46.7	173.4	0	0	0	0	0	111.1	F376 L380 L389 W390 K391 E395 L396 M405	F376-A393 HydrophobicContact CB-CB 4.06Å; F376-A393 HydrophobicContact CG-CB 4.46Å; L380-A393 HydrophobicContact CD1-CB 3.82Å; L389-A393 VanDerWaalsContact O-CB 3.23Å; L389-A393 WeakPolarHBondContact O-CB 3.41Å; L389-A393 PolarHBondContact O-N 3.45Å; W390-A393 PolarHBondContact O-N 3.23Å; K391-A393 VanDerWaalsContact C-N 3.28Å; K391-A393 PolarHBondContact O-N 3.25Å; A393-E395 VanDerWaalsContact C-N 3.32Å; A393-E395 PolarHBondContact O-N 3.11Å; A393-L396 PolarHBondContact O-N 2.89Å; A393-L396 VanDerWaalsContact O-N 3.12Å; A393-M405 HydrophobicContact CB-CE 4.14Å
394	V	89.6	Confident	88.8	Confident	23 Å²	23	64.8 Å²	64.8	14%	0.139	32%	0.323	C	S	.	.	H	α-helix	trans	-62.9	-37.7	-179.8	168.9	0	0	0	0	111.5	W390 K391 L396 E397 A402 M405 L406	W390-V394 WeakPolarHBondContact O-CB 3.39Å; W390-V394 WeakPolarHBondContact O-CG2 3.44Å; W390-V394 PolarHBondContact O-N 3.44Å; K391-V394 PolarHBondContact O-N 2.74Å; V394-L396 PolarHBondContact O-N 3.26Å; V394-L396 VanDerWaalsContact O-N 3.14Å; V394-E397 PolarHBondContact O-N 3.33Å; V394-A402 HydrophobicContact CG1-CB 4.13Å; V394-M405 HydrophobicContact CG2-CB 4.15Å; V394-L406 HydrophobicContact CG1-CD1 3.94Å; V394-L406 HydrophobicContact CG1-CD2 4.2Å; V394-L406 HydrophobicContact CG1-CG 3.95Å; V394-L406 HydrophobicContact CG2-CD2 3.9Å; V394-L406 HydrophobicContact CG2-CG 3.82Å
395	E	88.6	Confident	88.8	Confident	147 Å²	147	63.6 Å²	63.6	69%	0.687	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-19.6	175.9	-77.1	173	-174	0	0	114	K391 A393	K391-E395 WeakPolarHBondContact O-CG 3.42Å; K391-E395 PolarHBondContact O-N 2.79Å; A393-E395 VanDerWaalsContact C-N 3.32Å; A393-E395 PolarHBondContact O-N 3.11Å
396	L	88.3	Confident	88.9	Confident	40 Å²	40	58 Å²	58	21%	0.209	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-16.1	-179.8	-65.7	172.4	0	0	0	113.6	K372 K373 F376 L392 A393 V394	K372-L396 HydrophobicContact CB-CD1 3.87Å; K373-L396 WeakPolarHBondContact CE-O 3.46Å; K373-L396 HydrophobicContact CG-CB 4.12Å; K373-L396 HydrophobicContact CG-CD1 4.43Å; K373-L396 PolarHBondContact NZ-O 2.9Å; F376-L396 HydrophobicContact CD2-CD1 3.43Å; F376-L396 VanDerWaalsContact CD2-CD1 3.43Å; F376-L396 HydrophobicContact CE2-CD1 3.54Å; L392-L396 WeakPolarHBondContact O-CG 3.46Å; A393-L396 PolarHBondContact O-N 2.89Å; A393-L396 VanDerWaalsContact O-N 3.12Å; V394-L396 PolarHBondContact O-N 3.26Å; V394-L396 VanDerWaalsContact O-N 3.14Å
397	E	86	Confident	88.9	Confident	25 Å²	25	59.3 Å²	59.3	12%	0.117	29%	0.292	C	S	.	.	S	Bend	trans	-94	157.9	-174.1	-59.9	-65.8	-173.5	0	0	112.1	K373 K377 V394 D401 A402	K373-E397 WeakPolarHBondContact CD-OE2 3.34Å; K373-E397 VanDerWaalsContact CE-OE2 3.31Å; K373-E397 WeakPolarHBondContact CE-OE2 3.44Å; K373-E397 IonicContact NZ-OE2 3.91Å; K373-E397 PolarHBondContact NZ-OE2 3.01Å; K377-E397 VanDerWaalsContact CE-OE1 3.31Å; K377-E397 WeakPolarHBondContact CE-OE1 3.24Å; K377-E397 IonicContact NZ-OE1 3.41Å; K377-E397 PolarHBondContact NZ-OE1 3.28Å; V394-E397 PolarHBondContact O-N 3.33Å; E397-D401 HydrophobicContact CB-CB 4.01Å; E397-A402 HydrophobicContact CB-CB 4.45Å
398	D	87.9	Confident	88.9	Confident	116 Å²	116	61.9 Å²	61.9	62%	0.62	30%	0.304	S	S	*	.			trans	-73.9	163.5	175.2	-61.1	-50.1	0	0	0	110.5	D400 D401 A402	D398-D400 VanDerWaalsContact C-N 3.32Å; D398-D400 PolarHBondContact O-N 2.91Å; D398-D400 VanDerWaalsContact O-N 3.16Å; D398-D401 PolarHBondContact O-N 3.48Å; D398-D401 VanDerWaalsContact O-N 3.16Å; D398-A402 WeakPolarHBondContact O-CB 3.42Å; D398-A402 PolarHBondContact O-N 3.45Å
399	E	85.2	Confident	88.9	Confident	159 Å²	159	55.5 Å²	55.5	74%	0.743	28%	0.28	S	S	*	.	H	α-helix	trans	-54	-41.3	-170.3	-63.5	-177.8	170.5	0	0	114.5	R403	E399-R403 PolarHBondContact O-N 3.1Å
400	D	86.7	Confident	88.8	Confident	105 Å²	105	55.9 Å²	55.9	56%	0.561	28%	0.282	S	S	*	.	H	α-helix	trans	-69.3	-46.3	179.1	-82.5	-45.6	0	0	0	112.6	D398 A402 R403 L404	D398-D400 VanDerWaalsContact C-N 3.32Å; D398-D400 PolarHBondContact O-N 2.91Å; D398-D400 VanDerWaalsContact O-N 3.16Å; D400-A402 VanDerWaalsContact C-N 3.33Å; D400-R403 PolarHBondContact O-N 3.24Å; D400-R403 IonicContact OD1-CZ 3.9Å; D400-R403 IonicContact OD1-NH2 2.95Å; D400-R403 PolarHBondContact OD1-NH2 3.07Å; D400-L404 PolarHBondContact O-N 3.04Å
401	D	88.3	Confident	88.5	Confident	77 Å²	77	62.6 Å²	62.6	41%	0.412	31%	0.314	S	S	.	.	H	α-helix	trans	-69	-35.7	178	-76.9	-18.2	0	0	0	110.9	E397 D398 L404 M405	E397-D401 HydrophobicContact CB-CB 4.01Å; D398-D401 PolarHBondContact O-N 3.48Å; D398-D401 VanDerWaalsContact O-N 3.16Å; D401-L404 PolarHBondContact O-N 3.12Å; D401-M405 VanDerWaalsContact O-CB 3.31Å; D401-M405 WeakPolarHBondContact O-CB 3.47Å; D401-M405 VanDerWaalsContact O-CG 3.24Å; D401-M405 WeakPolarHBondContact O-CG 3.37Å; D401-M405 PolarHBondContact O-N 3.12Å
402	A	88.7	Confident	88.4	Confident	6 Å²	6	62.3 Å²	62.3	5%	0.05	32%	0.318	C	S	.	.	H	α-helix	trans	-62.4	-41.8	175	0	0	0	0	0	111.3	V394 E397 D398 D400 M405 L406 L426	V394-A402 HydrophobicContact CG1-CB 4.13Å; E397-A402 HydrophobicContact CB-CB 4.45Å; D398-A402 WeakPolarHBondContact O-CB 3.42Å; D398-A402 PolarHBondContact O-N 3.45Å; D400-A402 VanDerWaalsContact C-N 3.33Å; A402-M405 PolarHBondContact O-N 3.49Å; A402-L406 VanDerWaalsContact O-CB 3.24Å; A402-L406 WeakPolarHBondContact O-CB 3.45Å; A402-L406 WeakPolarHBondContact O-CD1 3.44Å; A402-L406 WeakPolarHBondContact O-CG 3.3Å; A402-L406 PolarHBondContact O-N 3.24Å; A402-L426 HydrophobicContact CB-CD1 4.1Å
403	R	88.1	Confident	88.3	Confident	79 Å²	79	60.4 Å²	60.4	30%	0.298	31%	0.309	S	S	.	.	H	α-helix	trans	-62.4	-46.5	174.5	175.1	-178.8	54.3	148.2	-8.1	111.9	E399 D400 L406 S407 E427	E399-R403 PolarHBondContact O-N 3.1Å; D400-R403 PolarHBondContact O-N 3.24Å; D400-R403 IonicContact OD1-CZ 3.9Å; D400-R403 IonicContact OD1-NH2 2.95Å; D400-R403 PolarHBondContact OD1-NH2 3.07Å; R403-L406 PolarHBondContact O-N 2.91Å; R403-S407 PolarHBondContact O-N 3.32Å; R403-E427 WeakPolarHBondContact CD-OE1 3.42Å; R403-E427 WeakPolarHBondContact CG-OE1 3.44Å
404	L	88.3	Confident	88.1	Confident	104 Å²	104	63 Å²	63	55%	0.545	33%	0.325	S	S	.	.	H	α-helix	trans	-64.1	-40	176.6	-68.8	173.7	0	0	0	112.1	D400 D401 S407 L408	D400-L404 PolarHBondContact O-N 3.04Å; D401-L404 PolarHBondContact O-N 3.12Å; L404-S407 PolarHBondContact O-OG 3.1Å; L404-L408 PolarHBondContact O-N 2.83Å
405	M	87.7	Confident	88	Confident	34 Å²	34	67.3 Å²	67.3	17%	0.167	35%	0.352	C	S	.	.	H	α-helix	trans	-66.5	-40.8	175.2	-75.9	-71.2	-74.8	0	0	111.2	L380 W390 A393 V394 D401 A402 L408 A409	L380-M405 HydrophobicContact CD1-CE 3.62Å; W390-M405 HydrophobicContact CE3-CE 4.01Å; W390-M405 HydrophobicContact CH2-CE 4.47Å; W390-M405 HydrophobicContact CZ3-CB 4.41Å; W390-M405 HydrophobicContact CZ3-CE 3.51Å; W390-M405 WeakPolarHBondContact CZ3-O 3.37Å; W390-M405 HydrophobicContact CZ3-SD 3.98Å; A393-M405 HydrophobicContact CB-CE 4.14Å; V394-M405 HydrophobicContact CG2-CB 4.15Å; D401-M405 VanDerWaalsContact O-CB 3.31Å; D401-M405 WeakPolarHBondContact O-CB 3.47Å; D401-M405 VanDerWaalsContact O-CG 3.24Å; D401-M405 WeakPolarHBondContact O-CG 3.37Å; D401-M405 PolarHBondContact O-N 3.12Å; A402-M405 PolarHBondContact O-N 3.49Å; M405-L408 PolarHBondContact O-N 3.14Å; M405-A409 VanDerWaalsContact O-CB 3.25Å; M405-A409 WeakPolarHBondContact O-CB 3.32Å; M405-A409 PolarHBondContact O-N 3.48Å
406	L	89.7	Confident	88	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-66.6	-36.8	177.8	-79.5	165.7	0	0	0	112.3	V394 A402 R403 A409 V410 L419 A422 L423 L426	V394-L406 HydrophobicContact CG1-CD1 3.94Å; V394-L406 HydrophobicContact CG1-CD2 4.2Å; V394-L406 HydrophobicContact CG1-CG 3.95Å; V394-L406 HydrophobicContact CG2-CD2 3.9Å; V394-L406 HydrophobicContact CG2-CG 3.82Å; A402-L406 VanDerWaalsContact O-CB 3.24Å; A402-L406 WeakPolarHBondContact O-CB 3.45Å; A402-L406 WeakPolarHBondContact O-CD1 3.44Å; A402-L406 WeakPolarHBondContact O-CG 3.3Å; A402-L406 PolarHBondContact O-N 3.24Å; R403-L406 PolarHBondContact O-N 2.91Å; L406-A409 WeakPolarHBondContact O-CB 3.16Å; L406-A409 PolarHBondContact O-N 3.17Å; L406-A409 VanDerWaalsContact O-N 3.12Å; L406-V410 WeakPolarHBondContact O-CG1 3.39Å; L406-V410 WeakPolarHBondContact O-CG2 3.34Å; L406-V410 PolarHBondContact O-N 3.39Å; L406-L419 HydrophobicContact CD2-CB 4.32Å; L406-L419 HydrophobicContact CD2-CD2 3.95Å; L406-A422 HydrophobicContact CD1-CB 3.9Å; L406-A422 HydrophobicContact CD2-CB 4Å; L406-L423 HydrophobicContact CB-CB 4.18Å; L406-L423 HydrophobicContact CB-CD1 4.12Å; L406-L423 HydrophobicContact CB-CG 4.17Å; L406-L426 HydrophobicContact CD1-CD1 3.64Å
407	S	88.8	Confident	88.1	Confident	38 Å²	38	60.3 Å²	60.3	27%	0.266	32%	0.321	S	S	.	.	H	α-helix	trans	-63	-43.5	175.8	68.1	0	0	0	0	111.6	R403 L404 A409 V410 E411	R403-S407 PolarHBondContact O-N 3.32Å; L404-S407 PolarHBondContact O-OG 3.1Å; S407-A409 VanDerWaalsContact C-N 3.31Å; S407-A409 PolarHBondContact O-N 3.3Å; S407-V410 WeakPolarHBondContact O-CG2 3.17Å; S407-E411 WeakPolarHBondContact O-CG 3.49Å; S407-E411 PolarHBondContact O-N 3.29Å
408	L	89.8	Confident	88.2	Confident	93 Å²	93	64.7 Å²	64.7	49%	0.487	34%	0.342	S	S	.	.	H	α-helix	trans	-62.4	-40	169.5	-110.8	86.7	0	0	0	112	W390 L404 M405 E411 C412	W390-L408 HydrophobicContact CH2-CB 3.91Å; W390-L408 HydrophobicContact CH2-CD2 4.27Å; W390-L408 HydrophobicContact CZ3-CB 4.36Å; L404-L408 PolarHBondContact O-N 2.83Å; M405-L408 PolarHBondContact O-N 3.14Å; L408-E411 PolarHBondContact O-N 2.89Å; L408-C412 PolarHBondContact O-N 3.09Å; L408-C412 PolarHBondContact O-SG 3.3Å
409	A	90.6	Very high	88.3	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.2	-40.2	-175.7	0	0	0	0	0	112.2	W390 M405 L406 S407 E411 C412 C413 L419	W390-A409 HydrophobicContact CB-CB 4.01Å; W390-A409 HydrophobicContact CD2-CB 3.37Å; W390-A409 HydrophobicContact CE3-CB 3.45Å; W390-A409 VanDerWaalsContact CE3-CB 3.45Å; W390-A409 HydrophobicContact CG-CB 3.64Å; W390-A409 HydrophobicContact CZ2-CB 4.5Å; W390-A409 HydrophobicContact CZ3-CB 4.04Å; M405-A409 VanDerWaalsContact O-CB 3.25Å; M405-A409 WeakPolarHBondContact O-CB 3.32Å; M405-A409 PolarHBondContact O-N 3.48Å; L406-A409 WeakPolarHBondContact O-CB 3.16Å; L406-A409 PolarHBondContact O-N 3.17Å; L406-A409 VanDerWaalsContact O-N 3.12Å; S407-A409 VanDerWaalsContact C-N 3.31Å; S407-A409 PolarHBondContact O-N 3.3Å; A409-E411 VanDerWaalsContact C-N 3.33Å; A409-C412 PolarHBondContact O-N 3.43Å; A409-C413 WeakPolarHBondContact O-CA 3.4Å; A409-C413 VanDerWaalsContact O-CB 3.32Å; A409-C413 WeakPolarHBondContact O-CB 3.34Å; A409-C413 PolarHBondContact O-N 2.84Å; A409-L419 HydrophobicContact CB-CD1 3.78Å
410	V	88.8	Confident	88.7	Confident	8 Å²	8	52.8 Å²	52.8	5%	0.048	28%	0.282	C	S	.	.	H	α-helix	trans	-71.4	-28.1	177	-62.9	0	0	0	0	112.5	L406 S407 C413 P414 L419 W420 L423	L406-V410 WeakPolarHBondContact O-CG1 3.39Å; L406-V410 WeakPolarHBondContact O-CG2 3.34Å; L406-V410 PolarHBondContact O-N 3.39Å; S407-V410 WeakPolarHBondContact O-CG2 3.17Å; V410-C413 CarbonylContact O-C 3.54Å; V410-P414 VanDerWaalsContact O-CA 3.3Å; V410-P414 WeakPolarHBondContact O-CA 3.49Å; V410-L419 HydrophobicContact CG1-CB 3.89Å; V410-W420 HydrophobicContact CB-CD2 3.92Å; V410-W420 HydrophobicContact CB-CE3 3.96Å; V410-W420 HydrophobicContact CB-CH2 3.78Å; V410-W420 HydrophobicContact CB-CZ2 3.74Å; V410-W420 HydrophobicContact CB-CZ3 3.89Å; V410-W420 HydrophobicContact CG1-CD2 3.74Å; V410-W420 HydrophobicContact CG1-CE3 3.83Å; V410-W420 HydrophobicContact CG1-CG 4.13Å; V410-W420 HydrophobicContact CG1-CZ2 4.49Å; V410-W420 HydrophobicContact CG1-CZ3 4.25Å; V410-W420 HydrophobicContact CG2-CE3 4.21Å; V410-W420 HydrophobicContact CG2-CH2 3.78Å; V410-W420 HydrophobicContact CG2-CZ2 4.26Å; V410-W420 HydrophobicContact CG2-CZ3 3.76Å; V410-L423 HydrophobicContact CB-CD1 4.42Å; V410-L423 HydrophobicContact CG1-CD1 3.88Å; V410-L423 HydrophobicContact CG2-CD1 3.62Å
411	E	88.1	Confident	88.8	Confident	152 Å²	152	48.9 Å²	48.9	71%	0.71	26%	0.261	S	S	*	.	H	α-helix	trans	-70.6	-41.3	171.8	-71.7	179.3	176.3	0	0	111.5	S407 L408 A409	S407-E411 WeakPolarHBondContact O-CG 3.49Å; S407-E411 PolarHBondContact O-N 3.29Å; L408-E411 PolarHBondContact O-N 2.89Å; A409-E411 VanDerWaalsContact C-N 3.33Å
412	C	88.4	Confident	88.8	Confident	53 Å²	53	46.6 Å²	46.6	36%	0.358	25%	0.253	S	S	.	.	H	α-helix	trans	-73.8	-35	177.1	-64.1	0	0	0	0	112.6	P384 W390 L408 A409 P414	P384-C412 WeakPolarHBondContact O-CB 3.49Å; W390-C412 HydrophobicContact CZ2-CB 4.33Å; L408-C412 PolarHBondContact O-N 3.09Å; L408-C412 PolarHBondContact O-SG 3.3Å; A409-C412 PolarHBondContact O-N 3.43Å; C412-P414 WeakPolarHBondContact O-CD 3.36Å
413	C	86.6	Confident	88.8	Confident	5 Å²	5	46.6 Å²	46.6	3%	0.034	25%	0.251	C	S	.	.			trans	-126	68.2	-174.8	-63.8	0	0	0	0	111.6	N385 V387 A409 V410 T415 S416 L419	N385-C413 PolarHBondContact O-SG 3.05Å; N385-C413 VanDerWaalsContact O-SG 3.42Å; V387-C413 HydrophobicContact CG2-CB 4.13Å; A409-C413 WeakPolarHBondContact O-CA 3.4Å; A409-C413 VanDerWaalsContact O-CB 3.32Å; A409-C413 WeakPolarHBondContact O-CB 3.34Å; A409-C413 PolarHBondContact O-N 2.84Å; V410-C413 CarbonylContact O-C 3.54Å; C413-T415 PolarHBondContact O-N 3.4Å; C413-T415 VanDerWaalsContact O-N 3.16Å; C413-S416 PolarHBondContact O-N 3.11Å; C413-S416 PolarHBondContact O-OG 3.01Å; C413-L419 HydrophobicContact CB-CD1 4.07Å
414	P	86.2	Confident	88.9	Confident	58 Å²	58	43.3 Å²	43.3	38%	0.377	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-20.8	-173.8	26.7	-35.3	0	0	0	113.6	V410 C412 S416 W420 S442	V410-P414 VanDerWaalsContact O-CA 3.3Å; V410-P414 WeakPolarHBondContact O-CA 3.49Å; C412-P414 WeakPolarHBondContact O-CD 3.36Å; P414-S416 VanDerWaalsContact C-N 3.31Å; P414-W420 PolarHBondContact O-NE1 3.48Å; P414-S442 PolarHBondContact O-OG 3.08Å
415	T	87.8	Confident	88.8	Confident	114 Å²	114	47 Å²	47	70%	0.699	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-4	-179.2	55.4	0	0	0	0	114	C413 I443	C413-T415 PolarHBondContact O-N 3.4Å; C413-T415 VanDerWaalsContact O-N 3.16Å; T415-I443 VanDerWaalsContact O-CD1 3.27Å; T415-I443 WeakPolarHBondContact O-CD1 3.24Å
416	S	88.7	Confident	88.8	Confident	11 Å²	11	48.8 Å²	48.8	8%	0.077	26%	0.258	C	S	.	.			trans	-97.5	104.3	-173.2	69.1	0	0	0	0	112.6	V387 C413 P414 E418 L419 W420	V387-S416 VanDerWaalsContact CG2-CB 3.44Å; C413-S416 PolarHBondContact O-N 3.11Å; C413-S416 PolarHBondContact O-OG 3.01Å; P414-S416 VanDerWaalsContact C-N 3.31Å; S416-E418 VanDerWaalsContact C-N 3.28Å; S416-E418 PolarHBondContact O-N 3.05Å; S416-L419 PolarHBondContact O-N 2.92Å; S416-L419 WeakPolarHBondContact OG-CD1 3.47Å; S416-L419 WeakPolarHBondContact OG-CG 3.33Å; S416-W420 PolarHBondContact O-N 3.03Å
417	V	89.1	Confident	88.5	Confident	29 Å²	29	50.4 Å²	50.4	18%	0.176	27%	0.265	C	S	.	.	H	α-helix	trans	-56.3	-44	179.9	-173.7	0	0	0	0	111.6	L419 W420 L421 I443 D446 Q448 I449	V417-L419 VanDerWaalsContact C-N 3.3Å; V417-L419 PolarHBondContact O-N 3.32Å; V417-W420 WeakPolarHBondContact O-CB 3.4Å; V417-W420 PolarHBondContact O-N 3.5Å; V417-W420 VanDerWaalsContact O-N 3.13Å; V417-L421 HydrophobicContact CG1-CD1 3.77Å; V417-L421 HydrophobicContact CG1-CG 3.97Å; V417-L421 VanDerWaalsContact O-CG 3.32Å; V417-L421 WeakPolarHBondContact O-CG 2.86Å; V417-L421 PolarHBondContact O-N 3.21Å; V417-I443 HydrophobicContact CB-CD1 4.45Å; V417-I443 HydrophobicContact CG2-CD1 3.75Å; V417-I443 HydrophobicContact CG2-CG2 4.31Å; V417-D446 WeakPolarHBondContact CG1-OD2 3.24Å; V417-D446 HydrophobicContact CG2-CB 3.91Å; V417-D446 WeakPolarHBondContact CG2-OD2 3.5Å; V417-Q448 HydrophobicContact CG1-CB 4.16Å; V417-I449 HydrophobicContact CG1-CD1 4.49Å; V417-I449 HydrophobicContact CG1-CG1 3.91Å
418	E	88.9	Confident	88.5	Confident	117 Å²	117	52.3 Å²	52.3	55%	0.547	28%	0.275	S	S	.	.	H	α-helix	trans	-64	-35.2	-171.2	-62.9	178	-110.8	0	0	112.9	K391 S416 L421 A422	K391-E418 VanDerWaalsContact CE-CD 3.48Å; K391-E418 WeakPolarHBondContact CE-OE2 3.22Å; K391-E418 IonicContact NZ-OE1 3.41Å; K391-E418 PolarHBondContact NZ-OE1 3.17Å; K391-E418 IonicContact NZ-OE2 2.75Å; K391-E418 PolarHBondContact NZ-OE2 3.46Å; S416-E418 VanDerWaalsContact C-N 3.28Å; S416-E418 PolarHBondContact O-N 3.05Å; E418-L421 PolarHBondContact O-N 3.17Å; E418-A422 WeakPolarHBondContact O-CB 3Å; E418-A422 PolarHBondContact O-N 3.38Å
419	L	90.5	Very high	88.4	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-70	-41.3	176.1	-59.7	-175.3	0	0	0	110.9	V387 W390 K391 L406 A409 V410 C413 S416 V417 L421 A422 L423	V387-L419 HydrophobicContact CG1-CD1 4.34Å; V387-L419 HydrophobicContact CG1-CG 4.27Å; W390-L419 HydrophobicContact CB-CD1 4.05Å; W390-L419 HydrophobicContact CB-CD2 4.26Å; W390-L419 HydrophobicContact CG-CD1 4.45Å; K391-L419 HydrophobicContact CG-CD2 3.97Å; L406-L419 HydrophobicContact CD2-CB 4.32Å; L406-L419 HydrophobicContact CD2-CD2 3.95Å; A409-L419 HydrophobicContact CB-CD1 3.78Å; V410-L419 HydrophobicContact CG1-CB 3.89Å; C413-L419 HydrophobicContact CB-CD1 4.07Å; S416-L419 PolarHBondContact O-N 2.92Å; S416-L419 WeakPolarHBondContact OG-CD1 3.47Å; S416-L419 WeakPolarHBondContact OG-CG 3.33Å; V417-L419 VanDerWaalsContact C-N 3.3Å; V417-L419 PolarHBondContact O-N 3.32Å; L419-L421 VanDerWaalsContact C-N 3.33Å; L419-L421 PolarHBondContact O-N 3.11Å; L419-A422 PolarHBondContact O-N 2.66Å; L419-L423 WeakPolarHBondContact O-CB 3.27Å; L419-L423 PolarHBondContact O-N 3.41Å
420	W	92.2	Very high	88.3	Confident	21 Å²	21	58 Å²	58	8%	0.08	30%	0.297	C	S	.	.	H	α-helix	trans	-59.6	-42.8	173.4	-72	114.1	0	0	0	112.3	V410 P414 S416 V417 L423 A424 V435 K438 A439	V410-W420 HydrophobicContact CB-CD2 3.92Å; V410-W420 HydrophobicContact CB-CE3 3.96Å; V410-W420 HydrophobicContact CB-CH2 3.78Å; V410-W420 HydrophobicContact CB-CZ2 3.74Å; V410-W420 HydrophobicContact CB-CZ3 3.89Å; V410-W420 HydrophobicContact CG1-CD2 3.74Å; V410-W420 HydrophobicContact CG1-CE3 3.83Å; V410-W420 HydrophobicContact CG1-CG 4.13Å; V410-W420 HydrophobicContact CG1-CZ2 4.49Å; V410-W420 HydrophobicContact CG1-CZ3 4.25Å; V410-W420 HydrophobicContact CG2-CE3 4.21Å; V410-W420 HydrophobicContact CG2-CH2 3.78Å; V410-W420 HydrophobicContact CG2-CZ2 4.26Å; V410-W420 HydrophobicContact CG2-CZ3 3.76Å; P414-W420 PolarHBondContact O-NE1 3.48Å; S416-W420 PolarHBondContact O-N 3.03Å; V417-W420 WeakPolarHBondContact O-CB 3.4Å; V417-W420 PolarHBondContact O-N 3.5Å; V417-W420 VanDerWaalsContact O-N 3.13Å; W420-L423 PolarHBondContact O-N 2.87Å; W420-A424 WeakPolarHBondContact O-CB 3.36Å; W420-A424 PolarHBondContact O-N 3.41Å; W420-V435 HydrophobicContact CE3-CG1 3.77Å; W420-V435 HydrophobicContact CZ3-CG1 4.15Å; W420-K438 HydrophobicContact CH2-CB 4.03Å; W420-K438 HydrophobicContact CZ3-CB 4.04Å; W420-A439 HydrophobicContact CB-CB 3.76Å; W420-A439 HydrophobicContact CD2-CB 3.65Å; W420-A439 HydrophobicContact CE3-CB 3.88Å; W420-A439 HydrophobicContact CG-CB 3.59Å
421	L	89.8	Confident	88.3	Confident	24 Å²	24	61.8 Å²	61.8	13%	0.126	32%	0.315	C	S	.	.	H	α-helix	trans	-68.8	-38.2	178.8	-66.5	-178.1	0	0	0	112.7	V417 E418 L419 R425 L436 Q448 A452	V417-L421 HydrophobicContact CG1-CD1 3.77Å; V417-L421 HydrophobicContact CG1-CG 3.97Å; V417-L421 VanDerWaalsContact O-CG 3.32Å; V417-L421 WeakPolarHBondContact O-CG 2.86Å; V417-L421 PolarHBondContact O-N 3.21Å; E418-L421 PolarHBondContact O-N 3.17Å; L419-L421 VanDerWaalsContact C-N 3.33Å; L419-L421 PolarHBondContact O-N 3.11Å; L421-R425 PolarHBondContact O-N 3.23Å; L421-L436 HydrophobicContact CD2-CD2 4.4Å; L421-Q448 HydrophobicContact CD1-CB 3.84Å; L421-A452 HydrophobicContact CD2-CB 3.29Å
422	A	87.8	Confident	88.3	Confident	29 Å²	29	54.6 Å²	54.6	24%	0.24	28%	0.281	C	S	.	.	H	α-helix	trans	-64.9	-44.4	174.3	0	0	0	0	0	110.8	L406 E418 L419 R425 L426	L406-A422 HydrophobicContact CD1-CB 3.9Å; L406-A422 HydrophobicContact CD2-CB 4Å; E418-A422 WeakPolarHBondContact O-CB 3Å; E418-A422 PolarHBondContact O-N 3.38Å; L419-A422 PolarHBondContact O-N 2.66Å; A422-R425 PolarHBondContact O-N 2.96Å; A422-L426 PolarHBondContact O-N 2.93Å
423	L	89.7	Confident	88.4	Confident	5 Å²	5	57.5 Å²	57.5	3%	0.026	29%	0.285	C	S	.	.	H	α-helix	trans	-61.2	-48.7	176.8	-162	160.3	0	0	0	110.9	L406 V410 L419 W420 R425 L426 E427 V435	L406-L423 HydrophobicContact CB-CB 4.18Å; L406-L423 HydrophobicContact CB-CD1 4.12Å; L406-L423 HydrophobicContact CB-CG 4.17Å; V410-L423 HydrophobicContact CB-CD1 4.42Å; V410-L423 HydrophobicContact CG1-CD1 3.88Å; V410-L423 HydrophobicContact CG2-CD1 3.62Å; L419-L423 WeakPolarHBondContact O-CB 3.27Å; L419-L423 PolarHBondContact O-N 3.41Å; W420-L423 PolarHBondContact O-N 2.87Å; L423-R425 PolarHBondContact O-N 2.79Å; L423-R425 VanDerWaalsContact O-N 3.14Å; L423-L426 PolarHBondContact O-N 3.37Å; L423-L426 VanDerWaalsContact O-N 3.11Å; L423-E427 HydrophobicContact CD2-CG 3.42Å; L423-E427 VanDerWaalsContact CD2-CG 3.42Å; L423-E427 HydrophobicContact CG-CG 4.4Å; L423-E427 WeakPolarHBondContact O-CG 3.34Å; L423-E427 PolarHBondContact O-N 2.89Å; L423-V435 HydrophobicContact CB-CG1 4.3Å; L423-V435 HydrophobicContact CD2-CB 3.94Å; L423-V435 HydrophobicContact CD2-CG1 3.44Å; L423-V435 VanDerWaalsContact CD2-CG1 3.44Å; L423-V435 HydrophobicContact CD2-CG2 3.27Å; L423-V435 HydrophobicContact CG-CG1 4.36Å
424	A	88.8	Confident	88.6	Confident	10 Å²	10	60.9 Å²	60.9	8%	0.083	31%	0.305	C	S	.	.	H	α-helix	trans	-61.8	-22.8	179.1	0	0	0	0	0	113.8	W420 A432 V435 L436	W420-A424 WeakPolarHBondContact O-CB 3.36Å; W420-A424 PolarHBondContact O-N 3.41Å; A424-A432 WeakPolarHBondContact O-CB 3.01Å; A424-V435 HydrophobicContact CB-CG1 4.14Å; A424-L436 HydrophobicContact CB-CD1 4.25Å; A424-L436 HydrophobicContact CB-CD2 3.68Å; A424-L436 HydrophobicContact CB-CG 3.76Å
425	R	86.7	Confident	88.9	Confident	182 Å²	182	58.8 Å²	58.8	69%	0.687	29%	0.291	S	S	*	.	H	α-helix	trans	-80.5	-31.8	176.6	-169.1	-177.8	-60.4	145.4	4.5	112.8	L421 A422 L423	L421-R425 PolarHBondContact O-N 3.23Å; A422-R425 PolarHBondContact O-N 2.96Å; L423-R425 PolarHBondContact O-N 2.79Å; L423-R425 VanDerWaalsContact O-N 3.14Å
426	L	86.9	Confident	89	Confident	71 Å²	71	53.6 Å²	53.6	37%	0.372	26%	0.259	S	S	.	.	H	α-helix	trans	-88.4	-23	-179.3	-67.1	178.1	0	0	0	113.1	A402 L406 A422 L423	A402-L426 HydrophobicContact CB-CD1 4.1Å; L406-L426 HydrophobicContact CD1-CD1 3.64Å; A422-L426 PolarHBondContact O-N 2.93Å; L423-L426 PolarHBondContact O-N 3.37Å; L423-L426 VanDerWaalsContact O-N 3.11Å
427	E	84.9	Confident	89.1	Confident	35 Å²	35	56.6 Å²	56.6	16%	0.164	27%	0.274	C	S	.	.	S	Bend	trans	-77.2	159.8	179.8	-74.6	-67.2	176.5	0	0	113.6	R403 L423 Q431 A432 V435	R403-E427 WeakPolarHBondContact CD-OE1 3.42Å; R403-E427 WeakPolarHBondContact CG-OE1 3.44Å; L423-E427 HydrophobicContact CD2-CG 3.42Å; L423-E427 VanDerWaalsContact CD2-CG 3.42Å; L423-E427 HydrophobicContact CG-CG 4.4Å; L423-E427 WeakPolarHBondContact O-CG 3.34Å; L423-E427 PolarHBondContact O-N 2.89Å; E427-Q431 HydrophobicContact CB-CB 4Å; E427-Q431 HydrophobicContact CG-CB 4.32Å; E427-Q431 PolarHBondContact OE2-OE1 3.43Å; E427-A432 HydrophobicContact CB-CB 4.28Å; E427-V435 HydrophobicContact CG-CG2 4.41Å
428	T	89.1	Confident	89.2	Confident	78 Å²	78	60.7 Å²	60.7	48%	0.479	29%	0.289	S	S	.	.			trans	-63.4	157.9	170.2	65.4	0	0	0	0	111.2	E430 Q431 A432	T428-E430 VanDerWaalsContact C-N 3.3Å; T428-E430 PolarHBondContact O-N 3.29Å; T428-Q431 PolarHBondContact O-N 2.98Å; T428-Q431 VanDerWaalsContact O-N 3.13Å; T428-Q431 WeakPolarHBondContact OG1-CG 3.5Å; T428-Q431 PolarHBondContact OG1-OE1 3.1Å; T428-A432 VanDerWaalsContact O-CB 3.23Å; T428-A432 WeakPolarHBondContact O-CB 3.35Å; T428-A432 PolarHBondContact O-N 3.02Å
429	Y	87.6	Confident	89.3	Confident	59 Å²	59	55.1 Å²	55.1	23%	0.231	26%	0.263	C	S	.	.	H	α-helix	trans	-52.2	-43.9	-177.7	167	-111.4	0	0	0	114.1	R433 L456 E457 Q460	Y429-R433 HydrophobicContact CD2-CG 4.42Å; Y429-R433 HydrophobicContact CE2-CG 4.08Å; Y429-R433 VanDerWaalsContact CZ-CD 3.45Å; Y429-R433 WeakPolarHBondContact O-CG 3.4Å; Y429-R433 PolarHBondContact O-N 3.4Å; Y429-R433 VanDerWaalsContact O-N 3.08Å; Y429-R433 PolarHBondContact OH-NH1 3.35Å; Y429-L456 HydrophobicContact CD2-CD1 4.19Å; Y429-L456 HydrophobicContact CD2-CD2 4Å; Y429-L456 HydrophobicContact CD2-CG 3.88Å; Y429-L456 HydrophobicContact CE2-CD2 4.33Å; Y429-L456 HydrophobicContact CE2-CG 4.27Å; Y429-E457 PolarHBondContact OH-OE1 3.36Å; Y429-E457 PolarHBondContact OH-OE2 3.27Å; Y429-Q460 HydrophobicContact CD2-CG 3.55Å; Y429-Q460 HydrophobicContact CE2-CB 4.41Å; Y429-Q460 HydrophobicContact CE2-CG 3.78Å; Y429-Q460 HydrophobicContact CG-CG 4.01Å
430	E	88.3	Confident	89.3	Confident	153 Å²	153	57.7 Å²	57.7	72%	0.715	27%	0.273	S	S	*	.	H	α-helix	trans	-66.3	-44.7	-179.7	-63	-176.2	174.1	0	0	111.4	T428 R433 V434	T428-E430 VanDerWaalsContact C-N 3.3Å; T428-E430 PolarHBondContact O-N 3.29Å; E430-R433 PolarHBondContact O-N 3.03Å; E430-V434 PolarHBondContact O-N 3.34Å
431	Q	88.1	Confident	89.1	Confident	89 Å²	89	64.2 Å²	64.2	42%	0.416	30%	0.304	S	S	.	.	H	α-helix	trans	-69.9	-40.6	178.2	-71	171.9	-53.3	0	0	111.4	E427 T428 R433 V434 V435	E427-Q431 HydrophobicContact CB-CB 4Å; E427-Q431 HydrophobicContact CG-CB 4.32Å; E427-Q431 PolarHBondContact OE2-OE1 3.43Å; T428-Q431 PolarHBondContact O-N 2.98Å; T428-Q431 VanDerWaalsContact O-N 3.13Å; T428-Q431 WeakPolarHBondContact OG1-CG 3.5Å; T428-Q431 PolarHBondContact OG1-OE1 3.1Å; Q431-R433 VanDerWaalsContact C-N 3.27Å; Q431-R433 PolarHBondContact O-N 2.78Å; Q431-V434 CarbonylContact O-C 3.52Å; Q431-V434 WeakPolarHBondContact O-CA 3.5Å; Q431-V434 WeakPolarHBondContact O-CB 3.13Å; Q431-V434 PolarHBondContact O-N 2.88Å; Q431-V435 WeakPolarHBondContact O-CB 3.33Å; Q431-V435 WeakPolarHBondContact O-CG2 3.43Å; Q431-V435 PolarHBondContact O-N 3.3Å
432	A	89	Confident	89	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-58.7	-38.4	175.6	0	0	0	0	0	111.6	A424 E427 T428 V435 L436 L456	A424-A432 WeakPolarHBondContact O-CB 3.01Å; E427-A432 HydrophobicContact CB-CB 4.28Å; T428-A432 VanDerWaalsContact O-CB 3.23Å; T428-A432 WeakPolarHBondContact O-CB 3.35Å; T428-A432 PolarHBondContact O-N 3.02Å; A432-V435 PolarHBondContact O-N 3.36Å; A432-L436 WeakPolarHBondContact O-CB 3.47Å; A432-L436 WeakPolarHBondContact O-CG 3.41Å; A432-L436 PolarHBondContact O-N 3.39Å; A432-L456 HydrophobicContact CB-CD1 4.21Å; A432-L456 HydrophobicContact CB-CD2 3.76Å
433	R	89.3	Confident	89	Confident	115 Å²	115	64.8 Å²	64.8	43%	0.434	31%	0.307	S	S	.	.	H	α-helix	trans	-63.6	-42.2	172.8	-76.5	179.2	59	169.6	-2.9	112.4	Y429 E430 Q431 N437 L456	Y429-R433 HydrophobicContact CD2-CG 4.42Å; Y429-R433 HydrophobicContact CE2-CG 4.08Å; Y429-R433 VanDerWaalsContact CZ-CD 3.45Å; Y429-R433 WeakPolarHBondContact O-CG 3.4Å; Y429-R433 PolarHBondContact O-N 3.4Å; Y429-R433 VanDerWaalsContact O-N 3.08Å; Y429-R433 PolarHBondContact OH-NH1 3.35Å; E430-R433 PolarHBondContact O-N 3.03Å; Q431-R433 VanDerWaalsContact C-N 3.27Å; Q431-R433 PolarHBondContact O-N 2.78Å; R433-N437 WeakPolarHBondContact O-CB 3.42Å; R433-N437 PolarHBondContact O-N 3.36Å; R433-N437 PolarHBondContact O-ND2 2.83Å; R433-N437 PolarHBondContact O-OD1 2.87Å; R433-L456 HydrophobicContact CG-CD2 3.95Å
434	V	91.5	Very high	88.9	Confident	75 Å²	75	67.1 Å²	67.1	46%	0.455	32%	0.322	S	S	.	.	H	α-helix	trans	-64	-44.2	175.7	175.4	0	0	0	0	110.6	E430 Q431 N437 K438	E430-V434 PolarHBondContact O-N 3.34Å; Q431-V434 CarbonylContact O-C 3.52Å; Q431-V434 WeakPolarHBondContact O-CA 3.5Å; Q431-V434 WeakPolarHBondContact O-CB 3.13Å; Q431-V434 PolarHBondContact O-N 2.88Å; V434-N437 WeakPolarHBondContact O-CB 2.97Å; V434-N437 PolarHBondContact O-N 2.72Å; V434-K438 HydrophobicContact CG1-CD 4.4Å; V434-K438 WeakPolarHBondContact O-CG 3.4Å; V434-K438 PolarHBondContact O-N 3.2Å
435	V	91.5	Very high	88.8	Confident	15 Å²	15	70.5 Å²	70.5	9%	0.091	34%	0.342	C	S	.	.	H	α-helix	trans	-61.9	-47.2	178.5	168.8	0	0	0	0	111.1	W420 L423 A424 E427 Q431 A432 N437 K438 A439	W420-V435 HydrophobicContact CE3-CG1 3.77Å; W420-V435 HydrophobicContact CZ3-CG1 4.15Å; L423-V435 HydrophobicContact CB-CG1 4.3Å; L423-V435 HydrophobicContact CD2-CB 3.94Å; L423-V435 HydrophobicContact CD2-CG1 3.44Å; L423-V435 VanDerWaalsContact CD2-CG1 3.44Å; L423-V435 HydrophobicContact CD2-CG2 3.27Å; L423-V435 HydrophobicContact CG-CG1 4.36Å; A424-V435 HydrophobicContact CB-CG1 4.14Å; E427-V435 HydrophobicContact CG-CG2 4.41Å; Q431-V435 WeakPolarHBondContact O-CB 3.33Å; Q431-V435 WeakPolarHBondContact O-CG2 3.43Å; Q431-V435 PolarHBondContact O-N 3.3Å; A432-V435 PolarHBondContact O-N 3.36Å; V435-N437 VanDerWaalsContact C-N 3.28Å; V435-N437 PolarHBondContact O-N 2.64Å; V435-K438 PolarHBondContact O-N 3.13Å; V435-A439 WeakPolarHBondContact O-CB 3.46Å; V435-A439 PolarHBondContact O-N 2.72Å
436	L	91.1	Very high	88.9	Confident	4 Å²	4	63.4 Å²	63.4	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-69	-26	177.8	-68.7	171.3	0	0	0	112.6	L421 A424 A432 R440 I449 A452 A453 L456	L421-L436 HydrophobicContact CD2-CD2 4.4Å; A424-L436 HydrophobicContact CB-CD1 4.25Å; A424-L436 HydrophobicContact CB-CD2 3.68Å; A424-L436 HydrophobicContact CB-CG 3.76Å; A432-L436 WeakPolarHBondContact O-CB 3.47Å; A432-L436 WeakPolarHBondContact O-CG 3.41Å; A432-L436 PolarHBondContact O-N 3.39Å; L436-R440 WeakPolarHBondContact O-CB 3.33Å; L436-R440 VanDerWaalsContact O-CG 3.28Å; L436-R440 WeakPolarHBondContact O-CG 3.47Å; L436-R440 PolarHBondContact O-N 3.38Å; L436-R440 VanDerWaalsContact O-N 3.13Å; L436-R440 PolarHBondContact O-NE 3.12Å; L436-I449 HydrophobicContact CD2-CG2 3.97Å; L436-A452 HydrophobicContact CD2-CB 4.09Å; L436-A453 HydrophobicContact CD1-CB 4.05Å; L436-L456 HydrophobicContact CD1-CD2 3.99Å
437	N	91	Very high	89	Confident	74 Å²	74	62.3 Å²	62.3	40%	0.396	31%	0.309	S	S	.	.	H	α-helix	trans	-71.2	-46.8	170.2	-73.1	-12.8	0	0	0	111	R433 V434 V435 A439 R440 E441	R433-N437 WeakPolarHBondContact O-CB 3.42Å; R433-N437 PolarHBondContact O-N 3.36Å; R433-N437 PolarHBondContact O-ND2 2.83Å; R433-N437 PolarHBondContact O-OD1 2.87Å; V434-N437 WeakPolarHBondContact O-CB 2.97Å; V434-N437 PolarHBondContact O-N 2.72Å; V435-N437 VanDerWaalsContact C-N 3.28Å; V435-N437 PolarHBondContact O-N 2.64Å; N437-A439 VanDerWaalsContact C-N 3.29Å; N437-A439 PolarHBondContact O-N 2.88Å; N437-R440 WeakPolarHBondContact O-CB 3.2Å; N437-R440 PolarHBondContact O-N 3.41Å; N437-R440 VanDerWaalsContact O-N 3.11Å; N437-R440 PolarHBondContact OD1-NH2 3.39Å; N437-E441 PolarHBondContact O-N 2.87Å
438	K	90.6	Very high	89.2	Confident	116 Å²	116	62.8 Å²	62.8	50%	0.504	31%	0.311	S	S	.	.	H	α-helix	trans	-59	-40.8	173.8	-72	-179.4	178	-175.2	0	112	W420 V434 V435 R440 E441 S442	W420-K438 HydrophobicContact CH2-CB 4.03Å; W420-K438 HydrophobicContact CZ3-CB 4.04Å; V434-K438 HydrophobicContact CG1-CD 4.4Å; V434-K438 WeakPolarHBondContact O-CG 3.4Å; V434-K438 PolarHBondContact O-N 3.2Å; V435-K438 PolarHBondContact O-N 3.13Å; K438-R440 VanDerWaalsContact C-N 3.32Å; K438-R440 PolarHBondContact O-N 3.13Å; K438-E441 PolarHBondContact O-N 2.92Å; K438-S442 PolarHBondContact O-N 3.33Å; K438-S442 PolarHBondContact O-OG 3.33Å
439	A	91	Very high	89.2	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.1	-35.8	176.1	0	0	0	0	0	112.3	W420 V435 N437 S442 I443 I449	W420-A439 HydrophobicContact CB-CB 3.76Å; W420-A439 HydrophobicContact CD2-CB 3.65Å; W420-A439 HydrophobicContact CE3-CB 3.88Å; W420-A439 HydrophobicContact CG-CB 3.59Å; V435-A439 WeakPolarHBondContact O-CB 3.46Å; V435-A439 PolarHBondContact O-N 2.72Å; N437-A439 VanDerWaalsContact C-N 3.29Å; N437-A439 PolarHBondContact O-N 2.88Å; A439-S442 WeakPolarHBondContact CA-OG 3.37Å; A439-S442 PolarHBondContact O-OG 2.87Å; A439-S442 VanDerWaalsContact O-OG 3.09Å; A439-I443 PolarHBondContact O-N 3.42Å; A439-I449 HydrophobicContact CB-CD1 4.06Å; A439-I449 HydrophobicContact CB-CG2 4Å; A439-I449 WeakPolarHBondContact O-CD1 3.39Å
440	R	89.6	Confident	89.4	Confident	57 Å²	57	57.6 Å²	57.6	22%	0.215	28%	0.282	C	S	.	.	H	α-helix	trans	-70.2	-34.5	174.8	-80.2	179.4	-85.7	-167	-5.3	112.6	L436 N437 K438 I443 P444 I449 W450	L436-R440 WeakPolarHBondContact O-CB 3.33Å; L436-R440 VanDerWaalsContact O-CG 3.28Å; L436-R440 WeakPolarHBondContact O-CG 3.47Å; L436-R440 PolarHBondContact O-N 3.38Å; L436-R440 VanDerWaalsContact O-N 3.13Å; L436-R440 PolarHBondContact O-NE 3.12Å; N437-R440 WeakPolarHBondContact O-CB 3.2Å; N437-R440 PolarHBondContact O-N 3.41Å; N437-R440 VanDerWaalsContact O-N 3.11Å; N437-R440 PolarHBondContact OD1-NH2 3.39Å; K438-R440 VanDerWaalsContact C-N 3.32Å; K438-R440 PolarHBondContact O-N 3.13Å; R440-I443 CarbonylContact O-C 3.57Å; R440-P444 WeakPolarHBondContact O-CA 3.47Å; R440-P444 WeakPolarHBondContact O-CG 3.42Å; R440-I449 HydrophobicContact CG-CG2 3.71Å; R440-W450 VanDerWaalsContact NH1-CZ3 3.3Å
441	E	89.1	Confident	89.5	Confident	158 Å²	158	50.4 Å²	50.4	74%	0.738	25%	0.248	S	C	*	.	H	α-helix	trans	-68.8	-41	174.2	-71.5	174.1	-175.4	0	0	111.4	N437 K438	N437-E441 PolarHBondContact O-N 2.87Å; K438-E441 PolarHBondContact O-N 2.92Å
442	S	87.6	Confident	89.4	Confident	47 Å²	47	46.8 Å²	46.8	33%	0.329	23%	0.234	S	C	.	.	H	α-helix	trans	-75.9	-36.4	178.7	63.4	0	0	0	0	113.2	P414 K438 A439	P414-S442 PolarHBondContact O-OG 3.08Å; K438-S442 PolarHBondContact O-N 3.33Å; K438-S442 PolarHBondContact O-OG 3.33Å; A439-S442 WeakPolarHBondContact CA-OG 3.37Å; A439-S442 PolarHBondContact O-OG 2.87Å; A439-S442 VanDerWaalsContact O-OG 3.09Å
443	I	87.8	Confident	89.4	Confident	18 Å²	18	47 Å²	47	9%	0.092	24%	0.236	C	C	.	.			trans	-132	81.6	-177.5	-47	168.2	0	0	0	110.2	T415 V417 A439 R440 T445 D446 I449	T415-I443 VanDerWaalsContact O-CD1 3.27Å; T415-I443 WeakPolarHBondContact O-CD1 3.24Å; V417-I443 HydrophobicContact CB-CD1 4.45Å; V417-I443 HydrophobicContact CG2-CD1 3.75Å; V417-I443 HydrophobicContact CG2-CG2 4.31Å; A439-I443 PolarHBondContact O-N 3.42Å; R440-I443 CarbonylContact O-C 3.57Å; I443-T445 VanDerWaalsContact C-N 3.25Å; I443-T445 PolarHBondContact O-N 2.71Å; I443-D446 HydrophobicContact CG2-CB 3.69Å; I443-I449 HydrophobicContact CB-CD1 3.96Å; I443-I449 HydrophobicContact CG2-CD1 4.48Å
444	P	86.7	Confident	89.3	Confident	53 Å²	53	41.6 Å²	41.6	34%	0.344	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-16.9	178.3	-19.4	33.3	0	0	0	114.1	R440 N480	R440-P444 WeakPolarHBondContact O-CA 3.47Å; R440-P444 WeakPolarHBondContact O-CG 3.42Å; P444-N480 WeakPolarHBondContact CB-ND2 3.4Å; P444-N480 PolarHBondContact O-ND2 3.24Å
445	T	87.9	Confident	89.1	Confident	82 Å²	82	40.8 Å²	40.8	50%	0.503	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-7.7	-172	55.1	0	0	0	0	113.9	I443 L477 V482	I443-T445 VanDerWaalsContact C-N 3.25Å; I443-T445 PolarHBondContact O-N 2.71Å; T445-L477 WeakPolarHBondContact O-CD2 3.48Å; T445-V482 HydrophobicContact CG2-CG2 4.28Å
446	D	87.8	Confident	88.9	Confident	33 Å²	33	41.6 Å²	41.6	18%	0.176	21%	0.208	C	C	.	.			trans	-101.4	140.8	-174.5	-176.4	46.6	0	0	0	113.4	V417 I443 Q448 I449	V417-D446 WeakPolarHBondContact CG1-OD2 3.24Å; V417-D446 HydrophobicContact CG2-CB 3.91Å; V417-D446 WeakPolarHBondContact CG2-OD2 3.5Å; I443-D446 HydrophobicContact CG2-CB 3.69Å; D446-Q448 WeakPolarHBondContact OD2-CB 3.29Å; D446-Q448 PolarHBondContact OD2-N 2.73Å; D446-I449 HydrophobicContact CB-CD1 4.33Å
447	R	88.8	Confident	88.7	Confident	48 Å²	48	42 Å²	42	18%	0.181	21%	0.21	C	C	.	.	S	Bend	trans	-90.9	-26	-177	73	-174.6	108	116.3	1.8	113.4	I449 W450 F451 L477 Q488 W489 D492	R447-I449 PolarHBondContact O-N 2.96Å; R447-W450 WeakPolarHBondContact O-CB 3.31Å; R447-W450 PolarHBondContact O-N 2.89Å; R447-F451 HydrophobicContact CB-CE2 4.19Å; R447-F451 HydrophobicContact CB-CZ 4.28Å; R447-F451 HydrophobicContact CG-CD2 4.42Å; R447-F451 HydrophobicContact CG-CE2 3.68Å; R447-F451 HydrophobicContact CG-CZ 4.14Å; R447-F451 PolarHBondContact O-N 3.32Å; R447-F451 VanDerWaalsContact O-N 3.14Å; R447-L477 HydrophobicContact CB-CD1 3.65Å; R447-Q488 VanDerWaalsContact NH1-CB 3.29Å; R447-W489 HydrophobicContact CB-CH2 4.48Å; R447-W489 HydrophobicContact CB-CZ2 4.24Å; R447-D492 WeakPolarHBondContact CD-OD2 3.16Å; R447-D492 IonicContact CZ-OD2 2.73Å; R447-D492 IonicContact NE-OD2 2.76Å; R447-D492 IonicContact NH1-OD1 3.86Å; R447-D492 IonicContact NH1-OD2 3.2Å; R447-D492 PolarHBondContact NH1-OD2 3.42Å
448	Q	89.3	Confident	88.6	Confident	44 Å²	44	40.2 Å²	40.2	21%	0.206	20%	0.199	C	C	.	.	H	α-helix	trans	-65.9	-30.7	-175.4	-67	-70.8	-12.1	0	0	111.7	V417 L421 D446 W450 F451 A452 D492	V417-Q448 HydrophobicContact CG1-CB 4.16Å; L421-Q448 HydrophobicContact CD1-CB 3.84Å; D446-Q448 WeakPolarHBondContact OD2-CB 3.29Å; D446-Q448 PolarHBondContact OD2-N 2.73Å; Q448-W450 VanDerWaalsContact C-N 3.31Å; Q448-W450 PolarHBondContact O-N 3.11Å; Q448-F451 PolarHBondContact O-N 2.99Å; Q448-A452 WeakPolarHBondContact O-CB 3.34Å; Q448-A452 PolarHBondContact O-N 3.4Å; Q448-D492 PolarHBondContact NE2-OD1 3.32Å
449	I	90.5	Very high	88.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.8	-41	174.2	-51.1	174.3	0	0	0	110.8	V417 L436 A439 R440 I443 D446 R447 A452 A453	V417-I449 HydrophobicContact CG1-CD1 4.49Å; V417-I449 HydrophobicContact CG1-CG1 3.91Å; L436-I449 HydrophobicContact CD2-CG2 3.97Å; A439-I449 HydrophobicContact CB-CD1 4.06Å; A439-I449 HydrophobicContact CB-CG2 4Å; A439-I449 WeakPolarHBondContact O-CD1 3.39Å; R440-I449 HydrophobicContact CG-CG2 3.71Å; I443-I449 HydrophobicContact CB-CD1 3.96Å; I443-I449 HydrophobicContact CG2-CD1 4.48Å; D446-I449 HydrophobicContact CB-CD1 4.33Å; R447-I449 PolarHBondContact O-N 2.96Å; I449-A452 PolarHBondContact O-N 3.15Å; I449-A453 PolarHBondContact O-N 2.88Å
450	W	90.8	Very high	88	Confident	28 Å²	28	43.8 Å²	43.8	11%	0.106	23%	0.232	C	C	.	.	H	α-helix	trans	-65.6	-44.6	175.4	-68.7	98.7	0	0	0	111.4	R440 R447 Q448 A452 A453 T454 I469 R472 G473	R440-W450 VanDerWaalsContact NH1-CZ3 3.3Å; R447-W450 WeakPolarHBondContact O-CB 3.31Å; R447-W450 PolarHBondContact O-N 2.89Å; Q448-W450 VanDerWaalsContact C-N 3.31Å; Q448-W450 PolarHBondContact O-N 3.11Å; W450-A452 VanDerWaalsContact C-N 3.34Å; W450-A452 PolarHBondContact O-N 3.26Å; W450-A453 WeakPolarHBondContact O-CB 3.42Å; W450-A453 PolarHBondContact O-N 3.21Å; W450-T454 VanDerWaalsContact O-CG2 3.23Å; W450-T454 WeakPolarHBondContact O-CG2 3.4Å; W450-T454 PolarHBondContact O-N 3.44Å; W450-I469 HydrophobicContact CE3-CG2 3.75Å; W450-I469 HydrophobicContact CZ3-CG2 4.19Å; W450-R472 HydrophobicContact CH2-CB 4.23Å; W450-R472 HydrophobicContact CZ3-CB 3.94Å; W450-G473 VanDerWaalsContact CE3-CA 3.49Å
451	F	89.6	Confident	87.6	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.009	25%	0.245	C	C	.	.	H	α-helix	trans	-63.7	-39.8	176.4	-56.4	-34.7	0	0	0	112.4	R447 Q448 A453 T454 R455 W489 D492 I508	R447-F451 HydrophobicContact CB-CE2 4.19Å; R447-F451 HydrophobicContact CB-CZ 4.28Å; R447-F451 HydrophobicContact CG-CD2 4.42Å; R447-F451 HydrophobicContact CG-CE2 3.68Å; R447-F451 HydrophobicContact CG-CZ 4.14Å; R447-F451 PolarHBondContact O-N 3.32Å; R447-F451 VanDerWaalsContact O-N 3.14Å; Q448-F451 PolarHBondContact O-N 2.99Å; F451-A453 VanDerWaalsContact C-N 3.34Å; F451-A453 PolarHBondContact O-N 3.25Å; F451-T454 WeakPolarHBondContact CA-OG1 3.45Å; F451-T454 PolarHBondContact O-N 3.37Å; F451-T454 PolarHBondContact O-OG1 3.05Å; F451-R455 WeakPolarHBondContact O-CB 3.43Å; F451-R455 WeakPolarHBondContact O-CG 3.48Å; F451-R455 PolarHBondContact O-N 3.29Å; F451-W489 AromaticContact CE1-CE3 3.51Å; F451-W489 HydrophobicContact CE1-CE3 3.51Å; F451-W489 HydrophobicContact CE1-CH2 4.45Å; F451-W489 AromaticContact CE1-CZ3 3.46Å; F451-W489 HydrophobicContact CE1-CZ3 3.46Å; F451-W489 VanDerWaalsContact CE1-CZ3 3.46Å; F451-W489 HydrophobicContact CE2-CE3 4.43Å; F451-W489 AromaticContact CZ-CD2 3.86Å; F451-W489 HydrophobicContact CZ-CD2 3.86Å; F451-W489 AromaticContact CZ-CE3 3.19Å; F451-W489 HydrophobicContact CZ-CE3 3.19Å; F451-W489 HydrophobicContact CZ-CH2 4.41Å; F451-W489 AromaticContact CZ-CZ3 3.55Å; F451-W489 HydrophobicContact CZ-CZ3 3.55Å; F451-D492 HydrophobicContact CD2-CB 4.06Å; F451-D492 HydrophobicContact CE2-CB 3.49Å; F451-D492 VanDerWaalsContact CE2-CB 3.49Å; F451-D492 WeakPolarHBondContact CE2-OD2 3.3Å; F451-D492 HydrophobicContact CZ-CB 4.16Å; F451-I508 HydrophobicContact CD1-CD1 3.43Å; F451-I508 VanDerWaalsContact CD1-CD1 3.43Å; F451-I508 HydrophobicContact CD1-CG1 3.79Å; F451-I508 HydrophobicContact CE1-CD1 3.59Å; F451-I508 HydrophobicContact CE1-CG1 3.62Å; F451-I508 HydrophobicContact CE1-CG2 4.21Å; F451-I508 HydrophobicContact CG-CD1 4.02Å; F451-I508 HydrophobicContact CZ-CD1 4.29Å; F451-I508 HydrophobicContact CZ-CG2 4.42Å
452	A	87.4	Confident	87.3	Confident	14 Å²	14	39.6 Å²	39.6	12%	0.116	23%	0.23	C	C	.	.	H	α-helix	trans	-62.4	-41.1	174.3	0	0	0	0	0	112.4	L421 L436 Q448 I449 W450 T454 R455 L456	L421-A452 HydrophobicContact CD2-CB 3.29Å; L436-A452 HydrophobicContact CD2-CB 4.09Å; Q448-A452 WeakPolarHBondContact O-CB 3.34Å; Q448-A452 PolarHBondContact O-N 3.4Å; I449-A452 PolarHBondContact O-N 3.15Å; W450-A452 VanDerWaalsContact C-N 3.34Å; W450-A452 PolarHBondContact O-N 3.26Å; A452-T454 VanDerWaalsContact C-N 3.33Å; A452-T454 PolarHBondContact O-N 3.13Å; A452-R455 PolarHBondContact O-N 3.15Å; A452-L456 WeakPolarHBondContact O-CB 3.23Å; A452-L456 PolarHBondContact O-N 3.02Å
453	A	88.3	Confident	87.1	Confident	5 Å²	5	43.4 Å²	43.4	4%	0.041	24%	0.242	C	C	.	.	H	α-helix	trans	-61.3	-41.4	172.1	0	0	0	0	0	111.9	L436 I449 W450 F451 L456 E457 I469	L436-A453 HydrophobicContact CD1-CB 4.05Å; I449-A453 PolarHBondContact O-N 2.88Å; W450-A453 WeakPolarHBondContact O-CB 3.42Å; W450-A453 PolarHBondContact O-N 3.21Å; F451-A453 VanDerWaalsContact C-N 3.34Å; F451-A453 PolarHBondContact O-N 3.25Å; A453-L456 PolarHBondContact O-N 3.09Å; A453-E457 WeakPolarHBondContact O-CG 3.48Å; A453-E457 PolarHBondContact O-N 2.97Å; A453-E457 VanDerWaalsContact O-N 3.15Å; A453-I469 HydrophobicContact CB-CG2 4.22Å
454	T	87.5	Confident	86.8	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-67.2	-38.8	178	66.4	0	0	0	0	112.3	W450 F451 A452 E457 E458 I469 V470 T504	W450-T454 VanDerWaalsContact O-CG2 3.23Å; W450-T454 WeakPolarHBondContact O-CG2 3.4Å; W450-T454 PolarHBondContact O-N 3.44Å; F451-T454 WeakPolarHBondContact CA-OG1 3.45Å; F451-T454 PolarHBondContact O-N 3.37Å; F451-T454 PolarHBondContact O-OG1 3.05Å; A452-T454 VanDerWaalsContact C-N 3.33Å; A452-T454 PolarHBondContact O-N 3.13Å; T454-E457 PolarHBondContact O-N 2.56Å; T454-E458 PolarHBondContact O-N 3.43Å; T454-I469 HydrophobicContact CG2-CB 3.75Å; T454-I469 HydrophobicContact CG2-CG2 3.45Å; T454-I469 VanDerWaalsContact CG2-CG2 3.45Å; T454-V470 HydrophobicContact CG2-CG2 3.58Å; T454-T504 WeakPolarHBondContact O-CG2 3.27Å; T454-T504 VanDerWaalsContact OG1-CG2 3.25Å; T454-T504 WeakPolarHBondContact OG1-CG2 3.44Å
455	R	87.3	Confident	86.8	Confident	59 Å²	59	49.2 Å²	49.2	22%	0.223	27%	0.27	C	S	.	.	H	α-helix	trans	-66.9	-38.2	176.7	-73.7	-174.8	-67.5	-179.7	-6.8	111.6	F451 A452 E458 A459 T504	F451-R455 WeakPolarHBondContact O-CB 3.43Å; F451-R455 WeakPolarHBondContact O-CG 3.48Å; F451-R455 PolarHBondContact O-N 3.29Å; A452-R455 PolarHBondContact O-N 3.15Å; R455-E458 PolarHBondContact O-N 3Å; R455-A459 WeakPolarHBondContact O-CB 3.45Å; R455-A459 PolarHBondContact O-N 3.31Å; R455-T504 HydrophobicContact CG-CG2 4.1Å
456	L	86.9	Confident	86.7	Confident	32 Å²	32	45.4 Å²	45.4	17%	0.168	25%	0.247	C	C	.	.	H	α-helix	trans	-61.7	-43.1	175.2	-175.2	70.4	0	0	0	111.4	Y429 A432 R433 L436 A452 A453 A459 Q460	Y429-L456 HydrophobicContact CD2-CD1 4.19Å; Y429-L456 HydrophobicContact CD2-CD2 4Å; Y429-L456 HydrophobicContact CD2-CG 3.88Å; Y429-L456 HydrophobicContact CE2-CD2 4.33Å; Y429-L456 HydrophobicContact CE2-CG 4.27Å; A432-L456 HydrophobicContact CB-CD1 4.21Å; A432-L456 HydrophobicContact CB-CD2 3.76Å; R433-L456 HydrophobicContact CG-CD2 3.95Å; L436-L456 HydrophobicContact CD1-CD2 3.99Å; A452-L456 WeakPolarHBondContact O-CB 3.23Å; A452-L456 PolarHBondContact O-N 3.02Å; A453-L456 PolarHBondContact O-N 3.09Å; L456-A459 PolarHBondContact O-N 3.26Å; L456-Q460 WeakPolarHBondContact O-CG 3.42Å; L456-Q460 PolarHBondContact O-N 2.9Å
457	E	87.8	Confident	86.7	Confident	13 Å²	13	46.8 Å²	46.8	6%	0.061	25%	0.252	C	S	.	.	H	α-helix	trans	-71.8	-35.3	177.3	-66.7	-67.8	165.7	0	0	112.8	Y429 A453 T454 A459 Q460 G461 N462 M465 V466 I469	Y429-E457 PolarHBondContact OH-OE1 3.36Å; Y429-E457 PolarHBondContact OH-OE2 3.27Å; A453-E457 WeakPolarHBondContact O-CG 3.48Å; A453-E457 PolarHBondContact O-N 2.97Å; A453-E457 VanDerWaalsContact O-N 3.15Å; T454-E457 PolarHBondContact O-N 2.56Å; E457-A459 VanDerWaalsContact C-N 3.33Å; E457-Q460 PolarHBondContact O-N 3.41Å; E457-G461 PolarHBondContact O-N 3.43Å; E457-N462 HydrophobicContact CB-CB 4.35Å; E457-N462 PolarHBondContact O-N 2.98Å; E457-N462 VanDerWaalsContact OE2-CB 3.31Å; E457-N462 WeakPolarHBondContact OE2-CB 3.48Å; E457-N462 PolarHBondContact OE2-ND2 3.3Å; E457-M465 HydrophobicContact CG-CG 4.45Å; E457-V466 HydrophobicContact CB-CG2 4.44Å; E457-I469 HydrophobicContact CB-CD1 4.37Å; E457-I469 HydrophobicContact CG-CD1 3.56Å
458	E	88.5	Confident	86.7	Confident	35 Å²	35	50 Å²	50	16%	0.164	27%	0.267	C	S	.	.	H	α-helix	trans	-61.6	-43	172	-176.6	175	-176.2	0	0	110.8	T454 R455 Q460 G461 V466 S501 V502 L503 T504	T454-E458 PolarHBondContact O-N 3.43Å; R455-E458 PolarHBondContact O-N 3Å; E458-Q460 VanDerWaalsContact C-N 3.26Å; E458-Q460 PolarHBondContact O-N 3.47Å; E458-G461 PolarHBondContact O-N 3.01Å; E458-G461 VanDerWaalsContact O-N 3.12Å; E458-V466 HydrophobicContact CB-CG2 4.15Å; E458-S501 VanDerWaalsContact OE2-C 3.31Å; E458-S501 WeakPolarHBondContact OE2-CA 3.27Å; E458-S501 VanDerWaalsContact OE2-CB 3.27Å; E458-S501 WeakPolarHBondContact OE2-CB 3.17Å; E458-V502 PolarHBondContact OE1-N 3.5Å; E458-L503 HydrophobicContact CG-CB 4.25Å; E458-L503 HydrophobicContact CG-CD1 4.46Å; E458-L503 WeakPolarHBondContact OE1-CB 3.4Å; E458-L503 PolarHBondContact OE1-N 3.18Å; E458-T504 HydrophobicContact CB-CG2 4.09Å; E458-T504 WeakPolarHBondContact OE2-CB 3.47Å; E458-T504 WeakPolarHBondContact OE2-CG2 3.3Å; E458-T504 PolarHBondContact OE2-N 2.9Å; E458-T504 PolarHBondContact OE2-OG1 3.01Å
459	A	85.9	Confident	86.8	Confident	82 Å²	82	48.4 Å²	48.4	68%	0.678	26%	0.26	S	S	*	.	H	α-helix	trans	-63.5	-29.2	178.3	0	0	0	0	0	113.5	R455 L456 E457	R455-A459 WeakPolarHBondContact O-CB 3.45Å; R455-A459 PolarHBondContact O-N 3.31Å; L456-A459 PolarHBondContact O-N 3.26Å; E457-A459 VanDerWaalsContact C-N 3.33Å
460	Q	82.8	Confident	86.7	Confident	110 Å²	110	48.5 Å²	48.5	51%	0.514	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-0.1	177.1	-64.3	-62.7	-25.9	0	0	113.8	Y429 L456 E457 E458	Y429-Q460 HydrophobicContact CD2-CG 3.55Å; Y429-Q460 HydrophobicContact CE2-CB 4.41Å; Y429-Q460 HydrophobicContact CE2-CG 3.78Å; Y429-Q460 HydrophobicContact CG-CG 4.01Å; L456-Q460 WeakPolarHBondContact O-CG 3.42Å; L456-Q460 PolarHBondContact O-N 2.9Å; E457-Q460 PolarHBondContact O-N 3.41Å; E458-Q460 VanDerWaalsContact C-N 3.26Å; E458-Q460 PolarHBondContact O-N 3.47Å
461	G	81	Confident	86.6	Confident	49 Å²	49	51 Å²	51	51%	0.505	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	8.9	177.3	0	0	0	0	0	115.6	E457 E458 Q463	E457-G461 PolarHBondContact O-N 3.43Å; E458-G461 PolarHBondContact O-N 3.01Å; E458-G461 VanDerWaalsContact O-N 3.12Å; G461-Q463 VanDerWaalsContact C-N 3.26Å; G461-Q463 PolarHBondContact O-N 3.42Å
462	N	82.3	Confident	86.7	Confident	77 Å²	77	57.7 Å²	57.7	41%	0.412	30%	0.301	S	S	.	.			trans	-82.3	63.9	178.2	-76.7	-26	0	0	0	112.3	E457 N464 M465	E457-N462 HydrophobicContact CB-CB 4.35Å; E457-N462 PolarHBondContact O-N 2.98Å; E457-N462 VanDerWaalsContact OE2-CB 3.31Å; E457-N462 WeakPolarHBondContact OE2-CB 3.48Å; E457-N462 PolarHBondContact OE2-ND2 3.3Å; N462-N464 VanDerWaalsContact C-N 3.34Å; N462-N464 PolarHBondContact O-N 2.78Å; N462-M465 HydrophobicContact CB-CB 4.2Å; N462-M465 WeakPolarHBondContact O-CB 3.43Å; N462-M465 PolarHBondContact O-N 2.9Å
463	Q	83.5	Confident	86.7	Confident	127 Å²	127	57.1 Å²	57.1	59%	0.593	30%	0.296	S	S	*	.	H	α-helix	trans	-56.2	-41.4	-172.1	-59.9	-179.6	0.3	0	0	114	G461 M465 V466 L503	G461-Q463 VanDerWaalsContact C-N 3.26Å; G461-Q463 PolarHBondContact O-N 3.42Å; Q463-M465 PolarHBondContact O-N 3.43Å; Q463-V466 WeakPolarHBondContact O-CB 3.46Å; Q463-V466 PolarHBondContact O-N 2.9Å; Q463-L503 HydrophobicContact CB-CD1 4.38Å; Q463-L503 HydrophobicContact CG-CD1 3.8Å
464	N	83.1	Confident	86.7	Confident	137 Å²	137	57.1 Å²	57.1	73%	0.733	30%	0.296	S	S	*	.	H	α-helix	trans	-67.9	-22.4	-178.8	-68.1	-26.7	0	0	0	113.2	N462	N462-N464 VanDerWaalsContact C-N 3.34Å; N462-N464 PolarHBondContact O-N 2.78Å
465	M	84.8	Confident	86.7	Confident	56 Å²	56	59.6 Å²	59.6	28%	0.276	32%	0.316	S	S	.	.	H	α-helix	trans	-80.8	-28.1	-179.2	-164.4	60.9	-173.4	0	0	111.5	E457 N462 Q463 Q467 K468 I469	E457-M465 HydrophobicContact CG-CG 4.45Å; N462-M465 HydrophobicContact CB-CB 4.2Å; N462-M465 WeakPolarHBondContact O-CB 3.43Å; N462-M465 PolarHBondContact O-N 2.9Å; Q463-M465 PolarHBondContact O-N 3.43Å; M465-Q467 PolarHBondContact O-N 2.87Å; M465-K468 PolarHBondContact O-N 2.99Å; M465-K468 VanDerWaalsContact O-N 3.16Å; M465-K468 HydrophobicContact SD-CB 4.29Å; M465-K468 HydrophobicContact SD-CD 4.27Å; M465-I469 HydrophobicContact CE-CD1 4.23Å; M465-I469 HydrophobicContact CE-CG1 3.85Å; M465-I469 HydrophobicContact CG-CD1 3.7Å; M465-I469 HydrophobicContact CG-CG1 3.99Å; M465-I469 WeakPolarHBondContact O-CG1 3.32Å; M465-I469 PolarHBondContact O-N 3.3Å
466	V	87.1	Confident	86.8	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.018	32%	0.318	C	S	.	.	H	α-helix	trans	-54.4	-53.4	-179.4	175.3	0	0	0	0	111.3	E457 E458 Q463 K468 I469 V470 T504 A507	E457-V466 HydrophobicContact CB-CG2 4.44Å; E458-V466 HydrophobicContact CB-CG2 4.15Å; Q463-V466 WeakPolarHBondContact O-CB 3.46Å; Q463-V466 PolarHBondContact O-N 2.9Å; V466-K468 VanDerWaalsContact C-N 3.34Å; V466-K468 PolarHBondContact O-N 3.22Å; V466-I469 PolarHBondContact O-N 3.47Å; V466-V470 WeakPolarHBondContact O-CG2 3.4Å; V466-V470 PolarHBondContact O-N 3.39Å; V466-V470 VanDerWaalsContact O-N 3.1Å; V466-T504 HydrophobicContact CG1-CG2 3.78Å; V466-A507 HydrophobicContact CG1-CB 3.95Å
467	Q	87.3	Confident	86.9	Confident	62 Å²	62	57 Å²	57	29%	0.29	31%	0.31	S	S	.	.	H	α-helix	trans	-60.6	-44.2	178.9	-171.7	64.7	42.6	0	0	111.6	M465 I469 V470 D471 A507	M465-Q467 PolarHBondContact O-N 2.87Å; Q467-I469 VanDerWaalsContact C-N 3.3Å; Q467-I469 PolarHBondContact O-N 2.93Å; Q467-V470 PolarHBondContact O-N 3.22Å; Q467-D471 PolarHBondContact NE2-OD1 2.74Å; Q467-D471 PolarHBondContact O-N 3.38Å; Q467-A507 VanDerWaalsContact OE1-CB 3.3Å
468	K	89.9	Confident	86.9	Confident	116 Å²	116	60.6 Å²	60.6	50%	0.504	33%	0.327	S	S	.	.	H	α-helix	trans	-62.9	-35.4	-179.9	-65.8	179.7	-178	178.3	0	112.5	M465 V466 R472	M465-K468 PolarHBondContact O-N 2.99Å; M465-K468 VanDerWaalsContact O-N 3.16Å; M465-K468 HydrophobicContact SD-CB 4.29Å; M465-K468 HydrophobicContact SD-CD 4.27Å; V466-K468 VanDerWaalsContact C-N 3.34Å; V466-K468 PolarHBondContact O-N 3.22Å; K468-R472 WeakPolarHBondContact O-CB 3.36Å; K468-R472 WeakPolarHBondContact O-CG 3.23Å; K468-R472 PolarHBondContact O-N 3.49Å
469	I	90.7	Very high	87	Confident	9 Å²	9	62.5 Å²	62.5	5%	0.046	35%	0.349	C	S	.	.	H	α-helix	trans	-72.7	-41.6	178.3	-66.7	169.5	0	0	0	110.5	W450 A453 T454 E457 M465 V466 Q467 R472 G473	W450-I469 HydrophobicContact CE3-CG2 3.75Å; W450-I469 HydrophobicContact CZ3-CG2 4.19Å; A453-I469 HydrophobicContact CB-CG2 4.22Å; T454-I469 HydrophobicContact CG2-CB 3.75Å; T454-I469 HydrophobicContact CG2-CG2 3.45Å; T454-I469 VanDerWaalsContact CG2-CG2 3.45Å; E457-I469 HydrophobicContact CB-CD1 4.37Å; E457-I469 HydrophobicContact CG-CD1 3.56Å; M465-I469 HydrophobicContact CE-CD1 4.23Å; M465-I469 HydrophobicContact CE-CG1 3.85Å; M465-I469 HydrophobicContact CG-CD1 3.7Å; M465-I469 HydrophobicContact CG-CG1 3.99Å; M465-I469 WeakPolarHBondContact O-CG1 3.32Å; M465-I469 PolarHBondContact O-N 3.3Å; V466-I469 PolarHBondContact O-N 3.47Å; Q467-I469 VanDerWaalsContact C-N 3.3Å; Q467-I469 PolarHBondContact O-N 2.93Å; I469-R472 PolarHBondContact O-N 3.43Å; I469-G473 PolarHBondContact O-N 2.95Å
470	V	88.9	Confident	87.1	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.018	33%	0.332	C	S	.	.	H	α-helix	trans	-59.7	-48	174.5	176	0	0	0	0	110.2	T454 V466 Q467 R472 G473 V474 A507 I508 A511	T454-V470 HydrophobicContact CG2-CG2 3.58Å; V466-V470 WeakPolarHBondContact O-CG2 3.4Å; V466-V470 PolarHBondContact O-N 3.39Å; V466-V470 VanDerWaalsContact O-N 3.1Å; Q467-V470 PolarHBondContact O-N 3.22Å; V470-R472 PolarHBondContact O-N 3.15Å; V470-G473 WeakPolarHBondContact O-CA 3.24Å; V470-G473 PolarHBondContact O-N 3.31Å; V470-V474 HydrophobicContact CG1-CG2 4.43Å; V470-V474 WeakPolarHBondContact O-CG2 3.49Å; V470-V474 PolarHBondContact O-N 2.86Å; V470-A507 HydrophobicContact CG2-CB 4.04Å; V470-I508 HydrophobicContact CG2-CG1 4.24Å; V470-A511 HydrophobicContact CG1-CB 3.8Å
471	D	88.9	Confident	87.1	Confident	80 Å²	80	64.6 Å²	64.6	43%	0.428	35%	0.349	S	S	.	.	H	α-helix	trans	-62.1	-41.8	-179.9	-62.9	-21.1	0	0	0	111.8	Q467 G473 V474 A475	Q467-D471 PolarHBondContact NE2-OD1 2.74Å; Q467-D471 PolarHBondContact O-N 3.38Å; D471-G473 VanDerWaalsContact C-N 3.33Å; D471-V474 PolarHBondContact O-N 3.49Å; D471-A475 WeakPolarHBondContact O-CB 3.43Å; D471-A475 PolarHBondContact O-N 3Å
472	R	89.9	Confident	87.2	Confident	143 Å²	143	64.6 Å²	64.6	54%	0.54	34%	0.338	S	S	.	.	H	α-helix	trans	-64	-38.2	172.8	-74.3	172.4	-168.6	179.9	2.9	112.3	W450 K468 I469 V470 A475 S476	W450-R472 HydrophobicContact CH2-CB 4.23Å; W450-R472 HydrophobicContact CZ3-CB 3.94Å; K468-R472 WeakPolarHBondContact O-CB 3.36Å; K468-R472 WeakPolarHBondContact O-CG 3.23Å; K468-R472 PolarHBondContact O-N 3.49Å; I469-R472 PolarHBondContact O-N 3.43Å; V470-R472 PolarHBondContact O-N 3.15Å; R472-A475 PolarHBondContact O-N 3.31Å; R472-S476 WeakPolarHBondContact O-CB 3.38Å; R472-S476 PolarHBondContact O-N 2.88Å
473	G	87.6	Confident	87	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.01	35%	0.354	C	S	.	.	H	α-helix	trans	-65	-46.3	177.9	0	0	0	0	0	111.8	W450 I469 V470 D471 A475 S476 L477	W450-G473 VanDerWaalsContact CE3-CA 3.49Å; I469-G473 PolarHBondContact O-N 2.95Å; V470-G473 WeakPolarHBondContact O-CA 3.24Å; V470-G473 PolarHBondContact O-N 3.31Å; D471-G473 VanDerWaalsContact C-N 3.33Å; G473-A475 PolarHBondContact O-N 2.85Å; G473-S476 PolarHBondContact O-N 3.34Å; G473-L477 WeakPolarHBondContact O-CB 3.44Å; G473-L477 VanDerWaalsContact O-CG 3.23Å; G473-L477 WeakPolarHBondContact O-CG 3.28Å; G473-L477 PolarHBondContact O-N 2.9Å
474	V	88.2	Confident	86.9	Confident	5 Å²	5	64.1 Å²	64.1	3%	0.03	34%	0.335	C	S	.	.	H	α-helix	trans	-59.1	-47.2	174.1	173.6	0	0	0	0	110.8	V470 D471 S476 L477 Q478 I484 W489 A511 Y515	V470-V474 HydrophobicContact CG1-CG2 4.43Å; V470-V474 WeakPolarHBondContact O-CG2 3.49Å; V470-V474 PolarHBondContact O-N 2.86Å; D471-V474 PolarHBondContact O-N 3.49Å; V474-S476 PolarHBondContact O-N 2.92Å; V474-L477 PolarHBondContact O-N 3.26Å; V474-Q478 WeakPolarHBondContact O-CB 3.42Å; V474-Q478 VanDerWaalsContact O-CG 3.32Å; V474-Q478 WeakPolarHBondContact O-CG 3.36Å; V474-Q478 PolarHBondContact O-N 2.99Å; V474-I484 HydrophobicContact CG1-CD1 3.79Å; V474-W489 HydrophobicContact CG2-CH2 3.63Å; V474-W489 HydrophobicContact CG2-CZ3 3.91Å; V474-A511 HydrophobicContact CG2-CB 4.41Å; V474-Y515 HydrophobicContact CG1-CE2 4.18Å; V474-Y515 WeakPolarHBondContact CG1-OH 3.47Å
475	A	89.2	Confident	86.9	Confident	52 Å²	52	60.9 Å²	60.9	43%	0.43	32%	0.317	S	S	.	.	H	α-helix	trans	-62.4	-40.9	177.7	0	0	0	0	0	112.8	D471 R472 G473 Q478 A479	D471-A475 WeakPolarHBondContact O-CB 3.43Å; D471-A475 PolarHBondContact O-N 3Å; R472-A475 PolarHBondContact O-N 3.31Å; G473-A475 PolarHBondContact O-N 2.85Å; A475-Q478 PolarHBondContact O-N 3.12Å; A475-A479 WeakPolarHBondContact O-CB 3.48Å; A475-A479 PolarHBondContact O-N 3.01Å
476	S	89.2	Confident	86.9	Confident	36 Å²	36	59.5 Å²	59.5	25%	0.252	31%	0.309	S	S	.	.	H	α-helix	trans	-66.6	-40.8	177.2	-172.7	0	0	0	0	112.1	R472 G473 V474 A479 N480	R472-S476 WeakPolarHBondContact O-CB 3.38Å; R472-S476 PolarHBondContact O-N 2.88Å; G473-S476 PolarHBondContact O-N 3.34Å; V474-S476 PolarHBondContact O-N 2.92Å; S476-A479 PolarHBondContact O-N 3.32Å; S476-N480 VanDerWaalsContact O-CG 3.31Å; S476-N480 PolarHBondContact O-N 2.95Å; S476-N480 PolarHBondContact O-ND2 3.42Å
477	L	88.5	Confident	86.8	Confident	2 Å²	2	64.3 Å²	64.3	1%	0.01	34%	0.335	C	S	.	.	H	α-helix	trans	-68.8	-36.9	178.8	-70.6	169.1	0	0	0	111.5	T445 R447 G473 V474 N480 M481 V482 W489	T445-L477 WeakPolarHBondContact O-CD2 3.48Å; R447-L477 HydrophobicContact CB-CD1 3.65Å; G473-L477 WeakPolarHBondContact O-CB 3.44Å; G473-L477 VanDerWaalsContact O-CG 3.23Å; G473-L477 WeakPolarHBondContact O-CG 3.28Å; G473-L477 PolarHBondContact O-N 2.9Å; V474-L477 PolarHBondContact O-N 3.26Å; L477-N480 CarbonylContact O-C 3.53Å; L477-N480 PolarHBondContact O-N 3.49Å; L477-M481 PolarHBondContact O-N 3.03Å; L477-V482 HydrophobicContact CB-CB 4.38Å; L477-V482 HydrophobicContact CD2-CB 4.43Å; L477-V482 HydrophobicContact CD2-CG2 4.31Å; L477-V482 PolarHBondContact O-N 2.94Å; L477-W489 HydrophobicContact CD1-CH2 3.64Å; L477-W489 HydrophobicContact CD1-CZ2 3.48Å; L477-W489 VanDerWaalsContact CD1-CZ2 3.48Å
478	Q	87.6	Confident	86.9	Confident	87 Å²	87	65.2 Å²	65.2	41%	0.407	34%	0.339	S	S	.	.	H	α-helix	trans	-64.2	-43	171.4	-73.9	172.6	-8.5	0	0	112	V474 A475 N480 M481 I484	V474-Q478 WeakPolarHBondContact O-CB 3.42Å; V474-Q478 VanDerWaalsContact O-CG 3.32Å; V474-Q478 WeakPolarHBondContact O-CG 3.36Å; V474-Q478 PolarHBondContact O-N 2.99Å; A475-Q478 PolarHBondContact O-N 3.12Å; Q478-N480 PolarHBondContact O-N 3.21Å; Q478-M481 PolarHBondContact O-N 3.23Å; Q478-I484 HydrophobicContact CG-CD1 3.75Å
479	A	90.4	Very high	86.9	Confident	76 Å²	76	60 Å²	60	63%	0.628	32%	0.316	S	S	*	.	H	α-helix	trans	-62	-33.5	176.1	0	0	0	0	0	112.2	A475 S476 M481	A475-A479 WeakPolarHBondContact O-CB 3.48Å; A475-A479 PolarHBondContact O-N 3.01Å; S476-A479 PolarHBondContact O-N 3.32Å; A479-M481 PolarHBondContact O-N 2.82Å
480	N	87.7	Confident	86.9	Confident	63 Å²	63	60.3 Å²	60.3	34%	0.337	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	11	175.3	-65	-29.7	0	0	0	113.6	P444 S476 L477 Q478 V482	P444-N480 WeakPolarHBondContact CB-ND2 3.4Å; P444-N480 PolarHBondContact O-ND2 3.24Å; S476-N480 VanDerWaalsContact O-CG 3.31Å; S476-N480 PolarHBondContact O-N 2.95Å; S476-N480 PolarHBondContact O-ND2 3.42Å; L477-N480 CarbonylContact O-C 3.53Å; L477-N480 PolarHBondContact O-N 3.49Å; Q478-N480 PolarHBondContact O-N 3.21Å; N480-V482 VanDerWaalsContact C-N 3.28Å; N480-V482 HydrophobicContact CB-CG2 4.45Å; N480-V482 PolarHBondContact O-N 3.38Å
481	M	83	Confident	86.9	Confident	173 Å²	173	66.2 Å²	66.2	85%	0.852	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	30.8	178.2	-59.6	-178.5	-79.2	0	0	114.6	L477 Q478 A479	L477-M481 PolarHBondContact O-N 3.03Å; Q478-M481 PolarHBondContact O-N 3.23Å; A479-M481 PolarHBondContact O-N 2.82Å
482	V	82.5	Confident	86.9	Confident	48 Å²	48	62.9 Å²	62.9	29%	0.291	33%	0.325	S	S	.	.			trans	-85.5	120.9	174.3	-178.8	0	0	0	0	109.6	T445 L477 N480 I484	T445-V482 HydrophobicContact CG2-CG2 4.28Å; L477-V482 HydrophobicContact CB-CB 4.38Å; L477-V482 HydrophobicContact CD2-CB 4.43Å; L477-V482 HydrophobicContact CD2-CG2 4.31Å; L477-V482 PolarHBondContact O-N 2.94Å; N480-V482 VanDerWaalsContact C-N 3.28Å; N480-V482 HydrophobicContact CB-CG2 4.45Å; N480-V482 PolarHBondContact O-N 3.38Å; V482-I484 PolarHBondContact O-N 3.35Å
483	E	78.7	Confident	86.9	Confident	160 Å²	160	56.1 Å²	56.1	75%	0.748	30%	0.3	S	S	*	.			trans	-64.3	126.1	175.3	-67.4	-177.4	175.6	0	0	111.2	N485	E483-N485 PolarHBondContact O-N 3.48Å; E483-N485 VanDerWaalsContact O-N 3.15Å
484	I	82.5	Confident	87	Confident	35 Å²	35	57.1 Å²	57.1	18%	0.179	30%	0.304	C	S	.	.			trans	-82.6	94.9	179.4	-61.3	168.3	0	0	0	108.5	V474 Q478 V482 R486 W489 I512 Y515	V474-I484 HydrophobicContact CG1-CD1 3.79Å; Q478-I484 HydrophobicContact CG-CD1 3.75Å; V482-I484 PolarHBondContact O-N 3.35Å; I484-R486 PolarHBondContact O-N 2.82Å; I484-W489 HydrophobicContact CG1-CZ2 4.41Å; I484-W489 HydrophobicContact CG2-CZ2 4.34Å; I484-I512 HydrophobicContact CG2-CG2 4.42Å; I484-Y515 HydrophobicContact CD1-CD1 4.48Å
485	N	83.2	Confident	87	Confident	69 Å²	69	62.1 Å²	62.1	37%	0.369	33%	0.327	S	S	.	.			trans	-75.3	103.4	173.7	-71.6	-31.1	0	0	0	111.1	E483 D487 Q488 W489	E483-N485 PolarHBondContact O-N 3.48Å; E483-N485 VanDerWaalsContact O-N 3.15Å; N485-D487 VanDerWaalsContact C-N 3.28Å; N485-D487 PolarHBondContact O-N 3.15Å; N485-D487 VanDerWaalsContact O-N 3.17Å; N485-Q488 HydrophobicContact CB-CB 4.07Å; N485-Q488 HydrophobicContact CB-CG 3.84Å; N485-Q488 PolarHBondContact ND2-OE1 2.74Å; N485-Q488 VanDerWaalsContact ND2-OE1 3.14Å; N485-Q488 PolarHBondContact O-N 2.99Å; N485-W489 VanDerWaalsContact O-CD1 3.23Å; N485-W489 PolarHBondContact O-N 3.44Å
486	R	84.4	Confident	86.9	Confident	27 Å²	27	59.9 Å²	59.9	10%	0.102	31%	0.308	C	S	.	.	H	α-helix	trans	-43.2	-51.4	178.3	-176.6	-165.3	-179.7	80.8	5.4	113	I484 Q488 W489 I490 I512 I513 D529	I484-R486 PolarHBondContact O-N 2.82Å; R486-Q488 VanDerWaalsContact C-N 3.34Å; R486-Q488 PolarHBondContact O-N 3.14Å; R486-W489 PolarHBondContact O-N 3.17Å; R486-I490 HydrophobicContact CG-CD1 3.89Å; R486-I490 WeakPolarHBondContact O-CG1 3.44Å; R486-I490 PolarHBondContact O-N 2.75Å; R486-I512 HydrophobicContact CG-CG2 4.39Å; R486-I513 VanDerWaalsContact NH1-C 3.32Å; R486-I513 PolarHBondContact NH1-O 3.43Å; R486-D529 IonicContact CZ-OD2 2.74Å; R486-D529 IonicContact NE-OD2 2.71Å; R486-D529 PolarHBondContact NE-OD2 3.05Å; R486-D529 IonicContact NH2-OD2 3.74Å; R486-D529 PolarHBondContact NH2-OD2 2.91Å
487	D	85.6	Confident	86.8	Confident	104 Å²	104	59.6 Å²	59.6	56%	0.556	30%	0.303	S	S	*	.	H	α-helix	trans	-64.7	-36.5	-175.4	-62.1	-18.1	0	0	0	113.2	N485 K491	N485-D487 VanDerWaalsContact C-N 3.28Å; N485-D487 PolarHBondContact O-N 3.15Å; N485-D487 VanDerWaalsContact O-N 3.17Å; D487-K491 WeakPolarHBondContact O-CG 3.5Å; D487-K491 PolarHBondContact O-N 2.97Å
488	Q	88	Confident	86.8	Confident	81 Å²	81	66.5 Å²	66.5	38%	0.379	33%	0.333	S	S	.	.	H	α-helix	trans	-71.2	-39.6	-178.7	-62.6	-178.9	-20.8	0	0	110.5	R447 N485 R486 K491 D492	R447-Q488 VanDerWaalsContact NH1-CB 3.29Å; N485-Q488 HydrophobicContact CB-CB 4.07Å; N485-Q488 HydrophobicContact CB-CG 3.84Å; N485-Q488 PolarHBondContact ND2-OE1 2.74Å; N485-Q488 VanDerWaalsContact ND2-OE1 3.14Å; N485-Q488 PolarHBondContact O-N 2.99Å; R486-Q488 VanDerWaalsContact C-N 3.34Å; R486-Q488 PolarHBondContact O-N 3.14Å; Q488-K491 WeakPolarHBondContact O-CB 3.28Å; Q488-K491 PolarHBondContact O-N 3.07Å; Q488-D492 PolarHBondContact O-N 3.1Å; Q488-D492 VanDerWaalsContact O-OD2 3.09Å
489	W	91	Very high	86.7	Confident	7 Å²	7	65 Å²	65	3%	0.027	34%	0.335	C	S	.	.	H	α-helix	trans	-72.6	-31.2	176.9	-70.8	67.8	0	0	0	113.1	R447 F451 V474 L477 I484 N485 R486 K491 D492 A493 I508 I512	R447-W489 HydrophobicContact CB-CH2 4.48Å; R447-W489 HydrophobicContact CB-CZ2 4.24Å; F451-W489 AromaticContact CE1-CE3 3.51Å; F451-W489 HydrophobicContact CE1-CE3 3.51Å; F451-W489 HydrophobicContact CE1-CH2 4.45Å; F451-W489 AromaticContact CE1-CZ3 3.46Å; F451-W489 HydrophobicContact CE1-CZ3 3.46Å; F451-W489 VanDerWaalsContact CE1-CZ3 3.46Å; F451-W489 HydrophobicContact CE2-CE3 4.43Å; F451-W489 AromaticContact CZ-CD2 3.86Å; F451-W489 HydrophobicContact CZ-CD2 3.86Å; F451-W489 AromaticContact CZ-CE3 3.19Å; F451-W489 HydrophobicContact CZ-CE3 3.19Å; F451-W489 HydrophobicContact CZ-CH2 4.41Å; F451-W489 AromaticContact CZ-CZ3 3.55Å; F451-W489 HydrophobicContact CZ-CZ3 3.55Å; V474-W489 HydrophobicContact CG2-CH2 3.63Å; V474-W489 HydrophobicContact CG2-CZ3 3.91Å; L477-W489 HydrophobicContact CD1-CH2 3.64Å; L477-W489 HydrophobicContact CD1-CZ2 3.48Å; L477-W489 VanDerWaalsContact CD1-CZ2 3.48Å; I484-W489 HydrophobicContact CG1-CZ2 4.41Å; I484-W489 HydrophobicContact CG2-CZ2 4.34Å; N485-W489 VanDerWaalsContact O-CD1 3.23Å; N485-W489 PolarHBondContact O-N 3.44Å; R486-W489 PolarHBondContact O-N 3.17Å; W489-K491 VanDerWaalsContact C-N 3.34Å; W489-D492 PolarHBondContact O-N 3.34Å; W489-A493 PolarHBondContact O-N 2.69Å; W489-I508 HydrophobicContact CE3-CG2 4.14Å; W489-I512 HydrophobicContact CB-CD1 3.42Å; W489-I512 VanDerWaalsContact CB-CD1 3.42Å; W489-I512 HydrophobicContact CB-CG1 4.42Å; W489-I512 HydrophobicContact CB-CG2 4.22Å; W489-I512 HydrophobicContact CD2-CD1 3.36Å; W489-I512 HydrophobicContact CD2-CG1 4.2Å; W489-I512 HydrophobicContact CE3-CD1 2.94Å; W489-I512 HydrophobicContact CE3-CG1 3.96Å; W489-I512 HydrophobicContact CG-CD1 3.63Å; W489-I512 HydrophobicContact CG-CG1 4.47Å; W489-I512 HydrophobicContact CZ3-CD1 3.71Å; W489-I512 HydrophobicContact CZ3-CG1 4.44Å
490	I	89.3	Confident	86.4	Confident	15 Å²	15	70.2 Å²	70.2	8%	0.077	34%	0.343	C	S	.	.	H	α-helix	trans	-62.3	-45.3	170.4	-69.2	170.7	0	0	0	109.4	R486 D492 A493 E494 D529 C533	R486-I490 HydrophobicContact CG-CD1 3.89Å; R486-I490 WeakPolarHBondContact O-CG1 3.44Å; R486-I490 PolarHBondContact O-N 2.75Å; I490-D492 VanDerWaalsContact C-N 3.33Å; I490-D492 PolarHBondContact O-N 3.34Å; I490-A493 WeakPolarHBondContact O-CB 3.39Å; I490-A493 PolarHBondContact O-N 2.64Å; I490-A493 VanDerWaalsContact O-N 3.11Å; I490-E494 WeakPolarHBondContact O-CG 3.43Å; I490-E494 PolarHBondContact O-N 3.47Å; I490-D529 HydrophobicContact CD1-CB 4.42Å; I490-C533 VanDerWaalsContact CG2-SG 3.59Å
491	K	89.3	Confident	86.2	Confident	126 Å²	126	68.1 Å²	68.1	55%	0.548	33%	0.334	S	S	.	.	H	α-helix	trans	-59.4	-42.7	174.2	-72.4	174.3	-177.3	178.4	0	112.3	D487 Q488 W489 A493 E494 E495	D487-K491 WeakPolarHBondContact O-CG 3.5Å; D487-K491 PolarHBondContact O-N 2.97Å; Q488-K491 WeakPolarHBondContact O-CB 3.28Å; Q488-K491 PolarHBondContact O-N 3.07Å; W489-K491 VanDerWaalsContact C-N 3.34Å; K491-A493 VanDerWaalsContact C-N 3.27Å; K491-A493 PolarHBondContact O-N 3.32Å; K491-E494 WeakPolarHBondContact O-CB 3.49Å; K491-E494 PolarHBondContact O-N 3.08Å; K491-E495 WeakPolarHBondContact O-CG 3.37Å; K491-E495 PolarHBondContact O-N 3.12Å
492	D	88.6	Confident	86.4	Confident	11 Å²	11	62 Å²	62	6%	0.059	31%	0.306	C	S	.	.	H	α-helix	trans	-62.5	-35.8	176.3	-62.3	-36.1	0	0	0	111.5	R447 Q448 F451 Q488 W489 I490 E495 C496	R447-D492 WeakPolarHBondContact CD-OD2 3.16Å; R447-D492 IonicContact CZ-OD2 2.73Å; R447-D492 IonicContact NE-OD2 2.76Å; R447-D492 IonicContact NH1-OD1 3.86Å; R447-D492 IonicContact NH1-OD2 3.2Å; R447-D492 PolarHBondContact NH1-OD2 3.42Å; Q448-D492 PolarHBondContact NE2-OD1 3.32Å; F451-D492 HydrophobicContact CD2-CB 4.06Å; F451-D492 HydrophobicContact CE2-CB 3.49Å; F451-D492 VanDerWaalsContact CE2-CB 3.49Å; F451-D492 WeakPolarHBondContact CE2-OD2 3.3Å; F451-D492 HydrophobicContact CZ-CB 4.16Å; Q488-D492 PolarHBondContact O-N 3.1Å; Q488-D492 VanDerWaalsContact O-OD2 3.09Å; W489-D492 PolarHBondContact O-N 3.34Å; I490-D492 VanDerWaalsContact C-N 3.33Å; I490-D492 PolarHBondContact O-N 3.34Å; D492-E495 PolarHBondContact O-N 3.41Å; D492-C496 PolarHBondContact O-N 3.14Å; D492-C496 PolarHBondContact O-SG 2.88Å
493	A	90.1	Very high	86.6	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-68.2	-41.4	173.3	0	0	0	0	0	112.3	W489 I490 K491 E495 C496 E497 A505 I508 I509	W489-A493 PolarHBondContact O-N 2.69Å; I490-A493 WeakPolarHBondContact O-CB 3.39Å; I490-A493 PolarHBondContact O-N 2.64Å; I490-A493 VanDerWaalsContact O-N 3.11Å; K491-A493 VanDerWaalsContact C-N 3.27Å; K491-A493 PolarHBondContact O-N 3.32Å; A493-E495 VanDerWaalsContact C-N 3.28Å; A493-E495 PolarHBondContact O-N 3.31Å; A493-C496 WeakPolarHBondContact O-CB 3.39Å; A493-C496 PolarHBondContact O-N 3.05Å; A493-C496 VanDerWaalsContact O-N 3.16Å; A493-E497 PolarHBondContact O-N 3.04Å; A493-A505 HydrophobicContact CB-CB 4.31Å; A493-A505 WeakPolarHBondContact O-CB 3.41Å; A493-I508 HydrophobicContact CB-CB 4.29Å; A493-I508 HydrophobicContact CB-CG2 3.92Å; A493-I509 HydrophobicContact CB-CD1 3.76Å; A493-I509 HydrophobicContact CB-CG1 3.67Å
494	E	89.7	Confident	87	Confident	22 Å²	22	55 Å²	55	10%	0.103	27%	0.272	C	S	.	.	H	α-helix	trans	-60.3	-38.4	173	-64.6	-175.2	163.4	0	0	111.4	I490 K491 E497 K498 S536 A538	I490-E494 WeakPolarHBondContact O-CG 3.43Å; I490-E494 PolarHBondContact O-N 3.47Å; K491-E494 WeakPolarHBondContact O-CB 3.49Å; K491-E494 PolarHBondContact O-N 3.08Å; E494-E497 PolarHBondContact O-N 3.47Å; E494-K498 WeakPolarHBondContact O-CG 3.48Å; E494-K498 PolarHBondContact O-N 2.99Å; E494-S536 WeakPolarHBondContact OE1-CB 3.48Å; E494-S536 PolarHBondContact OE1-OG 3.38Å; E494-A538 HydrophobicContact CB-CB 4.13Å; E494-A538 HydrophobicContact CG-CB 3.69Å
495	E	88.2	Confident	87.3	Confident	111 Å²	111	53.3 Å²	53.3	52%	0.519	26%	0.263	S	S	.	.	H	α-helix	trans	-66.9	-38.1	174.1	-72.3	179.5	-170.8	0	0	112.3	K491 D492 A493 K498 A499	K491-E495 WeakPolarHBondContact O-CG 3.37Å; K491-E495 PolarHBondContact O-N 3.12Å; D492-E495 PolarHBondContact O-N 3.41Å; A493-E495 VanDerWaalsContact C-N 3.28Å; A493-E495 PolarHBondContact O-N 3.31Å; E495-K498 PolarHBondContact O-N 3.36Å; E495-A499 WeakPolarHBondContact O-CB 3.28Å; E495-A499 PolarHBondContact O-N 2.83Å
496	C	87	Confident	87.6	Confident	4 Å²	4	52.2 Å²	52.2	3%	0.027	26%	0.256	C	S	.	.	H	α-helix	trans	-65.3	-39.8	173.6	-68	0	0	0	0	112	D492 A493 A499 K500 S501 A505	D492-C496 PolarHBondContact O-N 3.14Å; D492-C496 PolarHBondContact O-SG 2.88Å; A493-C496 WeakPolarHBondContact O-CB 3.39Å; A493-C496 PolarHBondContact O-N 3.05Å; A493-C496 VanDerWaalsContact O-N 3.16Å; C496-A499 CarbonylContact O-C 3.56Å; C496-A499 WeakPolarHBondContact O-CA 3.43Å; C496-A499 WeakPolarHBondContact O-CB 3.34Å; C496-A499 PolarHBondContact O-N 2.64Å; C496-A499 VanDerWaalsContact O-N 3.14Å; C496-K500 PolarHBondContact O-N 3.32Å; C496-S501 PolarHBondContact O-N 2.67Å; C496-A505 HydrophobicContact CB-CB 4.1Å
497	E	88.4	Confident	87.7	Confident	31 Å²	31	51.1 Å²	51.1	15%	0.145	25%	0.252	C	S	.	.	H	α-helix	trans	-63.9	-42.8	174.8	-172.9	177.4	161.9	0	0	111.1	A493 E494 A499 K500 A505 A538 I539 E540 C541	A493-E497 PolarHBondContact O-N 3.04Å; E494-E497 PolarHBondContact O-N 3.47Å; E497-A499 PolarHBondContact O-N 2.83Å; E497-K500 WeakPolarHBondContact O-CA 3.44Å; E497-K500 PolarHBondContact O-N 3.41Å; E497-A505 HydrophobicContact CB-CB 4.39Å; E497-A538 VanDerWaalsContact OE2-C 3.24Å; E497-A538 VanDerWaalsContact OE2-CA 3.25Å; E497-A538 WeakPolarHBondContact OE2-CA 3.31Å; E497-A538 WeakPolarHBondContact OE2-CB 3.42Å; E497-I539 PolarHBondContact OE1-N 3.5Å; E497-I539 PolarHBondContact OE2-N 3.12Å; E497-E540 HydrophobicContact CG-CB 4.34Å; E497-E540 HydrophobicContact CG-CG 4.49Å; E497-E540 PolarHBondContact OE1-N 3.3Å; E497-E540 PolarHBondContact OE2-N 3.04Å; E497-C541 WeakPolarHBondContact OE2-CB 3.34Å; E497-C541 PolarHBondContact OE2-N 3.12Å; E497-C541 PolarHBondContact OE2-SG 2.79Å
498	K	88.2	Confident	87.9	Confident	147 Å²	147	46.1 Å²	46.1	64%	0.639	23%	0.226	S	C	*	.	H	α-helix	trans	-60.1	-33.7	172.7	-72.7	169	-175.4	165.2	0	112.3	E494 E495 K500	E494-K498 WeakPolarHBondContact O-CG 3.48Å; E494-K498 PolarHBondContact O-N 2.99Å; E495-K498 PolarHBondContact O-N 3.36Å; K498-K500 PolarHBondContact O-N 2.88Å
499	A	85.2	Confident	88	Confident	54 Å²	54	42.4 Å²	42.4	45%	0.446	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	4.7	174.1	0	0	0	0	0	114.2	E495 C496 E497 S501	E495-A499 WeakPolarHBondContact O-CB 3.28Å; E495-A499 PolarHBondContact O-N 2.83Å; C496-A499 CarbonylContact O-C 3.56Å; C496-A499 WeakPolarHBondContact O-CA 3.43Å; C496-A499 WeakPolarHBondContact O-CB 3.34Å; C496-A499 PolarHBondContact O-N 2.64Å; C496-A499 VanDerWaalsContact O-N 3.14Å; E497-A499 PolarHBondContact O-N 2.83Å; A499-S501 PolarHBondContact O-N 3.02Å
500	K	83.5	Confident	87.8	Confident	186 Å²	186	47 Å²	47	81%	0.809	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.3	17.3	-176.8	-54	179	179.2	176.3	0	115	C496 E497 K498 V502	C496-K500 PolarHBondContact O-N 3.32Å; E497-K500 WeakPolarHBondContact O-CA 3.44Å; E497-K500 PolarHBondContact O-N 3.41Å; K498-K500 PolarHBondContact O-N 2.88Å; K500-V502 PolarHBondContact O-N 2.94Å
501	S	83.6	Confident	87.6	Confident	20 Å²	20	47.1 Å²	47.1	14%	0.14	23%	0.232	C	C	.	.			trans	-95.2	83.7	173.7	-52.2	0	0	0	0	108.5	E458 C496 A499 T504 A505	E458-S501 VanDerWaalsContact OE2-C 3.31Å; E458-S501 WeakPolarHBondContact OE2-CA 3.27Å; E458-S501 VanDerWaalsContact OE2-CB 3.27Å; E458-S501 WeakPolarHBondContact OE2-CB 3.17Å; C496-S501 PolarHBondContact O-N 2.67Å; A499-S501 PolarHBondContact O-N 3.02Å; S501-T504 WeakPolarHBondContact CB-OG1 3.47Å; S501-T504 PolarHBondContact O-OG1 2.94Å; S501-A505 PolarHBondContact O-N 3.02Å
502	V	87.4	Confident	87.4	Confident	44 Å²	44	41.2 Å²	41.2	27%	0.267	21%	0.206	S	C	.	.	H	α-helix	trans	-79.1	-41.8	-169.5	179	0	0	0	0	111.1	E458 K500 T504 A505 Q506 E540	E458-V502 PolarHBondContact OE1-N 3.5Å; K500-V502 PolarHBondContact O-N 2.94Å; V502-T504 VanDerWaalsContact C-N 3.32Å; V502-T504 PolarHBondContact O-N 2.95Å; V502-A505 PolarHBondContact O-N 3.41Å; V502-Q506 HydrophobicContact CG1-CG 4.32Å; V502-Q506 VanDerWaalsContact O-CG 3.29Å; V502-Q506 WeakPolarHBondContact O-CG 3.43Å; V502-Q506 PolarHBondContact O-N 3.25Å; V502-E540 HydrophobicContact CG1-CB 3.7Å; V502-E540 HydrophobicContact CG1-CG 3.69Å; V502-E540 HydrophobicContact CG2-CG 4.35Å
503	L	87.3	Confident	87	Confident	61 Å²	61	40.9 Å²	40.9	32%	0.319	20%	0.204	S	C	.	.	H	α-helix	trans	-67.9	-36.3	-176.8	-62.3	177.1	0	0	0	111.3	E458 Q463 Q506 A507	E458-L503 HydrophobicContact CG-CB 4.25Å; E458-L503 HydrophobicContact CG-CD1 4.46Å; E458-L503 WeakPolarHBondContact OE1-CB 3.4Å; E458-L503 PolarHBondContact OE1-N 3.18Å; Q463-L503 HydrophobicContact CB-CD1 4.38Å; Q463-L503 HydrophobicContact CG-CD1 3.8Å; L503-Q506 PolarHBondContact O-N 3.23Å; L503-A507 WeakPolarHBondContact O-CB 3.33Å; L503-A507 PolarHBondContact O-N 2.68Å
504	T	87.3	Confident	86.4	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62	-49.7	171.5	44.9	0	0	0	0	111.9	T454 R455 E458 V466 S501 V502 Q506 A507 I508	T454-T504 WeakPolarHBondContact O-CG2 3.27Å; T454-T504 VanDerWaalsContact OG1-CG2 3.25Å; T454-T504 WeakPolarHBondContact OG1-CG2 3.44Å; R455-T504 HydrophobicContact CG-CG2 4.1Å; E458-T504 HydrophobicContact CB-CG2 4.09Å; E458-T504 WeakPolarHBondContact OE2-CB 3.47Å; E458-T504 WeakPolarHBondContact OE2-CG2 3.3Å; E458-T504 PolarHBondContact OE2-N 2.9Å; E458-T504 PolarHBondContact OE2-OG1 3.01Å; V466-T504 HydrophobicContact CG1-CG2 3.78Å; S501-T504 WeakPolarHBondContact CB-OG1 3.47Å; S501-T504 PolarHBondContact O-OG1 2.94Å; V502-T504 VanDerWaalsContact C-N 3.32Å; V502-T504 PolarHBondContact O-N 2.95Å; T504-Q506 VanDerWaalsContact C-N 3.3Å; T504-Q506 PolarHBondContact O-N 3.35Å; T504-A507 PolarHBondContact O-N 3.25Å; T504-A507 VanDerWaalsContact O-N 3.13Å; T504-I508 WeakPolarHBondContact O-CB 3.33Å; T504-I508 WeakPolarHBondContact O-CG1 3.44Å; T504-I508 PolarHBondContact O-N 3.45Å
505	A	88.5	Confident	85.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-56.8	-44.5	176.9	0	0	0	0	0	111.8	A493 C496 E497 S501 V502 A507 I508 I509	A493-A505 HydrophobicContact CB-CB 4.31Å; A493-A505 WeakPolarHBondContact O-CB 3.41Å; C496-A505 HydrophobicContact CB-CB 4.1Å; E497-A505 HydrophobicContact CB-CB 4.39Å; S501-A505 PolarHBondContact O-N 3.02Å; V502-A505 PolarHBondContact O-N 3.41Å; A505-A507 PolarHBondContact O-N 2.84Å; A505-I508 PolarHBondContact O-N 2.9Å; A505-I509 VanDerWaalsContact O-CB 3.31Å; A505-I509 WeakPolarHBondContact O-CB 3.49Å; A505-I509 VanDerWaalsContact O-CG1 3.28Å; A505-I509 WeakPolarHBondContact O-CG1 3.3Å; A505-I509 PolarHBondContact O-N 2.9Å
506	Q	88.4	Confident	85.1	Confident	45 Å²	45	45 Å²	45	21%	0.21	25%	0.254	C	S	.	.	H	α-helix	trans	-63.2	-41.3	176.1	-66.8	-177.6	2.3	0	0	112.6	V502 L503 T504 K510 A544	V502-Q506 HydrophobicContact CG1-CG 4.32Å; V502-Q506 VanDerWaalsContact O-CG 3.29Å; V502-Q506 WeakPolarHBondContact O-CG 3.43Å; V502-Q506 PolarHBondContact O-N 3.25Å; L503-Q506 PolarHBondContact O-N 3.23Å; T504-Q506 VanDerWaalsContact C-N 3.3Å; T504-Q506 PolarHBondContact O-N 3.35Å; Q506-K510 WeakPolarHBondContact O-CB 3.3Å; Q506-K510 WeakPolarHBondContact O-CG 3.47Å; Q506-K510 PolarHBondContact O-N 3.38Å; Q506-A544 HydrophobicContact CB-CB 4.19Å; Q506-A544 HydrophobicContact CG-CB 4.05Å
507	A	87.9	Confident	84.6	Confident	4 Å²	4	46.6 Å²	46.6	3%	0.033	26%	0.262	C	S	.	.	H	α-helix	trans	-67.2	-43.3	179	0	0	0	0	0	112	V466 Q467 V470 L503 T504 A505 I509 K510 A511	V466-A507 HydrophobicContact CG1-CB 3.95Å; Q467-A507 VanDerWaalsContact OE1-CB 3.3Å; V470-A507 HydrophobicContact CG2-CB 4.04Å; L503-A507 WeakPolarHBondContact O-CB 3.33Å; L503-A507 PolarHBondContact O-N 2.68Å; T504-A507 PolarHBondContact O-N 3.25Å; T504-A507 VanDerWaalsContact O-N 3.13Å; A505-A507 PolarHBondContact O-N 2.84Å; A507-I509 VanDerWaalsContact C-N 3.34Å; A507-I509 PolarHBondContact O-N 3.42Å; A507-K510 PolarHBondContact O-N 3.22Å; A507-A511 PolarHBondContact O-N 3.39Å
508	I	89.3	Confident	84	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-55.7	-52.3	174.1	-69.2	167.2	0	0	0	109.4	F451 V470 W489 A493 T504 A505 K510 A511 I512	F451-I508 HydrophobicContact CD1-CD1 3.43Å; F451-I508 VanDerWaalsContact CD1-CD1 3.43Å; F451-I508 HydrophobicContact CD1-CG1 3.79Å; F451-I508 HydrophobicContact CE1-CD1 3.59Å; F451-I508 HydrophobicContact CE1-CG1 3.62Å; F451-I508 HydrophobicContact CE1-CG2 4.21Å; F451-I508 HydrophobicContact CG-CD1 4.02Å; F451-I508 HydrophobicContact CZ-CD1 4.29Å; F451-I508 HydrophobicContact CZ-CG2 4.42Å; V470-I508 HydrophobicContact CG2-CG1 4.24Å; W489-I508 HydrophobicContact CE3-CG2 4.14Å; A493-I508 HydrophobicContact CB-CB 4.29Å; A493-I508 HydrophobicContact CB-CG2 3.92Å; T504-I508 WeakPolarHBondContact O-CB 3.33Å; T504-I508 WeakPolarHBondContact O-CG1 3.44Å; T504-I508 PolarHBondContact O-N 3.45Å; A505-I508 PolarHBondContact O-N 2.9Å; I508-K510 PolarHBondContact O-N 2.92Å; I508-A511 PolarHBondContact O-N 3.19Å; I508-I512 HydrophobicContact CG2-CD1 3.54Å; I508-I512 WeakPolarHBondContact O-CD1 3.29Å; I508-I512 WeakPolarHBondContact O-CG1 3.16Å; I508-I512 PolarHBondContact O-N 2.85Å; I508-I512 VanDerWaalsContact O-N 3.15Å
509	I	89.2	Confident	83.5	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-62.3	-46.9	-178.3	-77.6	175.1	0	0	0	111.6	A493 A505 A507 A511 I512 I513 C541 A544 I545	A493-I509 HydrophobicContact CB-CD1 3.76Å; A493-I509 HydrophobicContact CB-CG1 3.67Å; A505-I509 VanDerWaalsContact O-CB 3.31Å; A505-I509 WeakPolarHBondContact O-CB 3.49Å; A505-I509 VanDerWaalsContact O-CG1 3.28Å; A505-I509 WeakPolarHBondContact O-CG1 3.3Å; A505-I509 PolarHBondContact O-N 2.9Å; A507-I509 VanDerWaalsContact C-N 3.34Å; A507-I509 PolarHBondContact O-N 3.42Å; I509-A511 VanDerWaalsContact C-N 3.26Å; I509-A511 PolarHBondContact O-N 2.94Å; I509-I512 PolarHBondContact O-N 3.01Å; I509-I513 HydrophobicContact CB-CD1 4.37Å; I509-I513 HydrophobicContact CG2-CD1 3.14Å; I509-I513 HydrophobicContact CG2-CG1 3.79Å; I509-I513 VanDerWaalsContact O-CD1 3.29Å; I509-I513 WeakPolarHBondContact O-CD1 3.32Å; I509-I513 WeakPolarHBondContact O-CG1 3.14Å; I509-I513 PolarHBondContact O-N 3.27Å; I509-C541 HydrophobicContact CD1-CB 3.22Å; I509-C541 WeakPolarHBondContact CD1-SG 3.45Å; I509-A544 HydrophobicContact CB-CB 4.32Å; I509-A544 HydrophobicContact CG2-CB 3.75Å; I509-I545 HydrophobicContact CG2-CG1 3.68Å
510	K	87.9	Confident	83.1	Confident	105 Å²	105	55.3 Å²	55.3	46%	0.457	30%	0.296	S	S	.	.	H	α-helix	trans	-57.3	-39	176.8	-77.7	170.6	-176.8	173.8	0	112.7	Q506 A507 I508 V548	Q506-K510 WeakPolarHBondContact O-CB 3.3Å; Q506-K510 WeakPolarHBondContact O-CG 3.47Å; Q506-K510 PolarHBondContact O-N 3.38Å; A507-K510 PolarHBondContact O-N 3.22Å; I508-K510 PolarHBondContact O-N 2.92Å; K510-V548 HydrophobicContact CB-CG2 4.46Å; K510-V548 HydrophobicContact CG-CG2 3.8Å
511	A	84.2	Confident	83.1	Confident	17 Å²	17	50.7 Å²	50.7	14%	0.14	28%	0.28	C	S	.	.	H	α-helix	trans	-65.6	-41.6	176.7	0	0	0	0	0	111	V470 V474 A507 I508 I509 Y515	V470-A511 HydrophobicContact CG1-CB 3.8Å; V474-A511 HydrophobicContact CG2-CB 4.41Å; A507-A511 PolarHBondContact O-N 3.39Å; I508-A511 PolarHBondContact O-N 3.19Å; I509-A511 VanDerWaalsContact C-N 3.26Å; I509-A511 PolarHBondContact O-N 2.94Å; A511-Y515 WeakPolarHBondContact O-CD2 3.31Å; A511-Y515 WeakPolarHBondContact O-CE2 3.27Å
512	I	85.1	Confident	83.2	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-99.7	-27.7	-159	-63.8	151.1	0	0	0	114.6	I484 R486 W489 I508 I509 G514 Y515	I484-I512 HydrophobicContact CG2-CG2 4.42Å; R486-I512 HydrophobicContact CG-CG2 4.39Å; W489-I512 HydrophobicContact CB-CD1 3.42Å; W489-I512 VanDerWaalsContact CB-CD1 3.42Å; W489-I512 HydrophobicContact CB-CG1 4.42Å; W489-I512 HydrophobicContact CB-CG2 4.22Å; W489-I512 HydrophobicContact CD2-CD1 3.36Å; W489-I512 HydrophobicContact CD2-CG1 4.2Å; W489-I512 HydrophobicContact CE3-CD1 2.94Å; W489-I512 HydrophobicContact CE3-CG1 3.96Å; W489-I512 HydrophobicContact CG-CD1 3.63Å; W489-I512 HydrophobicContact CG-CG1 4.47Å; W489-I512 HydrophobicContact CZ3-CD1 3.71Å; W489-I512 HydrophobicContact CZ3-CG1 4.44Å; I508-I512 HydrophobicContact CG2-CD1 3.54Å; I508-I512 WeakPolarHBondContact O-CD1 3.29Å; I508-I512 WeakPolarHBondContact O-CG1 3.16Å; I508-I512 PolarHBondContact O-N 2.85Å; I508-I512 VanDerWaalsContact O-N 3.15Å; I509-I512 PolarHBondContact O-N 3.01Å; I512-G514 PolarHBondContact O-N 2.75Å; I512-Y515 PolarHBondContact O-N 3.38Å
513	I	80	Confident	83.1	Confident	3 Å²	3	52 Å²	52	2%	0.015	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-28.8	-177.9	-73.1	160.4	0	0	0	112.3	R486 I509 W526 I545 V548	R486-I513 VanDerWaalsContact NH1-C 3.32Å; R486-I513 PolarHBondContact NH1-O 3.43Å; I509-I513 HydrophobicContact CB-CD1 4.37Å; I509-I513 HydrophobicContact CG2-CD1 3.14Å; I509-I513 HydrophobicContact CG2-CG1 3.79Å; I509-I513 VanDerWaalsContact O-CD1 3.29Å; I509-I513 WeakPolarHBondContact O-CD1 3.32Å; I509-I513 WeakPolarHBondContact O-CG1 3.14Å; I509-I513 PolarHBondContact O-N 3.27Å; I513-W526 HydrophobicContact CG2-CD2 3.71Å; I513-W526 HydrophobicContact CG2-CG 3.71Å; I513-W526 HydrophobicContact CG2-CZ2 3.85Å; I513-W526 PolarHBondContact O-NE1 3.1Å; I513-I545 HydrophobicContact CD1-CB 4.06Å; I513-I545 HydrophobicContact CD1-CG1 3.7Å; I513-I545 HydrophobicContact CD1-CG2 4.27Å; I513-I545 HydrophobicContact CG1-CG1 4.15Å; I513-V548 HydrophobicContact CB-CG1 4.46Å; I513-V548 HydrophobicContact CD1-CB 4.03Å; I513-V548 HydrophobicContact CD1-CG1 4.26Å; I513-V548 HydrophobicContact CD1-CG2 4.01Å; I513-V548 HydrophobicContact CG2-CG1 4.09Å
514	G	78.7	Confident	83.1	Confident	39 Å²	39	55.5 Å²	55.5	40%	0.402	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-17.5	178.3	0	0	0	0	0	115.5	I512	I512-G514 PolarHBondContact O-N 2.75Å
515	Y	78.6	Confident	83.2	Confident	93 Å²	93	57.1 Å²	57.1	37%	0.365	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	137.2	-173.1	-77.2	-86.1	0	0	0	112.2	V474 I484 A511 I512 L517	V474-Y515 HydrophobicContact CG1-CE2 4.18Å; V474-Y515 WeakPolarHBondContact CG1-OH 3.47Å; I484-Y515 HydrophobicContact CD1-CD1 4.48Å; A511-Y515 WeakPolarHBondContact O-CD2 3.31Å; A511-Y515 WeakPolarHBondContact O-CE2 3.27Å; I512-Y515 PolarHBondContact O-N 3.38Å; Y515-L517 VanDerWaalsContact C-N 3.29Å; Y515-L517 PolarHBondContact O-N 2.82Å
516	G	71.8	Confident	83.3	Confident	87 Å²	87	57.4 Å²	57.4	90%	0.897	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.8	8.1	173.2	0	0	0	0	0	115.7
517	L	76.7	Confident	83.4	Confident	39 Å²	39	55.5 Å²	55.5	20%	0.204	30%	0.297	C	S	.	.			trans	-114.1	132.4	-178.7	-65.6	179.7	0	0	0	112.9	Y515 K522 T525	Y515-L517 VanDerWaalsContact C-N 3.29Å; Y515-L517 PolarHBondContact O-N 2.82Å; L517-K522 HydrophobicContact CB-CG 3.78Å; L517-K522 HydrophobicContact CD1-CG 4.39Å; L517-K522 VanDerWaalsContact O-CE 3.23Å; L517-K522 WeakPolarHBondContact O-CE 3.13Å; L517-T525 HydrophobicContact CD1-CG2 3.88Å; L517-T525 HydrophobicContact CD2-CG2 3.94Å
518	E	76.2	Confident	83.5	Confident	138 Å²	138	57.3 Å²	57.3	65%	0.645	31%	0.309	S	S	*	.			trans	-66.2	145.6	167.3	-63.9	-170.4	-177.2	0	0	111.1	Q520 D521 K522	E518-Q520 PolarHBondContact O-N 2.93Å; E518-D521 PolarHBondContact O-N 3.31Å; E518-D521 VanDerWaalsContact O-N 3.11Å; E518-K522 WeakPolarHBondContact O-CG 3.29Å; E518-K522 PolarHBondContact O-N 3.35Å; E518-K522 VanDerWaalsContact O-N 3.15Å
519	E	76.4	Confident	83.4	Confident	106 Å²	106	58.1 Å²	58.1	50%	0.495	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-32.5	-176	-158.8	72.1	-153	0	0	113.4	K522 H552	E519-K522 IonicContact OE1-NZ 3.43Å; E519-K522 IonicContact OE2-NZ 3.17Å; E519-K522 PolarHBondContact OE2-NZ 3.43Å; E519-H552 IonicContact OE1-CD2 4Å; E519-H552 IonicContact OE1-CE1 3.95Å; E519-H552 PolarHBondContact OE1-CE1 2.86Å; E519-H552 IonicContact OE1-NE2 3.93Å; E519-H552 PolarHBondContact OE1-NE2 3.28Å
520	Q	77.7	Confident	83.4	Confident	170 Å²	170	58 Å²	58	79%	0.794	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-41.1	-177.5	-58.1	-173.3	14.5	0	0	112.3	E518	E518-Q520 PolarHBondContact O-N 2.93Å
521	D	83.9	Confident	83.5	Confident	90 Å²	90	57 Å²	57	48%	0.481	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-19.4	-174.1	-70.5	-20.9	0	0	0	113.5	E518 K523 H524 T525	E518-D521 PolarHBondContact O-N 3.31Å; E518-D521 VanDerWaalsContact O-N 3.11Å; D521-K523 PolarHBondContact O-N 2.81Å; D521-H524 PolarHBondContact O-N 3.48Å; D521-T525 PolarHBondContact O-N 3.09Å; D521-T525 PolarHBondContact O-OG1 3.34Å
522	K	84.2	Confident	83.7	Confident	28 Å²	28	60.1 Å²	60.1	12%	0.122	32%	0.324	C	S	.	.	H	α-helix	trans	-41.4	-48.2	177.2	-81.2	175.6	-168.7	177.9	0	112.6	L517 E518 E519 H524 W526 F553	L517-K522 HydrophobicContact CB-CG 3.78Å; L517-K522 HydrophobicContact CD1-CG 4.39Å; L517-K522 VanDerWaalsContact O-CE 3.23Å; L517-K522 WeakPolarHBondContact O-CE 3.13Å; E518-K522 WeakPolarHBondContact O-CG 3.29Å; E518-K522 PolarHBondContact O-N 3.35Å; E518-K522 VanDerWaalsContact O-N 3.15Å; E519-K522 IonicContact OE1-NZ 3.43Å; E519-K522 IonicContact OE2-NZ 3.17Å; E519-K522 PolarHBondContact OE2-NZ 3.43Å; K522-H524 PolarHBondContact O-N 3.18Å; K522-W526 HydrophobicContact CB-CD2 4.23Å; K522-W526 HydrophobicContact CB-CE3 4.49Å; K522-W526 HydrophobicContact CB-CH2 4.07Å; K522-W526 HydrophobicContact CB-CZ2 3.74Å; K522-W526 HydrophobicContact CB-CZ3 4.4Å; K522-W526 HydrophobicContact CD-CH2 4.04Å; K522-W526 HydrophobicContact CD-CZ2 3.72Å; K522-W526 HydrophobicContact CG-CH2 4.29Å; K522-W526 HydrophobicContact CG-CZ2 3.67Å; K522-W526 VanDerWaalsContact O-CB 3.27Å; K522-W526 WeakPolarHBondContact O-CB 3.31Å; K522-W526 PolarHBondContact O-N 3.32Å; K522-F553 HydrophobicContact CB-CE2 4.31Å; K522-F553 HydrophobicContact CB-CZ 4.49Å
523	K	86.1	Confident	83.8	Confident	63 Å²	63	60.1 Å²	60.1	27%	0.274	32%	0.324	S	S	.	.	H	α-helix	trans	-58.9	-52	-179.7	-178.6	-165.5	179.7	-170.4	0	112.4	D521 L527 F553 K556 S558 I559	D521-K523 PolarHBondContact O-N 2.81Å; K523-L527 HydrophobicContact CG-CD1 4.22Å; K523-L527 VanDerWaalsContact O-CG 3.24Å; K523-L527 WeakPolarHBondContact O-CG 3.49Å; K523-L527 PolarHBondContact O-N 2.85Å; K523-F553 HydrophobicContact CB-CD2 4.48Å; K523-F553 HydrophobicContact CB-CE2 4.04Å; K523-K556 HydrophobicContact CD-CD 3.83Å; K523-S558 WeakPolarHBondContact CE-OG 3.38Å; K523-S558 PolarHBondContact NZ-OG 2.91Å; K523-I559 HydrophobicContact CG-CD1 4.12Å; K523-I559 HydrophobicContact CG-CG1 4.36Å
524	H	87.8	Confident	84.2	Confident	135 Å²	135	60.9 Å²	60.9	63%	0.625	33%	0.331	S	S	*	.	H	α-helix	trans	-67.4	-46.3	-174.2	179.5	-87.7	0	0	0	110.1	D521 K522 L527 S528	D521-H524 PolarHBondContact O-N 3.48Å; K522-H524 PolarHBondContact O-N 3.18Å; H524-L527 PolarHBondContact O-N 3.45Å; H524-S528 PolarHBondContact O-N 3.01Å
525	T	89.2	Confident	84.7	Confident	33 Å²	33	64.7 Å²	64.7	20%	0.202	35%	0.346	C	S	.	.	H	α-helix	trans	-63.3	-44.7	-179.2	-49.9	0	0	0	0	111.8	L517 D521 L527 S528 D529	L517-T525 HydrophobicContact CD1-CG2 3.88Å; L517-T525 HydrophobicContact CD2-CG2 3.94Å; D521-T525 PolarHBondContact O-N 3.09Å; D521-T525 PolarHBondContact O-OG1 3.34Å; T525-L527 VanDerWaalsContact C-N 3.32Å; T525-L527 PolarHBondContact O-N 2.96Å; T525-S528 WeakPolarHBondContact O-CB 3.44Å; T525-S528 PolarHBondContact O-N 3.35Å; T525-D529 WeakPolarHBondContact O-CB 3.45Å; T525-D529 PolarHBondContact O-N 3.03Å
526	W	90.9	Very high	84.9	Confident	6 Å²	6	63 Å²	63	2%	0.023	35%	0.349	C	S	.	.	H	α-helix	trans	-64.5	-36.9	178.9	-61.1	-6.9	0	0	0	112.9	I513 K522 A530 I545 A549 H552 F553	I513-W526 HydrophobicContact CG2-CD2 3.71Å; I513-W526 HydrophobicContact CG2-CG 3.71Å; I513-W526 HydrophobicContact CG2-CZ2 3.85Å; I513-W526 PolarHBondContact O-NE1 3.1Å; K522-W526 HydrophobicContact CB-CD2 4.23Å; K522-W526 HydrophobicContact CB-CE3 4.49Å; K522-W526 HydrophobicContact CB-CH2 4.07Å; K522-W526 HydrophobicContact CB-CZ2 3.74Å; K522-W526 HydrophobicContact CB-CZ3 4.4Å; K522-W526 HydrophobicContact CD-CH2 4.04Å; K522-W526 HydrophobicContact CD-CZ2 3.72Å; K522-W526 HydrophobicContact CG-CH2 4.29Å; K522-W526 HydrophobicContact CG-CZ2 3.67Å; K522-W526 VanDerWaalsContact O-CB 3.27Å; K522-W526 WeakPolarHBondContact O-CB 3.31Å; K522-W526 PolarHBondContact O-N 3.32Å; W526-A530 VanDerWaalsContact O-CB 3.31Å; W526-A530 WeakPolarHBondContact O-CB 3.17Å; W526-A530 PolarHBondContact O-N 2.98Å; W526-I545 HydrophobicContact CB-CG2 4.14Å; W526-I545 VanDerWaalsContact O-CG2 3.31Å; W526-I545 WeakPolarHBondContact O-CG2 3.28Å; W526-A549 HydrophobicContact CB-CB 4.49Å; W526-A549 HydrophobicContact CE3-CB 3.7Å; W526-A549 HydrophobicContact CZ3-CB 4.35Å; W526-H552 HydrophobicContact CH2-CB 3.94Å; W526-H552 AromaticContact CH2-CD2 4Å; W526-H552 AromaticContact CH2-CG 3.83Å; W526-H552 HydrophobicContact CZ3-CB 3.74Å; W526-F553 HydrophobicContact CE3-CD2 4.43Å; W526-F553 HydrophobicContact CE3-CE2 4.26Å; W526-F553 HydrophobicContact CH2-CE2 4.46Å; W526-F553 AromaticContact CZ3-CD2 4Å; W526-F553 HydrophobicContact CZ3-CD2 4Å; W526-F553 AromaticContact CZ3-CE2 3.78Å; W526-F553 HydrophobicContact CZ3-CE2 3.78Å
527	L	89.3	Confident	85.5	Confident	6 Å²	6	61.3 Å²	61.3	3%	0.031	33%	0.33	C	S	.	.	H	α-helix	trans	-68.6	-40.4	175.5	-69.9	176.4	0	0	0	111.6	K523 H524 T525 A530 E531 Y546 I559 R562	K523-L527 HydrophobicContact CG-CD1 4.22Å; K523-L527 VanDerWaalsContact O-CG 3.24Å; K523-L527 WeakPolarHBondContact O-CG 3.49Å; K523-L527 PolarHBondContact O-N 2.85Å; H524-L527 PolarHBondContact O-N 3.45Å; T525-L527 VanDerWaalsContact C-N 3.32Å; T525-L527 PolarHBondContact O-N 2.96Å; L527-A530 PolarHBondContact O-N 3.07Å; L527-E531 WeakPolarHBondContact O-CB 3.38Å; L527-E531 WeakPolarHBondContact O-CG 3.49Å; L527-E531 PolarHBondContact O-N 3.07Å; L527-Y546 HydrophobicContact CD2-CE1 3.92Å; L527-I559 HydrophobicContact CD1-CG1 4.27Å; L527-I559 HydrophobicContact CD2-CB 4.44Å; L527-I559 HydrophobicContact CD2-CG1 4.27Å; L527-I559 HydrophobicContact CD2-CG2 4.13Å; L527-R562 HydrophobicContact CD2-CB 4.37Å
528	S	89.5	Confident	85.9	Confident	42 Å²	42	59.6 Å²	59.6	29%	0.294	32%	0.322	S	S	.	.	H	α-helix	trans	-62.5	-43.6	174.3	-170.6	0	0	0	0	111.5	H524 T525 E531 N532	H524-S528 PolarHBondContact O-N 3.01Å; T525-S528 WeakPolarHBondContact O-CB 3.44Å; T525-S528 PolarHBondContact O-N 3.35Å; S528-E531 PolarHBondContact O-N 3.38Å; S528-N532 WeakPolarHBondContact O-CB 3.35Å; S528-N532 PolarHBondContact O-N 2.88Å; S528-N532 PolarHBondContact O-ND2 2.76Å
529	D	88.4	Confident	86.5	Confident	17 Å²	17	55.2 Å²	55.2	9%	0.091	30%	0.303	C	S	.	.	H	α-helix	trans	-68.8	-38.3	179.7	-67.2	-21.1	0	0	0	111.9	R486 I490 T525 E531 N532 C533 I545	R486-D529 IonicContact CZ-OD2 2.74Å; R486-D529 IonicContact NE-OD2 2.71Å; R486-D529 PolarHBondContact NE-OD2 3.05Å; R486-D529 IonicContact NH2-OD2 3.74Å; R486-D529 PolarHBondContact NH2-OD2 2.91Å; I490-D529 HydrophobicContact CD1-CB 4.42Å; T525-D529 WeakPolarHBondContact O-CB 3.45Å; T525-D529 PolarHBondContact O-N 3.03Å; D529-E531 VanDerWaalsContact C-N 3.32Å; D529-E531 PolarHBondContact O-N 2.9Å; D529-N532 PolarHBondContact O-N 2.98Å; D529-C533 WeakPolarHBondContact O-CB 3.36Å; D529-C533 PolarHBondContact O-N 3.3Å; D529-C533 PolarHBondContact O-SG 3.49Å; D529-I545 HydrophobicContact CB-CD1 4.33Å
530	A	89.2	Confident	87	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.6	-39.9	174	0	0	0	0	0	111.7	W526 L527 A534 I545 Y546	W526-A530 VanDerWaalsContact O-CB 3.31Å; W526-A530 WeakPolarHBondContact O-CB 3.17Å; W526-A530 PolarHBondContact O-N 2.98Å; L527-A530 PolarHBondContact O-N 3.07Å; A530-A534 VanDerWaalsContact O-CB 3.29Å; A530-A534 WeakPolarHBondContact O-CB 3.49Å; A530-A534 PolarHBondContact O-N 3.39Å; A530-I545 HydrophobicContact CB-CB 4.18Å; A530-I545 HydrophobicContact CB-CG2 3.87Å; A530-Y546 HydrophobicContact CB-CD1 4.4Å; A530-Y546 HydrophobicContact CB-CD2 4.28Å; A530-Y546 HydrophobicContact CB-CE1 3.92Å; A530-Y546 HydrophobicContact CB-CE2 3.76Å
531	E	89.3	Confident	87.5	Confident	83 Å²	83	44.7 Å²	44.7	39%	0.388	25%	0.253	S	S	.	.	H	α-helix	trans	-64.8	-43.3	173.4	-75	169.4	-162.2	0	0	111.2	L527 S528 D529 A534 T535 R562	L527-E531 WeakPolarHBondContact O-CB 3.38Å; L527-E531 WeakPolarHBondContact O-CG 3.49Å; L527-E531 PolarHBondContact O-N 3.07Å; S528-E531 PolarHBondContact O-N 3.38Å; D529-E531 VanDerWaalsContact C-N 3.32Å; D529-E531 PolarHBondContact O-N 2.9Å; E531-A534 WeakPolarHBondContact O-CB 3.47Å; E531-A534 PolarHBondContact O-N 3.2Å; E531-T535 WeakPolarHBondContact O-CG2 3.47Å; E531-T535 PolarHBondContact O-N 3.31Å; E531-T535 PolarHBondContact O-OG1 3.24Å; E531-R562 WeakPolarHBondContact OE1-CD 3.43Å; E531-R562 IonicContact OE1-CZ 3.89Å; E531-R562 VanDerWaalsContact OE1-CZ 3.3Å; E531-R562 IonicContact OE1-NE 3.7Å; E531-R562 IonicContact OE1-NH1 3.87Å; E531-R562 PolarHBondContact OE1-NH1 3.39Å; E531-R562 IonicContact OE2-NH1 3.01Å
532	N	89.4	Confident	87.8	Confident	83 Å²	83	40.4 Å²	40.4	44%	0.444	23%	0.23	S	C	.	.	H	α-helix	trans	-61.2	-50.9	176	-70.2	-22	0	0	0	111.6	S528 D529 A534 T535 S536	S528-N532 WeakPolarHBondContact O-CB 3.35Å; S528-N532 PolarHBondContact O-N 2.88Å; S528-N532 PolarHBondContact O-ND2 2.76Å; D529-N532 PolarHBondContact O-N 2.98Å; N532-A534 VanDerWaalsContact C-N 3.28Å; N532-A534 PolarHBondContact O-N 3.36Å; N532-T535 WeakPolarHBondContact CA-OG1 3.16Å; N532-T535 PolarHBondContact O-N 2.85Å; N532-T535 PolarHBondContact O-OG1 2.95Å; N532-S536 PolarHBondContact O-N 2.69Å; N532-S536 PolarHBondContact O-OG 2.84Å
533	C	87.3	Confident	88.1	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.007	23%	0.233	C	C	.	.	H	α-helix	trans	-58	-40.4	176	-69.9	0	0	0	0	111.9	I490 D529 T535 S536 G537 A538 C541 A542 I545	I490-C533 VanDerWaalsContact CG2-SG 3.59Å; D529-C533 WeakPolarHBondContact O-CB 3.36Å; D529-C533 PolarHBondContact O-N 3.3Å; D529-C533 PolarHBondContact O-SG 3.49Å; C533-T535 VanDerWaalsContact C-N 3.34Å; C533-T535 PolarHBondContact O-N 2.91Å; C533-S536 PolarHBondContact O-N 2.89Å; C533-G537 PolarHBondContact O-N 2.94Å; C533-G537 VanDerWaalsContact O-N 3.14Å; C533-A538 HydrophobicContact CB-CB 4.46Å; C533-A538 PolarHBondContact O-N 3.18Å; C533-C541 HydrophobicContact CB-CB 4.46Å; C533-A542 HydrophobicContact CB-CB 4.13Å; C533-I545 HydrophobicContact CB-CD1 4.36Å
534	A	88	Confident	88.2	Confident	20 Å²	20	38.4 Å²	38.4	17%	0.165	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-39.3	175.8	0	0	0	0	0	112	A530 E531 N532 G537 F566	A530-A534 VanDerWaalsContact O-CB 3.29Å; A530-A534 WeakPolarHBondContact O-CB 3.49Å; A530-A534 PolarHBondContact O-N 3.39Å; E531-A534 WeakPolarHBondContact O-CB 3.47Å; E531-A534 PolarHBondContact O-N 3.2Å; N532-A534 VanDerWaalsContact C-N 3.28Å; N532-A534 PolarHBondContact O-N 3.36Å; A534-G537 PolarHBondContact O-N 3.13Å; A534-F566 HydrophobicContact CB-CD2 4Å; A534-F566 HydrophobicContact CB-CE2 3.67Å
535	T	88.1	Confident	88.3	Confident	118 Å²	118	32 Å²	32	72%	0.724	19%	0.192	S	C	*	.	H	α-helix	trans	-70	-32.3	174.4	61	0	0	0	0	113.2	E531 N532 C533 G537	E531-T535 WeakPolarHBondContact O-CG2 3.47Å; E531-T535 PolarHBondContact O-N 3.31Å; E531-T535 PolarHBondContact O-OG1 3.24Å; N532-T535 WeakPolarHBondContact CA-OG1 3.16Å; N532-T535 PolarHBondContact O-N 2.85Å; N532-T535 PolarHBondContact O-OG1 2.95Å; C533-T535 VanDerWaalsContact C-N 3.34Å; C533-T535 PolarHBondContact O-N 2.91Å; T535-G537 PolarHBondContact O-N 3.28Å
536	S	84.5	Confident	88.4	Confident	59 Å²	59	31.1 Å²	31.1	41%	0.413	19%	0.185	S	C	.	.	H	α-helix	trans	-71	-13.3	173.5	-61	0	0	0	0	113.5	E494 N532 C533	E494-S536 WeakPolarHBondContact OE1-CB 3.48Å; E494-S536 PolarHBondContact OE1-OG 3.38Å; N532-S536 PolarHBondContact O-N 2.69Å; N532-S536 PolarHBondContact O-OG 2.84Å; C533-S536 PolarHBondContact O-N 2.89Å
537	G	83.6	Confident	88.3	Confident	50 Å²	50	33.4 Å²	33.4	52%	0.515	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	88	9.5	-177.3	0	0	0	0	0	114.9	C533 A534 T535 I539	C533-G537 PolarHBondContact O-N 2.94Å; C533-G537 VanDerWaalsContact O-N 3.14Å; A534-G537 PolarHBondContact O-N 3.13Å; T535-G537 PolarHBondContact O-N 3.28Å; G537-I539 PolarHBondContact O-N 3.5Å
538	A	85.7	Confident	88.3	Confident	4 Å²	4	34.7 Å²	34.7	3%	0.033	21%	0.213	C	C	.	.			trans	-91.4	86.5	177.2	0	0	0	0	0	110	E494 E497 C533 C541 A542	E494-A538 HydrophobicContact CB-CB 4.13Å; E494-A538 HydrophobicContact CG-CB 3.69Å; E497-A538 VanDerWaalsContact OE2-C 3.24Å; E497-A538 VanDerWaalsContact OE2-CA 3.25Å; E497-A538 WeakPolarHBondContact OE2-CA 3.31Å; E497-A538 WeakPolarHBondContact OE2-CB 3.42Å; C533-A538 HydrophobicContact CB-CB 4.46Å; C533-A538 PolarHBondContact O-N 3.18Å; A538-C541 HydrophobicContact CB-CB 3.87Å; A538-A542 PolarHBondContact O-N 3.32Å
539	I	88.7	Confident	88.3	Confident	46 Å²	46	32.9 Å²	32.9	24%	0.236	20%	0.2	C	C	.	.	H	α-helix	trans	-76.7	-43.8	-171.1	-60.1	169.5	0	0	0	109.8	E497 G537 C541 A542 R543 F566 H570	E497-I539 PolarHBondContact OE1-N 3.5Å; E497-I539 PolarHBondContact OE2-N 3.12Å; G537-I539 PolarHBondContact O-N 3.5Å; I539-C541 VanDerWaalsContact C-N 3.34Å; I539-A542 PolarHBondContact O-N 3.02Å; I539-R543 WeakPolarHBondContact O-CG 3.39Å; I539-R543 PolarHBondContact O-N 3.46Å; I539-F566 HydrophobicContact CB-CZ 4.39Å; I539-F566 HydrophobicContact CG2-CE1 4.24Å; I539-F566 HydrophobicContact CG2-CZ 3.68Å; I539-F566 WeakPolarHBondContact O-CZ 3.29Å; I539-H570 HydrophobicContact CD1-CB 4.19Å; I539-H570 HydrophobicContact CG1-CB 4.39Å; I539-H570 HydrophobicContact CG2-CB 3.82Å
540	E	87.1	Confident	88.3	Confident	54 Å²	54	32.7 Å²	32.7	25%	0.252	20%	0.199	S	C	.	.	H	α-helix	trans	-70	-35	-178.8	-56.2	-60	163	0	0	111.6	E497 V502 R543 A544	E497-E540 HydrophobicContact CG-CB 4.34Å; E497-E540 HydrophobicContact CG-CG 4.49Å; E497-E540 PolarHBondContact OE1-N 3.3Å; E497-E540 PolarHBondContact OE2-N 3.04Å; V502-E540 HydrophobicContact CG1-CB 3.7Å; V502-E540 HydrophobicContact CG1-CG 3.69Å; V502-E540 HydrophobicContact CG2-CG 4.35Å; E540-R543 WeakPolarHBondContact O-CB 3.39Å; E540-R543 PolarHBondContact O-N 2.82Å; E540-R543 IonicContact OE1-CZ 3.25Å; E540-R543 IonicContact OE1-NH1 3.22Å; E540-R543 PolarHBondContact OE1-NH1 3.2Å; E540-R543 IonicContact OE2-CZ 2.81Å; E540-R543 IonicContact OE2-NH1 3.92Å; E540-R543 PolarHBondContact OE2-NH1 2.95Å; E540-A544 PolarHBondContact O-N 3.49Å
541	C	87.5	Confident	88.3	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-58.1	-49.5	169.9	-69.3	0	0	0	0	111.4	E497 I509 C533 A538 I539 R543 A544 I545	E497-C541 WeakPolarHBondContact OE2-CB 3.34Å; E497-C541 PolarHBondContact OE2-N 3.12Å; E497-C541 PolarHBondContact OE2-SG 2.79Å; I509-C541 HydrophobicContact CD1-CB 3.22Å; I509-C541 WeakPolarHBondContact CD1-SG 3.45Å; C533-C541 HydrophobicContact CB-CB 4.46Å; A538-C541 HydrophobicContact CB-CB 3.87Å; I539-C541 VanDerWaalsContact C-N 3.34Å; C541-R543 VanDerWaalsContact C-N 3.33Å; C541-R543 PolarHBondContact O-N 3.31Å; C541-A544 PolarHBondContact O-N 3.44Å; C541-I545 WeakPolarHBondContact O-CG1 3.32Å; C541-I545 PolarHBondContact O-N 2.94Å
542	A	90.2	Very high	88.2	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.9	-39.6	176.7	0	0	0	0	0	112	C533 A538 I539 A544 I545 Y546 F566	C533-A542 HydrophobicContact CB-CB 4.13Å; A538-A542 PolarHBondContact O-N 3.32Å; I539-A542 PolarHBondContact O-N 3.02Å; A542-A544 PolarHBondContact O-N 3.49Å; A542-I545 PolarHBondContact O-N 2.73Å; A542-Y546 WeakPolarHBondContact O-CD2 3.23Å; A542-Y546 PolarHBondContact O-N 3.44Å; A542-F566 HydrophobicContact CB-CE1 4.36Å; A542-F566 HydrophobicContact CB-CE2 3.68Å; A542-F566 HydrophobicContact CB-CZ 3.55Å
543	R	89.8	Confident	88.1	Confident	46 Å²	46	34 Å²	34	17%	0.174	22%	0.216	C	C	.	.	H	α-helix	trans	-59.6	-43.7	173.1	-73.7	-170.8	-177.8	121.1	8.3	112.5	I539 E540 C541 I545 Y546 A547 F566 E567 H570	I539-R543 WeakPolarHBondContact O-CG 3.39Å; I539-R543 PolarHBondContact O-N 3.46Å; E540-R543 WeakPolarHBondContact O-CB 3.39Å; E540-R543 PolarHBondContact O-N 2.82Å; E540-R543 IonicContact OE1-CZ 3.25Å; E540-R543 IonicContact OE1-NH1 3.22Å; E540-R543 PolarHBondContact OE1-NH1 3.2Å; E540-R543 IonicContact OE2-CZ 2.81Å; E540-R543 IonicContact OE2-NH1 3.92Å; E540-R543 PolarHBondContact OE2-NH1 2.95Å; C541-R543 VanDerWaalsContact C-N 3.33Å; C541-R543 PolarHBondContact O-N 3.31Å; R543-I545 VanDerWaalsContact C-N 3.35Å; R543-Y546 PolarHBondContact O-N 2.83Å; R543-A547 WeakPolarHBondContact O-CB 3.34Å; R543-A547 PolarHBondContact O-N 3.28Å; R543-F566 HydrophobicContact CG-CE1 3.67Å; R543-F566 HydrophobicContact CG-CZ 4.37Å; R543-E567 VanDerWaalsContact CD-OE1 3.31Å; R543-E567 WeakPolarHBondContact CD-OE1 3.48Å; R543-E567 VanDerWaalsContact CG-OE1 3.29Å; R543-E567 WeakPolarHBondContact CG-OE1 3.26Å; R543-E567 IonicContact CZ-OE1 3.61Å; R543-E567 IonicContact CZ-OE2 3.99Å; R543-E567 IonicContact NE-OE1 3.82Å; R543-E567 PolarHBondContact NE-OE1 3.48Å; R543-E567 IonicContact NE-OE2 3.55Å; R543-E567 PolarHBondContact NE-OE2 3Å; R543-E567 IonicContact NH2-OE2 3.99Å; R543-E567 PolarHBondContact NH2-OE2 3.37Å; R543-H570 PolarHBondContact NH2-O 3.19Å
544	A	89.1	Confident	88	Confident	4 Å²	4	36 Å²	36	3%	0.033	23%	0.229	C	C	.	.	H	α-helix	trans	-63.2	-41	175.9	0	0	0	0	0	111.9	Q506 I509 E540 C541 A542 A547 V548	Q506-A544 HydrophobicContact CB-CB 4.19Å; Q506-A544 HydrophobicContact CG-CB 4.05Å; I509-A544 HydrophobicContact CB-CB 4.32Å; I509-A544 HydrophobicContact CG2-CB 3.75Å; E540-A544 PolarHBondContact O-N 3.49Å; C541-A544 PolarHBondContact O-N 3.44Å; A542-A544 PolarHBondContact O-N 3.49Å; A544-A547 PolarHBondContact O-N 3.05Å; A544-V548 WeakPolarHBondContact O-CG2 3.37Å; A544-V548 PolarHBondContact O-N 2.87Å
545	I	90.5	Very high	87.7	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-61.4	-47.1	174.6	-61.1	161.7	0	0	0	110.8	I509 I513 W526 D529 A530 C533 C541 A542 R543 A547 V548 A549	I509-I545 HydrophobicContact CG2-CG1 3.68Å; I513-I545 HydrophobicContact CD1-CB 4.06Å; I513-I545 HydrophobicContact CD1-CG1 3.7Å; I513-I545 HydrophobicContact CD1-CG2 4.27Å; I513-I545 HydrophobicContact CG1-CG1 4.15Å; W526-I545 HydrophobicContact CB-CG2 4.14Å; W526-I545 VanDerWaalsContact O-CG2 3.31Å; W526-I545 WeakPolarHBondContact O-CG2 3.28Å; D529-I545 HydrophobicContact CB-CD1 4.33Å; A530-I545 HydrophobicContact CB-CB 4.18Å; A530-I545 HydrophobicContact CB-CG2 3.87Å; C533-I545 HydrophobicContact CB-CD1 4.36Å; C541-I545 WeakPolarHBondContact O-CG1 3.32Å; C541-I545 PolarHBondContact O-N 2.94Å; A542-I545 PolarHBondContact O-N 2.73Å; R543-I545 VanDerWaalsContact C-N 3.35Å; I545-A547 PolarHBondContact O-N 2.63Å; I545-V548 PolarHBondContact O-N 3.37Å; I545-A549 VanDerWaalsContact O-CB 3.3Å; I545-A549 WeakPolarHBondContact O-CB 3.25Å; I545-A549 PolarHBondContact O-N 2.94Å
546	Y	90.4	Very high	87.6	Confident	14 Å²	14	37.8 Å²	37.8	6%	0.055	23%	0.233	C	C	.	.	H	α-helix	trans	-62.3	-42.4	176.3	-75.2	-58	0	0	0	112.1	L527 A530 A542 R543 V548 A549 L550 R562 A563 F566	L527-Y546 HydrophobicContact CD2-CE1 3.92Å; A530-Y546 HydrophobicContact CB-CD1 4.4Å; A530-Y546 HydrophobicContact CB-CD2 4.28Å; A530-Y546 HydrophobicContact CB-CE1 3.92Å; A530-Y546 HydrophobicContact CB-CE2 3.76Å; A542-Y546 WeakPolarHBondContact O-CD2 3.23Å; A542-Y546 PolarHBondContact O-N 3.44Å; R543-Y546 PolarHBondContact O-N 2.83Å; Y546-V548 PolarHBondContact O-N 3.23Å; Y546-A549 PolarHBondContact O-N 3.34Å; Y546-L550 VanDerWaalsContact O-CB 3.29Å; Y546-L550 WeakPolarHBondContact O-CB 3.26Å; Y546-L550 WeakPolarHBondContact O-CG 3.3Å; Y546-L550 PolarHBondContact O-N 2.81Å; Y546-R562 HydrophobicContact CE1-CB 4.2Å; Y546-A563 HydrophobicContact CD1-CB 3.83Å; Y546-A563 HydrophobicContact CE1-CB 4.32Å; Y546-A563 HydrophobicContact CG-CB 3.97Å; Y546-F566 HydrophobicContact CD2-CB 4.5Å; Y546-F566 AromaticContact CD2-CD1 3.93Å; Y546-F566 HydrophobicContact CD2-CD1 3.93Å; Y546-F566 HydrophobicContact CD2-CE1 4.38Å; Y546-F566 HydrophobicContact CD2-CG 4.14Å; Y546-F566 HydrophobicContact CE2-CB 3.76Å; Y546-F566 AromaticContact CE2-CD1 3.83Å; Y546-F566 HydrophobicContact CE2-CD1 3.83Å; Y546-F566 AromaticContact CE2-CD2 3.94Å; Y546-F566 HydrophobicContact CE2-CD2 3.94Å; Y546-F566 HydrophobicContact CE2-CE1 4.43Å; Y546-F566 AromaticContact CE2-CG 3.54Å; Y546-F566 HydrophobicContact CE2-CG 3.54Å
547	A	89.7	Confident	87.7	Confident	53 Å²	53	41.8 Å²	41.8	44%	0.438	24%	0.243	S	C	.	.	H	α-helix	trans	-60.4	-43.9	177.9	0	0	0	0	0	112	R543 A544 I545 A551	R543-A547 WeakPolarHBondContact O-CB 3.34Å; R543-A547 PolarHBondContact O-N 3.28Å; A544-A547 PolarHBondContact O-N 3.05Å; I545-A547 PolarHBondContact O-N 2.63Å; A547-A551 WeakPolarHBondContact O-CB 3.23Å; A547-A551 PolarHBondContact O-N 3.45Å
548	V	88.2	Confident	87.9	Confident	34 Å²	34	41 Å²	41	21%	0.206	23%	0.23	C	C	.	.	H	α-helix	trans	-64.8	-45	174.8	173.3	0	0	0	0	110.9	K510 I513 A544 I545 Y546 L550 A551 H552	K510-V548 HydrophobicContact CB-CG2 4.46Å; K510-V548 HydrophobicContact CG-CG2 3.8Å; I513-V548 HydrophobicContact CB-CG1 4.46Å; I513-V548 HydrophobicContact CD1-CB 4.03Å; I513-V548 HydrophobicContact CD1-CG1 4.26Å; I513-V548 HydrophobicContact CD1-CG2 4.01Å; I513-V548 HydrophobicContact CG2-CG1 4.09Å; A544-V548 WeakPolarHBondContact O-CG2 3.37Å; A544-V548 PolarHBondContact O-N 2.87Å; I545-V548 PolarHBondContact O-N 3.37Å; Y546-V548 PolarHBondContact O-N 3.23Å; V548-L550 VanDerWaalsContact C-N 3.33Å; V548-L550 PolarHBondContact O-N 3.47Å; V548-A551 PolarHBondContact O-N 3.28Å; V548-H552 PolarHBondContact O-N 2.9Å; V548-H552 VanDerWaalsContact O-N 3.09Å
549	A	89.2	Confident	88.1	Confident	3 Å²	3	40.9 Å²	40.9	3%	0.025	23%	0.228	C	C	.	.	H	α-helix	trans	-63.2	-38.1	179.9	0	0	0	0	0	112.9	W526 I545 Y546 F553 I559	W526-A549 HydrophobicContact CB-CB 4.49Å; W526-A549 HydrophobicContact CE3-CB 3.7Å; W526-A549 HydrophobicContact CZ3-CB 4.35Å; I545-A549 VanDerWaalsContact O-CB 3.3Å; I545-A549 WeakPolarHBondContact O-CB 3.25Å; I545-A549 PolarHBondContact O-N 2.94Å; Y546-A549 PolarHBondContact O-N 3.34Å; A549-F553 PolarHBondContact O-N 3.44Å; A549-I559 HydrophobicContact CB-CG2 4.09Å
550	L	89.1	Confident	88.2	Confident	14 Å²	14	38.9 Å²	38.9	7%	0.073	22%	0.218	C	C	.	.	H	α-helix	trans	-73.4	-37.2	178.5	-70.1	171.8	0	0	0	112.2	Y546 V548 H552 F553 P554 I559 W560 A563 L579	Y546-L550 VanDerWaalsContact O-CB 3.29Å; Y546-L550 WeakPolarHBondContact O-CB 3.26Å; Y546-L550 WeakPolarHBondContact O-CG 3.3Å; Y546-L550 PolarHBondContact O-N 2.81Å; V548-L550 VanDerWaalsContact C-N 3.33Å; V548-L550 PolarHBondContact O-N 3.47Å; L550-H552 VanDerWaalsContact C-N 3.33Å; L550-F553 CarbonylContact O-C 3.56Å; L550-P554 WeakPolarHBondContact O-CA 3.43Å; L550-I559 HydrophobicContact CD2-CB 4.19Å; L550-I559 HydrophobicContact CD2-CG2 3.6Å; L550-I559 HydrophobicContact CG-CG2 4.08Å; L550-W560 HydrophobicContact CB-CH2 4.5Å; L550-W560 HydrophobicContact CD1-CE3 4.04Å; L550-W560 HydrophobicContact CD1-CH2 4.21Å; L550-W560 HydrophobicContact CD1-CZ3 3.84Å; L550-W560 HydrophobicContact CD2-CD2 3.41Å; L550-W560 VanDerWaalsContact CD2-CD2 3.41Å; L550-W560 HydrophobicContact CD2-CE3 3.67Å; L550-W560 HydrophobicContact CD2-CG 3.86Å; L550-W560 HydrophobicContact CD2-CH2 4.13Å; L550-W560 HydrophobicContact CD2-CZ2 3.88Å; L550-W560 HydrophobicContact CD2-CZ3 4.04Å; L550-W560 HydrophobicContact CG-CE3 4.48Å; L550-W560 HydrophobicContact CG-CZ3 4.47Å; L550-A563 HydrophobicContact CD1-CB 4.25Å; L550-L579 HydrophobicContact CD1-CD1 3.63Å
551	A	88.6	Confident	88.3	Confident	83 Å²	83	38 Å²	38	69%	0.686	21%	0.214	S	C	*	.	H	α-helix	trans	-63.7	-39.2	174	0	0	0	0	0	111.9	A547 V548	A547-A551 WeakPolarHBondContact O-CB 3.23Å; A547-A551 PolarHBondContact O-N 3.45Å; V548-A551 PolarHBondContact O-N 3.28Å
552	H	87.6	Confident	88.3	Confident	81 Å²	81	42.5 Å²	42.5	38%	0.375	23%	0.231	S	C	.	.	H	α-helix	trans	-78.6	-35.7	180	-159.7	81.6	0	0	0	113.2	E519 W526 V548 L550	E519-H552 IonicContact OE1-CD2 4Å; E519-H552 IonicContact OE1-CE1 3.95Å; E519-H552 PolarHBondContact OE1-CE1 2.86Å; E519-H552 IonicContact OE1-NE2 3.93Å; E519-H552 PolarHBondContact OE1-NE2 3.28Å; W526-H552 HydrophobicContact CH2-CB 3.94Å; W526-H552 AromaticContact CH2-CD2 4Å; W526-H552 AromaticContact CH2-CG 3.83Å; W526-H552 HydrophobicContact CZ3-CB 3.74Å; V548-H552 PolarHBondContact O-N 2.9Å; V548-H552 VanDerWaalsContact O-N 3.09Å; L550-H552 VanDerWaalsContact C-N 3.33Å
553	F	86.4	Confident	88.3	Confident	28 Å²	28	42.6 Å²	42.6	12%	0.123	23%	0.232	C	C	.	.			trans	-127.1	69.2	-177.3	-61.2	-62.5	0	0	0	113	K522 K523 W526 A549 L550 T555 K556 I559	K522-F553 HydrophobicContact CB-CE2 4.31Å; K522-F553 HydrophobicContact CB-CZ 4.49Å; K523-F553 HydrophobicContact CB-CD2 4.48Å; K523-F553 HydrophobicContact CB-CE2 4.04Å; W526-F553 HydrophobicContact CE3-CD2 4.43Å; W526-F553 HydrophobicContact CE3-CE2 4.26Å; W526-F553 HydrophobicContact CH2-CE2 4.46Å; W526-F553 AromaticContact CZ3-CD2 4Å; W526-F553 HydrophobicContact CZ3-CD2 4Å; W526-F553 AromaticContact CZ3-CE2 3.78Å; W526-F553 HydrophobicContact CZ3-CE2 3.78Å; A549-F553 PolarHBondContact O-N 3.44Å; L550-F553 CarbonylContact O-C 3.56Å; F553-T555 VanDerWaalsContact C-N 3.26Å; F553-T555 PolarHBondContact O-N 3.35Å; F553-K556 HydrophobicContact CB-CD 3.94Å; F553-K556 HydrophobicContact CB-CG 4.26Å; F553-K556 HydrophobicContact CD1-CD 4.21Å; F553-K556 HydrophobicContact CG-CD 4.07Å; F553-K556 PolarHBondContact O-N 2.89Å; F553-I559 HydrophobicContact CB-CD1 3.69Å; F553-I559 HydrophobicContact CD2-CD1 4.04Å; F553-I559 HydrophobicContact CG-CD1 4.28Å
554	P	85.5	Confident	88.2	Confident	43 Å²	43	40.4 Å²	40.4	28%	0.279	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-23.7	-174.9	25	-34.2	0	0	0	113.9	L550 W560 H586 C587	L550-P554 WeakPolarHBondContact O-CA 3.43Å; P554-W560 PolarHBondContact O-NE1 2.82Å; P554-H586 HydrophobicContact CB-CB 4.36Å; P554-H586 WeakPolarHBondContact O-CB 3.24Å; P554-C587 PolarHBondContact O-SG 3.45Å
555	T	83.4	Confident	88.1	Confident	111 Å²	111	45 Å²	45	68%	0.681	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-7.1	-172.9	57	0	0	0	0	114.7	F553 K557 C587	F553-T555 VanDerWaalsContact C-N 3.26Å; F553-T555 PolarHBondContact O-N 3.35Å; T555-K557 PolarHBondContact O-N 2.69Å; T555-C587 PolarHBondContact O-SG 3.34Å
556	K	85.1	Confident	88	Confident	66 Å²	66	45.5 Å²	45.5	29%	0.287	24%	0.244	S	C	.	.			trans	-92.3	107.2	-170.9	-67.4	-176	-175.2	165.7	0	112.1	K523 F553 S558 I559	K523-K556 HydrophobicContact CD-CD 3.83Å; F553-K556 HydrophobicContact CB-CD 3.94Å; F553-K556 HydrophobicContact CB-CG 4.26Å; F553-K556 HydrophobicContact CD1-CD 4.21Å; F553-K556 HydrophobicContact CG-CD 4.07Å; F553-K556 PolarHBondContact O-N 2.89Å; K556-S558 PolarHBondContact O-N 3.02Å; K556-S558 VanDerWaalsContact O-N 3.09Å; K556-I559 HydrophobicContact CB-CD1 4.07Å; K556-I559 HydrophobicContact CB-CG1 4.29Å; K556-I559 HydrophobicContact CD-CD1 4.25Å; K556-I559 PolarHBondContact O-N 3.26Å
557	K	87	Confident	87.8	Confident	143 Å²	143	45.8 Å²	45.8	62%	0.622	25%	0.245	S	C	*	.	H	α-helix	trans	-51.8	-34.6	177.9	72	-180	-179.1	-178.6	0	115.3	T555 I559 W560 L561 A590	T555-K557 PolarHBondContact O-N 2.69Å; K557-I559 VanDerWaalsContact C-N 3.34Å; K557-I559 PolarHBondContact O-N 3.09Å; K557-W560 PolarHBondContact O-N 3.36Å; K557-L561 WeakPolarHBondContact O-CB 3.42Å; K557-L561 WeakPolarHBondContact O-CG 3.49Å; K557-L561 PolarHBondContact O-N 3.41Å; K557-A590 HydrophobicContact CB-CB 4.17Å
558	S	87.7	Confident	87.6	Confident	34 Å²	34	49.9 Å²	49.9	24%	0.238	25%	0.25	C	C	.	.	H	α-helix	trans	-67.1	-34.6	-174.6	63.1	0	0	0	0	113	K523 K556 R562	K523-S558 WeakPolarHBondContact CE-OG 3.38Å; K523-S558 PolarHBondContact NZ-OG 2.91Å; K556-S558 PolarHBondContact O-N 3.02Å; K556-S558 VanDerWaalsContact O-N 3.09Å; S558-R562 WeakPolarHBondContact O-CG 3.49Å; S558-R562 PolarHBondContact O-N 3.06Å; S558-R562 VanDerWaalsContact O-N 3.15Å
559	I	89.3	Confident	87.4	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-73.2	-47.1	-179.5	-55.5	173.3	0	0	0	108.7	K523 L527 A549 L550 F553 K556 K557 L561 R562 A563	K523-I559 HydrophobicContact CG-CD1 4.12Å; K523-I559 HydrophobicContact CG-CG1 4.36Å; L527-I559 HydrophobicContact CD1-CG1 4.27Å; L527-I559 HydrophobicContact CD2-CB 4.44Å; L527-I559 HydrophobicContact CD2-CG1 4.27Å; L527-I559 HydrophobicContact CD2-CG2 4.13Å; A549-I559 HydrophobicContact CB-CG2 4.09Å; L550-I559 HydrophobicContact CD2-CB 4.19Å; L550-I559 HydrophobicContact CD2-CG2 3.6Å; L550-I559 HydrophobicContact CG-CG2 4.08Å; F553-I559 HydrophobicContact CB-CD1 3.69Å; F553-I559 HydrophobicContact CD2-CD1 4.04Å; F553-I559 HydrophobicContact CG-CD1 4.28Å; K556-I559 HydrophobicContact CB-CD1 4.07Å; K556-I559 HydrophobicContact CB-CG1 4.29Å; K556-I559 HydrophobicContact CD-CD1 4.25Å; K556-I559 PolarHBondContact O-N 3.26Å; K557-I559 VanDerWaalsContact C-N 3.34Å; K557-I559 PolarHBondContact O-N 3.09Å; I559-L561 VanDerWaalsContact C-N 3.32Å; I559-L561 PolarHBondContact O-N 3.35Å; I559-R562 PolarHBondContact O-N 2.99Å; I559-A563 WeakPolarHBondContact O-CB 3.49Å; I559-A563 PolarHBondContact O-N 3.19Å
560	W	91.4	Very high	87	Confident	3 Å²	3	57 Å²	57	1%	0.011	28%	0.284	C	S	.	.	H	α-helix	trans	-56.4	-43.7	174.1	-72	108.6	0	0	0	112.8	L550 P554 K557 A563 A564 L579 Q582 A583 H586 C587 L593	L550-W560 HydrophobicContact CB-CH2 4.5Å; L550-W560 HydrophobicContact CD1-CE3 4.04Å; L550-W560 HydrophobicContact CD1-CH2 4.21Å; L550-W560 HydrophobicContact CD1-CZ3 3.84Å; L550-W560 HydrophobicContact CD2-CD2 3.41Å; L550-W560 VanDerWaalsContact CD2-CD2 3.41Å; L550-W560 HydrophobicContact CD2-CE3 3.67Å; L550-W560 HydrophobicContact CD2-CG 3.86Å; L550-W560 HydrophobicContact CD2-CH2 4.13Å; L550-W560 HydrophobicContact CD2-CZ2 3.88Å; L550-W560 HydrophobicContact CD2-CZ3 4.04Å; L550-W560 HydrophobicContact CG-CE3 4.48Å; L550-W560 HydrophobicContact CG-CZ3 4.47Å; P554-W560 PolarHBondContact O-NE1 2.82Å; K557-W560 PolarHBondContact O-N 3.36Å; W560-A563 PolarHBondContact O-N 2.95Å; W560-A564 WeakPolarHBondContact O-CB 3.29Å; W560-A564 PolarHBondContact O-N 3.12Å; W560-L579 HydrophobicContact CE3-CD1 4.13Å; W560-L579 HydrophobicContact CE3-CG 4.37Å; W560-L579 HydrophobicContact CZ3-CD1 3.71Å; W560-L579 HydrophobicContact CZ3-CG 4.21Å; W560-L579 WeakPolarHBondContact CZ3-O 3.05Å; W560-Q582 HydrophobicContact CH2-CB 3.76Å; W560-Q582 HydrophobicContact CZ3-CB 4.03Å; W560-A583 HydrophobicContact CB-CB 4.37Å; W560-A583 HydrophobicContact CD2-CB 3.61Å; W560-A583 HydrophobicContact CE3-CB 3.22Å; W560-A583 HydrophobicContact CG-CB 4.15Å; W560-A583 HydrophobicContact CH2-CB 4.44Å; W560-A583 HydrophobicContact CZ3-CB 3.68Å; W560-H586 HydrophobicContact CZ2-CB 4.01Å; W560-H586 AromaticContact CZ2-CD2 3.65Å; W560-C587 VanDerWaalsContact CD1-SG 3.5Å; W560-L593 HydrophobicContact CB-CD1 3.62Å; W560-L593 HydrophobicContact CB-CD2 4.12Å; W560-L593 HydrophobicContact CG-CD1 4.29Å
561	L	89.3	Confident	86.4	Confident	36 Å²	36	57.6 Å²	57.6	19%	0.188	29%	0.293	C	S	.	.	H	α-helix	trans	-62.6	-46.7	177	-76.7	169.4	0	0	0	111.7	K557 I559 A564 Y565 V592 L593	K557-L561 WeakPolarHBondContact O-CB 3.42Å; K557-L561 WeakPolarHBondContact O-CG 3.49Å; K557-L561 PolarHBondContact O-N 3.41Å; I559-L561 VanDerWaalsContact C-N 3.32Å; I559-L561 PolarHBondContact O-N 3.35Å; L561-A564 PolarHBondContact O-N 2.89Å; L561-Y565 HydrophobicContact CB-CD2 4.46Å; L561-Y565 HydrophobicContact CB-CE2 4.25Å; L561-Y565 HydrophobicContact CD2-CE2 4.46Å; L561-Y565 WeakPolarHBondContact O-CD2 3.31Å; L561-Y565 PolarHBondContact O-N 3.21Å; L561-V592 HydrophobicContact CD2-CB 3.9Å; L561-V592 HydrophobicContact CD2-CG1 3.54Å; L561-L593 HydrophobicContact CD2-CD2 3.67Å; L561-L593 HydrophobicContact CD2-CG 4.01Å; L561-L593 HydrophobicContact CG-CD2 4.08Å; L561-L593 HydrophobicContact CG-CG 4.35Å
562	R	88	Confident	86	Confident	94 Å²	94	57.5 Å²	57.5	36%	0.355	28%	0.283	S	S	.	.	H	α-helix	trans	-63.6	-44.6	177.9	-73.3	-175.6	-173.7	-165.7	7.9	112	L527 E531 Y546 S558 I559 A564 Y565 F566	L527-R562 HydrophobicContact CD2-CB 4.37Å; E531-R562 WeakPolarHBondContact OE1-CD 3.43Å; E531-R562 IonicContact OE1-CZ 3.89Å; E531-R562 VanDerWaalsContact OE1-CZ 3.3Å; E531-R562 IonicContact OE1-NE 3.7Å; E531-R562 IonicContact OE1-NH1 3.87Å; E531-R562 PolarHBondContact OE1-NH1 3.39Å; E531-R562 IonicContact OE2-NH1 3.01Å; Y546-R562 HydrophobicContact CE1-CB 4.2Å; S558-R562 WeakPolarHBondContact O-CG 3.49Å; S558-R562 PolarHBondContact O-N 3.06Å; S558-R562 VanDerWaalsContact O-N 3.15Å; I559-R562 PolarHBondContact O-N 2.99Å; R562-A564 VanDerWaalsContact C-N 3.32Å; R562-A564 PolarHBondContact O-N 3.2Å; R562-Y565 PolarHBondContact O-N 3.41Å; R562-F566 VanDerWaalsContact O-CB 3.3Å; R562-F566 WeakPolarHBondContact O-CB 3.31Å; R562-F566 PolarHBondContact O-N 3.37Å
563	A	89	Confident	85.6	Confident	2 Å²	2	60.4 Å²	60.4	2%	0.017	29%	0.291	C	S	.	.	H	α-helix	trans	-60.8	-41.2	175.2	0	0	0	0	0	111.7	Y546 L550 I559 W560 F566 E567 L579	Y546-A563 HydrophobicContact CD1-CB 3.83Å; Y546-A563 HydrophobicContact CE1-CB 4.32Å; Y546-A563 HydrophobicContact CG-CB 3.97Å; L550-A563 HydrophobicContact CD1-CB 4.25Å; I559-A563 WeakPolarHBondContact O-CB 3.49Å; I559-A563 PolarHBondContact O-N 3.19Å; W560-A563 PolarHBondContact O-N 2.95Å; A563-F566 WeakPolarHBondContact O-CB 3.13Å; A563-F566 PolarHBondContact O-N 3.17Å; A563-E567 PolarHBondContact O-N 2.78Å; A563-L579 HydrophobicContact CB-CD2 3.83Å
564	A	87.9	Confident	85.5	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.008	32%	0.318	C	S	.	.	H	α-helix	trans	-70.5	-37.2	178	0	0	0	0	0	112.6	W560 L561 R562 F566 R568 L576 L579 L580 L593 M596	W560-A564 WeakPolarHBondContact O-CB 3.29Å; W560-A564 PolarHBondContact O-N 3.12Å; L561-A564 PolarHBondContact O-N 2.89Å; R562-A564 VanDerWaalsContact C-N 3.32Å; R562-A564 PolarHBondContact O-N 3.2Å; A564-F566 VanDerWaalsContact C-N 3.34Å; A564-R568 VanDerWaalsContact O-CB 3.27Å; A564-R568 WeakPolarHBondContact O-CB 3.34Å; A564-R568 PolarHBondContact O-N 3.19Å; A564-L576 HydrophobicContact CB-CD1 4.29Å; A564-L579 HydrophobicContact CB-CD2 4.29Å; A564-L580 HydrophobicContact CB-CD2 3.97Å; A564-L593 HydrophobicContact CB-CD2 4.3Å; A564-M596 HydrophobicContact CB-CE 4.31Å; A564-M596 HydrophobicContact CB-SD 3.47Å; A564-M596 WeakPolarHBondContact CB-SD 3.31Å
565	Y	87.1	Confident	85.5	Confident	100 Å²	100	66.6 Å²	66.6	39%	0.392	32%	0.321	S	S	.	.	H	α-helix	trans	-64.7	-38.9	170.1	-74.2	-57.2	0	0	0	112	L561 R562 R568 N569 M596	L561-Y565 HydrophobicContact CB-CD2 4.46Å; L561-Y565 HydrophobicContact CB-CE2 4.25Å; L561-Y565 HydrophobicContact CD2-CE2 4.46Å; L561-Y565 WeakPolarHBondContact O-CD2 3.31Å; L561-Y565 PolarHBondContact O-N 3.21Å; R562-Y565 PolarHBondContact O-N 3.41Å; Y565-R568 PolarHBondContact O-N 3.41Å; Y565-N569 PolarHBondContact O-N 2.93Å; Y565-N569 PolarHBondContact O-ND2 3.36Å; Y565-N569 PolarHBondContact O-OD1 2.95Å; Y565-M596 HydrophobicContact CD1-CE 3.94Å; Y565-M596 HydrophobicContact CE1-CE 3.67Å; Y565-M596 HydrophobicContact CG-CE 4.48Å
566	F	88	Confident	85.6	Confident	12 Å²	12	61.8 Å²	61.8	5%	0.053	29%	0.291	C	S	.	.	H	α-helix	trans	-63.3	-50.5	176	172.4	-94.1	0	0	0	111.6	A534 I539 A542 R543 Y546 R562 A563 A564 R568 N569 H570	A534-F566 HydrophobicContact CB-CD2 4Å; A534-F566 HydrophobicContact CB-CE2 3.67Å; I539-F566 HydrophobicContact CB-CZ 4.39Å; I539-F566 HydrophobicContact CG2-CE1 4.24Å; I539-F566 HydrophobicContact CG2-CZ 3.68Å; I539-F566 WeakPolarHBondContact O-CZ 3.29Å; A542-F566 HydrophobicContact CB-CE1 4.36Å; A542-F566 HydrophobicContact CB-CE2 3.68Å; A542-F566 HydrophobicContact CB-CZ 3.55Å; R543-F566 HydrophobicContact CG-CE1 3.67Å; R543-F566 HydrophobicContact CG-CZ 4.37Å; Y546-F566 HydrophobicContact CD2-CB 4.5Å; Y546-F566 AromaticContact CD2-CD1 3.93Å; Y546-F566 HydrophobicContact CD2-CD1 3.93Å; Y546-F566 HydrophobicContact CD2-CE1 4.38Å; Y546-F566 HydrophobicContact CD2-CG 4.14Å; Y546-F566 HydrophobicContact CE2-CB 3.76Å; Y546-F566 AromaticContact CE2-CD1 3.83Å; Y546-F566 HydrophobicContact CE2-CD1 3.83Å; Y546-F566 AromaticContact CE2-CD2 3.94Å; Y546-F566 HydrophobicContact CE2-CD2 3.94Å; Y546-F566 HydrophobicContact CE2-CE1 4.43Å; Y546-F566 AromaticContact CE2-CG 3.54Å; Y546-F566 HydrophobicContact CE2-CG 3.54Å; R562-F566 VanDerWaalsContact O-CB 3.3Å; R562-F566 WeakPolarHBondContact O-CB 3.31Å; R562-F566 PolarHBondContact O-N 3.37Å; A563-F566 WeakPolarHBondContact O-CB 3.13Å; A563-F566 PolarHBondContact O-N 3.17Å; A564-F566 VanDerWaalsContact C-N 3.34Å; F566-R568 VanDerWaalsContact C-N 3.29Å; F566-R568 PolarHBondContact O-N 2.93Å; F566-N569 PolarHBondContact O-N 3.15Å; F566-H570 AromaticContact CD2-CD2 3.78Å; F566-H570 AromaticContact CE2-CD2 3.72Å; F566-H570 HydrophobicContact CZ-CB 4.45Å; F566-H570 PolarHBondContact O-N 2.77Å
567	E	87.6	Confident	85.6	Confident	20 Å²	20	60 Å²	60	9%	0.093	28%	0.283	C	S	.	.	H	α-helix	trans	-67	-28.4	176.1	-70.8	-59.5	163.9	0	0	112.5	R543 A563 N569 G571 T575 L576 L579	R543-E567 VanDerWaalsContact CD-OE1 3.31Å; R543-E567 WeakPolarHBondContact CD-OE1 3.48Å; R543-E567 VanDerWaalsContact CG-OE1 3.29Å; R543-E567 WeakPolarHBondContact CG-OE1 3.26Å; R543-E567 IonicContact CZ-OE1 3.61Å; R543-E567 IonicContact CZ-OE2 3.99Å; R543-E567 IonicContact NE-OE1 3.82Å; R543-E567 PolarHBondContact NE-OE1 3.48Å; R543-E567 IonicContact NE-OE2 3.55Å; R543-E567 PolarHBondContact NE-OE2 3Å; R543-E567 IonicContact NH2-OE2 3.99Å; R543-E567 PolarHBondContact NH2-OE2 3.37Å; A563-E567 PolarHBondContact O-N 2.78Å; E567-N569 PolarHBondContact O-N 3.08Å; E567-G571 WeakPolarHBondContact O-CA 3.43Å; E567-G571 PolarHBondContact O-N 2.83Å; E567-G571 WeakPolarHBondContact OE2-CA 3.3Å; E567-T575 PolarHBondContact OE2-OG1 3.45Å; E567-L576 HydrophobicContact CB-CB 4.15Å; E567-L576 HydrophobicContact CB-CD1 3.88Å; E567-L579 HydrophobicContact CB-CD2 4.42Å; E567-L579 HydrophobicContact CG-CD2 3.92Å
568	R	84	Confident	85.6	Confident	139 Å²	139	56.7 Å²	56.7	53%	0.525	27%	0.27	S	S	.	.	H	α-helix	trans	-64.6	-30.8	171.4	-169.2	-175.1	72.3	160	3.9	112.4	A564 Y565 F566 L576	A564-R568 VanDerWaalsContact O-CB 3.27Å; A564-R568 WeakPolarHBondContact O-CB 3.34Å; A564-R568 PolarHBondContact O-N 3.19Å; Y565-R568 PolarHBondContact O-N 3.41Å; F566-R568 VanDerWaalsContact C-N 3.29Å; F566-R568 PolarHBondContact O-N 2.93Å; R568-L576 HydrophobicContact CB-CD2 4.26Å
569	N	83.9	Confident	85.7	Confident	107 Å²	107	56.1 Å²	56.1	57%	0.572	26%	0.264	S	S	*	.	H	α-helix	trans	-89.4	-39.2	-177.7	-65.8	-10.5	0	0	0	112.6	Y565 F566 E567	Y565-N569 PolarHBondContact O-N 2.93Å; Y565-N569 PolarHBondContact O-ND2 3.36Å; Y565-N569 PolarHBondContact O-OD1 2.95Å; F566-N569 PolarHBondContact O-N 3.15Å; E567-N569 PolarHBondContact O-N 3.08Å
570	H	80.9	Confident	85.6	Confident	80 Å²	80	56.2 Å²	56.2	37%	0.37	27%	0.265	S	S	.	.	H	α-helix	trans	-120.8	-13.3	-171.4	-59.9	-76.2	0	0	0	114.5	I539 R543 F566	I539-H570 HydrophobicContact CD1-CB 4.19Å; I539-H570 HydrophobicContact CG1-CB 4.39Å; I539-H570 HydrophobicContact CG2-CB 3.82Å; R543-H570 PolarHBondContact NH2-O 3.19Å; F566-H570 AromaticContact CD2-CD2 3.78Å; F566-H570 AromaticContact CE2-CD2 3.72Å; F566-H570 HydrophobicContact CZ-CB 4.45Å; F566-H570 PolarHBondContact O-N 2.77Å
571	G	76.4	Confident	85.4	Confident	26 Å²	26	63.1 Å²	63.1	27%	0.268	29%	0.291	S	S	.	.	S	Bend	trans	-81	163.7	-174.1	0	0	0	0	0	115	E567	E567-G571 WeakPolarHBondContact O-CA 3.43Å; E567-G571 PolarHBondContact O-N 2.83Å; E567-G571 WeakPolarHBondContact OE2-CA 3.3Å
572	T	80.9	Confident	85.3	Confident	80 Å²	80	65 Å²	65	49%	0.491	30%	0.299	S	S	.	.			trans	-77.5	156.6	160.1	62.4	0	0	0	0	109.2	E574 T575 L576	T572-E574 PolarHBondContact O-N 3.46Å; T572-T575 PolarHBondContact N-OG1 2.96Å; T572-T575 PolarHBondContact O-N 3.27Å; T572-T575 PolarHBondContact O-OG1 3.12Å; T572-T575 WeakPolarHBondContact OG1-CG2 3.29Å; T572-T575 PolarHBondContact OG1-N 2.99Å; T572-T575 PolarHBondContact OG1-OG1 3.32Å; T572-L576 PolarHBondContact O-N 3.14Å
573	R	78.9	Confident	85.2	Confident	142 Å²	142	60.6 Å²	60.6	54%	0.536	28%	0.282	S	S	.	.	H	α-helix	trans	-57.3	-36.3	175.9	-163.5	-177.5	84.6	-163.2	-0.9	111.8	L576 E577	R573-L576 PolarHBondContact O-N 3.4Å; R573-E577 IonicContact CZ-OE1 2.74Å; R573-E577 IonicContact NE-OE1 3.9Å; R573-E577 PolarHBondContact NE-OE1 3.21Å; R573-E577 IonicContact NH2-OE1 2.87Å; R573-E577 WeakPolarHBondContact O-CB 3.37Å; R573-E577 VanDerWaalsContact O-CG 3.26Å; R573-E577 WeakPolarHBondContact O-CG 3.31Å; R573-E577 PolarHBondContact O-N 3.29Å
574	E	84.2	Confident	85.1	Confident	149 Å²	149	60.9 Å²	60.9	70%	0.696	28%	0.284	S	S	*	.	H	α-helix	trans	-68.4	-43.7	-178.4	-62.8	175.2	179.3	0	0	112.5	T572 L576 E577 E578	T572-E574 PolarHBondContact O-N 3.46Å; E574-L576 VanDerWaalsContact C-N 3.33Å; E574-L576 PolarHBondContact O-N 3.32Å; E574-E577 PolarHBondContact O-N 2.94Å; E574-E578 WeakPolarHBondContact O-CB 3.38Å; E574-E578 PolarHBondContact O-N 2.88Å
575	T	85	Confident	85	Confident	53 Å²	53	64.7 Å²	64.7	33%	0.325	31%	0.31	S	S	.	.	H	α-helix	trans	-63.7	-40.2	176.1	45.8	0	0	0	0	111.3	E567 T572 E578 L579	E567-T575 PolarHBondContact OE2-OG1 3.45Å; T572-T575 PolarHBondContact N-OG1 2.96Å; T572-T575 PolarHBondContact O-N 3.27Å; T572-T575 PolarHBondContact O-OG1 3.12Å; T572-T575 WeakPolarHBondContact OG1-CG2 3.29Å; T572-T575 PolarHBondContact OG1-N 2.99Å; T572-T575 PolarHBondContact OG1-OG1 3.32Å; T575-E578 PolarHBondContact O-N 3.3Å; T575-L579 VanDerWaalsContact O-CB 3.31Å; T575-L579 WeakPolarHBondContact O-CB 3.33Å; T575-L579 PolarHBondContact O-N 3.45Å
576	L	85.8	Confident	85	Confident	10 Å²	10	64.5 Å²	64.5	5%	0.052	31%	0.313	C	S	.	.	H	α-helix	trans	-64.8	-42.3	174.1	-179.9	60.5	0	0	0	112.3	A564 E567 R568 T572 R573 E574 L579 L580 T600	A564-L576 HydrophobicContact CB-CD1 4.29Å; E567-L576 HydrophobicContact CB-CB 4.15Å; E567-L576 HydrophobicContact CB-CD1 3.88Å; R568-L576 HydrophobicContact CB-CD2 4.26Å; T572-L576 PolarHBondContact O-N 3.14Å; R573-L576 PolarHBondContact O-N 3.4Å; E574-L576 VanDerWaalsContact C-N 3.33Å; E574-L576 PolarHBondContact O-N 3.32Å; L576-L579 PolarHBondContact O-N 2.93Å; L576-L580 HydrophobicContact CD1-CD1 3.76Å; L576-L580 HydrophobicContact CD1-CG 3.99Å; L576-L580 HydrophobicContact CG-CD1 3.76Å; L576-L580 HydrophobicContact CG-CG 4.39Å; L576-L580 VanDerWaalsContact O-CB 3.29Å; L576-L580 WeakPolarHBondContact O-CB 3.39Å; L576-L580 WeakPolarHBondContact O-CD1 3.02Å; L576-L580 WeakPolarHBondContact O-CG 2.98Å; L576-L580 PolarHBondContact O-N 2.98Å; L576-T600 HydrophobicContact CD2-CG2 3.41Å; L576-T600 VanDerWaalsContact CD2-CG2 3.41Å; L576-T600 HydrophobicContact CG-CG2 4.07Å
577	E	86.3	Confident	84.8	Confident	28 Å²	28	64.4 Å²	64.4	13%	0.131	31%	0.314	C	S	.	.	H	α-helix	trans	-64	-42.2	177.1	-76.1	175.4	-159.6	0	0	112	R573 E574 L580 R581 R601	R573-E577 IonicContact CZ-OE1 2.74Å; R573-E577 IonicContact NE-OE1 3.9Å; R573-E577 PolarHBondContact NE-OE1 3.21Å; R573-E577 IonicContact NH2-OE1 2.87Å; R573-E577 WeakPolarHBondContact O-CB 3.37Å; R573-E577 VanDerWaalsContact O-CG 3.26Å; R573-E577 WeakPolarHBondContact O-CG 3.31Å; R573-E577 PolarHBondContact O-N 3.29Å; E574-E577 PolarHBondContact O-N 2.94Å; E577-L580 PolarHBondContact O-N 3.06Å; E577-R581 VanDerWaalsContact O-CB 3.31Å; E577-R581 WeakPolarHBondContact O-CB 3.47Å; E577-R581 PolarHBondContact O-N 3.49Å; E577-R601 IonicContact OE1-NE 3.65Å; E577-R601 IonicContact OE2-CZ 2.69Å; E577-R601 IonicContact OE2-NE 2.83Å; E577-R601 PolarHBondContact OE2-NE 3.16Å; E577-R601 IonicContact OE2-NH2 3.38Å; E577-R601 PolarHBondContact OE2-NH2 3.41Å
578	E	86.6	Confident	84.5	Confident	73 Å²	73	66.3 Å²	66.3	34%	0.341	33%	0.328	S	S	.	.	H	α-helix	trans	-65.4	-45.5	177	179.4	53.1	-153.8	0	0	111.3	E574 T575 L580 R581 Q582	E574-E578 WeakPolarHBondContact O-CB 3.38Å; E574-E578 PolarHBondContact O-N 2.88Å; T575-E578 PolarHBondContact O-N 3.3Å; E578-L580 PolarHBondContact O-N 2.9Å; E578-R581 WeakPolarHBondContact O-CB 3.32Å; E578-R581 PolarHBondContact O-N 3.2Å; E578-R581 IonicContact OE1-CZ 3.88Å; E578-R581 IonicContact OE1-NE 2.76Å; E578-R581 IonicContact OE1-NH2 3.61Å; E578-R581 PolarHBondContact OE1-NH2 3.24Å; E578-R581 IonicContact OE2-CZ 3.72Å; E578-R581 VanDerWaalsContact OE2-CZ 3.28Å; E578-R581 IonicContact OE2-NE 3.81Å; E578-R581 PolarHBondContact OE2-NE 3.43Å; E578-R581 IonicContact OE2-NH2 3.91Å; E578-R581 PolarHBondContact OE2-NH2 2.91Å; E578-Q582 WeakPolarHBondContact O-CG 3.16Å; E578-Q582 PolarHBondContact O-N 2.87Å; E578-Q582 PolarHBondContact OE1-NE2 3.48Å
579	L	88.4	Confident	84.5	Confident	23 Å²	23	67.6 Å²	67.6	12%	0.12	34%	0.34	C	S	.	.	H	α-helix	trans	-59.5	-46.4	175	-176.2	75.7	0	0	0	111.2	L550 W560 A563 A564 E567 T575 L576 R581 Q582 A583	L550-L579 HydrophobicContact CD1-CD1 3.63Å; W560-L579 HydrophobicContact CE3-CD1 4.13Å; W560-L579 HydrophobicContact CE3-CG 4.37Å; W560-L579 HydrophobicContact CZ3-CD1 3.71Å; W560-L579 HydrophobicContact CZ3-CG 4.21Å; W560-L579 WeakPolarHBondContact CZ3-O 3.05Å; A563-L579 HydrophobicContact CB-CD2 3.83Å; A564-L579 HydrophobicContact CB-CD2 4.29Å; E567-L579 HydrophobicContact CB-CD2 4.42Å; E567-L579 HydrophobicContact CG-CD2 3.92Å; T575-L579 VanDerWaalsContact O-CB 3.31Å; T575-L579 WeakPolarHBondContact O-CB 3.33Å; T575-L579 PolarHBondContact O-N 3.45Å; L576-L579 PolarHBondContact O-N 2.93Å; L579-R581 VanDerWaalsContact C-N 3.33Å; L579-R581 PolarHBondContact O-N 2.96Å; L579-Q582 PolarHBondContact O-N 3.37Å; L579-A583 VanDerWaalsContact O-CB 3.31Å; L579-A583 WeakPolarHBondContact O-CB 3.49Å; L579-A583 PolarHBondContact O-N 2.98Å
580	L	87.2	Confident	84.5	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-67.2	-34.3	-179.9	-72.3	170.1	0	0	0	112.1	A564 L576 E577 E578 A583 V584 L593 M596 A597 T600	A564-L580 HydrophobicContact CB-CD2 3.97Å; L576-L580 HydrophobicContact CD1-CD1 3.76Å; L576-L580 HydrophobicContact CD1-CG 3.99Å; L576-L580 HydrophobicContact CG-CD1 3.76Å; L576-L580 HydrophobicContact CG-CG 4.39Å; L576-L580 VanDerWaalsContact O-CB 3.29Å; L576-L580 WeakPolarHBondContact O-CB 3.39Å; L576-L580 WeakPolarHBondContact O-CD1 3.02Å; L576-L580 WeakPolarHBondContact O-CG 2.98Å; L576-L580 PolarHBondContact O-N 2.98Å; E577-L580 PolarHBondContact O-N 3.06Å; E578-L580 PolarHBondContact O-N 2.9Å; L580-A583 PolarHBondContact O-N 2.92Å; L580-V584 WeakPolarHBondContact O-CB 3.08Å; L580-V584 VanDerWaalsContact O-CG2 3.29Å; L580-V584 WeakPolarHBondContact O-CG2 3.26Å; L580-V584 PolarHBondContact O-N 3.47Å; L580-L593 HydrophobicContact CD2-CD2 4.28Å; L580-M596 HydrophobicContact CD1-CB 4.49Å; L580-M596 HydrophobicContact CD1-CG 4.15Å; L580-M596 HydrophobicContact CD2-CB 4.2Å; L580-M596 HydrophobicContact CD2-CG 4.29Å; L580-M596 HydrophobicContact CD2-SD 4.24Å; L580-A597 HydrophobicContact CB-CB 4.08Å; L580-A597 HydrophobicContact CD1-CB 4.19Å; L580-T600 HydrophobicContact CD1-CG2 4.03Å
581	R	87.3	Confident	84.8	Confident	148 Å²	148	62 Å²	62	56%	0.558	31%	0.312	S	S	*	.	H	α-helix	trans	-61.5	-44.9	173.2	-173.5	-179	70.9	87	-3	111.1	E577 E578 L579 S585	E577-R581 VanDerWaalsContact O-CB 3.31Å; E577-R581 WeakPolarHBondContact O-CB 3.47Å; E577-R581 PolarHBondContact O-N 3.49Å; E578-R581 WeakPolarHBondContact O-CB 3.32Å; E578-R581 PolarHBondContact O-N 3.2Å; E578-R581 IonicContact OE1-CZ 3.88Å; E578-R581 IonicContact OE1-NE 2.76Å; E578-R581 IonicContact OE1-NH2 3.61Å; E578-R581 PolarHBondContact OE1-NH2 3.24Å; E578-R581 IonicContact OE2-CZ 3.72Å; E578-R581 VanDerWaalsContact OE2-CZ 3.28Å; E578-R581 IonicContact OE2-NE 3.81Å; E578-R581 PolarHBondContact OE2-NE 3.43Å; E578-R581 IonicContact OE2-NH2 3.91Å; E578-R581 PolarHBondContact OE2-NH2 2.91Å; L579-R581 VanDerWaalsContact C-N 3.33Å; L579-R581 PolarHBondContact O-N 2.96Å; R581-S585 PolarHBondContact O-N 3.06Å; R581-S585 PolarHBondContact O-OG 3.38Å
582	Q	87.6	Confident	85.4	Confident	76 Å²	76	63.6 Å²	63.6	36%	0.355	32%	0.316	S	S	.	.	H	α-helix	trans	-66.6	-41.9	174.8	-65.4	176.2	8.8	0	0	111.6	W560 E578 L579 V584 S585 H586	W560-Q582 HydrophobicContact CH2-CB 3.76Å; W560-Q582 HydrophobicContact CZ3-CB 4.03Å; E578-Q582 WeakPolarHBondContact O-CG 3.16Å; E578-Q582 PolarHBondContact O-N 2.87Å; E578-Q582 PolarHBondContact OE1-NE2 3.48Å; L579-Q582 PolarHBondContact O-N 3.37Å; Q582-V584 VanDerWaalsContact C-N 3.31Å; Q582-V584 PolarHBondContact O-N 3.23Å; Q582-S585 WeakPolarHBondContact CA-OG 3.18Å; Q582-S585 PolarHBondContact O-N 3.48Å; Q582-S585 PolarHBondContact O-OG 3.48Å; Q582-H586 PolarHBondContact O-CD2 3.42Å; Q582-H586 PolarHBondContact O-N 3.09Å; Q582-H586 VanDerWaalsContact O-N 3.1Å
583	A	87.3	Confident	85.8	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.008	29%	0.293	C	S	.	.	H	α-helix	trans	-59.7	-44.1	-180	0	0	0	0	0	111.7	W560 L579 L580 S585 H586 C587 L593	W560-A583 HydrophobicContact CB-CB 4.37Å; W560-A583 HydrophobicContact CD2-CB 3.61Å; W560-A583 HydrophobicContact CE3-CB 3.22Å; W560-A583 HydrophobicContact CG-CB 4.15Å; W560-A583 HydrophobicContact CH2-CB 4.44Å; W560-A583 HydrophobicContact CZ3-CB 3.68Å; L579-A583 VanDerWaalsContact O-CB 3.31Å; L579-A583 WeakPolarHBondContact O-CB 3.49Å; L579-A583 PolarHBondContact O-N 2.98Å; L580-A583 PolarHBondContact O-N 2.92Å; A583-S585 VanDerWaalsContact C-N 3.34Å; A583-S585 PolarHBondContact O-N 3.45Å; A583-H586 PolarHBondContact O-N 3.3Å; A583-C587 WeakPolarHBondContact O-CA 3.49Å; A583-C587 WeakPolarHBondContact O-CB 3.25Å; A583-C587 PolarHBondContact O-N 3Å; A583-L593 HydrophobicContact CB-CD1 4.1Å
584	V	85.5	Confident	86.3	Confident	9 Å²	9	53.5 Å²	53.5	6%	0.055	27%	0.269	C	S	.	.	H	α-helix	trans	-62.9	-38.4	177.7	156.5	0	0	0	0	112.1	L580 Q582 W594	L580-V584 WeakPolarHBondContact O-CB 3.08Å; L580-V584 VanDerWaalsContact O-CG2 3.29Å; L580-V584 WeakPolarHBondContact O-CG2 3.26Å; L580-V584 PolarHBondContact O-N 3.47Å; Q582-V584 VanDerWaalsContact C-N 3.31Å; Q582-V584 PolarHBondContact O-N 3.23Å; V584-W594 HydrophobicContact CB-CH2 4.27Å; V584-W594 HydrophobicContact CB-CZ2 4.34Å; V584-W594 HydrophobicContact CB-CZ3 4.33Å; V584-W594 HydrophobicContact CG1-CD2 4.29Å; V584-W594 HydrophobicContact CG1-CE3 4Å; V584-W594 HydrophobicContact CG1-CH2 3.07Å; V584-W594 HydrophobicContact CG1-CZ2 3.38Å; V584-W594 HydrophobicContact CG1-CZ3 3.4Å; V584-W594 HydrophobicContact CG2-CD2 3.78Å; V584-W594 HydrophobicContact CG2-CE3 3.69Å; V584-W594 HydrophobicContact CG2-CG 4.45Å; V584-W594 HydrophobicContact CG2-CH2 4.3Å; V584-W594 HydrophobicContact CG2-CZ2 4.34Å; V584-W594 HydrophobicContact CG2-CZ3 3.97Å
585	S	86.3	Confident	86.6	Confident	80 Å²	80	48.3 Å²	48.3	56%	0.559	25%	0.247	S	C	*	.	H	α-helix	trans	-70.6	-35.2	177.3	48.9	0	0	0	0	113.3	R581 Q582 A583	R581-S585 PolarHBondContact O-N 3.06Å; R581-S585 PolarHBondContact O-OG 3.38Å; Q582-S585 WeakPolarHBondContact CA-OG 3.18Å; Q582-S585 PolarHBondContact O-N 3.48Å; Q582-S585 PolarHBondContact O-OG 3.48Å; A583-S585 VanDerWaalsContact C-N 3.34Å; A583-S585 PolarHBondContact O-N 3.45Å
586	H	86.9	Confident	86.6	Confident	97 Å²	97	46.7 Å²	46.7	45%	0.449	24%	0.235	S	C	.	.	H	α-helix	trans	-87.6	-31.8	-177.8	-69.3	-65.7	0	0	0	113.5	P554 W560 Q582 A583	P554-H586 HydrophobicContact CB-CB 4.36Å; P554-H586 WeakPolarHBondContact O-CB 3.24Å; W560-H586 HydrophobicContact CZ2-CB 4.01Å; W560-H586 AromaticContact CZ2-CD2 3.65Å; Q582-H586 PolarHBondContact O-CD2 3.42Å; Q582-H586 PolarHBondContact O-N 3.09Å; Q582-H586 VanDerWaalsContact O-N 3.1Å; A583-H586 PolarHBondContact O-N 3.3Å
587	C	83.3	Confident	86.7	Confident	10 Å²	10	46.6 Å²	46.6	7%	0.068	24%	0.236	C	C	.	.			trans	-127.1	71.6	-175.3	-72.2	0	0	0	0	111.7	P554 T555 W560 A583 Q589 A590 L593	P554-C587 PolarHBondContact O-SG 3.45Å; T555-C587 PolarHBondContact O-SG 3.34Å; W560-C587 VanDerWaalsContact CD1-SG 3.5Å; A583-C587 WeakPolarHBondContact O-CA 3.49Å; A583-C587 WeakPolarHBondContact O-CB 3.25Å; A583-C587 PolarHBondContact O-N 3Å; C587-Q589 VanDerWaalsContact C-N 3.31Å; C587-Q589 PolarHBondContact O-N 3.27Å; C587-A590 HydrophobicContact CB-CB 4.21Å; C587-A590 PolarHBondContact O-N 3Å; C587-L593 HydrophobicContact CB-CD1 4.4Å
588	P	82.7	Confident	86.9	Confident	60 Å²	60	45.6 Å²	45.6	39%	0.39	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-27.2	-175.1	25.9	-34.5	0	0	0	113.9	A590 W594 A620 N621	P588-A590 VanDerWaalsContact C-N 3.28Å; P588-A590 PolarHBondContact O-N 2.68Å; P588-W594 PolarHBondContact O-NE1 3.41Å; P588-A620 HydrophobicContact CB-CB 4.25Å; P588-N621 PolarHBondContact O-ND2 2.85Å
589	Q	82.6	Confident	86.9	Confident	166 Å²	166	45.3 Å²	45.3	78%	0.776	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-8.6	-179.6	-66.3	-177.2	-20.4	0	0	114	C587 E591	C587-Q589 VanDerWaalsContact C-N 3.31Å; C587-Q589 PolarHBondContact O-N 3.27Å; Q589-E591 PolarHBondContact O-N 3.05Å; Q589-E591 VanDerWaalsContact O-N 3.12Å
590	A	85.4	Confident	86.8	Confident	12 Å²	12	45 Å²	45	10%	0.099	23%	0.229	C	C	.	.			trans	-85.3	87.8	-175.2	0	0	0	0	0	111.4	K557 C587 P588 V592 L593 W594	K557-A590 HydrophobicContact CB-CB 4.17Å; C587-A590 HydrophobicContact CB-CB 4.21Å; C587-A590 PolarHBondContact O-N 3Å; P588-A590 VanDerWaalsContact C-N 3.28Å; P588-A590 PolarHBondContact O-N 2.68Å; A590-V592 VanDerWaalsContact C-N 3.3Å; A590-V592 PolarHBondContact O-N 3.19Å; A590-L593 HydrophobicContact CB-CB 4.39Å; A590-L593 HydrophobicContact CB-CD1 3.67Å; A590-L593 HydrophobicContact CB-CG 4.13Å; A590-L593 PolarHBondContact O-N 3.32Å; A590-L593 VanDerWaalsContact O-N 3.1Å; A590-W594 PolarHBondContact O-N 3.45Å
591	E	86.9	Confident	86.8	Confident	56 Å²	56	48.5 Å²	48.5	26%	0.262	24%	0.242	S	C	.	.	H	α-helix	trans	-52.2	-43.6	-177.7	-57.7	-179.7	-169.3	0	0	113.2	Q589 L593 W594 L595 S624 I627	Q589-E591 PolarHBondContact O-N 3.05Å; Q589-E591 VanDerWaalsContact O-N 3.12Å; E591-L593 VanDerWaalsContact C-N 3.26Å; E591-L593 PolarHBondContact O-N 3.28Å; E591-W594 WeakPolarHBondContact O-CB 3.36Å; E591-W594 PolarHBondContact O-N 2.94Å; E591-W594 VanDerWaalsContact O-N 3.1Å; E591-L595 WeakPolarHBondContact O-CG 3.4Å; E591-L595 PolarHBondContact O-N 3.3Å; E591-S624 VanDerWaalsContact CD-CB 3.44Å; E591-S624 VanDerWaalsContact OE1-CB 3.28Å; E591-S624 WeakPolarHBondContact OE1-CB 3.48Å; E591-S624 PolarHBondContact OE1-OG 3.47Å; E591-I627 HydrophobicContact CG-CD1 4.38Å
592	V	88.9	Confident	86.8	Confident	60 Å²	60	43.5 Å²	43.5	36%	0.364	22%	0.223	S	C	.	.	H	α-helix	trans	-60.5	-34.4	-178.3	-177.9	0	0	0	0	112.5	L561 A590 L595 M596	L561-V592 HydrophobicContact CD2-CB 3.9Å; L561-V592 HydrophobicContact CD2-CG1 3.54Å; A590-V592 VanDerWaalsContact C-N 3.3Å; A590-V592 PolarHBondContact O-N 3.19Å; V592-L595 PolarHBondContact O-N 2.89Å; V592-M596 WeakPolarHBondContact O-CB 3.33Å; V592-M596 PolarHBondContact O-N 2.99Å
593	L	88.7	Confident	86.7	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-70.2	-39.8	177.7	-67	171.6	0	0	0	111.2	W560 L561 A564 L580 A583 C587 A590 E591 M596 A597	W560-L593 HydrophobicContact CB-CD1 3.62Å; W560-L593 HydrophobicContact CB-CD2 4.12Å; W560-L593 HydrophobicContact CG-CD1 4.29Å; L561-L593 HydrophobicContact CD2-CD2 3.67Å; L561-L593 HydrophobicContact CD2-CG 4.01Å; L561-L593 HydrophobicContact CG-CD2 4.08Å; L561-L593 HydrophobicContact CG-CG 4.35Å; A564-L593 HydrophobicContact CB-CD2 4.3Å; L580-L593 HydrophobicContact CD2-CD2 4.28Å; A583-L593 HydrophobicContact CB-CD1 4.1Å; C587-L593 HydrophobicContact CB-CD1 4.4Å; A590-L593 HydrophobicContact CB-CB 4.39Å; A590-L593 HydrophobicContact CB-CD1 3.67Å; A590-L593 HydrophobicContact CB-CG 4.13Å; A590-L593 PolarHBondContact O-N 3.32Å; A590-L593 VanDerWaalsContact O-N 3.1Å; E591-L593 VanDerWaalsContact C-N 3.26Å; E591-L593 PolarHBondContact O-N 3.28Å; L593-M596 PolarHBondContact O-N 2.91Å; L593-A597 WeakPolarHBondContact O-CB 3.35Å; L593-A597 PolarHBondContact O-N 2.85Å
594	W	90.6	Very high	86.5	Confident	9 Å²	9	47.3 Å²	47.3	3%	0.034	25%	0.25	C	C	.	.	H	α-helix	trans	-61	-45.5	171.9	-70.6	107.2	0	0	0	112	V584 P588 A590 E591 M596 A597 A598 I613 R616 A617 A620	V584-W594 HydrophobicContact CB-CH2 4.27Å; V584-W594 HydrophobicContact CB-CZ2 4.34Å; V584-W594 HydrophobicContact CB-CZ3 4.33Å; V584-W594 HydrophobicContact CG1-CD2 4.29Å; V584-W594 HydrophobicContact CG1-CE3 4Å; V584-W594 HydrophobicContact CG1-CH2 3.07Å; V584-W594 HydrophobicContact CG1-CZ2 3.38Å; V584-W594 HydrophobicContact CG1-CZ3 3.4Å; V584-W594 HydrophobicContact CG2-CD2 3.78Å; V584-W594 HydrophobicContact CG2-CE3 3.69Å; V584-W594 HydrophobicContact CG2-CG 4.45Å; V584-W594 HydrophobicContact CG2-CH2 4.3Å; V584-W594 HydrophobicContact CG2-CZ2 4.34Å; V584-W594 HydrophobicContact CG2-CZ3 3.97Å; P588-W594 PolarHBondContact O-NE1 3.41Å; A590-W594 PolarHBondContact O-N 3.45Å; E591-W594 WeakPolarHBondContact O-CB 3.36Å; E591-W594 PolarHBondContact O-N 2.94Å; E591-W594 VanDerWaalsContact O-N 3.1Å; W594-M596 VanDerWaalsContact C-N 3.28Å; W594-M596 PolarHBondContact O-N 3.05Å; W594-A597 PolarHBondContact O-N 3.38Å; W594-A598 WeakPolarHBondContact O-CB 3.1Å; W594-A598 PolarHBondContact O-N 3.37Å; W594-I613 HydrophobicContact CE3-CG2 3.83Å; W594-I613 HydrophobicContact CZ3-CG2 4.16Å; W594-I613 WeakPolarHBondContact CZ3-O 3.34Å; W594-R616 HydrophobicContact CH2-CB 3.75Å; W594-R616 HydrophobicContact CZ3-CB 3.76Å; W594-A617 HydrophobicContact CB-CB 3.92Å; W594-A617 HydrophobicContact CD2-CB 3.63Å; W594-A617 HydrophobicContact CE3-CB 3.66Å; W594-A617 HydrophobicContact CG-CB 3.78Å; W594-A617 HydrophobicContact CZ3-CB 4.24Å; W594-A620 HydrophobicContact CZ2-CB 3.99Å
595	L	89.1	Confident	86.4	Confident	41 Å²	41	49.6 Å²	49.6	22%	0.215	28%	0.275	C	S	.	.	H	α-helix	trans	-62.3	-38	177	-66.4	178.1	0	0	0	111.6	E591 V592 K599 E626 A630	E591-L595 WeakPolarHBondContact O-CG 3.4Å; E591-L595 PolarHBondContact O-N 3.3Å; V592-L595 PolarHBondContact O-N 2.89Å; L595-K599 WeakPolarHBondContact O-CB 3.19Å; L595-K599 PolarHBondContact O-N 2.93Å; L595-E626 HydrophobicContact CD1-CB 4Å; L595-A630 HydrophobicContact CD2-CB 3.23Å
596	M	86.2	Confident	86.5	Confident	19 Å²	19	48.9 Å²	48.9	9%	0.094	27%	0.265	C	S	.	.	H	α-helix	trans	-65.9	-45.8	175.2	-164.7	174.7	-62.6	0	0	111.3	A564 Y565 L580 V592 L593 W594 A598 K599 T600	A564-M596 HydrophobicContact CB-CE 4.31Å; A564-M596 HydrophobicContact CB-SD 3.47Å; A564-M596 WeakPolarHBondContact CB-SD 3.31Å; Y565-M596 HydrophobicContact CD1-CE 3.94Å; Y565-M596 HydrophobicContact CE1-CE 3.67Å; Y565-M596 HydrophobicContact CG-CE 4.48Å; L580-M596 HydrophobicContact CD1-CB 4.49Å; L580-M596 HydrophobicContact CD1-CG 4.15Å; L580-M596 HydrophobicContact CD2-CB 4.2Å; L580-M596 HydrophobicContact CD2-CG 4.29Å; L580-M596 HydrophobicContact CD2-SD 4.24Å; V592-M596 WeakPolarHBondContact O-CB 3.33Å; V592-M596 PolarHBondContact O-N 2.99Å; L593-M596 PolarHBondContact O-N 2.91Å; W594-M596 VanDerWaalsContact C-N 3.28Å; W594-M596 PolarHBondContact O-N 3.05Å; M596-A598 PolarHBondContact O-N 2.81Å; M596-K599 PolarHBondContact O-N 3.27Å; M596-T600 VanDerWaalsContact O-CG2 3.3Å; M596-T600 WeakPolarHBondContact O-CG2 3.47Å; M596-T600 PolarHBondContact O-N 3.4Å; M596-T600 PolarHBondContact O-OG1 3.34Å
597	A	87.3	Confident	86.5	Confident	7 Å²	7	45.4 Å²	45.4	6%	0.058	25%	0.25	C	S	.	.	H	α-helix	trans	-62.1	-40.3	176.6	0	0	0	0	0	112.9	L580 L593 W594 T600 R601 I613	L580-A597 HydrophobicContact CB-CB 4.08Å; L580-A597 HydrophobicContact CD1-CB 4.19Å; L593-A597 WeakPolarHBondContact O-CB 3.35Å; L593-A597 PolarHBondContact O-N 2.85Å; W594-A597 PolarHBondContact O-N 3.38Å; A597-T600 PolarHBondContact O-OG1 2.89Å; A597-R601 PolarHBondContact O-N 3.27Å; A597-I613 HydrophobicContact CB-CD1 4.49Å; A597-I613 HydrophobicContact CB-CG2 4Å
598	A	89.6	Confident	86.9	Confident	7 Å²	7	49 Å²	49	6%	0.058	27%	0.273	C	S	.	.	H	α-helix	trans	-66.1	-43.7	173.8	0	0	0	0	0	111.3	W594 M596 W602 I613 L614	W594-A598 WeakPolarHBondContact O-CB 3.1Å; W594-A598 PolarHBondContact O-N 3.37Å; M596-A598 PolarHBondContact O-N 2.81Å; A598-W602 WeakPolarHBondContact O-CB 3.48Å; A598-W602 PolarHBondContact O-N 2.83Å; A598-I613 HydrophobicContact CB-CG2 4.47Å; A598-L614 HydrophobicContact CB-CD1 4.31Å; A598-L614 HydrophobicContact CB-CD2 3.84Å; A598-L614 HydrophobicContact CB-CG 3.82Å
599	K	86.9	Confident	87.2	Confident	67 Å²	67	47 Å²	47	29%	0.291	26%	0.263	S	S	.	.	H	α-helix	trans	-64.5	-40.9	178.8	-170.3	177.1	-179.3	-177.8	0	111.6	L595 M596 W602 L603 E899	L595-K599 WeakPolarHBondContact O-CB 3.19Å; L595-K599 PolarHBondContact O-N 2.93Å; M596-K599 PolarHBondContact O-N 3.27Å; K599-W602 HydrophobicContact CG-CE3 4.4Å; K599-W602 PolarHBondContact O-N 3.43Å; K599-L603 HydrophobicContact CG-CD1 4.11Å; K599-L603 HydrophobicContact CG-CG 4.37Å; K599-L603 WeakPolarHBondContact O-CB 3.45Å; K599-L603 VanDerWaalsContact O-CG 3.27Å; K599-L603 WeakPolarHBondContact O-CG 3.5Å; K599-L603 PolarHBondContact O-N 3.49Å; K599-E899 IonicContact NZ-OE1 2.66Å; K599-E899 PolarHBondContact NZ-OE1 3.18Å; K599-E899 IonicContact NZ-OE2 3.35Å; K599-E899 PolarHBondContact NZ-OE2 3.42Å; K599-E899 VanDerWaalsContact NZ-OE2 3.09Å
600	T	86.3	Confident	87.6	Confident	16 Å²	16	39.1 Å²	39.1	10%	0.098	23%	0.226	C	C	.	.	H	α-helix	trans	-65.7	-46	-179.5	53.3	0	0	0	0	112.1	L576 L580 M596 A597 W602 L603 A604	L576-T600 HydrophobicContact CD2-CG2 3.41Å; L576-T600 VanDerWaalsContact CD2-CG2 3.41Å; L576-T600 HydrophobicContact CG-CG2 4.07Å; L580-T600 HydrophobicContact CD1-CG2 4.03Å; M596-T600 VanDerWaalsContact O-CG2 3.3Å; M596-T600 WeakPolarHBondContact O-CG2 3.47Å; M596-T600 PolarHBondContact O-N 3.4Å; M596-T600 PolarHBondContact O-OG1 3.34Å; A597-T600 PolarHBondContact O-OG1 2.89Å; T600-W602 VanDerWaalsContact C-N 3.33Å; T600-W602 PolarHBondContact O-N 3.49Å; T600-L603 PolarHBondContact O-N 3.17Å; T600-A604 PolarHBondContact O-N 2.92Å
601	R	87	Confident	87.8	Confident	76 Å²	76	41.6 Å²	41.6	29%	0.287	23%	0.233	S	C	.	.	H	α-helix	trans	-66.2	-35.1	174.6	-70.7	-61.1	-173.5	123.7	-13.3	113	E577 A597 A604 G605 D606 A610 I613	E577-R601 IonicContact OE1-NE 3.65Å; E577-R601 IonicContact OE2-CZ 2.69Å; E577-R601 IonicContact OE2-NE 2.83Å; E577-R601 PolarHBondContact OE2-NE 3.16Å; E577-R601 IonicContact OE2-NH2 3.38Å; E577-R601 PolarHBondContact OE2-NH2 3.41Å; A597-R601 PolarHBondContact O-N 3.27Å; R601-A604 VanDerWaalsContact O-CB 3.3Å; R601-A604 WeakPolarHBondContact O-CB 3.5Å; R601-A604 PolarHBondContact O-N 2.7Å; R601-G605 PolarHBondContact O-N 3Å; R601-D606 PolarHBondContact O-N 2.95Å; R601-D606 VanDerWaalsContact O-N 3.12Å; R601-A610 HydrophobicContact CB-CB 4.17Å; R601-I613 HydrophobicContact CB-CD1 4.29Å; R601-I613 HydrophobicContact CG-CD1 3.61Å
602	W	88.7	Confident	88	Confident	43 Å²	43	42.2 Å²	42.2	16%	0.163	24%	0.243	C	C	.	.	H	α-helix	trans	-68.2	-42.1	175.4	175.6	43.2	0	0	0	112.4	A598 K599 T600 A604 G605 A610 L634 E637	A598-W602 WeakPolarHBondContact O-CB 3.48Å; A598-W602 PolarHBondContact O-N 2.83Å; K599-W602 HydrophobicContact CG-CE3 4.4Å; K599-W602 PolarHBondContact O-N 3.43Å; T600-W602 VanDerWaalsContact C-N 3.33Å; T600-W602 PolarHBondContact O-N 3.49Å; W602-A604 PolarHBondContact O-N 2.9Å; W602-G605 PolarHBondContact O-N 3.48Å; W602-A610 HydrophobicContact CB-CB 4.12Å; W602-L634 HydrophobicContact CB-CD1 4.28Å; W602-L634 HydrophobicContact CG-CD1 4.25Å; W602-E637 HydrophobicContact CH2-CG 4.42Å; W602-E637 WeakPolarHBondContact CH2-OE1 3.1Å; W602-E637 WeakPolarHBondContact CH2-OE2 3.31Å; W602-E637 HydrophobicContact CZ2-CB 3.84Å; W602-E637 VanDerWaalsContact CZ2-CD 3.45Å; W602-E637 HydrophobicContact CZ2-CG 4.2Å; W602-E637 WeakPolarHBondContact CZ2-OE2 3.27Å
603	L	84.3	Confident	88.1	Confident	127 Å²	127	40.7 Å²	40.7	67%	0.665	23%	0.232	S	C	*	.	H	α-helix	trans	-65	-27	172.6	-70.9	174.2	0	0	0	112.5	K599 T600 G605	K599-L603 HydrophobicContact CG-CD1 4.11Å; K599-L603 HydrophobicContact CG-CG 4.37Å; K599-L603 WeakPolarHBondContact O-CB 3.45Å; K599-L603 VanDerWaalsContact O-CG 3.27Å; K599-L603 WeakPolarHBondContact O-CG 3.5Å; K599-L603 PolarHBondContact O-N 3.49Å; T600-L603 PolarHBondContact O-N 3.17Å; L603-G605 PolarHBondContact O-N 3.17Å
604	A	83.2	Confident	88.1	Confident	31 Å²	31	41 Å²	41	26%	0.256	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-10.9	170.6	0	0	0	0	0	114	T600 R601 W602 D606	T600-A604 PolarHBondContact O-N 2.92Å; R601-A604 VanDerWaalsContact O-CB 3.3Å; R601-A604 WeakPolarHBondContact O-CB 3.5Å; R601-A604 PolarHBondContact O-N 2.7Å; W602-A604 PolarHBondContact O-N 2.9Å; A604-D606 VanDerWaalsContact C-N 3.33Å
605	G	83	Confident	88.1	Confident	57 Å²	57	42.9 Å²	42.9	59%	0.588	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.7	-5.8	-175.7	0	0	0	0	0	114.3	R601 W602 L603 V607	R601-G605 PolarHBondContact O-N 3Å; W602-G605 PolarHBondContact O-N 3.48Å; L603-G605 PolarHBondContact O-N 3.17Å; G605-V607 PolarHBondContact O-N 2.88Å
606	D	88	Confident	88.1	Confident	64 Å²	64	46.3 Å²	46.3	34%	0.342	26%	0.262	S	S	.	.			trans	-85.6	78.1	179.6	-169	-10.3	0	0	0	110.9	R601 A604 P608 A609 A610	R601-D606 PolarHBondContact O-N 2.95Å; R601-D606 VanDerWaalsContact O-N 3.12Å; A604-D606 VanDerWaalsContact C-N 3.33Å; D606-P608 WeakPolarHBondContact OD1-CD 3.36Å; D606-A609 HydrophobicContact CB-CB 4.18Å; D606-A609 PolarHBondContact O-N 2.88Å; D606-A609 WeakPolarHBondContact OD1-CB 3.32Å; D606-A609 PolarHBondContact OD1-N 3.23Å; D606-A609 WeakPolarHBondContact OD2-CB 3.46Å; D606-A610 PolarHBondContact O-N 3.34Å; D606-A610 VanDerWaalsContact O-N 3.13Å
607	V	88.2	Confident	88.3	Confident	24 Å²	24	45.4 Å²	45.4	15%	0.145	26%	0.257	C	S	.	.	H	α-helix	trans	-61.4	-44.3	177.3	-176.7	0	0	0	0	112.2	G605 A609 A610 R611 L634 N638	G605-V607 PolarHBondContact O-N 2.88Å; V607-A609 PolarHBondContact O-N 3.38Å; V607-A610 PolarHBondContact O-N 3.48Å; V607-R611 VanDerWaalsContact CG1-CZ 3.49Å; V607-R611 WeakPolarHBondContact O-CG 3.2Å; V607-R611 PolarHBondContact O-N 2.98Å; V607-L634 HydrophobicContact CG1-CD2 4.01Å; V607-N638 WeakPolarHBondContact CG1-ND2 3.2Å; V607-N638 WeakPolarHBondContact CG2-ND2 3.17Å
608	P	90.9	Very high	88.3	Confident	85 Å²	85	47.2 Å²	47.2	55%	0.552	26%	0.264	S	S	*	.	H	α-helix	trans	-58.8	-43.2	176.8	-25.3	35.8	0	0	0	113.6	D606 R611 S612	D606-P608 WeakPolarHBondContact OD1-CD 3.36Å; P608-R611 WeakPolarHBondContact O-CB 3.31Å; P608-R611 PolarHBondContact O-N 3.47Å; P608-S612 PolarHBondContact O-N 3.34Å
609	A	89.4	Confident	88.2	Confident	20 Å²	20	54.6 Å²	54.6	17%	0.165	30%	0.297	C	S	.	.	H	α-helix	trans	-65.8	-40.7	177	0	0	0	0	0	111.9	D606 V607 R611 S612 I613	D606-A609 HydrophobicContact CB-CB 4.18Å; D606-A609 PolarHBondContact O-N 2.88Å; D606-A609 WeakPolarHBondContact OD1-CB 3.32Å; D606-A609 PolarHBondContact OD1-N 3.23Å; D606-A609 WeakPolarHBondContact OD2-CB 3.46Å; V607-A609 PolarHBondContact O-N 3.38Å; A609-R611 VanDerWaalsContact C-N 3.29Å; A609-R611 PolarHBondContact O-N 2.84Å; A609-S612 WeakPolarHBondContact O-CB 2.94Å; A609-S612 PolarHBondContact O-N 2.92Å; A609-S612 VanDerWaalsContact O-N 3.12Å; A609-I613 WeakPolarHBondContact O-CG1 3.34Å; A609-I613 PolarHBondContact O-N 3.47Å
610	A	90.1	Very high	88.1	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60.8	-38.8	175.6	0	0	0	0	0	112.1	R601 W602 D606 V607 I613 L614 L634	R601-A610 HydrophobicContact CB-CB 4.17Å; W602-A610 HydrophobicContact CB-CB 4.12Å; D606-A610 PolarHBondContact O-N 3.34Å; D606-A610 VanDerWaalsContact O-N 3.13Å; V607-A610 PolarHBondContact O-N 3.48Å; A610-I613 PolarHBondContact O-N 3.21Å; A610-L614 WeakPolarHBondContact O-CG 3.25Å; A610-L614 PolarHBondContact O-N 3.04Å; A610-L634 HydrophobicContact CB-CD1 3.6Å
611	R	90.2	Very high	88.1	Confident	64 Å²	64	53.3 Å²	53.3	24%	0.242	30%	0.298	C	S	.	.	H	α-helix	trans	-63.3	-42.3	172	-70.5	173.8	179.4	134.4	-0.5	112.3	V607 P608 A609 I613 L614 A615 L634 E635	V607-R611 VanDerWaalsContact CG1-CZ 3.49Å; V607-R611 WeakPolarHBondContact O-CG 3.2Å; V607-R611 PolarHBondContact O-N 2.98Å; P608-R611 WeakPolarHBondContact O-CB 3.31Å; P608-R611 PolarHBondContact O-N 3.47Å; A609-R611 VanDerWaalsContact C-N 3.29Å; A609-R611 PolarHBondContact O-N 2.84Å; R611-I613 VanDerWaalsContact C-N 3.34Å; R611-L614 PolarHBondContact O-N 3Å; R611-A615 WeakPolarHBondContact O-CB 3.43Å; R611-A615 PolarHBondContact O-N 2.66Å; R611-L634 HydrophobicContact CG-CD2 3.81Å; R611-E635 WeakPolarHBondContact CD-OE1 3.49Å; R611-E635 IonicContact CZ-OE1 3.83Å; R611-E635 IonicContact CZ-OE2 3.26Å; R611-E635 IonicContact NE-OE1 2.98Å; R611-E635 PolarHBondContact NE-OE1 2.98Å; R611-E635 IonicContact NE-OE2 2.66Å; R611-E635 PolarHBondContact NE-OE2 3.37Å; R611-E635 IonicContact NH2-OE1 2.97Å; R611-E635 IonicContact NH2-OE2 3.19Å; R611-E635 PolarHBondContact NH2-OE2 3.14Å
612	S	91.4	Very high	87.7	Confident	69 Å²	69	53.2 Å²	53.2	48%	0.483	31%	0.307	S	S	.	.	H	α-helix	trans	-62.1	-41.9	176.8	-178.9	0	0	0	0	111.8	P608 A609 A615 R616	P608-S612 PolarHBondContact O-N 3.34Å; A609-S612 WeakPolarHBondContact O-CB 2.94Å; A609-S612 PolarHBondContact O-N 2.92Å; A609-S612 VanDerWaalsContact O-N 3.12Å; S612-A615 PolarHBondContact O-N 2.9Å; S612-R616 WeakPolarHBondContact O-CG 3.33Å; S612-R616 PolarHBondContact O-N 2.84Å
613	I	91.2	Very high	87.2	Confident	27 Å²	27	56.8 Å²	56.8	14%	0.138	33%	0.33	C	S	.	.	H	α-helix	trans	-63.3	-44.8	175.1	-67.4	168.8	0	0	0	110.9	W594 A597 A598 R601 A609 A610 R611 R616 A617	W594-I613 HydrophobicContact CE3-CG2 3.83Å; W594-I613 HydrophobicContact CZ3-CG2 4.16Å; W594-I613 WeakPolarHBondContact CZ3-O 3.34Å; A597-I613 HydrophobicContact CB-CD1 4.49Å; A597-I613 HydrophobicContact CB-CG2 4Å; A598-I613 HydrophobicContact CB-CG2 4.47Å; R601-I613 HydrophobicContact CB-CD1 4.29Å; R601-I613 HydrophobicContact CG-CD1 3.61Å; A609-I613 WeakPolarHBondContact O-CG1 3.34Å; A609-I613 PolarHBondContact O-N 3.47Å; A610-I613 PolarHBondContact O-N 3.21Å; R611-I613 VanDerWaalsContact C-N 3.34Å; I613-R616 PolarHBondContact O-N 2.88Å; I613-A617 WeakPolarHBondContact O-CB 3.38Å; I613-A617 PolarHBondContact O-N 2.96Å
614	L	89.2	Confident	87.1	Confident	7 Å²	7	51.2 Å²	51.2	4%	0.037	30%	0.302	C	S	.	.	H	α-helix	trans	-66.3	-35.4	176.5	-72.3	172	0	0	0	112.6	A598 A610 R611 A617 F618 I627 A631 L634	A598-L614 HydrophobicContact CB-CD1 4.31Å; A598-L614 HydrophobicContact CB-CD2 3.84Å; A598-L614 HydrophobicContact CB-CG 3.82Å; A610-L614 WeakPolarHBondContact O-CG 3.25Å; A610-L614 PolarHBondContact O-N 3.04Å; R611-L614 PolarHBondContact O-N 3Å; L614-A617 CarbonylContact O-C 3.59Å; L614-A617 WeakPolarHBondContact O-CA 3.42Å; L614-A617 WeakPolarHBondContact O-CB 3.39Å; L614-A617 PolarHBondContact O-N 2.85Å; L614-A617 VanDerWaalsContact O-N 3.14Å; L614-F618 WeakPolarHBondContact O-CD2 3.28Å; L614-F618 PolarHBondContact O-N 3.1Å; L614-I627 HydrophobicContact CD2-CG2 4.1Å; L614-A631 HydrophobicContact CD1-CB 4.17Å; L614-L634 HydrophobicContact CD1-CD1 4.13Å
615	A	89.5	Confident	87.2	Confident	49 Å²	49	51.5 Å²	51.5	41%	0.405	30%	0.298	S	S	.	.	H	α-helix	trans	-60.9	-46.2	173.4	0	0	0	0	0	111.2	R611 S612 A617 F618 E619	R611-A615 WeakPolarHBondContact O-CB 3.43Å; R611-A615 PolarHBondContact O-N 2.66Å; S612-A615 PolarHBondContact O-N 2.9Å; A615-A617 VanDerWaalsContact C-N 3.27Å; A615-A617 PolarHBondContact O-N 3.07Å; A615-F618 WeakPolarHBondContact O-CB 3.36Å; A615-F618 PolarHBondContact O-N 3.26Å; A615-F618 VanDerWaalsContact O-N 3.17Å; A615-E619 PolarHBondContact O-N 3.14Å; A615-E619 VanDerWaalsContact O-N 3.13Å
616	R	89.8	Confident	87.4	Confident	114 Å²	114	52.8 Å²	52.8	43%	0.43	29%	0.288	S	S	.	.	H	α-helix	trans	-62.9	-33.9	172.1	-69	175	60.9	-165.4	-3.9	112.4	W594 S612 I613 F618 E619 A620	W594-R616 HydrophobicContact CH2-CB 3.75Å; W594-R616 HydrophobicContact CZ3-CB 3.76Å; S612-R616 WeakPolarHBondContact O-CG 3.33Å; S612-R616 PolarHBondContact O-N 2.84Å; I613-R616 PolarHBondContact O-N 2.88Å; R616-F618 VanDerWaalsContact C-N 3.34Å; R616-E619 WeakPolarHBondContact O-CB 3.49Å; R616-E619 PolarHBondContact O-N 3.29Å; R616-A620 PolarHBondContact O-N 3.22Å; R616-A620 VanDerWaalsContact O-N 3.13Å
617	A	89.6	Confident	87.4	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.8	-35.8	175.4	0	0	0	0	0	111.9	W594 I613 L614 A615 A620 N621 I627	W594-A617 HydrophobicContact CB-CB 3.92Å; W594-A617 HydrophobicContact CD2-CB 3.63Å; W594-A617 HydrophobicContact CE3-CB 3.66Å; W594-A617 HydrophobicContact CG-CB 3.78Å; W594-A617 HydrophobicContact CZ3-CB 4.24Å; I613-A617 WeakPolarHBondContact O-CB 3.38Å; I613-A617 PolarHBondContact O-N 2.96Å; L614-A617 CarbonylContact O-C 3.59Å; L614-A617 WeakPolarHBondContact O-CA 3.42Å; L614-A617 WeakPolarHBondContact O-CB 3.39Å; L614-A617 PolarHBondContact O-N 2.85Å; L614-A617 VanDerWaalsContact O-N 3.14Å; A615-A617 VanDerWaalsContact C-N 3.27Å; A615-A617 PolarHBondContact O-N 3.07Å; A617-A620 PolarHBondContact O-N 3.35Å; A617-N621 PolarHBondContact O-N 2.76Å; A617-I627 HydrophobicContact CB-CD1 4.05Å; A617-I627 HydrophobicContact CB-CG2 4.16Å
618	F	88.1	Confident	87.5	Confident	45 Å²	45	49.8 Å²	49.8	20%	0.197	27%	0.269	C	S	.	.	H	α-helix	trans	-67.1	-36.6	172.7	-73.2	-59	0	0	0	112.7	L614 A615 R616 A620 N621 I627 W628 A631	L614-F618 WeakPolarHBondContact O-CD2 3.28Å; L614-F618 PolarHBondContact O-N 3.1Å; A615-F618 WeakPolarHBondContact O-CB 3.36Å; A615-F618 PolarHBondContact O-N 3.26Å; A615-F618 VanDerWaalsContact O-N 3.17Å; R616-F618 VanDerWaalsContact C-N 3.34Å; F618-A620 VanDerWaalsContact C-N 3.29Å; F618-A620 PolarHBondContact O-N 3.28Å; F618-N621 CarbonylContact O-C 3.45Å; F618-N621 PolarHBondContact O-N 2.73Å; F618-I627 HydrophobicContact CD1-CG2 3.92Å; F618-I627 HydrophobicContact CE1-CB 4.25Å; F618-I627 HydrophobicContact CE1-CG2 3.62Å; F618-I627 HydrophobicContact CE2-CG2 4.33Å; F618-I627 HydrophobicContact CG-CG2 4.38Å; F618-I627 HydrophobicContact CZ-CG2 3.85Å; F618-W628 HydrophobicContact CD1-CZ2 4.24Å; F618-W628 AromaticContact CE1-CD2 3.5Å; F618-W628 HydrophobicContact CE1-CD2 3.5Å; F618-W628 VanDerWaalsContact CE1-CD2 3.5Å; F618-W628 AromaticContact CE1-CE2 3.52Å; F618-W628 AromaticContact CE1-CE3 3.86Å; F618-W628 HydrophobicContact CE1-CE3 3.86Å; F618-W628 AromaticContact CE1-CG 3.89Å; F618-W628 HydrophobicContact CE1-CG 3.89Å; F618-W628 HydrophobicContact CE1-CH2 4.22Å; F618-W628 AromaticContact CE1-CZ2 3.9Å; F618-W628 HydrophobicContact CE1-CZ2 3.9Å; F618-W628 HydrophobicContact CE1-CZ3 4.21Å; F618-W628 AromaticContact CE1-NE1 3.87Å; F618-W628 AromaticContact CZ-CD2 3.9Å; F618-W628 HydrophobicContact CZ-CD2 3.9Å; F618-W628 AromaticContact CZ-CE3 3.77Å; F618-W628 HydrophobicContact CZ-CE3 3.77Å; F618-W628 HydrophobicContact CZ-CG 4.43Å; F618-W628 HydrophobicContact CZ-CH2 4.41Å; F618-W628 HydrophobicContact CZ-CZ3 4.05Å; F618-A631 HydrophobicContact CE2-CB 4.12Å; F618-A631 HydrophobicContact CZ-CB 3.92Å
619	E	86.5	Confident	87.4	Confident	161 Å²	161	46.7 Å²	46.7	75%	0.752	25%	0.248	S	C	*	.	H	α-helix	trans	-62.2	-39.2	173.6	-68.5	171.7	-178.9	0	0	111.6	A615 R616	A615-E619 PolarHBondContact O-N 3.14Å; A615-E619 VanDerWaalsContact O-N 3.13Å; R616-E619 WeakPolarHBondContact O-CB 3.49Å; R616-E619 PolarHBondContact O-N 3.29Å
620	A	86	Confident	87.2	Confident	39 Å²	39	47 Å²	47	32%	0.322	25%	0.251	S	S	.	.	H	α-helix	trans	-75.8	-40.5	177.3	0	0	0	0	0	112.8	P588 W594 R616 A617 F618	P588-A620 HydrophobicContact CB-CB 4.25Å; W594-A620 HydrophobicContact CZ2-CB 3.99Å; R616-A620 PolarHBondContact O-N 3.22Å; R616-A620 VanDerWaalsContact O-N 3.13Å; A617-A620 PolarHBondContact O-N 3.35Å; F618-A620 VanDerWaalsContact C-N 3.29Å; F618-A620 PolarHBondContact O-N 3.28Å
621	N	86	Confident	87.2	Confident	17 Å²	17	47.3 Å²	47.3	9%	0.091	25%	0.253	C	S	.	.			trans	-135.7	87	-171.9	-53.9	-62	0	0	0	111.1	P588 A617 F618 N623 S624 I627	P588-N621 PolarHBondContact O-ND2 2.85Å; A617-N621 PolarHBondContact O-N 2.76Å; F618-N621 CarbonylContact O-C 3.45Å; F618-N621 PolarHBondContact O-N 2.73Å; N621-N623 PolarHBondContact O-N 3.23Å; N621-S624 WeakPolarHBondContact CB-OG 3.04Å; N621-I627 HydrophobicContact CB-CD1 3.83Å
622	P	78.3	Confident	87.1	Confident	74 Å²	74	44.7 Å²	44.7	48%	0.481	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-26.4	-173.3	24.4	-33.2	0	0	0	114.3	W628	P622-W628 PolarHBondContact O-NE1 3.46Å
623	N	77.9	Confident	87	Confident	119 Å²	119	46.3 Å²	46.3	64%	0.636	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.4	2.4	-170.5	-62.4	-17.6	0	0	0	114	N621 E625	N621-N623 PolarHBondContact O-N 3.23Å; N623-E625 PolarHBondContact O-N 3.03Å
624	S	82.2	Confident	86.8	Confident	10 Å²	10	45.3 Å²	45.3	7%	0.07	24%	0.238	C	C	.	.			trans	-77.8	111.4	-169.4	-61.2	0	0	0	0	112.4	E591 N621 E626 I627 W628	E591-S624 VanDerWaalsContact CD-CB 3.44Å; E591-S624 VanDerWaalsContact OE1-CB 3.28Å; E591-S624 WeakPolarHBondContact OE1-CB 3.48Å; E591-S624 PolarHBondContact OE1-OG 3.47Å; N621-S624 WeakPolarHBondContact CB-OG 3.04Å; S624-E626 VanDerWaalsContact C-N 3.26Å; S624-E626 PolarHBondContact O-N 2.9Å; S624-I627 PolarHBondContact O-N 3.48Å; S624-W628 PolarHBondContact O-N 3.38Å
625	E	85	Confident	86.7	Confident	37 Å²	37	45.6 Å²	45.6	17%	0.173	24%	0.239	C	C	.	.	H	α-helix	trans	-55.5	-40.3	176.6	-179	-178	155.5	0	0	112.1	N623 I627 W628 L629 T657 R659 V660	N623-E625 PolarHBondContact O-N 3.03Å; E625-I627 VanDerWaalsContact C-N 3.34Å; E625-I627 PolarHBondContact O-N 3.29Å; E625-W628 PolarHBondContact O-N 3.08Å; E625-L629 HydrophobicContact CG-CD1 3.92Å; E625-L629 HydrophobicContact CG-CG 4.23Å; E625-L629 VanDerWaalsContact O-CG 3.32Å; E625-L629 WeakPolarHBondContact O-CG 3.38Å; E625-L629 PolarHBondContact O-N 3.35Å; E625-T657 VanDerWaalsContact OE2-CB 3.25Å; E625-T657 WeakPolarHBondContact OE2-CB 3.44Å; E625-T657 WeakPolarHBondContact OE2-CG2 3.46Å; E625-T657 PolarHBondContact OE2-OG1 3.07Å; E625-R659 WeakPolarHBondContact OE1-CB 3.39Å; E625-R659 WeakPolarHBondContact OE1-CD 3.41Å; E625-R659 WeakPolarHBondContact OE1-CG 3.47Å; E625-R659 IonicContact OE1-NE 3.87Å; E625-R659 IonicContact OE1-NH1 2.9Å; E625-V660 HydrophobicContact CG-CG2 3.73Å
626	E	86.9	Confident	86.6	Confident	83 Å²	83	43.6 Å²	43.6	39%	0.388	22%	0.222	S	C	.	.	H	α-helix	trans	-65.2	-38.3	-175.6	-56.2	-166.4	161.3	0	0	112.4	L595 S624 L629 A630	L595-E626 HydrophobicContact CD1-CB 4Å; S624-E626 VanDerWaalsContact C-N 3.26Å; S624-E626 PolarHBondContact O-N 2.9Å; E626-L629 PolarHBondContact O-N 2.8Å; E626-A630 VanDerWaalsContact O-CB 3.25Å; E626-A630 WeakPolarHBondContact O-CB 3.34Å; E626-A630 PolarHBondContact O-N 3.33Å
627	I	88.8	Confident	86.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-67.9	-44	177.8	-56.7	179.5	0	0	0	109.9	E591 L614 A617 F618 N621 S624 E625 L629 A630 A631	E591-I627 HydrophobicContact CG-CD1 4.38Å; L614-I627 HydrophobicContact CD2-CG2 4.1Å; A617-I627 HydrophobicContact CB-CD1 4.05Å; A617-I627 HydrophobicContact CB-CG2 4.16Å; F618-I627 HydrophobicContact CD1-CG2 3.92Å; F618-I627 HydrophobicContact CE1-CB 4.25Å; F618-I627 HydrophobicContact CE1-CG2 3.62Å; F618-I627 HydrophobicContact CE2-CG2 4.33Å; F618-I627 HydrophobicContact CG-CG2 4.38Å; F618-I627 HydrophobicContact CZ-CG2 3.85Å; N621-I627 HydrophobicContact CB-CD1 3.83Å; S624-I627 PolarHBondContact O-N 3.48Å; E625-I627 VanDerWaalsContact C-N 3.34Å; E625-I627 PolarHBondContact O-N 3.29Å; I627-L629 PolarHBondContact O-N 3.18Å; I627-A630 PolarHBondContact O-N 3.11Å; I627-A631 WeakPolarHBondContact O-CB 3.31Å; I627-A631 PolarHBondContact O-N 2.82Å
628	W	89.8	Confident	86.2	Confident	25 Å²	25	43.6 Å²	43.6	10%	0.095	23%	0.228	C	C	.	.	H	α-helix	trans	-57.3	-50.6	174.2	-79.4	110.8	0	0	0	111.6	F618 P622 S624 E625 A630 A631 V632 L647 K650 A651	F618-W628 HydrophobicContact CD1-CZ2 4.24Å; F618-W628 AromaticContact CE1-CD2 3.5Å; F618-W628 HydrophobicContact CE1-CD2 3.5Å; F618-W628 VanDerWaalsContact CE1-CD2 3.5Å; F618-W628 AromaticContact CE1-CE2 3.52Å; F618-W628 AromaticContact CE1-CE3 3.86Å; F618-W628 HydrophobicContact CE1-CE3 3.86Å; F618-W628 AromaticContact CE1-CG 3.89Å; F618-W628 HydrophobicContact CE1-CG 3.89Å; F618-W628 HydrophobicContact CE1-CH2 4.22Å; F618-W628 AromaticContact CE1-CZ2 3.9Å; F618-W628 HydrophobicContact CE1-CZ2 3.9Å; F618-W628 HydrophobicContact CE1-CZ3 4.21Å; F618-W628 AromaticContact CE1-NE1 3.87Å; F618-W628 AromaticContact CZ-CD2 3.9Å; F618-W628 HydrophobicContact CZ-CD2 3.9Å; F618-W628 AromaticContact CZ-CE3 3.77Å; F618-W628 HydrophobicContact CZ-CE3 3.77Å; F618-W628 HydrophobicContact CZ-CG 4.43Å; F618-W628 HydrophobicContact CZ-CH2 4.41Å; F618-W628 HydrophobicContact CZ-CZ3 4.05Å; P622-W628 PolarHBondContact O-NE1 3.46Å; S624-W628 PolarHBondContact O-N 3.38Å; E625-W628 PolarHBondContact O-N 3.08Å; W628-A630 VanDerWaalsContact C-N 3.29Å; W628-A630 PolarHBondContact O-N 3.34Å; W628-A631 PolarHBondContact O-N 2.88Å; W628-V632 VanDerWaalsContact O-CG2 3.29Å; W628-V632 WeakPolarHBondContact O-CG2 3.22Å; W628-V632 PolarHBondContact O-N 3.06Å; W628-L647 HydrophobicContact CE3-CD2 4.47Å; W628-L647 HydrophobicContact CZ3-CB 4.42Å; W628-L647 HydrophobicContact CZ3-CD2 3.78Å; W628-K650 HydrophobicContact CH2-CB 3.79Å; W628-K650 HydrophobicContact CH2-CD 4.42Å; W628-K650 HydrophobicContact CZ3-CB 3.95Å; W628-A651 HydrophobicContact CB-CB 3.98Å; W628-A651 HydrophobicContact CD2-CB 3.82Å; W628-A651 HydrophobicContact CE3-CB 3.83Å; W628-A651 HydrophobicContact CG-CB 3.9Å
629	L	88.6	Confident	86	Confident	21 Å²	21	48.8 Å²	48.8	11%	0.11	25%	0.251	C	S	.	.	H	α-helix	trans	-65.1	-33.5	179.6	-67.2	-178.3	0	0	0	112.5	E625 E626 I627 K633 R659 V660 K663	E625-L629 HydrophobicContact CG-CD1 3.92Å; E625-L629 HydrophobicContact CG-CG 4.23Å; E625-L629 VanDerWaalsContact O-CG 3.32Å; E625-L629 WeakPolarHBondContact O-CG 3.38Å; E625-L629 PolarHBondContact O-N 3.35Å; E626-L629 PolarHBondContact O-N 2.8Å; I627-L629 PolarHBondContact O-N 3.18Å; L629-K633 WeakPolarHBondContact O-CB 3.32Å; L629-K633 PolarHBondContact O-N 3.46Å; L629-R659 HydrophobicContact CD1-CG 3.97Å; L629-V660 HydrophobicContact CD2-CG2 4.33Å; L629-K663 HydrophobicContact CD2-CB 3.84Å; L629-K663 HydrophobicContact CD2-CG 3.77Å
630	A	86.9	Confident	86.1	Confident	27 Å²	27	45 Å²	45	22%	0.223	23%	0.233	C	C	.	.	H	α-helix	trans	-70	-40	174.7	0	0	0	0	0	112.6	L595 E626 I627 W628 K633 L634	L595-A630 HydrophobicContact CD2-CB 3.23Å; E626-A630 VanDerWaalsContact O-CB 3.25Å; E626-A630 WeakPolarHBondContact O-CB 3.34Å; E626-A630 PolarHBondContact O-N 3.33Å; I627-A630 PolarHBondContact O-N 3.11Å; W628-A630 VanDerWaalsContact C-N 3.29Å; W628-A630 PolarHBondContact O-N 3.34Å; A630-K633 WeakPolarHBondContact O-CB 3.5Å; A630-K633 PolarHBondContact O-N 2.96Å; A630-L634 WeakPolarHBondContact O-CB 3.4Å; A630-L634 PolarHBondContact O-N 3.24Å
631	A	89	Confident	86.2	Confident	5 Å²	5	45.6 Å²	45.6	4%	0.041	23%	0.227	C	C	.	.	H	α-helix	trans	-62.5	-43.9	173.5	0	0	0	0	0	111.2	L614 F618 I627 W628 K633 L634 E635 L647	L614-A631 HydrophobicContact CD1-CB 4.17Å; F618-A631 HydrophobicContact CE2-CB 4.12Å; F618-A631 HydrophobicContact CZ-CB 3.92Å; I627-A631 WeakPolarHBondContact O-CB 3.31Å; I627-A631 PolarHBondContact O-N 2.82Å; W628-A631 PolarHBondContact O-N 2.88Å; A631-K633 VanDerWaalsContact C-N 3.34Å; A631-K633 PolarHBondContact O-N 2.92Å; A631-L634 PolarHBondContact O-N 2.88Å; A631-E635 PolarHBondContact O-N 2.84Å; A631-L647 HydrophobicContact CB-CD1 4.26Å
632	V	89.2	Confident	86.4	Confident	10 Å²	10	47.6 Å²	47.6	6%	0.061	25%	0.247	C	C	.	.	H	α-helix	trans	-61.9	-42.9	174.4	173.5	0	0	0	0	111	W628 E635 S636 L647 L648	W628-V632 VanDerWaalsContact O-CG2 3.29Å; W628-V632 WeakPolarHBondContact O-CG2 3.22Å; W628-V632 PolarHBondContact O-N 3.06Å; V632-E635 PolarHBondContact O-N 3.39Å; V632-S636 WeakPolarHBondContact O-CB 3.12Å; V632-S636 PolarHBondContact O-N 3.31Å; V632-S636 PolarHBondContact O-OG 3.24Å; V632-L647 HydrophobicContact CG2-CB 4.1Å; V632-L648 HydrophobicContact CB-CD2 4.41Å; V632-L648 HydrophobicContact CB-CG 4.43Å; V632-L648 HydrophobicContact CG1-CD1 3.91Å; V632-L648 HydrophobicContact CG1-CD2 3.98Å; V632-L648 HydrophobicContact CG1-CG 3.86Å; V632-L648 HydrophobicContact CG2-CD2 3.73Å; V632-L648 HydrophobicContact CG2-CG 3.65Å
633	K	87.6	Confident	86.9	Confident	102 Å²	102	50 Å²	50	44%	0.443	25%	0.246	S	C	.	.	H	α-helix	trans	-58.5	-50.2	175.8	-177.3	178.4	177.1	177.5	0	111	L629 A630 A631 E635 S636 E637	L629-K633 WeakPolarHBondContact O-CB 3.32Å; L629-K633 PolarHBondContact O-N 3.46Å; A630-K633 WeakPolarHBondContact O-CB 3.5Å; A630-K633 PolarHBondContact O-N 2.96Å; A631-K633 VanDerWaalsContact C-N 3.34Å; A631-K633 PolarHBondContact O-N 2.92Å; K633-E635 PolarHBondContact O-N 3.26Å; K633-S636 WeakPolarHBondContact CA-OG 3.37Å; K633-S636 PolarHBondContact O-N 3.03Å; K633-S636 PolarHBondContact O-OG 2.93Å; K633-E637 WeakPolarHBondContact CE-OE1 3.17Å; K633-E637 HydrophobicContact CG-CG 4.48Å; K633-E637 WeakPolarHBondContact CG-OE1 3.05Å; K633-E637 WeakPolarHBondContact O-CG 3.45Å; K633-E637 PolarHBondContact O-N 3.42Å
634	L	87.6	Confident	87.4	Confident	7 Å²	7	44.3 Å²	44.3	4%	0.037	22%	0.216	C	C	.	.	H	α-helix	trans	-58.3	-46.2	179.9	-178.2	143.1	0	0	0	112.3	W602 V607 A610 R611 L614 A630 A631 N638	W602-L634 HydrophobicContact CB-CD1 4.28Å; W602-L634 HydrophobicContact CG-CD1 4.25Å; V607-L634 HydrophobicContact CG1-CD2 4.01Å; A610-L634 HydrophobicContact CB-CD1 3.6Å; R611-L634 HydrophobicContact CG-CD2 3.81Å; L614-L634 HydrophobicContact CD1-CD1 4.13Å; A630-L634 WeakPolarHBondContact O-CB 3.4Å; A630-L634 PolarHBondContact O-N 3.24Å; A631-L634 PolarHBondContact O-N 2.88Å; L634-N638 WeakPolarHBondContact O-CB 3.25Å; L634-N638 PolarHBondContact O-N 3.24Å; L634-N638 PolarHBondContact O-ND2 3.27Å
635	E	88.5	Confident	87.8	Confident	13 Å²	13	47.7 Å²	47.7	6%	0.061	23%	0.227	C	C	.	.	H	α-helix	trans	-71	-36.6	178.1	-62.9	-61.8	175.5	0	0	112.2	R611 A631 V632 K633 E637 N638 K639 E640 R643 A644 L647	R611-E635 WeakPolarHBondContact CD-OE1 3.49Å; R611-E635 IonicContact CZ-OE1 3.83Å; R611-E635 IonicContact CZ-OE2 3.26Å; R611-E635 IonicContact NE-OE1 2.98Å; R611-E635 PolarHBondContact NE-OE1 2.98Å; R611-E635 IonicContact NE-OE2 2.66Å; R611-E635 PolarHBondContact NE-OE2 3.37Å; R611-E635 IonicContact NH2-OE1 2.97Å; R611-E635 IonicContact NH2-OE2 3.19Å; R611-E635 PolarHBondContact NH2-OE2 3.14Å; A631-E635 PolarHBondContact O-N 2.84Å; V632-E635 PolarHBondContact O-N 3.39Å; K633-E635 PolarHBondContact O-N 3.26Å; E635-E637 VanDerWaalsContact C-N 3.35Å; E635-E637 PolarHBondContact O-N 3.03Å; E635-N638 PolarHBondContact O-N 3.26Å; E635-K639 PolarHBondContact O-N 2.66Å; E635-E640 HydrophobicContact CB-CB 4.41Å; E635-E640 PolarHBondContact O-N 3.26Å; E635-E640 WeakPolarHBondContact OE2-CB 2.99Å; E635-R643 HydrophobicContact CG-CB 4.27Å; E635-A644 HydrophobicContact CB-CB 3.99Å; E635-L647 HydrophobicContact CG-CD1 3.8Å
636	S	86.7	Confident	88	Confident	7 Å²	7	54.4 Å²	54.4	5%	0.049	25%	0.25	C	S	.	.	H	α-helix	trans	-65.4	-36.8	178.9	73.1	0	0	0	0	112.8	V632 K633 Y641	V632-S636 WeakPolarHBondContact O-CB 3.12Å; V632-S636 PolarHBondContact O-N 3.31Å; V632-S636 PolarHBondContact O-OG 3.24Å; K633-S636 WeakPolarHBondContact CA-OG 3.37Å; K633-S636 PolarHBondContact O-N 3.03Å; K633-S636 PolarHBondContact O-OG 2.93Å; S636-Y641 WeakPolarHBondContact O-CE1 3.38Å
637	E	85	Confident	88.1	Confident	65 Å²	65	52.2 Å²	52.2	30%	0.304	24%	0.241	S	C	.	.	H	α-helix	trans	-77.5	-28.3	179.1	-68.5	-166.4	-143.5	0	0	112.3	W602 K633 E635 K639 K919	W602-E637 HydrophobicContact CH2-CG 4.42Å; W602-E637 WeakPolarHBondContact CH2-OE1 3.1Å; W602-E637 WeakPolarHBondContact CH2-OE2 3.31Å; W602-E637 HydrophobicContact CZ2-CB 3.84Å; W602-E637 VanDerWaalsContact CZ2-CD 3.45Å; W602-E637 HydrophobicContact CZ2-CG 4.2Å; W602-E637 WeakPolarHBondContact CZ2-OE2 3.27Å; K633-E637 WeakPolarHBondContact CE-OE1 3.17Å; K633-E637 HydrophobicContact CG-CG 4.48Å; K633-E637 WeakPolarHBondContact CG-OE1 3.05Å; K633-E637 WeakPolarHBondContact O-CG 3.45Å; K633-E637 PolarHBondContact O-N 3.42Å; E635-E637 VanDerWaalsContact C-N 3.35Å; E635-E637 PolarHBondContact O-N 3.03Å; E637-K639 VanDerWaalsContact C-N 3.27Å; E637-K639 PolarHBondContact O-N 3.18Å; E637-K919 IonicContact OE2-NZ 2.8Å; E637-K919 PolarHBondContact OE2-NZ 2.97Å
638	N	85.3	Confident	88	Confident	49 Å²	49	52.4 Å²	52.4	26%	0.262	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	11	175.5	-65.4	-37.8	0	0	0	113.8	V607 L634 E635 E640	V607-N638 WeakPolarHBondContact CG1-ND2 3.2Å; V607-N638 WeakPolarHBondContact CG2-ND2 3.17Å; L634-N638 WeakPolarHBondContact O-CB 3.25Å; L634-N638 PolarHBondContact O-N 3.24Å; L634-N638 PolarHBondContact O-ND2 3.27Å; E635-N638 PolarHBondContact O-N 3.26Å; N638-E640 PolarHBondContact O-N 2.92Å
639	K	84.9	Confident	88	Confident	153 Å²	153	55.8 Å²	55.8	67%	0.665	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	14.7	178.2	-51.6	176.2	-177.9	175.1	0	115.4	E635 E637 Y641	E635-K639 PolarHBondContact O-N 2.66Å; E637-K639 VanDerWaalsContact C-N 3.27Å; E637-K639 PolarHBondContact O-N 3.18Å; K639-Y641 VanDerWaalsContact C-N 3.26Å; K639-Y641 HydrophobicContact CB-CE2 4.15Å; K639-Y641 WeakPolarHBondContact O-CD2 3.47Å; K639-Y641 PolarHBondContact O-N 3.45Å; K639-Y641 VanDerWaalsContact O-N 3.11Å
640	E	88.1	Confident	87.9	Confident	83 Å²	83	61.1 Å²	61.1	39%	0.388	28%	0.284	S	S	.	.			trans	-89.5	58.8	177.8	-71	-64.8	160.8	0	0	111.1	E635 N638 A642 R643 A644	E635-E640 HydrophobicContact CB-CB 4.41Å; E635-E640 PolarHBondContact O-N 3.26Å; E635-E640 WeakPolarHBondContact OE2-CB 2.99Å; N638-E640 PolarHBondContact O-N 2.92Å; E640-A642 VanDerWaalsContact C-N 3.27Å; E640-A642 PolarHBondContact O-N 2.9Å; E640-R643 HydrophobicContact CB-CB 4.42Å; E640-R643 PolarHBondContact O-N 2.84Å; E640-R643 VanDerWaalsContact O-N 3.12Å; E640-A644 PolarHBondContact O-N 3.25Å
641	Y	88.5	Confident	87.9	Confident	50 Å²	50	59.8 Å²	59.8	20%	0.196	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-31	-171.4	-51.4	-62.2	0	0	0	113.4	S636 K639 R643 A644 R645 L667 L671	S636-Y641 WeakPolarHBondContact O-CE1 3.38Å; K639-Y641 VanDerWaalsContact C-N 3.26Å; K639-Y641 HydrophobicContact CB-CE2 4.15Å; K639-Y641 WeakPolarHBondContact O-CD2 3.47Å; K639-Y641 PolarHBondContact O-N 3.45Å; K639-Y641 VanDerWaalsContact O-N 3.11Å; Y641-R643 VanDerWaalsContact C-N 3.32Å; Y641-R643 PolarHBondContact O-N 2.83Å; Y641-A644 PolarHBondContact O-N 2.66Å; Y641-R645 WeakPolarHBondContact O-CG 3.11Å; Y641-R645 PolarHBondContact O-N 3.01Å; Y641-L667 HydrophobicContact CD1-CD1 4.41Å; Y641-L671 HydrophobicContact CD1-CD2 3.89Å; Y641-L671 HydrophobicContact CD2-CD2 3.83Å; Y641-L671 HydrophobicContact CE1-CD2 4.02Å; Y641-L671 HydrophobicContact CE2-CD2 3.96Å; Y641-L671 HydrophobicContact CG-CD1 4.35Å; Y641-L671 HydrophobicContact CG-CD2 3.78Å
642	A	90.4	Very high	87.7	Confident	60 Å²	60	60.5 Å²	60.5	50%	0.496	28%	0.278	S	S	.	.	H	α-helix	trans	-64.1	-38	176.6	0	0	0	0	0	112	E640 R646	E640-A642 VanDerWaalsContact C-N 3.27Å; E640-A642 PolarHBondContact O-N 2.9Å; A642-R646 WeakPolarHBondContact O-CG 3.28Å; A642-R646 PolarHBondContact O-N 3.38Å
643	R	88	Confident	87.5	Confident	124 Å²	124	64.2 Å²	64.2	47%	0.468	31%	0.31	S	S	.	.	H	α-helix	trans	-70.3	-42.9	173.3	-66.4	-175.4	-178.5	-159.6	-0.9	110.7	E635 E640 Y641 R645 R646 L647	E635-R643 HydrophobicContact CG-CB 4.27Å; E640-R643 HydrophobicContact CB-CB 4.42Å; E640-R643 PolarHBondContact O-N 2.84Å; E640-R643 VanDerWaalsContact O-N 3.12Å; Y641-R643 VanDerWaalsContact C-N 3.32Å; Y641-R643 PolarHBondContact O-N 2.83Å; R643-R645 VanDerWaalsContact C-N 3.32Å; R643-R645 PolarHBondContact O-N 3.21Å; R643-R646 PolarHBondContact O-N 3.07Å; R643-L647 WeakPolarHBondContact O-CG 3.48Å; R643-L647 PolarHBondContact O-N 2.82Å
644	A	89.1	Confident	87.2	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-57.8	-43	176.6	0	0	0	0	0	112.2	E635 E640 Y641 L647 L648 L667	E635-A644 HydrophobicContact CB-CB 3.99Å; E640-A644 PolarHBondContact O-N 3.25Å; Y641-A644 PolarHBondContact O-N 2.66Å; A644-L647 PolarHBondContact O-N 3.32Å; A644-L648 WeakPolarHBondContact O-CB 3.35Å; A644-L648 WeakPolarHBondContact O-CG 3.46Å; A644-L648 PolarHBondContact O-N 3.31Å; A644-L667 HydrophobicContact CB-CD2 3.89Å
645	R	89.6	Confident	86.5	Confident	81 Å²	81	62.6 Å²	62.6	31%	0.306	31%	0.313	S	S	.	.	H	α-helix	trans	-58.5	-51.9	173.7	-76.4	174.9	174.1	160.7	-1.2	112	Y641 R643 L647 L648 D649 L667 E668	Y641-R645 WeakPolarHBondContact O-CG 3.11Å; Y641-R645 PolarHBondContact O-N 3.01Å; R643-R645 VanDerWaalsContact C-N 3.32Å; R643-R645 PolarHBondContact O-N 3.21Å; R645-L647 VanDerWaalsContact C-N 3.28Å; R645-L647 PolarHBondContact O-N 3.14Å; R645-L648 WeakPolarHBondContact O-CB 3.48Å; R645-L648 PolarHBondContact O-N 3.06Å; R645-L648 VanDerWaalsContact O-N 3.08Å; R645-D649 PolarHBondContact O-N 2.9Å; R645-L667 HydrophobicContact CG-CD2 4.42Å; R645-E668 WeakPolarHBondContact CD-OE1 3.32Å; R645-E668 WeakPolarHBondContact CG-OE1 3.47Å; R645-E668 IonicContact CZ-OE1 3.77Å; R645-E668 IonicContact CZ-OE2 3.7Å; R645-E668 IonicContact NE-OE1 3.28Å; R645-E668 PolarHBondContact NE-OE1 3.02Å; R645-E668 IonicContact NE-OE2 2.82Å; R645-E668 PolarHBondContact NE-OE2 3.27Å; R645-E668 IonicContact NH2-OE1 2.95Å; R645-E668 IonicContact NH2-OE2 3.53Å; R645-E668 PolarHBondContact NH2-OE2 3.36Å
646	R	90.2	Very high	85.9	Confident	177 Å²	177	65.1 Å²	65.1	67%	0.668	33%	0.332	S	S	*	.	H	α-helix	trans	-60.3	-37.2	177.7	-68.9	177.4	-174.4	169.1	2.2	112.7	A642 R643 K650	A642-R646 WeakPolarHBondContact O-CG 3.28Å; A642-R646 PolarHBondContact O-N 3.38Å; R643-R646 PolarHBondContact O-N 3.07Å; R646-K650 WeakPolarHBondContact O-CG 3.3Å; R646-K650 PolarHBondContact O-N 3Å; R646-K650 VanDerWaalsContact O-N 3.16Å
647	L	88.5	Confident	85.9	Confident	37 Å²	37	67.4 Å²	67.4	19%	0.194	35%	0.346	C	S	.	.	H	α-helix	trans	-67.9	-40.2	175.2	-73	170	0	0	0	111.4	W628 A631 V632 E635 R643 A644 R645 K650 A651	W628-L647 HydrophobicContact CE3-CD2 4.47Å; W628-L647 HydrophobicContact CZ3-CB 4.42Å; W628-L647 HydrophobicContact CZ3-CD2 3.78Å; A631-L647 HydrophobicContact CB-CD1 4.26Å; V632-L647 HydrophobicContact CG2-CB 4.1Å; E635-L647 HydrophobicContact CG-CD1 3.8Å; R643-L647 WeakPolarHBondContact O-CG 3.48Å; R643-L647 PolarHBondContact O-N 2.82Å; A644-L647 PolarHBondContact O-N 3.32Å; R645-L647 VanDerWaalsContact C-N 3.28Å; R645-L647 PolarHBondContact O-N 3.14Å; L647-K650 PolarHBondContact O-N 2.93Å; L647-A651 VanDerWaalsContact O-CB 3.3Å; L647-A651 WeakPolarHBondContact O-CB 3.42Å; L647-A651 PolarHBondContact O-N 3.35Å
648	L	87.4	Confident	86	Confident	5 Å²	5	65.2 Å²	65.2	3%	0.026	34%	0.339	C	S	.	.	H	α-helix	trans	-66.4	-41.6	175.3	-78.7	164.5	0	0	0	112.3	V632 A644 R645 K650 A651 C652 V660 A664 L667	V632-L648 HydrophobicContact CB-CD2 4.41Å; V632-L648 HydrophobicContact CB-CG 4.43Å; V632-L648 HydrophobicContact CG1-CD1 3.91Å; V632-L648 HydrophobicContact CG1-CD2 3.98Å; V632-L648 HydrophobicContact CG1-CG 3.86Å; V632-L648 HydrophobicContact CG2-CD2 3.73Å; V632-L648 HydrophobicContact CG2-CG 3.65Å; A644-L648 WeakPolarHBondContact O-CB 3.35Å; A644-L648 WeakPolarHBondContact O-CG 3.46Å; A644-L648 PolarHBondContact O-N 3.31Å; R645-L648 WeakPolarHBondContact O-CB 3.48Å; R645-L648 PolarHBondContact O-N 3.06Å; R645-L648 VanDerWaalsContact O-N 3.08Å; L648-K650 VanDerWaalsContact C-N 3.29Å; L648-K650 PolarHBondContact O-N 3.11Å; L648-A651 CarbonylContact O-C 3.55Å; L648-A651 PolarHBondContact O-N 3.42Å; L648-A651 VanDerWaalsContact O-N 3.14Å; L648-C652 WeakPolarHBondContact O-CB 3.33Å; L648-C652 PolarHBondContact O-N 3.33Å; L648-C652 PolarHBondContact O-SG 3.24Å; L648-V660 HydrophobicContact CD2-CG1 4.49Å; L648-A664 HydrophobicContact CB-CB 4.41Å; L648-A664 HydrophobicContact CD1-CB 4.23Å; L648-A664 HydrophobicContact CD2-CB 4.03Å; L648-A664 HydrophobicContact CG-CB 4.45Å; L648-L667 HydrophobicContact CD1-CB 4.09Å; L648-L667 HydrophobicContact CD1-CD2 3.42Å; L648-L667 VanDerWaalsContact CD1-CD2 3.42Å; L648-L667 HydrophobicContact CD1-CG 4.39Å
649	D	87.9	Confident	86.1	Confident	95 Å²	95	68.7 Å²	68.7	51%	0.508	35%	0.348	S	S	.	.	H	α-helix	trans	-60.5	-42.6	176	-66.5	-30.3	0	0	0	110.7	R645 A653	R645-D649 PolarHBondContact O-N 2.9Å; D649-A653 PolarHBondContact O-N 3.21Å
650	K	87.6	Confident	86.4	Confident	133 Å²	133	61.4 Å²	61.4	58%	0.578	32%	0.316	S	S	*	.	H	α-helix	trans	-64.7	-42.4	172.6	-72.9	179.8	179.3	-170.3	0	112.3	W628 R646 L647 L648 A653 S654	W628-K650 HydrophobicContact CH2-CB 3.79Å; W628-K650 HydrophobicContact CH2-CD 4.42Å; W628-K650 HydrophobicContact CZ3-CB 3.95Å; R646-K650 WeakPolarHBondContact O-CG 3.3Å; R646-K650 PolarHBondContact O-N 3Å; R646-K650 VanDerWaalsContact O-N 3.16Å; L647-K650 PolarHBondContact O-N 2.93Å; L648-K650 VanDerWaalsContact C-N 3.29Å; L648-K650 PolarHBondContact O-N 3.11Å; K650-A653 PolarHBondContact O-N 2.94Å; K650-S654 VanDerWaalsContact O-CB 3.29Å; K650-S654 WeakPolarHBondContact O-CB 3.35Å; K650-S654 PolarHBondContact O-N 3.3Å
651	A	87.1	Confident	86.5	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64.7	-42.1	178.3	0	0	0	0	0	111.3	W628 L647 L648 A653 S654 A655 V660	W628-A651 HydrophobicContact CB-CB 3.98Å; W628-A651 HydrophobicContact CD2-CB 3.82Å; W628-A651 HydrophobicContact CE3-CB 3.83Å; W628-A651 HydrophobicContact CG-CB 3.9Å; L647-A651 VanDerWaalsContact O-CB 3.3Å; L647-A651 WeakPolarHBondContact O-CB 3.42Å; L647-A651 PolarHBondContact O-N 3.35Å; L648-A651 CarbonylContact O-C 3.55Å; L648-A651 PolarHBondContact O-N 3.42Å; L648-A651 VanDerWaalsContact O-N 3.14Å; A651-A653 PolarHBondContact O-N 3.44Å; A651-S654 PolarHBondContact O-N 3.15Å; A651-A655 CarbonylContact O-C 3.44Å; A651-A655 WeakPolarHBondContact O-CA 3.45Å; A651-A655 PolarHBondContact O-N 3.48Å; A651-A655 VanDerWaalsContact O-O 3.09Å; A651-V660 HydrophobicContact CB-CG1 3.72Å
652	C	84.5	Confident	86.5	Confident	20 Å²	20	59.1 Å²	59.1	14%	0.135	31%	0.306	C	S	.	.	H	α-helix	trans	-62.4	-30.4	175.5	-72.6	0	0	0	0	112.4	L648 S656 W661	L648-C652 WeakPolarHBondContact O-CB 3.33Å; L648-C652 PolarHBondContact O-N 3.33Å; L648-C652 PolarHBondContact O-SG 3.24Å; C652-S656 WeakPolarHBondContact O-CB 3.25Å; C652-W661 HydrophobicContact CB-CZ2 4.12Å
653	A	85.6	Confident	86.4	Confident	88 Å²	88	59.8 Å²	59.8	73%	0.727	30%	0.298	S	S	*	.	H	α-helix	trans	-83	-39.6	176	0	0	0	0	0	113.4	D649 K650 A651	D649-A653 PolarHBondContact O-N 3.21Å; K650-A653 PolarHBondContact O-N 2.94Å; A651-A653 PolarHBondContact O-N 3.44Å
654	S	80.2	Confident	86.5	Confident	63 Å²	63	54 Å²	54	44%	0.441	28%	0.277	S	S	.	.	H	α-helix	trans	-88.5	-40.1	-173.5	-168.7	0	0	0	0	113.4	K650 A651	K650-S654 VanDerWaalsContact O-CB 3.29Å; K650-S654 WeakPolarHBondContact O-CB 3.35Å; K650-S654 PolarHBondContact O-N 3.3Å; A651-S654 PolarHBondContact O-N 3.15Å
655	A	72.4	Confident	86.5	Confident	12 Å²	12	54 Å²	54	10%	0.099	28%	0.277	C	S	.	.	S	Bend	trans	-133.2	70.3	-175.5	0	0	0	0	0	109	A651 T657 V660	A651-A655 CarbonylContact O-C 3.44Å; A651-A655 WeakPolarHBondContact O-CA 3.45Å; A651-A655 PolarHBondContact O-N 3.48Å; A651-A655 VanDerWaalsContact O-O 3.09Å; A655-T657 VanDerWaalsContact C-N 3.33Å; A655-T657 PolarHBondContact O-N 3.41Å; A655-V660 WeakPolarHBondContact O-CG2 3.29Å
656	S	77.3	Confident	86.5	Confident	66 Å²	66	51.6 Å²	51.6	46%	0.462	27%	0.267	S	S	.	.			trans	-72.4	82.1	-177.3	53	0	0	0	0	111.5	C652 Y688	C652-S656 WeakPolarHBondContact O-CB 3.25Å; S656-Y688 PolarHBondContact O-OH 3.2Å
657	T	85.9	Confident	86.4	Confident	55 Å²	55	43.6 Å²	43.6	34%	0.337	24%	0.238	S	C	.	.			trans	-108.8	146.1	169.9	-46.1	0	0	0	0	110.3	E625 A655 R659 V660 W661	E625-T657 VanDerWaalsContact OE2-CB 3.25Å; E625-T657 WeakPolarHBondContact OE2-CB 3.44Å; E625-T657 WeakPolarHBondContact OE2-CG2 3.46Å; E625-T657 PolarHBondContact OE2-OG1 3.07Å; A655-T657 VanDerWaalsContact C-N 3.33Å; A655-T657 PolarHBondContact O-N 3.41Å; T657-R659 HydrophobicContact CG2-CB 4.33Å; T657-R659 PolarHBondContact O-N 3.01Å; T657-V660 WeakPolarHBondContact O-CB 3.45Å; T657-V660 PolarHBondContact O-N 2.93Å; T657-W661 PolarHBondContact O-N 3.15Å
658	A	86.9	Confident	86.4	Confident	19 Å²	19	42.2 Å²	42.2	16%	0.157	23%	0.23	C	C	.	.	H	α-helix	trans	-51.1	-30.8	173.1	0	0	0	0	0	113.4	M662 Y688 A691 L694	A658-M662 VanDerWaalsContact O-CB 3.28Å; A658-M662 WeakPolarHBondContact O-CB 3.47Å; A658-M662 PolarHBondContact O-N 3.3Å; A658-Y688 HydrophobicContact CB-CD1 4.21Å; A658-Y688 HydrophobicContact CB-CD2 4.19Å; A658-Y688 HydrophobicContact CB-CG 3.86Å; A658-A691 HydrophobicContact CB-CB 3.82Å; A658-L694 HydrophobicContact CB-CD1 4.29Å
659	R	88.7	Confident	86.5	Confident	121 Å²	121	42.5 Å²	42.5	46%	0.457	23%	0.231	S	C	.	.	H	α-helix	trans	-71.5	-33.3	176.7	173.7	172.8	173.9	-151.5	7.6	113.1	E625 L629 T657 M662 K663	E625-R659 WeakPolarHBondContact OE1-CB 3.39Å; E625-R659 WeakPolarHBondContact OE1-CD 3.41Å; E625-R659 WeakPolarHBondContact OE1-CG 3.47Å; E625-R659 IonicContact OE1-NE 3.87Å; E625-R659 IonicContact OE1-NH1 2.9Å; L629-R659 HydrophobicContact CD1-CG 3.97Å; T657-R659 HydrophobicContact CG2-CB 4.33Å; T657-R659 PolarHBondContact O-N 3.01Å; R659-M662 HydrophobicContact CG-CE 4.18Å; R659-M662 WeakPolarHBondContact O-CB 3.18Å; R659-K663 WeakPolarHBondContact O-CG 3.42Å; R659-K663 PolarHBondContact O-N 3.49Å
660	V	89.9	Confident	86.4	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-67.3	-47.3	172.5	179.7	0	0	0	0	109.9	E625 L629 L648 A651 A655 T657 M662 K663 A664	E625-V660 HydrophobicContact CG-CG2 3.73Å; L629-V660 HydrophobicContact CD2-CG2 4.33Å; L648-V660 HydrophobicContact CD2-CG1 4.49Å; A651-V660 HydrophobicContact CB-CG1 3.72Å; A655-V660 WeakPolarHBondContact O-CG2 3.29Å; T657-V660 WeakPolarHBondContact O-CB 3.45Å; T657-V660 PolarHBondContact O-N 2.93Å; V660-M662 VanDerWaalsContact C-N 3.32Å; V660-M662 PolarHBondContact O-N 3.37Å; V660-K663 PolarHBondContact O-N 3.3Å; V660-A664 PolarHBondContact O-N 3.04Å
661	W	90.2	Very high	86.3	Confident	50 Å²	50	35.1 Å²	35.1	19%	0.189	20%	0.199	C	C	.	.	H	α-helix	trans	-57.8	-43.6	174.1	-76.9	96.9	0	0	0	112.6	C652 T657 K663 A664 A665 A684 Y688	C652-W661 HydrophobicContact CB-CZ2 4.12Å; T657-W661 PolarHBondContact O-N 3.15Å; W661-K663 VanDerWaalsContact C-N 3.3Å; W661-K663 PolarHBondContact O-N 2.95Å; W661-A664 PolarHBondContact O-N 3.07Å; W661-A665 WeakPolarHBondContact O-CB 3.23Å; W661-A665 PolarHBondContact O-N 3.23Å; W661-A684 HydrophobicContact CB-CB 3.77Å; W661-A684 HydrophobicContact CD2-CB 4.1Å; W661-A684 HydrophobicContact CE3-CB 4.01Å; W661-A684 HydrophobicContact CG-CB 4.02Å; W661-Y688 AromaticContact CD1-CE2 3.52Å; W661-Y688 HydrophobicContact CG-CE2 4.4Å; W661-Y688 AromaticContact NE1-CE2 3.72Å
662	M	90	Very high	86.2	Confident	35 Å²	35	37.5 Å²	37.5	17%	0.172	22%	0.224	C	C	.	.	H	α-helix	trans	-57.8	-42.5	174.6	-174.7	-166.4	67.5	0	0	111.5	A658 R659 V660 R666 K693 L694 M697	A658-M662 VanDerWaalsContact O-CB 3.28Å; A658-M662 WeakPolarHBondContact O-CB 3.47Å; A658-M662 PolarHBondContact O-N 3.3Å; R659-M662 HydrophobicContact CG-CE 4.18Å; R659-M662 WeakPolarHBondContact O-CB 3.18Å; V660-M662 VanDerWaalsContact C-N 3.32Å; V660-M662 PolarHBondContact O-N 3.37Å; M662-R666 VanDerWaalsContact O-CB 3.25Å; M662-R666 WeakPolarHBondContact O-CB 3.46Å; M662-R666 PolarHBondContact O-N 3.35Å; M662-K693 HydrophobicContact SD-CB 4.11Å; M662-K693 HydrophobicContact SD-CD 3.98Å; M662-L694 HydrophobicContact CB-CD2 3.88Å; M662-L694 HydrophobicContact CG-CD2 4.48Å; M662-M697 HydrophobicContact CB-SD 4.38Å; M662-M697 HydrophobicContact CG-CE 4.46Å; M662-M697 HydrophobicContact CG-SD 3.3Å; M662-M697 WeakPolarHBondContact CG-SD 3.33Å; M662-M697 WeakPolarHBondContact O-CE 3.49Å; M662-M697 HydrophobicContact SD-SD 4.43Å
663	K	88.1	Confident	86.4	Confident	75 Å²	75	40.2 Å²	40.2	33%	0.326	23%	0.234	S	C	.	.	H	α-helix	trans	-73.2	-35.7	178.5	-71.3	-72.5	-174.7	-176.8	0	112.6	L629 R659 V660 W661 R666 L667	L629-K663 HydrophobicContact CD2-CB 3.84Å; L629-K663 HydrophobicContact CD2-CG 3.77Å; R659-K663 WeakPolarHBondContact O-CG 3.42Å; R659-K663 PolarHBondContact O-N 3.49Å; V660-K663 PolarHBondContact O-N 3.3Å; W661-K663 VanDerWaalsContact C-N 3.3Å; W661-K663 PolarHBondContact O-N 2.95Å; K663-R666 PolarHBondContact O-N 3.35Å; K663-L667 PolarHBondContact O-N 3.5Å
664	A	88.9	Confident	86.4	Confident	3 Å²	3	36.3 Å²	36.3	3%	0.025	20%	0.201	C	C	.	.	H	α-helix	trans	-61.4	-52.7	173.5	0	0	0	0	0	111.2	L648 V660 W661 R666 L667 E668 M680	L648-A664 HydrophobicContact CB-CB 4.41Å; L648-A664 HydrophobicContact CD1-CB 4.23Å; L648-A664 HydrophobicContact CD2-CB 4.03Å; L648-A664 HydrophobicContact CG-CB 4.45Å; V660-A664 PolarHBondContact O-N 3.04Å; W661-A664 PolarHBondContact O-N 3.07Å; A664-R666 VanDerWaalsContact C-N 3.28Å; A664-R666 PolarHBondContact O-N 2.96Å; A664-L667 WeakPolarHBondContact O-CB 3.4Å; A664-L667 PolarHBondContact O-N 3.34Å; A664-L667 VanDerWaalsContact O-N 3.14Å; A664-E668 PolarHBondContact O-N 3.46Å; A664-M680 HydrophobicContact CB-SD 4.25Å
665	A	90.3	Very high	86.8	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58.7	-40.2	174.8	0	0	0	0	0	112.1	W661 L667 E668 W669 M680 L681 M697	W661-A665 WeakPolarHBondContact O-CB 3.23Å; W661-A665 PolarHBondContact O-N 3.23Å; A665-L667 VanDerWaalsContact C-N 3.34Å; A665-L667 PolarHBondContact O-N 3.02Å; A665-E668 PolarHBondContact O-N 3.27Å; A665-W669 VanDerWaalsContact O-CB 3.29Å; A665-W669 WeakPolarHBondContact O-CB 3.42Å; A665-W669 PolarHBondContact O-N 3.41Å; A665-M680 HydrophobicContact CB-CB 4.49Å; A665-L681 HydrophobicContact CB-CD1 4.16Å; A665-L681 HydrophobicContact CB-CD2 3.46Å; A665-L681 VanDerWaalsContact CB-CD2 3.46Å; A665-L681 HydrophobicContact CB-CG 3.52Å; A665-M697 HydrophobicContact CB-CE 4.12Å
666	R	89.1	Confident	87.5	Confident	29 Å²	29	42 Å²	42	11%	0.109	22%	0.221	C	C	.	.	H	α-helix	trans	-64.7	-37.5	177.7	-175.3	59.1	-179.2	-164.3	-1.3	112.2	M662 K663 A664 W669 C670 M697 K911	M662-R666 VanDerWaalsContact O-CB 3.25Å; M662-R666 WeakPolarHBondContact O-CB 3.46Å; M662-R666 PolarHBondContact O-N 3.35Å; K663-R666 PolarHBondContact O-N 3.35Å; A664-R666 VanDerWaalsContact C-N 3.28Å; A664-R666 PolarHBondContact O-N 2.96Å; R666-W669 PolarHBondContact O-N 3.26Å; R666-C670 PolarHBondContact NE-SG 2.98Å; R666-C670 VanDerWaalsContact NE-SG 3.37Å; R666-C670 WeakPolarHBondContact O-CB 3.42Å; R666-C670 PolarHBondContact O-N 3.47Å; R666-C670 PolarHBondContact O-SG 3.44Å; R666-M697 HydrophobicContact CB-CE 3.79Å; R666-K911 PolarHBondContact NH1-O 3.21Å; R666-K911 VanDerWaalsContact NH1-O 3.15Å; R666-K911 PolarHBondContact NH2-O 2.96Å
667	L	87.7	Confident	88.1	Confident	9 Å²	9	38.9 Å²	38.9	5%	0.047	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-49.7	177.4	-176.2	70.1	0	0	0	110.7	Y641 A644 R645 L648 K663 A664 A665 W669 C670 L671	Y641-L667 HydrophobicContact CD1-CD1 4.41Å; A644-L667 HydrophobicContact CB-CD2 3.89Å; R645-L667 HydrophobicContact CG-CD2 4.42Å; L648-L667 HydrophobicContact CD1-CB 4.09Å; L648-L667 HydrophobicContact CD1-CD2 3.42Å; L648-L667 VanDerWaalsContact CD1-CD2 3.42Å; L648-L667 HydrophobicContact CD1-CG 4.39Å; K663-L667 PolarHBondContact O-N 3.5Å; A664-L667 WeakPolarHBondContact O-CB 3.4Å; A664-L667 PolarHBondContact O-N 3.34Å; A664-L667 VanDerWaalsContact O-N 3.14Å; A665-L667 VanDerWaalsContact C-N 3.34Å; A665-L667 PolarHBondContact O-N 3.02Å; L667-W669 VanDerWaalsContact C-N 3.3Å; L667-W669 PolarHBondContact O-N 2.9Å; L667-C670 PolarHBondContact O-N 2.88Å; L667-L671 HydrophobicContact CG-CD1 4.23Å; L667-L671 VanDerWaalsContact O-CG 3.32Å; L667-L671 WeakPolarHBondContact O-CG 3.48Å; L667-L671 PolarHBondContact O-N 2.81Å
668	E	89.5	Confident	88.3	Confident	8 Å²	8	37.3 Å²	37.3	4%	0.037	19%	0.188	C	C	.	.	H	α-helix	trans	-63	-38.2	177.4	-64.9	-54.6	146.6	0	0	111.9	R645 A664 A665 L671 G672 E673 K676 A677 M680	R645-E668 WeakPolarHBondContact CD-OE1 3.32Å; R645-E668 WeakPolarHBondContact CG-OE1 3.47Å; R645-E668 IonicContact CZ-OE1 3.77Å; R645-E668 IonicContact CZ-OE2 3.7Å; R645-E668 IonicContact NE-OE1 3.28Å; R645-E668 PolarHBondContact NE-OE1 3.02Å; R645-E668 IonicContact NE-OE2 2.82Å; R645-E668 PolarHBondContact NE-OE2 3.27Å; R645-E668 IonicContact NH2-OE1 2.95Å; R645-E668 IonicContact NH2-OE2 3.53Å; R645-E668 PolarHBondContact NH2-OE2 3.36Å; A664-E668 PolarHBondContact O-N 3.46Å; A665-E668 PolarHBondContact O-N 3.27Å; E668-L671 PolarHBondContact O-N 2.84Å; E668-G672 PolarHBondContact O-N 2.85Å; E668-E673 HydrophobicContact CB-CB 4.5Å; E668-E673 PolarHBondContact O-N 3.39Å; E668-K676 HydrophobicContact CG-CB 4.42Å; E668-A677 HydrophobicContact CB-CB 3.99Å; E668-M680 HydrophobicContact CG-CE 4.23Å; E668-M680 HydrophobicContact CG-SD 4.01Å
669	W	89.6	Confident	88.5	Confident	12 Å²	12	41.4 Å²	41.4	5%	0.045	20%	0.204	C	C	.	.	H	α-helix	trans	-61.8	-45.4	174.9	-172.7	9.4	0	0	0	112	A665 R666 L667 L671 G672 L674 A677 M697 Q700 V701 P913	A665-W669 VanDerWaalsContact O-CB 3.29Å; A665-W669 WeakPolarHBondContact O-CB 3.42Å; A665-W669 PolarHBondContact O-N 3.41Å; R666-W669 PolarHBondContact O-N 3.26Å; L667-W669 VanDerWaalsContact C-N 3.3Å; L667-W669 PolarHBondContact O-N 2.9Å; W669-L671 PolarHBondContact O-N 3.41Å; W669-G672 PolarHBondContact O-N 2.82Å; W669-G672 VanDerWaalsContact O-N 3.13Å; W669-L674 VanDerWaalsContact CD1-CD2 3.46Å; W669-A677 HydrophobicContact CB-CB 4.16Å; W669-M697 HydrophobicContact CE3-CE 3.83Å; W669-M697 HydrophobicContact CZ3-CB 4.3Å; W669-M697 HydrophobicContact CZ3-CE 4.12Å; W669-M697 HydrophobicContact CZ3-CG 4.12Å; W669-Q700 HydrophobicContact CH2-CB 3.53Å; W669-Q700 HydrophobicContact CH2-CG 4.44Å; W669-Q700 HydrophobicContact CZ2-CB 3.99Å; W669-Q700 HydrophobicContact CZ3-CB 4.47Å; W669-V701 HydrophobicContact CD2-CG2 3.67Å; W669-V701 HydrophobicContact CE3-CG2 3.97Å; W669-V701 HydrophobicContact CG-CG2 4.03Å; W669-V701 HydrophobicContact CH2-CG2 4.47Å; W669-V701 HydrophobicContact CZ2-CG2 4.19Å; W669-V701 HydrophobicContact CZ3-CG2 4.35Å; W669-P913 HydrophobicContact CD2-CG 4.18Å; W669-P913 HydrophobicContact CH2-CG 4.49Å; W669-P913 HydrophobicContact CZ2-CG 3.76Å
670	C	85.4	Confident	88.5	Confident	23 Å²	23	37.7 Å²	37.7	16%	0.155	19%	0.193	C	C	.	.	H	α-helix	trans	-67.4	-22.4	176.6	-70.2	0	0	0	0	113.5	R666 L667 G672 W916	R666-C670 PolarHBondContact NE-SG 2.98Å; R666-C670 VanDerWaalsContact NE-SG 3.37Å; R666-C670 WeakPolarHBondContact O-CB 3.42Å; R666-C670 PolarHBondContact O-N 3.47Å; R666-C670 PolarHBondContact O-SG 3.44Å; L667-C670 PolarHBondContact O-N 2.88Å; C670-G672 VanDerWaalsContact C-N 3.31Å; C670-W916 HydrophobicContact CB-CG 4.23Å; C670-W916 VanDerWaalsContact SG-CG 3.51Å
671	L	85.8	Confident	88.6	Confident	49 Å²	49	37.7 Å²	37.7	26%	0.257	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-7.4	175.1	-68.8	172.8	0	0	0	113	Y641 L667 E668 W669	Y641-L671 HydrophobicContact CD1-CD2 3.89Å; Y641-L671 HydrophobicContact CD2-CD2 3.83Å; Y641-L671 HydrophobicContact CE1-CD2 4.02Å; Y641-L671 HydrophobicContact CE2-CD2 3.96Å; Y641-L671 HydrophobicContact CG-CD1 4.35Å; Y641-L671 HydrophobicContact CG-CD2 3.78Å; L667-L671 HydrophobicContact CG-CD1 4.23Å; L667-L671 VanDerWaalsContact O-CG 3.32Å; L667-L671 WeakPolarHBondContact O-CG 3.48Å; L667-L671 PolarHBondContact O-N 2.81Å; E668-L671 PolarHBondContact O-N 2.84Å; W669-L671 PolarHBondContact O-N 3.41Å
672	G	84.1	Confident	88.6	Confident	50 Å²	50	39 Å²	39	52%	0.515	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.9	3.9	-177.2	0	0	0	0	0	114.2	E668 W669 C670 L674	E668-G672 PolarHBondContact O-N 2.85Å; W669-G672 PolarHBondContact O-N 2.82Å; W669-G672 VanDerWaalsContact O-N 3.13Å; C670-G672 VanDerWaalsContact C-N 3.31Å; G672-L674 PolarHBondContact O-N 3.36Å
673	E	88	Confident	88.6	Confident	78 Å²	78	43 Å²	43	36%	0.364	22%	0.217	S	C	.	.			trans	-86.2	64.6	-178.7	-67.9	-84.3	-172.3	0	0	110.2	E668 N675 K676 A677	E668-E673 HydrophobicContact CB-CB 4.5Å; E668-E673 PolarHBondContact O-N 3.39Å; E673-N675 VanDerWaalsContact C-N 3.3Å; E673-N675 PolarHBondContact O-N 2.82Å; E673-K676 HydrophobicContact CB-CB 4.41Å; E673-K676 HydrophobicContact CB-CD 4.26Å; E673-K676 VanDerWaalsContact CD-NZ 3.25Å; E673-K676 PolarHBondContact O-N 2.8Å; E673-K676 IonicContact OE1-NZ 2.87Å; E673-K676 PolarHBondContact OE1-NZ 3.42Å; E673-K676 IonicContact OE2-NZ 3.66Å; E673-K676 PolarHBondContact OE2-NZ 2.86Å; E673-A677 PolarHBondContact O-N 2.84Å; E673-A677 VanDerWaalsContact O-N 3.08Å
674	L	85.6	Confident	88.6	Confident	6 Å²	6	39.5 Å²	39.5	3%	0.031	20%	0.202	C	C	.	.	H	α-helix	trans	-58.4	-39	-170.9	-60.2	-178	0	0	0	113	W669 G672 A677 L678 V701 Q704 L705	W669-L674 VanDerWaalsContact CD1-CD2 3.46Å; G672-L674 PolarHBondContact O-N 3.36Å; L674-A677 PolarHBondContact O-N 3.46Å; L674-L678 WeakPolarHBondContact O-CB 3.18Å; L674-L678 PolarHBondContact O-N 3.49Å; L674-V701 HydrophobicContact CB-CG1 4.48Å; L674-Q704 HydrophobicContact CD1-CG 4.36Å; L674-L705 HydrophobicContact CB-CD1 4.13Å; L674-L705 HydrophobicContact CD1-CD1 3.85Å
675	N	88.6	Confident	88.6	Confident	105 Å²	105	39.8 Å²	39.8	56%	0.561	20%	0.203	S	C	*	.	H	α-helix	trans	-63.9	-43	179.8	-68.3	-37.5	0	0	0	112.3	E673 L678 E679	E673-N675 VanDerWaalsContact C-N 3.3Å; E673-N675 PolarHBondContact O-N 2.82Å; N675-L678 WeakPolarHBondContact O-CB 3.4Å; N675-L678 PolarHBondContact O-N 2.82Å; N675-E679 PolarHBondContact O-N 3.26Å
676	K	88.4	Confident	88.5	Confident	90 Å²	90	46.8 Å²	46.8	39%	0.391	24%	0.24	S	C	.	.	H	α-helix	trans	-67.4	-41.4	176.8	-67.1	177.9	-174.6	132	0	111.2	E668 E673 L678 E679 M680	E668-K676 HydrophobicContact CG-CB 4.42Å; E673-K676 HydrophobicContact CB-CB 4.41Å; E673-K676 HydrophobicContact CB-CD 4.26Å; E673-K676 VanDerWaalsContact CD-NZ 3.25Å; E673-K676 PolarHBondContact O-N 2.8Å; E673-K676 IonicContact OE1-NZ 2.87Å; E673-K676 PolarHBondContact OE1-NZ 3.42Å; E673-K676 IonicContact OE2-NZ 3.66Å; E673-K676 PolarHBondContact OE2-NZ 2.86Å; K676-L678 VanDerWaalsContact C-N 3.28Å; K676-L678 PolarHBondContact O-N 2.71Å; K676-E679 PolarHBondContact O-N 2.78Å; K676-M680 WeakPolarHBondContact O-CG 3.44Å; K676-M680 PolarHBondContact O-N 3.45Å
677	A	89.6	Confident	88.4	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59.3	-42.4	175.3	0	0	0	0	0	111.1	E668 W669 E673 L674 M680 L681	E668-A677 HydrophobicContact CB-CB 3.99Å; W669-A677 HydrophobicContact CB-CB 4.16Å; E673-A677 PolarHBondContact O-N 2.84Å; E673-A677 VanDerWaalsContact O-N 3.08Å; L674-A677 PolarHBondContact O-N 3.46Å; A677-M680 PolarHBondContact O-N 3.5Å; A677-L681 WeakPolarHBondContact O-CB 3.48Å; A677-L681 WeakPolarHBondContact O-CG 3.35Å; A677-L681 PolarHBondContact O-N 2.88Å
678	L	90.1	Very high	88.4	Confident	22 Å²	22	52.2 Å²	52.2	12%	0.115	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-48.6	176.2	-177.1	162.4	0	0	0	111.6	L674 N675 K676 M680 L681 Q682 L698 V701 Y702	L674-L678 WeakPolarHBondContact O-CB 3.18Å; L674-L678 PolarHBondContact O-N 3.49Å; N675-L678 WeakPolarHBondContact O-CB 3.4Å; N675-L678 PolarHBondContact O-N 2.82Å; K676-L678 VanDerWaalsContact C-N 3.28Å; K676-L678 PolarHBondContact O-N 2.71Å; L678-M680 VanDerWaalsContact C-N 3.32Å; L678-M680 PolarHBondContact O-N 2.78Å; L678-L681 PolarHBondContact O-N 3.24Å; L678-Q682 HydrophobicContact CD2-CG 4.02Å; L678-Q682 WeakPolarHBondContact O-CB 3.48Å; L678-Q682 WeakPolarHBondContact O-CG 3.43Å; L678-Q682 PolarHBondContact O-N 3.47Å; L678-L698 HydrophobicContact CG-CD1 4.45Å; L678-V701 HydrophobicContact CB-CG1 4.32Å; L678-Y702 HydrophobicContact CD1-CD1 4.03Å; L678-Y702 HydrophobicContact CD1-CE1 3.4Å; L678-Y702 VanDerWaalsContact CD1-CE1 3.4Å; L678-Y702 HydrophobicContact CG-CE1 4.26Å
679	E	91	Very high	88.2	Confident	105 Å²	105	55.2 Å²	55.2	49%	0.491	29%	0.286	S	S	.	.	H	α-helix	trans	-58.9	-43.2	176.6	-73.8	179.9	-165.1	0	0	112.1	N675 K676 K683	N675-E679 PolarHBondContact O-N 3.26Å; K676-E679 PolarHBondContact O-N 2.78Å; E679-K683 VanDerWaalsContact O-CG 3.3Å; E679-K683 WeakPolarHBondContact O-CG 3.36Å; E679-K683 PolarHBondContact O-N 3.34Å
680	M	89	Confident	88	Confident	43 Å²	43	62 Å²	62	21%	0.212	32%	0.318	C	S	.	.	H	α-helix	trans	-63.9	-43.3	176.2	-73.2	-173.5	175.1	0	0	111.6	A664 A665 E668 K676 A677 L678 K683 A684	A664-M680 HydrophobicContact CB-SD 4.25Å; A665-M680 HydrophobicContact CB-CB 4.49Å; E668-M680 HydrophobicContact CG-CE 4.23Å; E668-M680 HydrophobicContact CG-SD 4.01Å; K676-M680 WeakPolarHBondContact O-CG 3.44Å; K676-M680 PolarHBondContact O-N 3.45Å; A677-M680 PolarHBondContact O-N 3.5Å; L678-M680 VanDerWaalsContact C-N 3.32Å; L678-M680 PolarHBondContact O-N 2.78Å; M680-K683 PolarHBondContact O-N 2.92Å; M680-A684 WeakPolarHBondContact O-CB 3.21Å; M680-A684 PolarHBondContact O-N 3.42Å
681	L	91	Very high	88.2	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66.2	-41.1	178.4	-73.8	167.1	0	0	0	111.7	A665 A677 L678 A684 T685 L694 M697 L698 V701	A665-L681 HydrophobicContact CB-CD1 4.16Å; A665-L681 HydrophobicContact CB-CD2 3.46Å; A665-L681 VanDerWaalsContact CB-CD2 3.46Å; A665-L681 HydrophobicContact CB-CG 3.52Å; A677-L681 WeakPolarHBondContact O-CB 3.48Å; A677-L681 WeakPolarHBondContact O-CG 3.35Å; A677-L681 PolarHBondContact O-N 2.88Å; L678-L681 PolarHBondContact O-N 3.24Å; L681-A684 CarbonylContact O-C 3.54Å; L681-A684 PolarHBondContact O-N 2.92Å; L681-T685 WeakPolarHBondContact O-CG2 3.38Å; L681-T685 PolarHBondContact O-N 3.11Å; L681-T685 PolarHBondContact O-OG1 3.12Å; L681-T685 VanDerWaalsContact O-OG1 3.04Å; L681-L694 HydrophobicContact CD2-CD2 4.12Å; L681-M697 HydrophobicContact CD1-CB 4.06Å; L681-M697 HydrophobicContact CD2-CB 3.97Å; L681-M697 HydrophobicContact CD2-CE 4.41Å; L681-L698 HydrophobicContact CB-CB 4.28Å; L681-L698 HydrophobicContact CB-CD1 3.79Å; L681-L698 HydrophobicContact CD1-CB 4.44Å; L681-V701 HydrophobicContact CD1-CG2 3.97Å
682	Q	90.4	Very high	88.3	Confident	77 Å²	77	60.8 Å²	60.8	36%	0.36	32%	0.315	S	S	.	.	H	α-helix	trans	-62.5	-45.3	175.7	-74.8	-179.2	-22.2	0	0	111.9	L678 A684 T685 L686 L698 Y702	L678-Q682 HydrophobicContact CD2-CG 4.02Å; L678-Q682 WeakPolarHBondContact O-CB 3.48Å; L678-Q682 WeakPolarHBondContact O-CG 3.43Å; L678-Q682 PolarHBondContact O-N 3.47Å; Q682-A684 VanDerWaalsContact C-N 3.29Å; Q682-A684 PolarHBondContact O-N 2.78Å; Q682-T685 WeakPolarHBondContact CA-OG1 3.17Å; Q682-T685 PolarHBondContact O-N 3.2Å; Q682-T685 PolarHBondContact O-OG1 3.5Å; Q682-L686 VanDerWaalsContact O-CG 3.27Å; Q682-L686 WeakPolarHBondContact O-CG 3.3Å; Q682-L686 PolarHBondContact O-N 2.84Å; Q682-L698 HydrophobicContact CG-CD1 4.12Å; Q682-Y702 PolarHBondContact NE2-OH 3.16Å
683	K	89.7	Confident	88.5	Confident	120 Å²	120	64 Å²	64	52%	0.522	32%	0.315	S	S	.	.	H	α-helix	trans	-60.1	-42.2	173.1	-71.4	171.5	-176	171.3	0	111.2	E679 M680 L686 T687	E679-K683 VanDerWaalsContact O-CG 3.3Å; E679-K683 WeakPolarHBondContact O-CG 3.36Å; E679-K683 PolarHBondContact O-N 3.34Å; M680-K683 PolarHBondContact O-N 2.92Å; K683-L686 PolarHBondContact O-N 2.73Å; K683-T687 PolarHBondContact O-N 3.14Å; K683-T687 PolarHBondContact O-OG1 3.04Å
684	A	89.3	Confident	88.7	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-68	-37.4	178.8	0	0	0	0	0	113	W661 M680 L681 Q682 T687 Y688 L694	W661-A684 HydrophobicContact CB-CB 3.77Å; W661-A684 HydrophobicContact CD2-CB 4.1Å; W661-A684 HydrophobicContact CE3-CB 4.01Å; W661-A684 HydrophobicContact CG-CB 4.02Å; M680-A684 WeakPolarHBondContact O-CB 3.21Å; M680-A684 PolarHBondContact O-N 3.42Å; L681-A684 CarbonylContact O-C 3.54Å; L681-A684 PolarHBondContact O-N 2.92Å; Q682-A684 VanDerWaalsContact C-N 3.29Å; Q682-A684 PolarHBondContact O-N 2.78Å; A684-T687 WeakPolarHBondContact CA-OG1 3.42Å; A684-T687 PolarHBondContact O-N 3.23Å; A684-T687 PolarHBondContact O-OG1 2.88Å; A684-Y688 WeakPolarHBondContact O-CA 3.46Å; A684-Y688 WeakPolarHBondContact O-CB 3.34Å; A684-Y688 PolarHBondContact O-N 3.23Å; A684-L694 HydrophobicContact CB-CD1 3.83Å; A684-L694 HydrophobicContact CB-CD2 4.24Å
685	T	87.7	Confident	89	Confident	9 Å²	9	60.7 Å²	60.7	6%	0.055	30%	0.299	C	S	.	.	H	α-helix	trans	-72.8	-31.1	177.5	48.6	0	0	0	0	112.4	L681 Q682 Y688 N689 L694 W695 L698	L681-T685 WeakPolarHBondContact O-CG2 3.38Å; L681-T685 PolarHBondContact O-N 3.11Å; L681-T685 PolarHBondContact O-OG1 3.12Å; L681-T685 VanDerWaalsContact O-OG1 3.04Å; Q682-T685 WeakPolarHBondContact CA-OG1 3.17Å; Q682-T685 PolarHBondContact O-N 3.2Å; Q682-T685 PolarHBondContact O-OG1 3.5Å; T685-Y688 CarbonylContact O-C 3.59Å; T685-N689 VanDerWaalsContact O-CA 3.23Å; T685-N689 WeakPolarHBondContact O-CA 3.4Å; T685-N689 PolarHBondContact O-N 2.82Å; T685-N689 VanDerWaalsContact O-N 3.14Å; T685-L694 HydrophobicContact CG2-CB 3.85Å; T685-W695 HydrophobicContact CG2-CD2 4Å; T685-W695 HydrophobicContact CG2-CE3 4.25Å; T685-W695 HydrophobicContact CG2-CG 4.42Å; T685-W695 HydrophobicContact CG2-CZ2 4.36Å; T685-L698 HydrophobicContact CG2-CD2 4.16Å
686	L	88.6	Confident	89.1	Confident	147 Å²	147	56.8 Å²	56.8	77%	0.77	28%	0.278	S	S	*	.	H	α-helix	trans	-67.8	-38.7	173.3	-71.7	170.1	0	0	0	111.8	Q682 K683	Q682-L686 VanDerWaalsContact O-CG 3.27Å; Q682-L686 WeakPolarHBondContact O-CG 3.3Å; Q682-L686 PolarHBondContact O-N 2.84Å; K683-L686 PolarHBondContact O-N 2.73Å
687	T	87.9	Confident	89.2	Confident	87 Å²	87	53.4 Å²	53.4	53%	0.534	26%	0.264	S	S	.	.	H	α-helix	trans	-80.3	-39.2	179.4	44.9	0	0	0	0	112.8	K683 A684	K683-T687 PolarHBondContact O-N 3.14Å; K683-T687 PolarHBondContact O-OG1 3.04Å; A684-T687 WeakPolarHBondContact CA-OG1 3.42Å; A684-T687 PolarHBondContact O-N 3.23Å; A684-T687 PolarHBondContact O-OG1 2.88Å
688	Y	86.8	Confident	89.2	Confident	66 Å²	66	53.6 Å²	53.6	26%	0.259	27%	0.265	S	S	.	.			trans	-124.3	61.9	-176.6	-55.3	-75.7	0	0	0	111.3	S656 A658 W661 A684 T685 Q690 A691	S656-Y688 PolarHBondContact O-OH 3.2Å; A658-Y688 HydrophobicContact CB-CD1 4.21Å; A658-Y688 HydrophobicContact CB-CD2 4.19Å; A658-Y688 HydrophobicContact CB-CG 3.86Å; W661-Y688 AromaticContact CD1-CE2 3.52Å; W661-Y688 HydrophobicContact CG-CE2 4.4Å; W661-Y688 AromaticContact NE1-CE2 3.72Å; A684-Y688 WeakPolarHBondContact O-CA 3.46Å; A684-Y688 WeakPolarHBondContact O-CB 3.34Å; A684-Y688 PolarHBondContact O-N 3.23Å; T685-Y688 CarbonylContact O-C 3.59Å; Y688-Q690 PolarHBondContact O-N 3.45Å; Y688-Q690 VanDerWaalsContact O-N 3.15Å; Y688-A691 PolarHBondContact O-N 3.05Å
689	N	86.2	Confident	89.2	Confident	70 Å²	70	52.5 Å²	52.5	37%	0.374	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-30	178.7	60	0	0	0	0	113.3	T685 A691 W695	T685-N689 VanDerWaalsContact O-CA 3.23Å; T685-N689 WeakPolarHBondContact O-CA 3.4Å; T685-N689 PolarHBondContact O-N 2.82Å; T685-N689 VanDerWaalsContact O-N 3.14Å; N689-A691 VanDerWaalsContact C-N 3.29Å; N689-A691 PolarHBondContact O-N 3.49Å; N689-W695 PolarHBondContact O-NE1 3.19Å
690	Q	85.7	Confident	89.1	Confident	154 Å²	154	49.9 Å²	49.9	72%	0.72	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-8.3	177.7	-68.5	-173.7	-3.2	0	0	114.4	Y688 P692 N733	Y688-Q690 PolarHBondContact O-N 3.45Å; Y688-Q690 VanDerWaalsContact O-N 3.15Å; Q690-P692 WeakPolarHBondContact O-CD 3.41Å; Q690-N733 PolarHBondContact O-ND2 2.98Å
691	A	87.9	Confident	89.1	Confident	21 Å²	21	47.8 Å²	47.8	17%	0.174	24%	0.237	C	C	.	.			trans	-90.6	102.2	-178.4	0	0	0	0	0	111.6	A658 Y688 N689 K693 L694	A658-A691 HydrophobicContact CB-CB 3.82Å; Y688-A691 PolarHBondContact O-N 3.05Å; N689-A691 VanDerWaalsContact C-N 3.29Å; N689-A691 PolarHBondContact O-N 3.49Å; A691-K693 VanDerWaalsContact C-N 3.29Å; A691-K693 PolarHBondContact O-N 2.84Å; A691-L694 HydrophobicContact CB-CD1 3.86Å; A691-L694 HydrophobicContact CB-CG 4.07Å; A691-L694 PolarHBondContact O-N 3.05Å
692	P	88.6	Confident	89.1	Confident	27 Å²	27	48.5 Å²	48.5	18%	0.175	24%	0.239	C	C	.	.	H	α-helix	trans	-69.7	-24.4	-171.3	30.1	-38.1	0	0	0	113.8	Q690 L694 W695 L696 N733 Y736	Q690-P692 WeakPolarHBondContact O-CD 3.41Å; P692-L694 VanDerWaalsContact C-N 3.28Å; P692-L694 PolarHBondContact O-N 3.13Å; P692-W695 PolarHBondContact O-N 3.15Å; P692-L696 PolarHBondContact O-N 2.94Å; P692-N733 HydrophobicContact CB-CB 4.29Å; P692-Y736 HydrophobicContact CB-CD1 3.41Å; P692-Y736 VanDerWaalsContact CB-CD1 3.41Å; P692-Y736 HydrophobicContact CB-CD2 4.23Å; P692-Y736 HydrophobicContact CB-CE1 3.95Å; P692-Y736 HydrophobicContact CB-CG 3.55Å; P692-Y736 HydrophobicContact CG-CD1 3.87Å; P692-Y736 HydrophobicContact CG-CD2 3.78Å; P692-Y736 HydrophobicContact CG-CE1 4.23Å; P692-Y736 HydrophobicContact CG-CE2 4.19Å; P692-Y736 HydrophobicContact CG-CG 3.61Å
693	K	88.1	Confident	88.9	Confident	117 Å²	117	45.9 Å²	45.9	51%	0.509	23%	0.227	S	C	.	.	H	α-helix	trans	-65.5	-31.7	177.3	-70.2	-177.9	-178.7	174.6	0	112.4	M662 A691 L696 M697	M662-K693 HydrophobicContact SD-CB 4.11Å; M662-K693 HydrophobicContact SD-CD 3.98Å; A691-K693 VanDerWaalsContact C-N 3.29Å; A691-K693 PolarHBondContact O-N 2.84Å; K693-L696 PolarHBondContact O-N 2.76Å; K693-M697 WeakPolarHBondContact O-CG 3.25Å; K693-M697 PolarHBondContact O-N 3.27Å
694	L	91.9	Very high	88.7	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-66.5	-45.5	176.2	-64.6	178	0	0	0	110.4	A658 M662 L681 A684 T685 A691 P692 L696 M697 L698	A658-L694 HydrophobicContact CB-CD1 4.29Å; M662-L694 HydrophobicContact CB-CD2 3.88Å; M662-L694 HydrophobicContact CG-CD2 4.48Å; L681-L694 HydrophobicContact CD2-CD2 4.12Å; A684-L694 HydrophobicContact CB-CD1 3.83Å; A684-L694 HydrophobicContact CB-CD2 4.24Å; T685-L694 HydrophobicContact CG2-CB 3.85Å; A691-L694 HydrophobicContact CB-CD1 3.86Å; A691-L694 HydrophobicContact CB-CG 4.07Å; A691-L694 PolarHBondContact O-N 3.05Å; P692-L694 VanDerWaalsContact C-N 3.28Å; P692-L694 PolarHBondContact O-N 3.13Å; L694-L696 VanDerWaalsContact C-N 3.31Å; L694-L696 PolarHBondContact O-N 2.89Å; L694-M697 PolarHBondContact O-N 3.49Å; L694-L698 WeakPolarHBondContact O-CB 3.21Å; L694-L698 PolarHBondContact O-N 3.37Å
695	W	92.6	Very high	88.5	Confident	13 Å²	13	43.8 Å²	43.8	5%	0.049	22%	0.22	C	C	.	.	H	α-helix	trans	-59.7	-40.4	174.4	-66	103.6	0	0	0	112.7	T685 N689 P692 L698 S699 E728 H732 L739	T685-W695 HydrophobicContact CG2-CD2 4Å; T685-W695 HydrophobicContact CG2-CE3 4.25Å; T685-W695 HydrophobicContact CG2-CG 4.42Å; T685-W695 HydrophobicContact CG2-CZ2 4.36Å; N689-W695 PolarHBondContact O-NE1 3.19Å; P692-W695 PolarHBondContact O-N 3.15Å; W695-L698 HydrophobicContact CE3-CD2 4.35Å; W695-L698 HydrophobicContact CZ3-CD2 4.45Å; W695-L698 PolarHBondContact O-N 3.08Å; W695-S699 WeakPolarHBondContact O-CB 3.26Å; W695-S699 PolarHBondContact O-N 2.91Å; W695-S699 PolarHBondContact O-OG 3.43Å; W695-E728 HydrophobicContact CE3-CB 4.35Å; W695-E728 HydrophobicContact CH2-CB 4Å; W695-E728 HydrophobicContact CZ3-CB 3.72Å; W695-E728 WeakPolarHBondContact CZ3-OE2 3.11Å; W695-H732 AromaticContact CZ2-CD2 3.48Å; W695-H732 VanDerWaalsContact CZ2-CD2 3.48Å; W695-H732 WeakPolarHBondContact CZ2-CD2 3.23Å; W695-H732 AromaticContact CZ2-NE2 3.93Å; W695-L739 HydrophobicContact CB-CD1 4.46Å
696	L	90	Very high	88.2	Confident	23 Å²	23	43.9 Å²	43.9	12%	0.12	22%	0.221	C	C	.	.	H	α-helix	trans	-61.7	-49.4	175.2	177.2	61.8	0	0	0	111.5	P692 K693 L694 S699 Q700 Y726 L739 Q742	P692-L696 PolarHBondContact O-N 2.94Å; K693-L696 PolarHBondContact O-N 2.76Å; L694-L696 VanDerWaalsContact C-N 3.31Å; L694-L696 PolarHBondContact O-N 2.89Å; L696-S699 PolarHBondContact O-N 3.41Å; L696-Q700 HydrophobicContact CD1-CG 4.33Å; L696-Q700 VanDerWaalsContact O-CG 3.3Å; L696-Q700 WeakPolarHBondContact O-CG 3.31Å; L696-Q700 PolarHBondContact O-N 2.92Å; L696-Y726 HydrophobicContact CD1-CE1 4.13Å; L696-L739 HydrophobicContact CB-CD1 4.26Å; L696-Q742 HydrophobicContact CD1-CB 3.75Å; L696-Q742 HydrophobicContact CD1-CG 3.6Å
697	M	90.3	Very high	87.7	Confident	18 Å²	18	43.2 Å²	43.2	9%	0.089	21%	0.214	C	C	.	.	H	α-helix	trans	-63.5	-41.8	178.4	-73.1	-178.4	62.8	0	0	112.1	M662 A665 R666 W669 L681 K693 L694 S699 Q700 V701	M662-M697 HydrophobicContact CB-SD 4.38Å; M662-M697 HydrophobicContact CG-CE 4.46Å; M662-M697 HydrophobicContact CG-SD 3.3Å; M662-M697 WeakPolarHBondContact CG-SD 3.33Å; M662-M697 WeakPolarHBondContact O-CE 3.49Å; M662-M697 HydrophobicContact SD-SD 4.43Å; A665-M697 HydrophobicContact CB-CE 4.12Å; R666-M697 HydrophobicContact CB-CE 3.79Å; W669-M697 HydrophobicContact CE3-CE 3.83Å; W669-M697 HydrophobicContact CZ3-CB 4.3Å; W669-M697 HydrophobicContact CZ3-CE 4.12Å; W669-M697 HydrophobicContact CZ3-CG 4.12Å; L681-M697 HydrophobicContact CD1-CB 4.06Å; L681-M697 HydrophobicContact CD2-CB 3.97Å; L681-M697 HydrophobicContact CD2-CE 4.41Å; K693-M697 WeakPolarHBondContact O-CG 3.25Å; K693-M697 PolarHBondContact O-N 3.27Å; L694-M697 PolarHBondContact O-N 3.49Å; M697-S699 VanDerWaalsContact C-N 3.31Å; M697-S699 PolarHBondContact O-N 3.41Å; M697-Q700 PolarHBondContact O-N 3.06Å; M697-V701 VanDerWaalsContact O-CG2 3.31Å; M697-V701 WeakPolarHBondContact O-CG2 3.46Å; M697-V701 PolarHBondContact O-N 2.88Å
698	L	91.2	Very high	87.1	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-58.6	-46.7	177.8	-178.7	64.5	0	0	0	110.7	L678 L681 Q682 T685 L694 W695 Q700 V701 Y702 T725	L678-L698 HydrophobicContact CG-CD1 4.45Å; L681-L698 HydrophobicContact CB-CB 4.28Å; L681-L698 HydrophobicContact CB-CD1 3.79Å; L681-L698 HydrophobicContact CD1-CB 4.44Å; Q682-L698 HydrophobicContact CG-CD1 4.12Å; T685-L698 HydrophobicContact CG2-CD2 4.16Å; L694-L698 WeakPolarHBondContact O-CB 3.21Å; L694-L698 PolarHBondContact O-N 3.37Å; W695-L698 HydrophobicContact CE3-CD2 4.35Å; W695-L698 HydrophobicContact CZ3-CD2 4.45Å; W695-L698 PolarHBondContact O-N 3.08Å; L698-Q700 PolarHBondContact O-N 2.74Å; L698-V701 PolarHBondContact O-N 3.38Å; L698-Y702 HydrophobicContact CD1-CD2 4.19Å; L698-Y702 HydrophobicContact CD1-CE2 3.59Å; L698-Y702 HydrophobicContact CD2-CE2 4.28Å; L698-Y702 HydrophobicContact CG-CD2 4.03Å; L698-Y702 HydrophobicContact CG-CE2 3.67Å; L698-Y702 WeakPolarHBondContact O-CD2 3.38Å; L698-Y702 PolarHBondContact O-N 3.18Å; L698-T725 HydrophobicContact CD2-CG2 3.79Å; L698-T725 HydrophobicContact CG-CG2 4.15Å
699	S	89.9	Confident	85.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-66.4	-38.1	179.3	-49.9	0	0	0	0	112.3	W695 L696 M697 Y702 E703 T725 Y726	W695-S699 WeakPolarHBondContact O-CB 3.26Å; W695-S699 PolarHBondContact O-N 2.91Å; W695-S699 PolarHBondContact O-OG 3.43Å; L696-S699 PolarHBondContact O-N 3.41Å; M697-S699 VanDerWaalsContact C-N 3.31Å; M697-S699 PolarHBondContact O-N 3.41Å; S699-Y702 PolarHBondContact O-N 3.02Å; S699-E703 PolarHBondContact O-N 2.97Å; S699-T725 WeakPolarHBondContact CB-OG1 3.35Å; S699-T725 WeakPolarHBondContact OG-CB 3.41Å; S699-T725 PolarHBondContact OG-OG1 2.86Å; S699-Y726 VanDerWaalsContact CB-CE2 3.43Å
700	Q	89	Confident	84.7	Confident	49 Å²	49	48.9 Å²	48.9	23%	0.229	24%	0.242	C	C	.	.	H	α-helix	trans	-68.1	-37	175.8	-72.4	175.7	-28.7	0	0	112.9	W669 L696 M697 L698 E703 Q704	W669-Q700 HydrophobicContact CH2-CB 3.53Å; W669-Q700 HydrophobicContact CH2-CG 4.44Å; W669-Q700 HydrophobicContact CZ2-CB 3.99Å; W669-Q700 HydrophobicContact CZ3-CB 4.47Å; L696-Q700 HydrophobicContact CD1-CG 4.33Å; L696-Q700 VanDerWaalsContact O-CG 3.3Å; L696-Q700 WeakPolarHBondContact O-CG 3.31Å; L696-Q700 PolarHBondContact O-N 2.92Å; M697-Q700 PolarHBondContact O-N 3.06Å; L698-Q700 PolarHBondContact O-N 2.74Å; Q700-E703 PolarHBondContact O-N 2.91Å; Q700-Q704 PolarHBondContact O-N 3.44Å
701	V	88.7	Confident	84.2	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.9	-41.3	174.1	171.6	0	0	0	0	110.4	W669 L674 L678 L681 M697 L698 E703 Q704 L705	W669-V701 HydrophobicContact CD2-CG2 3.67Å; W669-V701 HydrophobicContact CE3-CG2 3.97Å; W669-V701 HydrophobicContact CG-CG2 4.03Å; W669-V701 HydrophobicContact CH2-CG2 4.47Å; W669-V701 HydrophobicContact CZ2-CG2 4.19Å; W669-V701 HydrophobicContact CZ3-CG2 4.35Å; L674-V701 HydrophobicContact CB-CG1 4.48Å; L678-V701 HydrophobicContact CB-CG1 4.32Å; L681-V701 HydrophobicContact CD1-CG2 3.97Å; M697-V701 VanDerWaalsContact O-CG2 3.31Å; M697-V701 WeakPolarHBondContact O-CG2 3.46Å; M697-V701 PolarHBondContact O-N 2.88Å; L698-V701 PolarHBondContact O-N 3.38Å; V701-E703 VanDerWaalsContact C-N 3.33Å; V701-E703 PolarHBondContact O-N 3.16Å; V701-Q704 PolarHBondContact O-N 2.95Å; V701-L705 WeakPolarHBondContact O-CB 3.4Å; V701-L705 PolarHBondContact O-N 3.47Å
702	Y	89.7	Confident	83.5	Confident	14 Å²	14	52.7 Å²	52.7	6%	0.055	26%	0.263	C	S	.	.	H	α-helix	trans	-61.6	-40.4	172.4	-79.8	-58.5	0	0	0	112.8	L678 Q682 L698 S699 L705 S706 L718 R721 T725	L678-Y702 HydrophobicContact CD1-CD1 4.03Å; L678-Y702 HydrophobicContact CD1-CE1 3.4Å; L678-Y702 VanDerWaalsContact CD1-CE1 3.4Å; L678-Y702 HydrophobicContact CG-CE1 4.26Å; Q682-Y702 PolarHBondContact NE2-OH 3.16Å; L698-Y702 HydrophobicContact CD1-CD2 4.19Å; L698-Y702 HydrophobicContact CD1-CE2 3.59Å; L698-Y702 HydrophobicContact CD2-CE2 4.28Å; L698-Y702 HydrophobicContact CG-CD2 4.03Å; L698-Y702 HydrophobicContact CG-CE2 3.67Å; L698-Y702 WeakPolarHBondContact O-CD2 3.38Å; L698-Y702 PolarHBondContact O-N 3.18Å; S699-Y702 PolarHBondContact O-N 3.02Å; Y702-L705 PolarHBondContact O-N 2.92Å; Y702-S706 PolarHBondContact O-N 3.48Å; Y702-S706 VanDerWaalsContact O-N 3.09Å; Y702-L718 HydrophobicContact CD1-CD2 4.21Å; Y702-R721 HydrophobicContact CD1-CB 4.38Å; Y702-R721 HydrophobicContact CE1-CB 4.4Å; Y702-T725 HydrophobicContact CD2-CG2 3.93Å; Y702-T725 HydrophobicContact CE2-CG2 3.67Å
703	E	86.4	Confident	83	Confident	23 Å²	23	57.6 Å²	57.6	11%	0.107	29%	0.287	C	S	.	.	H	α-helix	trans	-62.1	-48.7	176	176.7	165.6	-136.4	0	0	111.5	S699 Q700 V701 L705 S706 E707 F746 R749	S699-E703 PolarHBondContact O-N 2.97Å; Q700-E703 PolarHBondContact O-N 2.91Å; V701-E703 VanDerWaalsContact C-N 3.33Å; V701-E703 PolarHBondContact O-N 3.16Å; E703-L705 VanDerWaalsContact C-N 3.33Å; E703-L705 PolarHBondContact O-N 2.87Å; E703-S706 WeakPolarHBondContact O-CB 3.29Å; E703-S706 PolarHBondContact O-N 3.13Å; E703-S706 PolarHBondContact O-OG 2.93Å; E703-E707 PolarHBondContact O-N 3.49Å; E703-F746 HydrophobicContact CB-CE2 4.35Å; E703-F746 HydrophobicContact CG-CD2 4.45Å; E703-F746 HydrophobicContact CG-CE2 4.29Å; E703-F746 WeakPolarHBondContact OE1-CD2 3.48Å; E703-R749 VanDerWaalsContact CD-CZ 3.47Å; E703-R749 VanDerWaalsContact CD-NH2 3.26Å; E703-R749 IonicContact OE1-CZ 3.88Å; E703-R749 IonicContact OE1-NE 3.34Å; E703-R749 IonicContact OE1-NH1 3.45Å; E703-R749 PolarHBondContact OE1-NH1 3.14Å; E703-R749 IonicContact OE1-NH2 2.75Å; E703-R749 PolarHBondContact OE1-NH2 3.47Å; E703-R749 IonicContact OE2-CZ 2.77Å; E703-R749 IonicContact OE2-NH1 3.8Å; E703-R749 PolarHBondContact OE2-NH1 2.86Å; E703-R749 VanDerWaalsContact OE2-NH1 3.08Å; E703-R749 IonicContact OE2-NH2 3.14Å; E703-R749 PolarHBondContact OE2-NH2 3.06Å
704	Q	86.1	Confident	82.5	Confident	52 Å²	52	56.1 Å²	56.1	24%	0.243	28%	0.283	C	S	.	.	H	α-helix	trans	-63.2	-39.5	178.2	-173.8	174	-14.7	0	0	112.1	L674 Q700 V701 S706 E707 E708	L674-Q704 HydrophobicContact CD1-CG 4.36Å; Q700-Q704 PolarHBondContact O-N 3.44Å; V701-Q704 PolarHBondContact O-N 2.95Å; Q704-S706 PolarHBondContact O-N 3.35Å; Q704-E707 PolarHBondContact O-N 2.87Å; Q704-E707 VanDerWaalsContact O-N 3.08Å; Q704-E708 PolarHBondContact O-N 3.28Å
705	L	85.7	Confident	81.9	Confident	23 Å²	23	56.6 Å²	56.6	12%	0.12	29%	0.287	C	S	.	.	H	α-helix	trans	-63.9	-27.7	175.8	-162.2	72.9	0	0	0	111.9	L674 V701 Y702 E703 E707 L718	L674-L705 HydrophobicContact CB-CD1 4.13Å; L674-L705 HydrophobicContact CD1-CD1 3.85Å; V701-L705 WeakPolarHBondContact O-CB 3.4Å; V701-L705 PolarHBondContact O-N 3.47Å; Y702-L705 PolarHBondContact O-N 2.92Å; E703-L705 VanDerWaalsContact C-N 3.33Å; E703-L705 PolarHBondContact O-N 2.87Å; L705-E707 VanDerWaalsContact C-N 3.32Å; L705-L718 HydrophobicContact CB-CD1 4.24Å; L705-L718 HydrophobicContact CD2-CD1 3.98Å; L705-L718 HydrophobicContact CD2-CD2 4.01Å; L705-L718 HydrophobicContact CG-CD1 3.95Å
706	S	81.6	Confident	81.3	Confident	11 Å²	11	61.9 Å²	61.9	8%	0.077	31%	0.312	C	S	.	.	H	α-helix	trans	-75.1	-20.4	175.5	83.4	0	0	0	0	113.7	Y702 E703 Q704	Y702-S706 PolarHBondContact O-N 3.48Å; Y702-S706 VanDerWaalsContact O-N 3.09Å; E703-S706 WeakPolarHBondContact O-CB 3.29Å; E703-S706 PolarHBondContact O-N 3.13Å; E703-S706 PolarHBondContact O-OG 2.93Å; Q704-S706 PolarHBondContact O-N 3.35Å
707	E	77.8	Confident	81.1	Confident	133 Å²	133	63.6 Å²	63.6	62%	0.621	33%	0.326	S	S	*	.	H	α-helix	trans	-85	-24	177	-66.1	180	174.2	0	0	112.3	E703 Q704 L705 N709	E703-E707 PolarHBondContact O-N 3.49Å; Q704-E707 PolarHBondContact O-N 2.87Å; Q704-E707 VanDerWaalsContact O-N 3.08Å; L705-E707 VanDerWaalsContact C-N 3.32Å; E707-N709 VanDerWaalsContact C-N 3.34Å; E707-N709 PolarHBondContact O-N 3.07Å
708	E	74.5	Confident	80.8	Confident	100 Å²	100	63.4 Å²	63.4	47%	0.467	33%	0.325	S	S	.	.	S	Bend	trans	-73.4	78.7	178.2	-73.1	-170.8	167.2	0	0	112	Q704 L710	Q704-E708 PolarHBondContact O-N 3.28Å; E708-L710 WeakPolarHBondContact O-CD1 3.5Å; E708-L710 PolarHBondContact O-N 3.41Å
709	N	58	Low	80.6	Confident	173 Å²	173	66.8 Å²	66.8	93%	0.925	34%	0.34	S	S	*	.	S	Bend	trans	37.2	34.7	161.5	-69.2	-31.2	0	0	0	118.2	E707	E707-N709 VanDerWaalsContact C-N 3.34Å; E707-N709 PolarHBondContact O-N 3.07Å
710	L	65.5	Low	80.5	Confident	70 Å²	70	70.1 Å²	70.1	37%	0.366	36%	0.355	S	S	.	.			trans	-80.1	158.3	173.6	-98.8	74.8	0	0	0	111	E708 E714 L718	E708-L710 WeakPolarHBondContact O-CD1 3.5Å; E708-L710 PolarHBondContact O-N 3.41Å; L710-E714 HydrophobicContact CB-CB 4.15Å; L710-E714 HydrophobicContact CD2-CB 3.61Å; L710-E714 WeakPolarHBondContact CD2-OE2 3.23Å; L710-E714 HydrophobicContact CG-CB 4.29Å; L710-E714 WeakPolarHBondContact CG-OE2 3.33Å; L710-L718 HydrophobicContact CD2-CD1 3.83Å
711	K	74.4	Confident	80.5	Confident	149 Å²	149	74 Å²	74	65%	0.648	37%	0.368	S	S	*	.			trans	-55.1	144.4	171.8	-67.3	172.4	-175.6	165.8	0	109.1	N713 E714 A715	K711-N713 PolarHBondContact O-N 3.32Å; K711-E714 HydrophobicContact CB-CG 4.37Å; K711-E714 PolarHBondContact O-N 3.02Å; K711-A715 PolarHBondContact O-N 3.19Å
712	P	74	Confident	80.5	Confident	106 Å²	106	74 Å²	74	69%	0.688	37%	0.368	S	S	*	.	H	α-helix	trans	-52.1	-37.5	-173.8	16	-29.9	0	0	0	113.8	E714 A715 E716	P712-E714 PolarHBondContact O-N 3.1Å; P712-A715 PolarHBondContact O-N 3.26Å; P712-E716 PolarHBondContact O-N 3.42Å
713	N	77.2	Confident	80.6	Confident	129 Å²	129	74.7 Å²	74.7	69%	0.69	37%	0.37	S	S	*	.	H	α-helix	trans	-66.1	-37	178.1	-62.5	-0.7	0	0	0	113.1	K711 S717	K711-N713 PolarHBondContact O-N 3.32Å; N713-S717 PolarHBondContact O-N 2.82Å; N713-S717 VanDerWaalsContact O-N 3.11Å
714	E	77.7	Confident	80.9	Confident	87 Å²	87	76.6 Å²	76.6	41%	0.407	38%	0.381	S	S	.	.	H	α-helix	trans	-76.1	-37.4	179.7	-59.9	168.4	174.8	0	0	110.5	L710 K711 P712 E716 S717 L718	L710-E714 HydrophobicContact CB-CB 4.15Å; L710-E714 HydrophobicContact CD2-CB 3.61Å; L710-E714 WeakPolarHBondContact CD2-OE2 3.23Å; L710-E714 HydrophobicContact CG-CB 4.29Å; L710-E714 WeakPolarHBondContact CG-OE2 3.33Å; K711-E714 HydrophobicContact CB-CG 4.37Å; K711-E714 PolarHBondContact O-N 3.02Å; P712-E714 PolarHBondContact O-N 3.1Å; E714-E716 VanDerWaalsContact C-N 3.33Å; E714-E716 PolarHBondContact O-N 3.48Å; E714-S717 WeakPolarHBondContact O-CB 3.33Å; E714-S717 PolarHBondContact O-N 3.39Å; E714-L718 WeakPolarHBondContact O-CG 3.44Å; E714-L718 PolarHBondContact O-N 2.91Å
715	A	79.7	Confident	81.1	Confident	12 Å²	12	74.7 Å²	74.7	10%	0.099	37%	0.373	C	S	.	.	H	α-helix	trans	-61.3	-40.9	173	0	0	0	0	0	111.6	K711 P712 L718 K719	K711-A715 PolarHBondContact O-N 3.19Å; P712-A715 PolarHBondContact O-N 3.26Å; A715-L718 PolarHBondContact O-N 3.3Å; A715-K719 WeakPolarHBondContact O-CB 3.46Å; A715-K719 VanDerWaalsContact O-CG 3.24Å; A715-K719 WeakPolarHBondContact O-CG 3.46Å; A715-K719 PolarHBondContact O-N 2.87Å
716	E	81.1	Confident	81.4	Confident	124 Å²	124	73.6 Å²	73.6	58%	0.579	37%	0.367	S	S	*	.	H	α-helix	trans	-66.3	-40.6	175.2	-172.3	168	-162.9	0	0	112.4	P712 E714 L718 K719 E720	P712-E716 PolarHBondContact O-N 3.42Å; E714-E716 VanDerWaalsContact C-N 3.33Å; E714-E716 PolarHBondContact O-N 3.48Å; E716-L718 PolarHBondContact O-N 3.45Å; E716-K719 PolarHBondContact O-N 3.01Å; E716-E720 PolarHBondContact O-N 3.5Å
717	S	84.6	Confident	81.9	Confident	59 Å²	59	78.4 Å²	78.4	41%	0.413	38%	0.384	S	S	.	.	H	α-helix	trans	-60.6	-43.3	174.3	-177.1	0	0	0	0	112.3	N713 E714 E720 R721	N713-S717 PolarHBondContact O-N 2.82Å; N713-S717 VanDerWaalsContact O-N 3.11Å; E714-S717 WeakPolarHBondContact O-CB 3.33Å; E714-S717 PolarHBondContact O-N 3.39Å; S717-E720 PolarHBondContact O-N 3.05Å; S717-R721 WeakPolarHBondContact O-CG 3.34Å; S717-R721 PolarHBondContact O-N 2.9Å
718	L	85.1	Confident	82.5	Confident	13 Å²	13	76.7 Å²	76.7	7%	0.068	38%	0.376	C	S	.	.	H	α-helix	trans	-66.3	-39.1	175.3	-71.1	176.2	0	0	0	112.3	Y702 L705 L710 E714 A715 E716 E720 R721 A722	Y702-L718 HydrophobicContact CD1-CD2 4.21Å; L705-L718 HydrophobicContact CB-CD1 4.24Å; L705-L718 HydrophobicContact CD2-CD1 3.98Å; L705-L718 HydrophobicContact CD2-CD2 4.01Å; L705-L718 HydrophobicContact CG-CD1 3.95Å; L710-L718 HydrophobicContact CD2-CD1 3.83Å; E714-L718 WeakPolarHBondContact O-CG 3.44Å; E714-L718 PolarHBondContact O-N 2.91Å; A715-L718 PolarHBondContact O-N 3.3Å; E716-L718 PolarHBondContact O-N 3.45Å; L718-E720 VanDerWaalsContact C-N 3.35Å; L718-R721 WeakPolarHBondContact O-CB 3.33Å; L718-R721 PolarHBondContact O-N 2.9Å; L718-A722 PolarHBondContact O-N 2.79Å
719	K	86.1	Confident	83.2	Confident	76 Å²	76	71.9 Å²	71.9	33%	0.33	35%	0.353	S	S	.	.	H	α-helix	trans	-62.5	-41.2	173.8	-75.1	170.2	-175.5	179.4	0	111.6	A715 E716 A722 R723 F746	A715-K719 WeakPolarHBondContact O-CB 3.46Å; A715-K719 VanDerWaalsContact O-CG 3.24Å; A715-K719 WeakPolarHBondContact O-CG 3.46Å; A715-K719 PolarHBondContact O-N 2.87Å; E716-K719 PolarHBondContact O-N 3.01Å; K719-A722 WeakPolarHBondContact O-CB 2.93Å; K719-A722 PolarHBondContact O-N 3.2Å; K719-R723 WeakPolarHBondContact O-CG 3.42Å; K719-R723 PolarHBondContact O-N 3.48Å; K719-F746 HydrophobicContact CB-CZ 4.27Å; K719-F746 HydrophobicContact CG-CZ 4.44Å
720	E	87.7	Confident	84.7	Confident	69 Å²	69	64.2 Å²	64.2	32%	0.322	31%	0.312	S	S	.	.	H	α-helix	trans	-66.4	-38.4	175.1	-169.8	60.1	-152	0	0	111.6	E716 S717 L718 A722 R723 N724 R727	E716-E720 PolarHBondContact O-N 3.5Å; S717-E720 PolarHBondContact O-N 3.05Å; L718-E720 VanDerWaalsContact C-N 3.35Å; E720-A722 VanDerWaalsContact C-N 3.34Å; E720-A722 PolarHBondContact O-N 2.95Å; E720-R723 WeakPolarHBondContact O-CB 3.06Å; E720-R723 PolarHBondContact O-N 3.34Å; E720-R723 WeakPolarHBondContact OE2-CD 3.27Å; E720-R723 IonicContact OE2-CZ 3.2Å; E720-R723 IonicContact OE2-NE 3.3Å; E720-R723 IonicContact OE2-NH1 3.91Å; E720-R723 PolarHBondContact OE2-NH1 3.16Å; E720-N724 VanDerWaalsContact O-CG 3.31Å; E720-N724 PolarHBondContact O-N 3.39Å; E720-N724 PolarHBondContact O-ND2 2.72Å; E720-R727 IonicContact OE1-NH1 2.69Å; E720-R727 PolarHBondContact OE1-NH1 3.16Å
721	R	89.2	Confident	85.8	Confident	132 Å²	132	67 Å²	67	50%	0.498	33%	0.327	S	S	.	.	H	α-helix	trans	-59.4	-44.1	171.6	-72.2	176.8	-175.7	-176.3	-0.5	111.7	Y702 S717 L718 R723 N724 T725	Y702-R721 HydrophobicContact CD1-CB 4.38Å; Y702-R721 HydrophobicContact CE1-CB 4.4Å; S717-R721 WeakPolarHBondContact O-CG 3.34Å; S717-R721 PolarHBondContact O-N 2.9Å; L718-R721 WeakPolarHBondContact O-CB 3.33Å; L718-R721 PolarHBondContact O-N 2.9Å; R721-R723 PolarHBondContact O-N 3.15Å; R721-N724 PolarHBondContact O-N 2.99Å; R721-T725 WeakPolarHBondContact O-CG2 3.39Å; R721-T725 PolarHBondContact O-N 2.95Å; R721-T725 PolarHBondContact O-OG1 2.91Å
722	A	89.5	Confident	86.5	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-60.6	-42.1	175.1	0	0	0	0	0	112.2	L718 K719 E720 N724 T725 Y726 F746	L718-A722 PolarHBondContact O-N 2.79Å; K719-A722 WeakPolarHBondContact O-CB 2.93Å; K719-A722 PolarHBondContact O-N 3.2Å; E720-A722 VanDerWaalsContact C-N 3.34Å; E720-A722 PolarHBondContact O-N 2.95Å; A722-N724 VanDerWaalsContact C-N 3.31Å; A722-N724 PolarHBondContact O-N 3.42Å; A722-T725 WeakPolarHBondContact CA-OG1 3.38Å; A722-T725 PolarHBondContact O-N 3.18Å; A722-T725 PolarHBondContact O-OG1 2.89Å; A722-Y726 WeakPolarHBondContact O-CD2 3.25Å; A722-Y726 PolarHBondContact O-N 3.38Å; A722-F746 HydrophobicContact CB-CE2 4.09Å; A722-F746 HydrophobicContact CB-CZ 3.88Å
723	R	91.2	Very high	87	Confident	28 Å²	28	60.8 Å²	60.8	11%	0.106	29%	0.292	C	S	.	.	H	α-helix	trans	-59.5	-44	173.8	-67.1	-179.6	-167	120.9	-3.2	111.3	K719 E720 R721 Y726 R727 F746 E747	K719-R723 WeakPolarHBondContact O-CG 3.42Å; K719-R723 PolarHBondContact O-N 3.48Å; E720-R723 WeakPolarHBondContact O-CB 3.06Å; E720-R723 PolarHBondContact O-N 3.34Å; E720-R723 WeakPolarHBondContact OE2-CD 3.27Å; E720-R723 IonicContact OE2-CZ 3.2Å; E720-R723 IonicContact OE2-NE 3.3Å; E720-R723 IonicContact OE2-NH1 3.91Å; E720-R723 PolarHBondContact OE2-NH1 3.16Å; R721-R723 PolarHBondContact O-N 3.15Å; R723-Y726 PolarHBondContact O-N 3.02Å; R723-R727 VanDerWaalsContact O-CG 3.29Å; R723-R727 WeakPolarHBondContact O-CG 3.33Å; R723-R727 PolarHBondContact O-N 2.83Å; R723-F746 HydrophobicContact CG-CD1 4.18Å; R723-F746 HydrophobicContact CG-CE1 3.41Å; R723-F746 VanDerWaalsContact CG-CE1 3.41Å; R723-F746 HydrophobicContact CG-CZ 4.26Å; R723-E747 WeakPolarHBondContact CD-OE1 3.46Å; R723-E747 IonicContact NE-OE1 2.73Å; R723-E747 PolarHBondContact NE-OE1 2.97Å; R723-E747 VanDerWaalsContact NE-OE1 3.12Å
724	N	91.7	Very high	87.4	Confident	63 Å²	63	56.5 Å²	56.5	34%	0.337	27%	0.271	S	S	.	.	H	α-helix	trans	-67.1	-40.1	-179.6	-69.2	-22.7	0	0	0	111.7	E720 R721 A722 Y726 R727 E728	E720-N724 VanDerWaalsContact O-CG 3.31Å; E720-N724 PolarHBondContact O-N 3.39Å; E720-N724 PolarHBondContact O-ND2 2.72Å; R721-N724 PolarHBondContact O-N 2.99Å; A722-N724 VanDerWaalsContact C-N 3.31Å; A722-N724 PolarHBondContact O-N 3.42Å; N724-Y726 PolarHBondContact O-N 3.47Å; N724-R727 PolarHBondContact O-N 3.1Å; N724-R727 PolarHBondContact OD1-NH1 3.05Å; N724-E728 WeakPolarHBondContact O-CB 3.34Å; N724-E728 WeakPolarHBondContact O-CG 3.48Å; N724-E728 PolarHBondContact O-N 3.5Å
725	T	91.6	Very high	87.9	Confident	11 Å²	11	59.1 Å²	59.1	7%	0.067	28%	0.283	C	S	.	.	H	α-helix	trans	-66.1	-37	175.1	54.4	0	0	0	0	112.9	L698 S699 Y702 R721 A722 G729	L698-T725 HydrophobicContact CD2-CG2 3.79Å; L698-T725 HydrophobicContact CG-CG2 4.15Å; S699-T725 WeakPolarHBondContact CB-OG1 3.35Å; S699-T725 WeakPolarHBondContact OG-CB 3.41Å; S699-T725 PolarHBondContact OG-OG1 2.86Å; Y702-T725 HydrophobicContact CD2-CG2 3.93Å; Y702-T725 HydrophobicContact CE2-CG2 3.67Å; R721-T725 WeakPolarHBondContact O-CG2 3.39Å; R721-T725 PolarHBondContact O-N 2.95Å; R721-T725 PolarHBondContact O-OG1 2.91Å; A722-T725 WeakPolarHBondContact CA-OG1 3.38Å; A722-T725 PolarHBondContact O-N 3.18Å; A722-T725 PolarHBondContact O-OG1 2.89Å; T725-G729 PolarHBondContact O-N 3.5Å
726	Y	91.6	Very high	88.3	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61.9	-45.9	170.9	-80.2	-60	0	0	0	111.4	L696 S699 A722 R723 N724 G729 L730 L739 Q742 L743 F746	L696-Y726 HydrophobicContact CD1-CE1 4.13Å; S699-Y726 VanDerWaalsContact CB-CE2 3.43Å; A722-Y726 WeakPolarHBondContact O-CD2 3.25Å; A722-Y726 PolarHBondContact O-N 3.38Å; R723-Y726 PolarHBondContact O-N 3.02Å; N724-Y726 PolarHBondContact O-N 3.47Å; Y726-G729 PolarHBondContact O-N 2.91Å; Y726-L730 WeakPolarHBondContact O-CB 3.37Å; Y726-L730 VanDerWaalsContact O-CG 3.25Å; Y726-L730 WeakPolarHBondContact O-CG 3.42Å; Y726-L730 PolarHBondContact O-N 3.29Å; Y726-L739 HydrophobicContact CD1-CD1 3.42Å; Y726-L739 VanDerWaalsContact CD1-CD1 3.42Å; Y726-L739 HydrophobicContact CD1-CG 4.06Å; Y726-L739 HydrophobicContact CE1-CD1 3.78Å; Y726-Q742 HydrophobicContact CE1-CB 3.91Å; Y726-L743 HydrophobicContact CD1-CB 4.21Å; Y726-L743 HydrophobicContact CD2-CD1 3.96Å; Y726-L743 HydrophobicContact CG-CB 4.1Å; Y726-L743 HydrophobicContact CG-CD1 3.99Å; Y726-F746 HydrophobicContact CE2-CB 4.22Å; Y726-F746 HydrophobicContact CE2-CD2 4.28Å; Y726-F746 HydrophobicContact CE2-CG 4.13Å
727	R	91.1	Very high	88.8	Confident	113 Å²	113	57 Å²	57	43%	0.426	27%	0.271	S	S	.	.	H	α-helix	trans	-63.5	-45	178.3	-72.3	170.9	-177	152.8	0.4	112.1	E720 R723 N724 L730 N731	E720-R727 IonicContact OE1-NH1 2.69Å; E720-R727 PolarHBondContact OE1-NH1 3.16Å; R723-R727 VanDerWaalsContact O-CG 3.29Å; R723-R727 WeakPolarHBondContact O-CG 3.33Å; R723-R727 PolarHBondContact O-N 2.83Å; N724-R727 PolarHBondContact O-N 3.1Å; N724-R727 PolarHBondContact OD1-NH1 3.05Å; R727-L730 PolarHBondContact O-N 3.4Å; R727-N731 PolarHBondContact O-N 3.32Å; R727-N731 PolarHBondContact O-ND2 3.07Å; R727-N731 PolarHBondContact O-OD1 2.99Å
728	E	90.5	Very high	89	Confident	96 Å²	96	55.4 Å²	55.4	45%	0.449	26%	0.262	S	S	.	.	H	α-helix	trans	-61.4	-46.6	175.9	-74.8	177.5	178.7	0	0	111.3	W695 N724 L730 N731 H732	W695-E728 HydrophobicContact CE3-CB 4.35Å; W695-E728 HydrophobicContact CH2-CB 4Å; W695-E728 HydrophobicContact CZ3-CB 3.72Å; W695-E728 WeakPolarHBondContact CZ3-OE2 3.11Å; N724-E728 WeakPolarHBondContact O-CB 3.34Å; N724-E728 WeakPolarHBondContact O-CG 3.48Å; N724-E728 PolarHBondContact O-N 3.5Å; E728-L730 VanDerWaalsContact C-N 3.27Å; E728-L730 PolarHBondContact O-N 3.26Å; E728-N731 WeakPolarHBondContact O-CB 3.47Å; E728-N731 PolarHBondContact O-N 3.44Å; E728-N731 VanDerWaalsContact O-N 3.13Å; E728-H732 PolarHBondContact O-CD2 3.31Å; E728-H732 PolarHBondContact O-N 3.3Å
729	G	89.5	Confident	89.3	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.9	-37.3	175.3	0	0	0	0	0	112.9	T725 Y726 H732 N733	T725-G729 PolarHBondContact O-N 3.5Å; Y726-G729 PolarHBondContact O-N 2.91Å; G729-H732 PolarHBondContact O-N 3.29Å; G729-N733 PolarHBondContact O-N 3.46Å
730	L	90	Very high	89.6	Confident	11 Å²	11	51.8 Å²	51.8	6%	0.058	25%	0.245	C	C	.	.	H	α-helix	trans	-73.4	-31.1	175.7	-74.1	175.1	0	0	0	113.1	Y726 R727 E728 H732 N733 P734 L739 W740 L743	Y726-L730 WeakPolarHBondContact O-CB 3.37Å; Y726-L730 VanDerWaalsContact O-CG 3.25Å; Y726-L730 WeakPolarHBondContact O-CG 3.42Å; Y726-L730 PolarHBondContact O-N 3.29Å; R727-L730 PolarHBondContact O-N 3.4Å; E728-L730 VanDerWaalsContact C-N 3.27Å; E728-L730 PolarHBondContact O-N 3.26Å; L730-H732 VanDerWaalsContact C-N 3.34Å; L730-N733 CarbonylContact O-C 3.4Å; L730-P734 WeakPolarHBondContact O-CA 3.45Å; L730-P734 VanDerWaalsContact O-N 3.13Å; L730-L739 HydrophobicContact CB-CD2 4.41Å; L730-L739 HydrophobicContact CD2-CB 3.97Å; L730-L739 HydrophobicContact CD2-CD2 3.76Å; L730-L739 HydrophobicContact CD2-CG 3.93Å; L730-L739 HydrophobicContact CG-CD2 3.69Å; L730-L739 HydrophobicContact CG-CG 3.97Å; L730-W740 HydrophobicContact CD1-CD2 3.87Å; L730-W740 HydrophobicContact CD1-CE3 3.67Å; L730-W740 HydrophobicContact CD1-CH2 4.02Å; L730-W740 HydrophobicContact CD1-CZ2 4.2Å; L730-W740 HydrophobicContact CD1-CZ3 3.77Å; L730-W740 HydrophobicContact CD2-CD2 3.59Å; L730-W740 HydrophobicContact CD2-CE3 4.29Å; L730-W740 HydrophobicContact CD2-CG 3.74Å; L730-W740 HydrophobicContact CD2-CZ2 3.93Å; L730-W740 HydrophobicContact CG-CD2 4.38Å; L730-W740 HydrophobicContact CG-CZ2 4.47Å; L730-L743 HydrophobicContact CD1-CD2 3.5Å
731	N	89.4	Confident	89.9	Confident	128 Å²	128	49.4 Å²	49.4	68%	0.684	24%	0.235	S	C	*	.	H	α-helix	trans	-66.7	-38.6	173.3	-69.3	-19.6	0	0	0	111	R727 E728	R727-N731 PolarHBondContact O-N 3.32Å; R727-N731 PolarHBondContact O-ND2 3.07Å; R727-N731 PolarHBondContact O-OD1 2.99Å; E728-N731 WeakPolarHBondContact O-CB 3.47Å; E728-N731 PolarHBondContact O-N 3.44Å; E728-N731 VanDerWaalsContact O-N 3.13Å
732	H	87.3	Confident	89.9	Confident	91 Å²	91	45.1 Å²	45.1	42%	0.421	22%	0.22	S	C	.	.	H	α-helix	trans	-75.2	-41.7	175.6	-68.7	-57.2	0	0	0	112.6	W695 E728 G729 L730	W695-H732 AromaticContact CZ2-CD2 3.48Å; W695-H732 VanDerWaalsContact CZ2-CD2 3.48Å; W695-H732 WeakPolarHBondContact CZ2-CD2 3.23Å; W695-H732 AromaticContact CZ2-NE2 3.93Å; E728-H732 PolarHBondContact O-CD2 3.31Å; E728-H732 PolarHBondContact O-N 3.3Å; G729-H732 PolarHBondContact O-N 3.29Å; L730-H732 VanDerWaalsContact C-N 3.34Å
733	N	85.2	Confident	90.1	Very high	34 Å²	34	45.5 Å²	45.5	18%	0.182	22%	0.222	C	C	.	.			trans	-133.2	80.7	-176	-71.3	-53.7	0	0	0	111.9	Q690 P692 G729 L730 H735	Q690-N733 PolarHBondContact O-ND2 2.98Å; P692-N733 HydrophobicContact CB-CB 4.29Å; G729-N733 PolarHBondContact O-N 3.46Å; L730-N733 CarbonylContact O-C 3.4Å; N733-H735 PolarHBondContact O-N 2.89Å
734	P	86.3	Confident	90.2	Very high	39 Å²	39	44.3 Å²	44.3	25%	0.253	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-21.9	179.3	26	-33.7	0	0	0	112.8	L730 W740 N767	L730-P734 WeakPolarHBondContact O-CA 3.45Å; L730-P734 VanDerWaalsContact O-N 3.13Å; P734-W740 PolarHBondContact O-NE1 3.02Å; P734-N767 PolarHBondContact O-ND2 2.98Å
735	H	87.7	Confident	90.1	Very high	142 Å²	142	43.9 Å²	43.9	66%	0.657	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-13.7	-175.4	-60.4	-53.9	0	0	0	115.4	N733 T737 N767	N733-H735 PolarHBondContact O-N 2.89Å; H735-T737 PolarHBondContact O-N 2.83Å; H735-N767 WeakPolarHBondContact CA-OD1 3.39Å; H735-N767 PolarHBondContact ND1-OD1 3.42Å; H735-N767 VanDerWaalsContact ND1-OD1 3.11Å
736	Y	88.5	Confident	90.1	Very high	66 Å²	66	43.5 Å²	43.5	26%	0.259	21%	0.21	S	C	.	.			trans	-81.9	103.5	-175.8	-173.8	-112.8	0	0	0	111.3	P692 A738 L739	P692-Y736 HydrophobicContact CB-CD1 3.41Å; P692-Y736 VanDerWaalsContact CB-CD1 3.41Å; P692-Y736 HydrophobicContact CB-CD2 4.23Å; P692-Y736 HydrophobicContact CB-CE1 3.95Å; P692-Y736 HydrophobicContact CB-CG 3.55Å; P692-Y736 HydrophobicContact CG-CD1 3.87Å; P692-Y736 HydrophobicContact CG-CD2 3.78Å; P692-Y736 HydrophobicContact CG-CE1 4.23Å; P692-Y736 HydrophobicContact CG-CE2 4.19Å; P692-Y736 HydrophobicContact CG-CG 3.61Å; Y736-A738 HydrophobicContact CD1-CB 4.34Å; Y736-A738 HydrophobicContact CE1-CB 3.66Å; Y736-A738 HydrophobicContact CE2-CB 4.44Å; Y736-A738 PolarHBondContact O-N 3.46Å; Y736-L739 HydrophobicContact CD1-CB 3.78Å; Y736-L739 HydrophobicContact CE1-CB 4.41Å; Y736-L739 PolarHBondContact O-N 2.62Å
737	T	90.4	Very high	90.2	Very high	25 Å²	25	43.7 Å²	43.7	15%	0.153	21%	0.21	C	C	.	.	H	α-helix	trans	-56.8	-44.9	-173.9	55	0	0	0	0	112.9	H735 L739 W740 L741 T770 E772 L773	H735-T737 PolarHBondContact O-N 2.83Å; T737-L739 PolarHBondContact O-N 2.91Å; T737-L739 VanDerWaalsContact O-N 3.16Å; T737-W740 WeakPolarHBondContact O-CB 3.47Å; T737-W740 PolarHBondContact O-N 3.45Å; T737-L741 WeakPolarHBondContact O-CG 3.36Å; T737-L741 PolarHBondContact O-N 2.93Å; T737-T770 HydrophobicContact CG2-CG2 4.13Å; T737-E772 WeakPolarHBondContact CB-OE2 3.44Å; T737-E772 PolarHBondContact OG1-OE2 2.98Å; T737-L773 HydrophobicContact CG2-CG 4.38Å
738	A	89.2	Confident	90.1	Very high	27 Å²	27	39.9 Å²	39.9	22%	0.223	20%	0.197	C	C	.	.	H	α-helix	trans	-63.3	-26.8	-174.4	0	0	0	0	0	113.8	Y736 Q742	Y736-A738 HydrophobicContact CD1-CB 4.34Å; Y736-A738 HydrophobicContact CE1-CB 3.66Å; Y736-A738 HydrophobicContact CE2-CB 4.44Å; Y736-A738 PolarHBondContact O-N 3.46Å; A738-Q742 WeakPolarHBondContact O-CB 3.49Å; A738-Q742 WeakPolarHBondContact O-CG 3.15Å; A738-Q742 PolarHBondContact O-N 3.31Å
739	L	91.1	Very high	90	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-71.1	-39.4	175.3	-167.3	69.9	0	0	0	111.3	W695 L696 Y726 L730 Y736 T737 Q742 L743	W695-L739 HydrophobicContact CB-CD1 4.46Å; L696-L739 HydrophobicContact CB-CD1 4.26Å; Y726-L739 HydrophobicContact CD1-CD1 3.42Å; Y726-L739 VanDerWaalsContact CD1-CD1 3.42Å; Y726-L739 HydrophobicContact CD1-CG 4.06Å; Y726-L739 HydrophobicContact CE1-CD1 3.78Å; L730-L739 HydrophobicContact CB-CD2 4.41Å; L730-L739 HydrophobicContact CD2-CB 3.97Å; L730-L739 HydrophobicContact CD2-CD2 3.76Å; L730-L739 HydrophobicContact CD2-CG 3.93Å; L730-L739 HydrophobicContact CG-CD2 3.69Å; L730-L739 HydrophobicContact CG-CG 3.97Å; Y736-L739 HydrophobicContact CD1-CB 3.78Å; Y736-L739 HydrophobicContact CE1-CB 4.41Å; Y736-L739 PolarHBondContact O-N 2.62Å; T737-L739 PolarHBondContact O-N 2.91Å; T737-L739 VanDerWaalsContact O-N 3.16Å; L739-Q742 PolarHBondContact O-N 3.34Å; L739-L743 WeakPolarHBondContact O-CB 3.28Å; L739-L743 PolarHBondContact O-N 3.01Å
740	W	93.8	Very high	89.9	Confident	12 Å²	12	43.2 Å²	43.2	5%	0.045	21%	0.207	C	C	.	.	H	α-helix	trans	-61.3	-45.3	171.7	-71.8	105.3	0	0	0	112	L730 P734 T737 Q742 L743 A744 I759 K762 A763 Q766 L773	L730-W740 HydrophobicContact CD1-CD2 3.87Å; L730-W740 HydrophobicContact CD1-CE3 3.67Å; L730-W740 HydrophobicContact CD1-CH2 4.02Å; L730-W740 HydrophobicContact CD1-CZ2 4.2Å; L730-W740 HydrophobicContact CD1-CZ3 3.77Å; L730-W740 HydrophobicContact CD2-CD2 3.59Å; L730-W740 HydrophobicContact CD2-CE3 4.29Å; L730-W740 HydrophobicContact CD2-CG 3.74Å; L730-W740 HydrophobicContact CD2-CZ2 3.93Å; L730-W740 HydrophobicContact CG-CD2 4.38Å; L730-W740 HydrophobicContact CG-CZ2 4.47Å; P734-W740 PolarHBondContact O-NE1 3.02Å; T737-W740 WeakPolarHBondContact O-CB 3.47Å; T737-W740 PolarHBondContact O-N 3.45Å; W740-Q742 VanDerWaalsContact C-N 3.34Å; W740-Q742 PolarHBondContact O-N 2.93Å; W740-L743 PolarHBondContact O-N 3.04Å; W740-A744 WeakPolarHBondContact O-CB 3.23Å; W740-A744 PolarHBondContact O-N 2.89Å; W740-I759 HydrophobicContact CE3-CG2 3.86Å; W740-I759 HydrophobicContact CZ3-CG2 4.17Å; W740-K762 HydrophobicContact CH2-CB 4.48Å; W740-K762 HydrophobicContact CH2-CD 4.02Å; W740-K762 HydrophobicContact CH2-CG 3.95Å; W740-K762 HydrophobicContact CZ3-CB 4.32Å; W740-K762 HydrophobicContact CZ3-CD 4.28Å; W740-K762 HydrophobicContact CZ3-CG 4.25Å; W740-A763 HydrophobicContact CB-CB 3.76Å; W740-A763 HydrophobicContact CD2-CB 3.4Å; W740-A763 VanDerWaalsContact CD2-CB 3.4Å; W740-A763 HydrophobicContact CE3-CB 3.51Å; W740-A763 HydrophobicContact CG-CB 3.54Å; W740-A763 HydrophobicContact CZ3-CB 4.24Å; W740-Q766 HydrophobicContact CZ2-CB 4.43Å; W740-Q766 HydrophobicContact CZ2-CG 4.22Å; W740-L773 HydrophobicContact CB-CD2 4.01Å
741	L	92.8	Very high	89.7	Confident	20 Å²	20	48 Å²	48	11%	0.105	24%	0.241	C	C	.	.	H	α-helix	trans	-62.4	-43.4	-179.9	-62	-174.4	0	0	0	111.8	T737 A744 R745 L760 E772 L773 E776	T737-L741 WeakPolarHBondContact O-CG 3.36Å; T737-L741 PolarHBondContact O-N 2.93Å; L741-A744 PolarHBondContact O-N 3.29Å; L741-R745 WeakPolarHBondContact O-CB 3.47Å; L741-R745 VanDerWaalsContact O-CG 3.28Å; L741-R745 WeakPolarHBondContact O-CG 3.33Å; L741-R745 PolarHBondContact O-N 3.14Å; L741-L760 HydrophobicContact CD2-CD2 4.21Å; L741-E772 HydrophobicContact CD1-CB 4.25Å; L741-L773 HydrophobicContact CD2-CD2 3.52Å; L741-L773 HydrophobicContact CG-CD2 4.13Å; L741-E776 HydrophobicContact CD1-CG 4.03Å; L741-E776 HydrophobicContact CD2-CB 3.55Å; L741-E776 HydrophobicContact CD2-CG 3.46Å; L741-E776 VanDerWaalsContact CD2-CG 3.46Å; L741-E776 HydrophobicContact CG-CG 4.19Å
742	Q	90.6	Very high	89.7	Confident	41 Å²	41	44.1 Å²	44.1	19%	0.192	22%	0.22	C	C	.	.	H	α-helix	trans	-70.6	-37.9	-179.1	-68.2	-73	-25.8	0	0	111.5	L696 Y726 A738 L739 W740 R745 F746	L696-Q742 HydrophobicContact CD1-CB 3.75Å; L696-Q742 HydrophobicContact CD1-CG 3.6Å; Y726-Q742 HydrophobicContact CE1-CB 3.91Å; A738-Q742 WeakPolarHBondContact O-CB 3.49Å; A738-Q742 WeakPolarHBondContact O-CG 3.15Å; A738-Q742 PolarHBondContact O-N 3.31Å; L739-Q742 PolarHBondContact O-N 3.34Å; W740-Q742 VanDerWaalsContact C-N 3.34Å; W740-Q742 PolarHBondContact O-N 2.93Å; Q742-R745 PolarHBondContact O-N 3.31Å; Q742-F746 WeakPolarHBondContact O-CB 3.49Å; Q742-F746 PolarHBondContact O-N 3.35Å
743	L	92.8	Very high	89.9	Confident	8 Å²	8	42.9 Å²	42.9	4%	0.042	22%	0.216	C	C	.	.	H	α-helix	trans	-62.9	-42.9	171.9	177.4	59.2	0	0	0	112	Y726 L730 L739 W740 F746 E747 I759	Y726-L743 HydrophobicContact CD1-CB 4.21Å; Y726-L743 HydrophobicContact CD2-CD1 3.96Å; Y726-L743 HydrophobicContact CG-CB 4.1Å; Y726-L743 HydrophobicContact CG-CD1 3.99Å; L730-L743 HydrophobicContact CD1-CD2 3.5Å; L739-L743 WeakPolarHBondContact O-CB 3.28Å; L739-L743 PolarHBondContact O-N 3.01Å; W740-L743 PolarHBondContact O-N 3.04Å; L743-F746 WeakPolarHBondContact O-CB 3.38Å; L743-F746 PolarHBondContact O-N 3.39Å; L743-E747 PolarHBondContact O-N 3.26Å; L743-I759 HydrophobicContact CD2-CD1 4.33Å; L743-I759 HydrophobicContact CD2-CG2 3.92Å; L743-I759 HydrophobicContact CG-CD1 4.11Å; L743-I759 HydrophobicContact CG-CG2 4.04Å
744	A	92.6	Very high	90.2	Very high	4 Å²	4	46 Å²	46	3%	0.033	24%	0.237	C	C	.	.	H	α-helix	trans	-63.8	-45.3	176.7	0	0	0	0	0	112	W740 L741 F746 E747 E748 A756 I759 L760	W740-A744 WeakPolarHBondContact O-CB 3.23Å; W740-A744 PolarHBondContact O-N 2.89Å; L741-A744 PolarHBondContact O-N 3.29Å; A744-F746 VanDerWaalsContact C-N 3.29Å; A744-F746 PolarHBondContact O-N 3.47Å; A744-E747 PolarHBondContact O-N 2.98Å; A744-E748 WeakPolarHBondContact O-CB 3.36Å; A744-E748 PolarHBondContact O-N 3.41Å; A744-A756 WeakPolarHBondContact O-CB 2.81Å; A744-I759 HydrophobicContact CB-CG2 4.35Å; A744-L760 HydrophobicContact CB-CD1 4.12Å; A744-L760 HydrophobicContact CB-CD2 3.54Å; A744-L760 HydrophobicContact CB-CG 3.61Å
745	R	91.3	Very high	90.5	Very high	54 Å²	54	49.1 Å²	49.1	20%	0.204	25%	0.246	C	C	.	.	H	α-helix	trans	-65	-31.5	175.2	-72	172.8	177.8	-167.2	-3	112.6	L741 Q742 R749 E776 E904	L741-R745 WeakPolarHBondContact O-CB 3.47Å; L741-R745 VanDerWaalsContact O-CG 3.28Å; L741-R745 WeakPolarHBondContact O-CG 3.33Å; L741-R745 PolarHBondContact O-N 3.14Å; Q742-R745 PolarHBondContact O-N 3.31Å; R745-R749 WeakPolarHBondContact O-CG 3.4Å; R745-R749 PolarHBondContact O-N 3.19Å; R745-R749 VanDerWaalsContact O-N 3.08Å; R745-R749 PolarHBondContact O-NE 3.28Å; R745-E776 IonicContact CZ-OE1 3.56Å; R745-E776 IonicContact CZ-OE2 3.05Å; R745-E776 IonicContact NE-OE1 2.66Å; R745-E776 IonicContact NE-OE2 2.7Å; R745-E776 PolarHBondContact NE-OE2 3.39Å; R745-E776 IonicContact NH2-OE1 3.59Å; R745-E776 PolarHBondContact NH2-OE1 2.88Å; R745-E776 IonicContact NH2-OE2 2.89Å; R745-E776 PolarHBondContact NH2-OE2 3.3Å; R745-E904 IonicContact CZ-OE1 3.72Å; R745-E904 IonicContact NH2-OE1 2.73Å; R745-E904 PolarHBondContact NH2-OE1 2.82Å
746	F	91.3	Very high	90.8	Very high	3 Å²	3	42.3 Å²	42.3	1%	0.013	22%	0.215	C	C	.	.	H	α-helix	trans	-67.5	-48	174.5	176.8	-93.1	0	0	0	111.4	E703 K719 A722 R723 Y726 Q742 L743 A744 E748 R749 Q750	E703-F746 HydrophobicContact CB-CE2 4.35Å; E703-F746 HydrophobicContact CG-CD2 4.45Å; E703-F746 HydrophobicContact CG-CE2 4.29Å; E703-F746 WeakPolarHBondContact OE1-CD2 3.48Å; K719-F746 HydrophobicContact CB-CZ 4.27Å; K719-F746 HydrophobicContact CG-CZ 4.44Å; A722-F746 HydrophobicContact CB-CE2 4.09Å; A722-F746 HydrophobicContact CB-CZ 3.88Å; R723-F746 HydrophobicContact CG-CD1 4.18Å; R723-F746 HydrophobicContact CG-CE1 3.41Å; R723-F746 VanDerWaalsContact CG-CE1 3.41Å; R723-F746 HydrophobicContact CG-CZ 4.26Å; Y726-F746 HydrophobicContact CE2-CB 4.22Å; Y726-F746 HydrophobicContact CE2-CD2 4.28Å; Y726-F746 HydrophobicContact CE2-CG 4.13Å; Q742-F746 WeakPolarHBondContact O-CB 3.49Å; Q742-F746 PolarHBondContact O-N 3.35Å; L743-F746 WeakPolarHBondContact O-CB 3.38Å; L743-F746 PolarHBondContact O-N 3.39Å; A744-F746 VanDerWaalsContact C-N 3.29Å; A744-F746 PolarHBondContact O-N 3.47Å; F746-E748 VanDerWaalsContact C-N 3.33Å; F746-E748 PolarHBondContact O-N 2.99Å; F746-R749 PolarHBondContact O-N 2.93Å; F746-Q750 VanDerWaalsContact CE1-CD 3.48Å; F746-Q750 WeakPolarHBondContact O-CG 3.21Å; F746-Q750 PolarHBondContact O-N 2.7Å
747	E	92	Very high	91	Very high	3 Å²	3	42.3 Å²	42.3	1%	0.014	21%	0.214	C	C	.	.	H	α-helix	trans	-67.1	-33.4	175.7	-72.9	-69.6	165	0	0	112.7	R723 L743 A744 Q750 N752 A756 I759	R723-E747 WeakPolarHBondContact CD-OE1 3.46Å; R723-E747 IonicContact NE-OE1 2.73Å; R723-E747 PolarHBondContact NE-OE1 2.97Å; R723-E747 VanDerWaalsContact NE-OE1 3.12Å; L743-E747 PolarHBondContact O-N 3.26Å; A744-E747 PolarHBondContact O-N 2.98Å; E747-Q750 PolarHBondContact O-N 2.85Å; E747-N752 PolarHBondContact O-N 2.85Å; E747-N752 WeakPolarHBondContact OE2-CB 3.48Å; E747-N752 PolarHBondContact OE2-ND2 2.9Å; E747-A756 HydrophobicContact CB-CB 4.12Å; E747-I759 HydrophobicContact CB-CD1 4.31Å; E747-I759 HydrophobicContact CG-CD1 3.64Å
748	E	90.4	Very high	91.2	Very high	33 Å²	33	44 Å²	44	15%	0.154	23%	0.227	C	C	.	.	H	α-helix	trans	-61	-46.4	172.2	-175.3	-171.3	172.4	0	0	111.7	A744 F746 Q750 C751 L753 A756 R783	A744-E748 WeakPolarHBondContact O-CB 3.36Å; A744-E748 PolarHBondContact O-N 3.41Å; F746-E748 VanDerWaalsContact C-N 3.33Å; F746-E748 PolarHBondContact O-N 2.99Å; E748-Q750 PolarHBondContact O-N 3.18Å; E748-C751 WeakPolarHBondContact O-CA 3.37Å; E748-C751 PolarHBondContact O-N 3.48Å; E748-L753 HydrophobicContact CG-CD2 3.89Å; E748-A756 HydrophobicContact CB-CB 4.4Å; E748-R783 WeakPolarHBondContact OE1-CD 3.46Å; E748-R783 IonicContact OE1-CZ 3.82Å; E748-R783 IonicContact OE1-NE 3.99Å; E748-R783 PolarHBondContact OE1-NE 2.87Å; E748-R783 IonicContact OE1-NH1 3.4Å; E748-R783 PolarHBondContact OE1-NH1 3.38Å; E748-R783 IonicContact OE1-NH2 3.34Å; E748-R783 PolarHBondContact OE1-NH2 3.29Å; E748-R783 IonicContact OE2-CZ 2.66Å; E748-R783 IonicContact OE2-NE 3.96Å; E748-R783 IonicContact OE2-NH1 3.12Å; E748-R783 PolarHBondContact OE2-NH1 2.76Å; E748-R783 IonicContact OE2-NH2 3.39Å; E748-R783 PolarHBondContact OE2-NH2 2.65Å
749	R	88.6	Confident	91.5	Very high	129 Å²	129	44 Å²	44	49%	0.487	22%	0.223	S	C	.	.	H	α-helix	trans	-62.6	-23.4	176.4	-79	-178.1	-76.8	163.3	3.1	113.3	E703 R745 F746 C751	E703-R749 VanDerWaalsContact CD-CZ 3.47Å; E703-R749 VanDerWaalsContact CD-NH2 3.26Å; E703-R749 IonicContact OE1-CZ 3.88Å; E703-R749 IonicContact OE1-NE 3.34Å; E703-R749 IonicContact OE1-NH1 3.45Å; E703-R749 PolarHBondContact OE1-NH1 3.14Å; E703-R749 IonicContact OE1-NH2 2.75Å; E703-R749 PolarHBondContact OE1-NH2 3.47Å; E703-R749 IonicContact OE2-CZ 2.77Å; E703-R749 IonicContact OE2-NH1 3.8Å; E703-R749 PolarHBondContact OE2-NH1 2.86Å; E703-R749 VanDerWaalsContact OE2-NH1 3.08Å; E703-R749 IonicContact OE2-NH2 3.14Å; E703-R749 PolarHBondContact OE2-NH2 3.06Å; R745-R749 WeakPolarHBondContact O-CG 3.4Å; R745-R749 PolarHBondContact O-N 3.19Å; R745-R749 VanDerWaalsContact O-N 3.08Å; R745-R749 PolarHBondContact O-NE 3.28Å; F746-R749 PolarHBondContact O-N 2.93Å; R749-C751 VanDerWaalsContact C-N 3.26Å; R749-C751 PolarHBondContact O-N 2.78Å
750	Q	87.5	Confident	91.6	Very high	37 Å²	37	44.2 Å²	44.2	17%	0.173	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	11.6	174.5	-65.4	177.4	-13.5	0	0	113.4	F746 E747 E748 N752	F746-Q750 VanDerWaalsContact CE1-CD 3.48Å; F746-Q750 WeakPolarHBondContact O-CG 3.21Å; F746-Q750 PolarHBondContact O-N 2.7Å; E747-Q750 PolarHBondContact O-N 2.85Å; E748-Q750 PolarHBondContact O-N 3.18Å; Q750-N752 PolarHBondContact O-N 3.35Å
751	C	84.8	Confident	91.6	Very high	112 Å²	112	49.1 Å²	49.1	76%	0.757	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	64	14.6	-177.9	-57.8	0	0	0	0	114.8	E748 R749 L753	E748-C751 WeakPolarHBondContact O-CA 3.37Å; E748-C751 PolarHBondContact O-N 3.48Å; R749-C751 VanDerWaalsContact C-N 3.26Å; R749-C751 PolarHBondContact O-N 2.78Å; C751-L753 PolarHBondContact O-N 2.98Å
752	N	89	Confident	91.6	Very high	46 Å²	46	53.8 Å²	53.8	25%	0.246	27%	0.267	C	S	.	.			trans	-92.3	61.7	177.8	-68.2	-29.1	0	0	0	111.6	E747 Q750 T754 K755 A756	E747-N752 PolarHBondContact O-N 2.85Å; E747-N752 WeakPolarHBondContact OE2-CB 3.48Å; E747-N752 PolarHBondContact OE2-ND2 2.9Å; Q750-N752 PolarHBondContact O-N 3.35Å; N752-T754 VanDerWaalsContact C-N 3.27Å; N752-T754 PolarHBondContact O-N 3.4Å; N752-K755 HydrophobicContact CB-CB 4.04Å; N752-K755 HydrophobicContact CB-CD 3.99Å; N752-K755 HydrophobicContact CB-CG 4.15Å; N752-K755 PolarHBondContact O-N 3.03Å; N752-K755 VanDerWaalsContact O-N 3.1Å; N752-A756 PolarHBondContact O-N 3.22Å
753	L	91.1	Very high	91.7	Very high	65 Å²	65	51.8 Å²	51.8	34%	0.34	26%	0.258	S	S	.	.	H	α-helix	trans	-56.3	-38.2	-176.2	-67.3	176.6	0	0	0	113.4	E748 C751 A756 R757 A784	E748-L753 HydrophobicContact CG-CD2 3.89Å; C751-L753 PolarHBondContact O-N 2.98Å; L753-A756 PolarHBondContact O-N 3.25Å; L753-R757 WeakPolarHBondContact O-CG 3.48Å; L753-R757 PolarHBondContact O-N 3.23Å; L753-A784 HydrophobicContact CD1-CB 4.46Å
754	T	92.6	Very high	91.7	Very high	101 Å²	101	53.2 Å²	53.2	62%	0.62	26%	0.262	S	S	*	.	H	α-helix	trans	-65.7	-40.3	178.5	52.9	0	0	0	0	112.2	N752 R757 S758	N752-T754 VanDerWaalsContact C-N 3.27Å; N752-T754 PolarHBondContact O-N 3.4Å; T754-R757 PolarHBondContact O-N 3.26Å; T754-S758 PolarHBondContact O-N 3.3Å
755	K	92.4	Very high	91.6	Very high	103 Å²	103	57 Å²	57	45%	0.448	29%	0.289	S	S	.	.	H	α-helix	trans	-66.4	-44.5	174.4	-64.5	-175.2	-174	165.8	0	110.5	N752 R757 S758 I759	N752-K755 HydrophobicContact CB-CB 4.04Å; N752-K755 HydrophobicContact CB-CD 3.99Å; N752-K755 HydrophobicContact CB-CG 4.15Å; N752-K755 PolarHBondContact O-N 3.03Å; N752-K755 VanDerWaalsContact O-N 3.1Å; K755-R757 VanDerWaalsContact C-N 3.32Å; K755-R757 PolarHBondContact O-N 2.96Å; K755-S758 WeakPolarHBondContact CA-OG 3.43Å; K755-S758 PolarHBondContact O-N 2.9Å; K755-S758 VanDerWaalsContact O-N 3.12Å; K755-S758 PolarHBondContact O-OG 3.47Å; K755-I759 WeakPolarHBondContact O-CD1 3.2Å; K755-I759 VanDerWaalsContact O-CG1 3.26Å; K755-I759 WeakPolarHBondContact O-CG1 3.48Å; K755-I759 PolarHBondContact O-N 3.32Å
756	A	93.5	Very high	91.6	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-57.7	-43.3	177	0	0	0	0	0	112.1	A744 E747 E748 N752 L753 I759 L760 L780	A744-A756 WeakPolarHBondContact O-CB 2.81Å; E747-A756 HydrophobicContact CB-CB 4.12Å; E748-A756 HydrophobicContact CB-CB 4.4Å; N752-A756 PolarHBondContact O-N 3.22Å; L753-A756 PolarHBondContact O-N 3.25Å; A756-I759 PolarHBondContact O-N 3.37Å; A756-L760 WeakPolarHBondContact O-CG 3.44Å; A756-L760 PolarHBondContact O-N 3.3Å; A756-L780 HydrophobicContact CB-CD1 3.65Å
757	R	94.1	Very high	91.5	Very high	65 Å²	65	59.3 Å²	59.3	25%	0.245	30%	0.302	C	S	.	.	H	α-helix	trans	-57.9	-50.2	171.4	-73.4	176.8	-178.6	135.3	5.4	112.4	L753 T754 K755 I759 L760 E761 L780 E781 L786	L753-R757 WeakPolarHBondContact O-CG 3.48Å; L753-R757 PolarHBondContact O-N 3.23Å; T754-R757 PolarHBondContact O-N 3.26Å; K755-R757 VanDerWaalsContact C-N 3.32Å; K755-R757 PolarHBondContact O-N 2.96Å; R757-I759 PolarHBondContact O-N 2.99Å; R757-L760 PolarHBondContact O-N 2.84Å; R757-E761 WeakPolarHBondContact O-CB 3.36Å; R757-E761 PolarHBondContact O-N 3.44Å; R757-L780 HydrophobicContact CG-CD2 3.61Å; R757-E781 VanDerWaalsContact CD-OE1 3.3Å; R757-E781 WeakPolarHBondContact CD-OE1 3.47Å; R757-E781 WeakPolarHBondContact CG-OE1 3.47Å; R757-E781 IonicContact CZ-OE1 3.33Å; R757-E781 IonicContact CZ-OE2 3.93Å; R757-E781 VanDerWaalsContact NE-CD 3.34Å; R757-E781 IonicContact NE-OE1 2.63Å; R757-E781 PolarHBondContact NE-OE1 3.48Å; R757-E781 IonicContact NE-OE2 3.07Å; R757-E781 PolarHBondContact NE-OE2 3.31Å; R757-E781 VanDerWaalsContact NE-OE2 3.14Å; R757-E781 IonicContact NH2-OE1 3.68Å; R757-E781 IonicContact NH2-OE2 3.57Å; R757-E781 PolarHBondContact NH2-OE2 2.87Å; R757-L786 VanDerWaalsContact NH2-CD1 3.27Å
758	S	94.4	Very high	91.3	Very high	62 Å²	62	63.2 Å²	63.2	43%	0.434	33%	0.328	S	S	.	.	H	α-helix	trans	-61.1	-34.7	-179.9	75	0	0	0	0	112.5	T754 K755 K762	T754-S758 PolarHBondContact O-N 3.3Å; K755-S758 WeakPolarHBondContact CA-OG 3.43Å; K755-S758 PolarHBondContact O-N 2.9Å; K755-S758 VanDerWaalsContact O-N 3.12Å; K755-S758 PolarHBondContact O-OG 3.47Å; S758-K762 VanDerWaalsContact O-CB 3.31Å; S758-K762 WeakPolarHBondContact O-CB 3.37Å; S758-K762 PolarHBondContact O-N 2.83Å
759	I	94.4	Very high	91.2	Very high	25 Å²	25	68.7 Å²	68.7	13%	0.128	35%	0.351	C	S	.	.	H	α-helix	trans	-69.5	-44.3	177.2	-70.6	161.3	0	0	0	110.2	W740 L743 A744 E747 K755 A756 R757 K762 A763	W740-I759 HydrophobicContact CE3-CG2 3.86Å; W740-I759 HydrophobicContact CZ3-CG2 4.17Å; L743-I759 HydrophobicContact CD2-CD1 4.33Å; L743-I759 HydrophobicContact CD2-CG2 3.92Å; L743-I759 HydrophobicContact CG-CD1 4.11Å; L743-I759 HydrophobicContact CG-CG2 4.04Å; A744-I759 HydrophobicContact CB-CG2 4.35Å; E747-I759 HydrophobicContact CB-CD1 4.31Å; E747-I759 HydrophobicContact CG-CD1 3.64Å; K755-I759 WeakPolarHBondContact O-CD1 3.2Å; K755-I759 VanDerWaalsContact O-CG1 3.26Å; K755-I759 WeakPolarHBondContact O-CG1 3.48Å; K755-I759 PolarHBondContact O-N 3.32Å; A756-I759 PolarHBondContact O-N 3.37Å; R757-I759 PolarHBondContact O-N 2.99Å; I759-K762 PolarHBondContact O-N 2.91Å; I759-A763 VanDerWaalsContact O-CB 3.29Å; I759-A763 WeakPolarHBondContact O-CB 3.35Å; I759-A763 PolarHBondContact O-N 2.88Å
760	L	93.9	Very high	91.3	Very high	5 Å²	5	64.1 Å²	64.1	3%	0.026	34%	0.337	C	S	.	.	H	α-helix	trans	-67	-36.8	175.9	-70.1	176.2	0	0	0	112.2	L741 A744 A756 R757 A763 R764 E776 A777 L780	L741-L760 HydrophobicContact CD2-CD2 4.21Å; A744-L760 HydrophobicContact CB-CD1 4.12Å; A744-L760 HydrophobicContact CB-CD2 3.54Å; A744-L760 HydrophobicContact CB-CG 3.61Å; A756-L760 WeakPolarHBondContact O-CG 3.44Å; A756-L760 PolarHBondContact O-N 3.3Å; R757-L760 PolarHBondContact O-N 2.84Å; L760-A763 WeakPolarHBondContact O-CB 3.42Å; L760-A763 PolarHBondContact O-N 2.87Å; L760-R764 WeakPolarHBondContact O-CG 3.27Å; L760-R764 PolarHBondContact O-N 2.69Å; L760-E776 HydrophobicContact CD2-CB 4.41Å; L760-A777 HydrophobicContact CB-CB 4.44Å; L760-A777 HydrophobicContact CD1-CB 4.13Å; L760-L780 HydrophobicContact CD1-CB 4.29Å; L760-L780 HydrophobicContact CD1-CD1 3.73Å
761	E	92.8	Very high	91.5	Very high	115 Å²	115	64.1 Å²	64.1	54%	0.537	34%	0.341	S	S	.	.	H	α-helix	trans	-62.7	-47.7	172.2	-82	177.5	176.4	0	0	111.9	R757 A763 R764 S765	R757-E761 WeakPolarHBondContact O-CB 3.36Å; R757-E761 PolarHBondContact O-N 3.44Å; E761-A763 VanDerWaalsContact C-N 3.3Å; E761-A763 PolarHBondContact O-N 3.03Å; E761-R764 PolarHBondContact O-N 3.38Å; E761-R764 IonicContact OE1-NH2 3.54Å; E761-S765 PolarHBondContact O-N 2.83Å
762	K	93.3	Very high	91.8	Very high	118 Å²	118	63.3 Å²	63.3	51%	0.513	33%	0.326	S	S	.	.	H	α-helix	trans	-59	-44.2	173.3	-171.1	177.6	-178.9	-177.8	0	110.4	W740 S758 I759 R764 S765 Q766	W740-K762 HydrophobicContact CH2-CB 4.48Å; W740-K762 HydrophobicContact CH2-CD 4.02Å; W740-K762 HydrophobicContact CH2-CG 3.95Å; W740-K762 HydrophobicContact CZ3-CB 4.32Å; W740-K762 HydrophobicContact CZ3-CD 4.28Å; W740-K762 HydrophobicContact CZ3-CG 4.25Å; S758-K762 VanDerWaalsContact O-CB 3.31Å; S758-K762 WeakPolarHBondContact O-CB 3.37Å; S758-K762 PolarHBondContact O-N 2.83Å; I759-K762 PolarHBondContact O-N 2.91Å; K762-R764 PolarHBondContact O-N 2.98Å; K762-S765 PolarHBondContact O-N 3.38Å; K762-S765 PolarHBondContact O-OG 2.91Å; K762-Q766 WeakPolarHBondContact O-CG 3.39Å; K762-Q766 PolarHBondContact O-N 3.24Å
763	A	92.9	Very high	92	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-58.1	-45.8	177.4	0	0	0	0	0	111.8	W740 I759 L760 E761 S765 Q766 N767 L773	W740-A763 HydrophobicContact CB-CB 3.76Å; W740-A763 HydrophobicContact CD2-CB 3.4Å; W740-A763 VanDerWaalsContact CD2-CB 3.4Å; W740-A763 HydrophobicContact CE3-CB 3.51Å; W740-A763 HydrophobicContact CG-CB 3.54Å; W740-A763 HydrophobicContact CZ3-CB 4.24Å; I759-A763 VanDerWaalsContact O-CB 3.29Å; I759-A763 WeakPolarHBondContact O-CB 3.35Å; I759-A763 PolarHBondContact O-N 2.88Å; L760-A763 WeakPolarHBondContact O-CB 3.42Å; L760-A763 PolarHBondContact O-N 2.87Å; E761-A763 VanDerWaalsContact C-N 3.3Å; E761-A763 PolarHBondContact O-N 3.03Å; A763-S765 PolarHBondContact O-N 2.83Å; A763-Q766 PolarHBondContact O-N 3.25Å; A763-N767 PolarHBondContact O-N 3.3Å; A763-L773 HydrophobicContact CB-CD1 3.73Å; A763-L773 HydrophobicContact CB-CD2 4.15Å; A763-L773 WeakPolarHBondContact O-CD1 3.42Å
764	R	92.1	Very high	92.2	Very high	37 Å²	37	58.9 Å²	58.9	14%	0.14	30%	0.301	C	S	.	.	H	α-helix	trans	-65.8	-34.4	177	-71.4	-173.3	-56	-144.8	0.9	113.1	L760 E761 K762 N767 P768 L773	L760-R764 WeakPolarHBondContact O-CG 3.27Å; L760-R764 PolarHBondContact O-N 2.69Å; E761-R764 PolarHBondContact O-N 3.38Å; E761-R764 IonicContact OE1-NH2 3.54Å; K762-R764 PolarHBondContact O-N 2.98Å; R764-N767 CarbonylContact O-C 3.23Å; R764-N767 VanDerWaalsContact O-C 3.23Å; R764-P768 WeakPolarHBondContact O-CA 3.42Å; R764-L773 HydrophobicContact CG-CB 3.99Å
765	S	92.1	Very high	92.2	Very high	83 Å²	83	54.8 Å²	54.8	58%	0.58	28%	0.276	S	S	*	.	H	α-helix	trans	-68.5	-35.9	174.6	70.5	0	0	0	0	112.9	E761 K762 A763	E761-S765 PolarHBondContact O-N 2.83Å; K762-S765 PolarHBondContact O-N 3.38Å; K762-S765 PolarHBondContact O-OG 2.91Å; A763-S765 PolarHBondContact O-N 2.83Å
766	Q	91.1	Very high	92.2	Very high	95 Å²	95	50.2 Å²	50.2	44%	0.444	26%	0.256	S	S	.	.	H	α-helix	trans	-77.9	-39.2	179.7	-66.8	-64.3	-27.3	0	0	111	W740 K762 A763 P768	W740-Q766 HydrophobicContact CZ2-CB 4.43Å; W740-Q766 HydrophobicContact CZ2-CG 4.22Å; K762-Q766 WeakPolarHBondContact O-CG 3.39Å; K762-Q766 PolarHBondContact O-N 3.24Å; A763-Q766 PolarHBondContact O-N 3.25Å; Q766-P768 WeakPolarHBondContact O-CD 3.43Å
767	N	88.9	Confident	92.2	Very high	12 Å²	12	50.4 Å²	50.4	6%	0.064	26%	0.258	C	S	.	.	S	Bend	trans	-120.4	80.3	178	-60.5	-42.3	0	0	0	109.7	P734 H735 A763 R764 T770 L773	P734-N767 PolarHBondContact O-ND2 2.98Å; H735-N767 WeakPolarHBondContact CA-OD1 3.39Å; H735-N767 PolarHBondContact ND1-OD1 3.42Å; H735-N767 VanDerWaalsContact ND1-OD1 3.11Å; A763-N767 PolarHBondContact O-N 3.3Å; R764-N767 CarbonylContact O-C 3.23Å; R764-N767 VanDerWaalsContact O-C 3.23Å; N767-T770 HydrophobicContact CB-CG2 3.91Å; N767-T770 PolarHBondContact O-OG1 3.33Å; N767-T770 VanDerWaalsContact O-OG1 3.13Å; N767-L773 HydrophobicContact CB-CD1 3.93Å
768	P	88	Confident	92.1	Very high	85 Å²	85	47.4 Å²	47.4	55%	0.552	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	154.1	175.9	28.5	-34.7	0	0	0	110.5	R764 Q766 T770	R764-P768 WeakPolarHBondContact O-CA 3.42Å; Q766-P768 WeakPolarHBondContact O-CD 3.43Å; P768-T770 PolarHBondContact O-N 3.17Å
769	K	87.3	Confident	92	Very high	148 Å²	148	46.9 Å²	46.9	64%	0.643	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.5	20.7	175.5	-51.9	-179.8	-179.6	179.9	0	116	C801	K769-C801 VanDerWaalsContact CA-SG 3.58Å; K769-C801 PolarHBondContact O-SG 3.22Å
770	T	90.9	Very high	92	Very high	32 Å²	32	45.9 Å²	45.9	20%	0.196	23%	0.23	C	C	.	.			trans	-91.3	118.1	171	56.7	0	0	0	0	110.3	T737 N767 P768 E772 L773 W774	T737-T770 HydrophobicContact CG2-CG2 4.13Å; N767-T770 HydrophobicContact CB-CG2 3.91Å; N767-T770 PolarHBondContact O-OG1 3.33Å; N767-T770 VanDerWaalsContact O-OG1 3.13Å; P768-T770 PolarHBondContact O-N 3.17Å; T770-E772 PolarHBondContact O-N 3.24Å; T770-L773 PolarHBondContact O-N 3.36Å; T770-L773 WeakPolarHBondContact OG1-CD1 3.05Å; T770-L773 WeakPolarHBondContact OG1-CG 3.19Å; T770-W774 PolarHBondContact O-N 2.76Å
771	P	91.6	Very high	91.9	Very high	37 Å²	37	46.4 Å²	46.4	24%	0.24	23%	0.232	C	C	.	.	H	α-helix	trans	-71.7	-28.7	-173	28.6	-35.9	0	0	0	113.4	L773 W774 L775 S804 L807	P771-L773 VanDerWaalsContact C-N 3.34Å; P771-L773 PolarHBondContact O-N 2.95Å; P771-W774 PolarHBondContact O-N 3.15Å; P771-L775 VanDerWaalsContact O-CB 3.31Å; P771-L775 WeakPolarHBondContact O-CB 3.48Å; P771-L775 PolarHBondContact O-N 3.5Å; P771-S804 WeakPolarHBondContact CB-OG 3.32Å; P771-S804 WeakPolarHBondContact CG-OG 3.48Å; P771-L807 HydrophobicContact CB-CD1 3.86Å; P771-L807 HydrophobicContact CB-CG 3.95Å
772	E	91.3	Very high	91.8	Very high	96 Å²	96	43.2 Å²	43.2	45%	0.449	22%	0.22	S	C	.	.	H	α-helix	trans	-61.4	-40.8	177.8	-59.4	179.5	164.5	0	0	112.3	T737 L741 T770 L775 E776	T737-E772 WeakPolarHBondContact CB-OE2 3.44Å; T737-E772 PolarHBondContact OG1-OE2 2.98Å; L741-E772 HydrophobicContact CD1-CB 4.25Å; T770-E772 PolarHBondContact O-N 3.24Å; E772-L775 PolarHBondContact O-N 2.71Å; E772-E776 PolarHBondContact O-N 3.07Å
773	L	93.4	Very high	91.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-68.5	-39.1	177.1	-61.4	-172.2	0	0	0	111.7	T737 W740 L741 A763 R764 N767 T770 P771 A777	T737-L773 HydrophobicContact CG2-CG 4.38Å; W740-L773 HydrophobicContact CB-CD2 4.01Å; L741-L773 HydrophobicContact CD2-CD2 3.52Å; L741-L773 HydrophobicContact CG-CD2 4.13Å; A763-L773 HydrophobicContact CB-CD1 3.73Å; A763-L773 HydrophobicContact CB-CD2 4.15Å; A763-L773 WeakPolarHBondContact O-CD1 3.42Å; R764-L773 HydrophobicContact CG-CB 3.99Å; N767-L773 HydrophobicContact CB-CD1 3.93Å; T770-L773 PolarHBondContact O-N 3.36Å; T770-L773 WeakPolarHBondContact OG1-CD1 3.05Å; T770-L773 WeakPolarHBondContact OG1-CG 3.19Å; P771-L773 VanDerWaalsContact C-N 3.34Å; P771-L773 PolarHBondContact O-N 2.95Å; L773-A777 WeakPolarHBondContact O-CB 3.27Å; L773-A777 PolarHBondContact O-N 2.99Å; L773-A777 VanDerWaalsContact O-N 3.08Å
774	W	94.5	Very high	91.6	Very high	17 Å²	17	44.7 Å²	44.7	6%	0.064	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-46.2	174.2	-84.4	114	0	0	0	111.7	T770 P771 A777 I778 L793 K796 A797 E800 L807	T770-W774 PolarHBondContact O-N 2.76Å; P771-W774 PolarHBondContact O-N 3.15Å; W774-A777 PolarHBondContact O-N 3.41Å; W774-I778 WeakPolarHBondContact O-CD1 3.39Å; W774-I778 VanDerWaalsContact O-CG1 3.24Å; W774-I778 WeakPolarHBondContact O-CG1 3.41Å; W774-I778 PolarHBondContact O-N 2.69Å; W774-L793 HydrophobicContact CZ3-CD2 3.95Å; W774-K796 HydrophobicContact CH2-CB 4.02Å; W774-K796 HydrophobicContact CZ3-CB 4.2Å; W774-A797 HydrophobicContact CB-CB 3.75Å; W774-A797 HydrophobicContact CD2-CB 3.63Å; W774-A797 HydrophobicContact CE3-CB 3.68Å; W774-A797 HydrophobicContact CG-CB 3.68Å; W774-A797 HydrophobicContact CZ3-CB 4.46Å; W774-E800 WeakPolarHBondContact CZ2-OE1 3.43Å; W774-E800 WeakPolarHBondContact CZ2-OE2 3.25Å; W774-E800 PolarHBondContact NE1-OE2 3.4Å; W774-L807 HydrophobicContact CB-CD1 4.45Å; W774-L807 HydrophobicContact CB-CD2 3.8Å
775	L	93.3	Very high	91.4	Very high	16 Å²	16	49.4 Å²	49.4	8%	0.084	26%	0.256	C	S	.	.	H	α-helix	trans	-60.8	-45.2	179.1	174.7	151.5	0	0	0	111.8	P771 E772 A777 I778 R779 C806 L807 E810	P771-L775 VanDerWaalsContact O-CB 3.31Å; P771-L775 WeakPolarHBondContact O-CB 3.48Å; P771-L775 PolarHBondContact O-N 3.5Å; E772-L775 PolarHBondContact O-N 2.71Å; L775-A777 VanDerWaalsContact C-N 3.35Å; L775-A777 PolarHBondContact O-N 3.43Å; L775-I778 PolarHBondContact O-N 2.93Å; L775-R779 VanDerWaalsContact CD2-NH1 3.33Å; L775-R779 WeakPolarHBondContact O-CG 3.47Å; L775-R779 PolarHBondContact O-N 2.98Å; L775-C806 HydrophobicContact CD1-CB 3.67Å; L775-L807 HydrophobicContact CB-CD2 4.05Å; L775-E810 HydrophobicContact CD1-CG 3.85Å; L775-E810 HydrophobicContact CG-CG 4.1Å
776	E	92.3	Very high	91.4	Very high	6 Å²	6	48.9 Å²	48.9	3%	0.028	25%	0.247	C	C	.	.	H	α-helix	trans	-68.2	-33.6	177.1	-76.4	-65.5	125.8	0	0	112.8	L741 R745 L760 E772 R779 L780 R783	L741-E776 HydrophobicContact CD1-CG 4.03Å; L741-E776 HydrophobicContact CD2-CB 3.55Å; L741-E776 HydrophobicContact CD2-CG 3.46Å; L741-E776 VanDerWaalsContact CD2-CG 3.46Å; L741-E776 HydrophobicContact CG-CG 4.19Å; R745-E776 IonicContact CZ-OE1 3.56Å; R745-E776 IonicContact CZ-OE2 3.05Å; R745-E776 IonicContact NE-OE1 2.66Å; R745-E776 IonicContact NE-OE2 2.7Å; R745-E776 PolarHBondContact NE-OE2 3.39Å; R745-E776 IonicContact NH2-OE1 3.59Å; R745-E776 PolarHBondContact NH2-OE1 2.88Å; R745-E776 IonicContact NH2-OE2 2.89Å; R745-E776 PolarHBondContact NH2-OE2 3.3Å; L760-E776 HydrophobicContact CD2-CB 4.41Å; E772-E776 PolarHBondContact O-N 3.07Å; E776-R779 PolarHBondContact O-N 2.85Å; E776-R779 IonicContact OE1-NH1 3Å; E776-R779 PolarHBondContact OE1-NH1 3.29Å; E776-L780 WeakPolarHBondContact O-CB 3.44Å; E776-L780 PolarHBondContact O-N 3.19Å; E776-R783 IonicContact OE2-NH2 3.99Å
777	A	93.3	Very high	91.3	Very high	5 Å²	5	50.7 Å²	50.7	4%	0.041	25%	0.253	C	S	.	.	H	α-helix	trans	-65.6	-41.7	172.5	0	0	0	0	0	112.3	L760 L773 W774 L775 L780 E781	L760-A777 HydrophobicContact CB-CB 4.44Å; L760-A777 HydrophobicContact CD1-CB 4.13Å; L773-A777 WeakPolarHBondContact O-CB 3.27Å; L773-A777 PolarHBondContact O-N 2.99Å; L773-A777 VanDerWaalsContact O-N 3.08Å; W774-A777 PolarHBondContact O-N 3.41Å; L775-A777 VanDerWaalsContact C-N 3.35Å; L775-A777 PolarHBondContact O-N 3.43Å; A777-L780 PolarHBondContact O-N 2.91Å; A777-E781 PolarHBondContact O-N 3.4Å
778	I	93	Very high	91.5	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-61.7	-48.2	175.3	-66.7	157.3	0	0	0	109.7	W774 L775 L780 E781 V782 A790 L793 I794 A797 L807	W774-I778 WeakPolarHBondContact O-CD1 3.39Å; W774-I778 VanDerWaalsContact O-CG1 3.24Å; W774-I778 WeakPolarHBondContact O-CG1 3.41Å; W774-I778 PolarHBondContact O-N 2.69Å; L775-I778 PolarHBondContact O-N 2.93Å; I778-L780 VanDerWaalsContact C-N 3.33Å; I778-L780 PolarHBondContact O-N 3.44Å; I778-E781 PolarHBondContact O-N 2.67Å; I778-V782 HydrophobicContact CG2-CG2 4.42Å; I778-V782 WeakPolarHBondContact O-CG2 3.32Å; I778-V782 PolarHBondContact O-N 3.45Å; I778-A790 HydrophobicContact CG2-CB 4.28Å; I778-L793 HydrophobicContact CG1-CB 3.93Å; I778-I794 HydrophobicContact CD1-CB 3.82Å; I778-I794 HydrophobicContact CD1-CD1 4.13Å; I778-I794 HydrophobicContact CD1-CG1 3.82Å; I778-I794 HydrophobicContact CG1-CB 4.32Å; I778-I794 HydrophobicContact CG2-CD1 4.38Å; I778-A797 HydrophobicContact CD1-CB 4.17Å; I778-L807 HydrophobicContact CD1-CD2 4.01Å
779	R	92.3	Very high	91.7	Very high	52 Å²	52	53.8 Å²	53.8	20%	0.196	27%	0.272	C	S	.	.	H	α-helix	trans	-64.7	-34	179.2	-73.2	178.7	177.7	175.3	-7.5	113.5	L775 E776 V782 R783 E810 E904	L775-R779 VanDerWaalsContact CD2-NH1 3.33Å; L775-R779 WeakPolarHBondContact O-CG 3.47Å; L775-R779 PolarHBondContact O-N 2.98Å; E776-R779 PolarHBondContact O-N 2.85Å; E776-R779 IonicContact OE1-NH1 3Å; E776-R779 PolarHBondContact OE1-NH1 3.29Å; R779-V782 PolarHBondContact O-N 2.73Å; R779-R783 WeakPolarHBondContact O-CB 3.28Å; R779-R783 WeakPolarHBondContact O-CG 3.39Å; R779-R783 PolarHBondContact O-N 3.46Å; R779-R783 PolarHBondContact O-NE 3.12Å; R779-E810 IonicContact CZ-OE1 3.22Å; R779-E810 VanDerWaalsContact CZ-OE1 3.25Å; R779-E810 IonicContact NE-OE1 2.84Å; R779-E810 PolarHBondContact NE-OE1 3.27Å; R779-E810 IonicContact NH2-OE1 3.28Å; R779-E810 PolarHBondContact NH2-OE1 3.41Å; R779-E904 IonicContact CZ-OE1 3.46Å; R779-E904 IonicContact CZ-OE2 2.94Å; R779-E904 VanDerWaalsContact CZ-OE2 3.22Å; R779-E904 IonicContact NH1-OE1 3.21Å; R779-E904 PolarHBondContact NH1-OE1 3.29Å; R779-E904 IonicContact NH1-OE2 2.76Å; R779-E904 PolarHBondContact NH1-OE2 3.47Å; R779-E904 IonicContact NH2-OE2 3.19Å; R779-E904 PolarHBondContact NH2-OE2 3.18Å
780	L	92.8	Very high	92	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-60.9	-46.3	173.3	-173.3	155.2	0	0	0	110.4	A756 R757 L760 E776 A777 I778 R783 A784	A756-L780 HydrophobicContact CB-CD1 3.65Å; R757-L780 HydrophobicContact CG-CD2 3.61Å; L760-L780 HydrophobicContact CD1-CB 4.29Å; L760-L780 HydrophobicContact CD1-CD1 3.73Å; E776-L780 WeakPolarHBondContact O-CB 3.44Å; E776-L780 PolarHBondContact O-N 3.19Å; A777-L780 PolarHBondContact O-N 2.91Å; I778-L780 VanDerWaalsContact C-N 3.33Å; I778-L780 PolarHBondContact O-N 3.44Å; L780-R783 PolarHBondContact O-N 3.03Å; L780-A784 WeakPolarHBondContact O-CB 3.5Å; L780-A784 PolarHBondContact O-N 2.56Å
781	E	92.7	Very high	92	Very high	17 Å²	17	48.5 Å²	48.5	8%	0.079	25%	0.25	C	S	.	.	H	α-helix	trans	-68.7	-34.8	178.2	-61.4	-50.4	158.9	0	0	113.2	R757 A777 I778 A784 N785 L786 V789 A790 L793	R757-E781 VanDerWaalsContact CD-OE1 3.3Å; R757-E781 WeakPolarHBondContact CD-OE1 3.47Å; R757-E781 WeakPolarHBondContact CG-OE1 3.47Å; R757-E781 IonicContact CZ-OE1 3.33Å; R757-E781 IonicContact CZ-OE2 3.93Å; R757-E781 VanDerWaalsContact NE-CD 3.34Å; R757-E781 IonicContact NE-OE1 2.63Å; R757-E781 PolarHBondContact NE-OE1 3.48Å; R757-E781 IonicContact NE-OE2 3.07Å; R757-E781 PolarHBondContact NE-OE2 3.31Å; R757-E781 VanDerWaalsContact NE-OE2 3.14Å; R757-E781 IonicContact NH2-OE1 3.68Å; R757-E781 IonicContact NH2-OE2 3.57Å; R757-E781 PolarHBondContact NH2-OE2 2.87Å; A777-E781 PolarHBondContact O-N 3.4Å; I778-E781 PolarHBondContact O-N 2.67Å; E781-A784 CarbonylContact O-C 3.15Å; E781-A784 PolarHBondContact O-N 3.2Å; E781-N785 PolarHBondContact O-N 3.06Å; E781-L786 PolarHBondContact O-N 3.13Å; E781-V789 HydrophobicContact CG-CG1 4.1Å; E781-A790 HydrophobicContact CB-CB 4.02Å; E781-L793 HydrophobicContact CG-CD1 3.6Å
782	V	90.9	Very high	92.1	Very high	48 Å²	48	49.1 Å²	49.1	29%	0.291	26%	0.256	S	S	.	.	H	α-helix	trans	-62.9	-44.8	172.4	174.3	0	0	0	0	110.7	I778 R779 A784 N785 A790 M814	I778-V782 HydrophobicContact CG2-CG2 4.42Å; I778-V782 WeakPolarHBondContact O-CG2 3.32Å; I778-V782 PolarHBondContact O-N 3.45Å; R779-V782 PolarHBondContact O-N 2.73Å; V782-A784 VanDerWaalsContact C-N 3.3Å; V782-A784 PolarHBondContact O-N 2.7Å; V782-N785 PolarHBondContact O-N 3.38Å; V782-N785 VanDerWaalsContact O-N 3.08Å; V782-A790 HydrophobicContact CG2-CB 3.73Å; V782-M814 HydrophobicContact CG2-CE 3.81Å; V782-M814 HydrophobicContact CG2-SD 3.45Å; V782-M814 WeakPolarHBondContact CG2-SD 3.41Å
783	R	90.5	Very high	92.2	Very high	121 Å²	121	45.5 Å²	45.5	46%	0.457	24%	0.239	S	C	.	.	H	α-helix	trans	-65.6	-31.6	176	-75.3	-178.2	-74.8	171.5	4.7	112.6	E748 E776 R779 L780 N785	E748-R783 WeakPolarHBondContact OE1-CD 3.46Å; E748-R783 IonicContact OE1-CZ 3.82Å; E748-R783 IonicContact OE1-NE 3.99Å; E748-R783 PolarHBondContact OE1-NE 2.87Å; E748-R783 IonicContact OE1-NH1 3.4Å; E748-R783 PolarHBondContact OE1-NH1 3.38Å; E748-R783 IonicContact OE1-NH2 3.34Å; E748-R783 PolarHBondContact OE1-NH2 3.29Å; E748-R783 IonicContact OE2-CZ 2.66Å; E748-R783 IonicContact OE2-NE 3.96Å; E748-R783 IonicContact OE2-NH1 3.12Å; E748-R783 PolarHBondContact OE2-NH1 2.76Å; E748-R783 IonicContact OE2-NH2 3.39Å; E748-R783 PolarHBondContact OE2-NH2 2.65Å; E776-R783 IonicContact OE2-NH2 3.99Å; R779-R783 WeakPolarHBondContact O-CB 3.28Å; R779-R783 WeakPolarHBondContact O-CG 3.39Å; R779-R783 PolarHBondContact O-N 3.46Å; R779-R783 PolarHBondContact O-NE 3.12Å; L780-R783 PolarHBondContact O-N 3.03Å; R783-N785 PolarHBondContact O-N 3.32Å
784	A	90.6	Very high	92.2	Very high	27 Å²	27	46 Å²	46	22%	0.223	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	5.2	172.9	0	0	0	0	0	114.1	L753 L780 E781 V782 L786	L753-A784 HydrophobicContact CD1-CB 4.46Å; L780-A784 WeakPolarHBondContact O-CB 3.5Å; L780-A784 PolarHBondContact O-N 2.56Å; E781-A784 CarbonylContact O-C 3.15Å; E781-A784 PolarHBondContact O-N 3.2Å; V782-A784 VanDerWaalsContact C-N 3.3Å; V782-A784 PolarHBondContact O-N 2.7Å; A784-L786 PolarHBondContact O-N 3.44Å
785	N	88.6	Confident	92.1	Very high	136 Å²	136	48.3 Å²	48.3	73%	0.727	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	20.5	-175.8	-70.3	-39.3	0	0	0	115.5	E781 V782 R783 K787	E781-N785 PolarHBondContact O-N 3.06Å; V782-N785 PolarHBondContact O-N 3.38Å; V782-N785 VanDerWaalsContact O-N 3.08Å; R783-N785 PolarHBondContact O-N 3.32Å; N785-K787 PolarHBondContact O-N 2.93Å
786	L	92.3	Very high	92.1	Very high	73 Å²	73	53 Å²	53	38%	0.382	28%	0.28	S	S	.	.			trans	-96.5	60.8	176.8	-62.7	-177.7	0	0	0	111.7	R757 E781 A784 P788 V789 A790	R757-L786 VanDerWaalsContact NH2-CD1 3.27Å; E781-L786 PolarHBondContact O-N 3.13Å; A784-L786 PolarHBondContact O-N 3.44Å; L786-P788 VanDerWaalsContact C-CD 3.49Å; L786-V789 HydrophobicContact CB-CB 4.2Å; L786-V789 HydrophobicContact CB-CG2 4.14Å; L786-V789 PolarHBondContact O-N 2.94Å; L786-V789 VanDerWaalsContact O-N 3.12Å; L786-A790 PolarHBondContact O-N 3.44Å; L786-A790 VanDerWaalsContact O-N 3.08Å
787	K	89.5	Confident	92.2	Very high	132 Å²	132	52.7 Å²	52.7	57%	0.574	28%	0.279	S	S	*	.	H	α-helix	trans	-53.4	-43.8	-177.7	-63.8	-176.7	-179.7	-179.3	0	114.6	N785 V789 A790 D791	N785-K787 PolarHBondContact O-N 2.93Å; K787-V789 VanDerWaalsContact C-N 3.27Å; K787-V789 PolarHBondContact O-N 3.44Å; K787-A790 WeakPolarHBondContact O-CB 3.47Å; K787-A790 PolarHBondContact O-N 2.93Å; K787-A790 VanDerWaalsContact O-N 3.11Å; K787-D791 PolarHBondContact O-N 3.42Å
788	P	91.9	Very high	92.1	Very high	101 Å²	101	53.4 Å²	53.4	66%	0.656	28%	0.282	S	S	*	.	H	α-helix	trans	-62.8	-34.5	179.5	-22.9	34.5	0	0	0	113.1	L786 D791 S792	L786-P788 VanDerWaalsContact C-CD 3.49Å; P788-D791 PolarHBondContact O-N 3.34Å; P788-S792 PolarHBondContact O-N 3.46Å; P788-S792 VanDerWaalsContact O-N 3.09Å
789	V	92.8	Very high	92.1	Very high	61 Å²	61	60.8 Å²	60.8	37%	0.37	32%	0.316	S	S	.	.	H	α-helix	trans	-68.7	-44	175.5	-176.8	0	0	0	0	109.4	E781 L786 K787 D791 S792 L793	E781-V789 HydrophobicContact CG-CG1 4.1Å; L786-V789 HydrophobicContact CB-CB 4.2Å; L786-V789 HydrophobicContact CB-CG2 4.14Å; L786-V789 PolarHBondContact O-N 2.94Å; L786-V789 VanDerWaalsContact O-N 3.12Å; K787-V789 VanDerWaalsContact C-N 3.27Å; K787-V789 PolarHBondContact O-N 3.44Å; V789-D791 VanDerWaalsContact C-N 3.33Å; V789-D791 PolarHBondContact O-N 3.39Å; V789-S792 PolarHBondContact O-N 3.12Å; V789-S792 VanDerWaalsContact O-N 3.16Å; V789-S792 PolarHBondContact O-OG 2.94Å; V789-L793 HydrophobicContact CG1-CD1 4.22Å; V789-L793 HydrophobicContact CG1-CG 4.4Å; V789-L793 WeakPolarHBondContact O-CG 3.37Å; V789-L793 PolarHBondContact O-N 3Å
790	A	93.3	Very high	92	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-58.4	-41.4	175	0	0	0	0	0	112.7	I778 E781 V782 L786 K787 S792 L793 I794 M814	I778-A790 HydrophobicContact CG2-CB 4.28Å; E781-A790 HydrophobicContact CB-CB 4.02Å; V782-A790 HydrophobicContact CG2-CB 3.73Å; L786-A790 PolarHBondContact O-N 3.44Å; L786-A790 VanDerWaalsContact O-N 3.08Å; K787-A790 WeakPolarHBondContact O-CB 3.47Å; K787-A790 PolarHBondContact O-N 2.93Å; K787-A790 VanDerWaalsContact O-N 3.11Å; A790-S792 VanDerWaalsContact C-N 3.34Å; A790-S792 PolarHBondContact O-N 3.09Å; A790-L793 PolarHBondContact O-N 3.22Å; A790-I794 PolarHBondContact O-N 3.31Å; A790-M814 HydrophobicContact CB-CE 3.59Å
791	D	92.1	Very high	91.8	Very high	69 Å²	69	63 Å²	63	37%	0.369	33%	0.33	S	S	.	.	H	α-helix	trans	-65.8	-35.6	176	-72.6	-30.9	0	0	0	112.6	K787 P788 V789 I794 S795 M814	K787-D791 PolarHBondContact O-N 3.42Å; P788-D791 PolarHBondContact O-N 3.34Å; V789-D791 VanDerWaalsContact C-N 3.33Å; V789-D791 PolarHBondContact O-N 3.39Å; D791-I794 VanDerWaalsContact O-CG2 3.31Å; D791-I794 WeakPolarHBondContact O-CG2 3.33Å; D791-S795 WeakPolarHBondContact O-CB 3.23Å; D791-S795 PolarHBondContact O-N 2.85Å; D791-S795 PolarHBondContact O-OG 3.01Å; D791-M814 VanDerWaalsContact OD1-CE 3.28Å; D791-M814 WeakPolarHBondContact OD1-CE 3.33Å
792	S	93.7	Very high	91.6	Very high	51 Å²	51	64.9 Å²	64.9	36%	0.357	34%	0.344	S	S	.	.	H	α-helix	trans	-68.8	-38.7	172.8	81.8	0	0	0	0	111.7	P788 V789 A790 S795 K796	P788-S792 PolarHBondContact O-N 3.46Å; P788-S792 VanDerWaalsContact O-N 3.09Å; V789-S792 PolarHBondContact O-N 3.12Å; V789-S792 VanDerWaalsContact O-N 3.16Å; V789-S792 PolarHBondContact O-OG 2.94Å; A790-S792 VanDerWaalsContact C-N 3.34Å; A790-S792 PolarHBondContact O-N 3.09Å; S792-S795 PolarHBondContact O-N 2.97Å; S792-K796 WeakPolarHBondContact O-CG 3.31Å; S792-K796 PolarHBondContact O-N 3.15Å; S792-K796 VanDerWaalsContact O-N 3.12Å
793	L	93.1	Very high	91.5	Very high	19 Å²	19	67.8 Å²	67.8	10%	0.099	36%	0.362	C	S	.	.	H	α-helix	trans	-69.5	-40.7	179	-72.2	175.4	0	0	0	111.5	W774 I778 E781 V789 A790 S795 K796 A797	W774-L793 HydrophobicContact CZ3-CD2 3.95Å; I778-L793 HydrophobicContact CG1-CB 3.93Å; E781-L793 HydrophobicContact CG-CD1 3.6Å; V789-L793 HydrophobicContact CG1-CD1 4.22Å; V789-L793 HydrophobicContact CG1-CG 4.4Å; V789-L793 WeakPolarHBondContact O-CG 3.37Å; V789-L793 PolarHBondContact O-N 3Å; A790-L793 PolarHBondContact O-N 3.22Å; L793-S795 VanDerWaalsContact C-N 3.31Å; L793-S795 PolarHBondContact O-N 3.36Å; L793-K796 PolarHBondContact O-N 3.13Å; L793-A797 VanDerWaalsContact O-CB 3.3Å; L793-A797 WeakPolarHBondContact O-CB 3.46Å; L793-A797 PolarHBondContact O-N 2.7Å
794	I	93.4	Very high	91.4	Very high	10 Å²	10	62.8 Å²	62.8	5%	0.051	35%	0.345	C	S	.	.	H	α-helix	trans	-67.5	-35	178.1	-158.2	153.7	0	0	0	111.7	I778 A790 D791 A797 L798 E810 A811 M814	I778-I794 HydrophobicContact CD1-CB 3.82Å; I778-I794 HydrophobicContact CD1-CD1 4.13Å; I778-I794 HydrophobicContact CD1-CG1 3.82Å; I778-I794 HydrophobicContact CG1-CB 4.32Å; I778-I794 HydrophobicContact CG2-CD1 4.38Å; A790-I794 PolarHBondContact O-N 3.31Å; D791-I794 VanDerWaalsContact O-CG2 3.31Å; D791-I794 WeakPolarHBondContact O-CG2 3.33Å; I794-A797 PolarHBondContact O-N 3.49Å; I794-L798 HydrophobicContact CG1-CD1 4.45Å; I794-L798 WeakPolarHBondContact O-CB 3.35Å; I794-L798 VanDerWaalsContact O-CG 3.28Å; I794-L798 WeakPolarHBondContact O-CG 3.38Å; I794-L798 PolarHBondContact O-N 2.96Å; I794-E810 HydrophobicContact CD1-CB 4.18Å; I794-A811 HydrophobicContact CD1-CB 3.62Å; I794-A811 HydrophobicContact CG1-CB 4.04Å; I794-M814 HydrophobicContact CD1-CG 4.22Å
795	S	92	Very high	91.4	Very high	67 Å²	67	61.6 Å²	61.6	47%	0.469	34%	0.335	S	S	.	.	H	α-helix	trans	-64.6	-43.5	174.3	-59.8	0	0	0	0	111.4	D791 S792 L793 Q799	D791-S795 WeakPolarHBondContact O-CB 3.23Å; D791-S795 PolarHBondContact O-N 2.85Å; D791-S795 PolarHBondContact O-OG 3.01Å; S792-S795 PolarHBondContact O-N 2.97Å; L793-S795 VanDerWaalsContact C-N 3.31Å; L793-S795 PolarHBondContact O-N 3.36Å; S795-Q799 WeakPolarHBondContact O-CG 3.47Å; S795-Q799 PolarHBondContact O-N 3.25Å; S795-Q799 VanDerWaalsContact O-N 3.16Å
796	K	93.5	Very high	91.5	Very high	113 Å²	113	56.1 Å²	56.1	49%	0.491	31%	0.307	S	S	.	.	H	α-helix	trans	-64.1	-43.6	173.2	-70.6	175.3	-178.7	179.2	0	112	W774 S792 L793 L798 Q799 E800	W774-K796 HydrophobicContact CH2-CB 4.02Å; W774-K796 HydrophobicContact CZ3-CB 4.2Å; S792-K796 WeakPolarHBondContact O-CG 3.31Å; S792-K796 PolarHBondContact O-N 3.15Å; S792-K796 VanDerWaalsContact O-N 3.12Å; L793-K796 PolarHBondContact O-N 3.13Å; K796-L798 PolarHBondContact O-N 3.11Å; K796-Q799 WeakPolarHBondContact O-CB 3.49Å; K796-Q799 PolarHBondContact O-N 3.45Å; K796-Q799 VanDerWaalsContact O-N 3.16Å; K796-E800 PolarHBondContact O-N 3.06Å; K796-E800 VanDerWaalsContact O-N 3.13Å
797	A	93.6	Very high	91.6	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-61.2	-43.1	178.9	0	0	0	0	0	112	W774 I778 L793 I794 Q799 E800 C801 L807	W774-A797 HydrophobicContact CB-CB 3.75Å; W774-A797 HydrophobicContact CD2-CB 3.63Å; W774-A797 HydrophobicContact CE3-CB 3.68Å; W774-A797 HydrophobicContact CG-CB 3.68Å; W774-A797 HydrophobicContact CZ3-CB 4.46Å; I778-A797 HydrophobicContact CD1-CB 4.17Å; L793-A797 VanDerWaalsContact O-CB 3.3Å; L793-A797 WeakPolarHBondContact O-CB 3.46Å; L793-A797 PolarHBondContact O-N 2.7Å; I794-A797 PolarHBondContact O-N 3.49Å; A797-Q799 VanDerWaalsContact C-N 3.31Å; A797-Q799 PolarHBondContact O-N 2.85Å; A797-E800 PolarHBondContact O-N 3.46Å; A797-C801 PolarHBondContact O-N 3.06Å; A797-L807 HydrophobicContact CB-CD1 3.84Å; A797-L807 HydrophobicContact CB-CD2 3.99Å
798	L	92.6	Very high	91.8	Very high	20 Å²	20	47.2 Å²	47.2	11%	0.105	27%	0.265	C	S	.	.	H	α-helix	trans	-70.8	-23.9	177.3	-70.3	176.2	0	0	0	113.2	I794 K796 P802 L807 W808 A811	I794-L798 HydrophobicContact CG1-CD1 4.45Å; I794-L798 WeakPolarHBondContact O-CB 3.35Å; I794-L798 VanDerWaalsContact O-CG 3.28Å; I794-L798 WeakPolarHBondContact O-CG 3.38Å; I794-L798 PolarHBondContact O-N 2.96Å; K796-L798 PolarHBondContact O-N 3.11Å; L798-P802 WeakPolarHBondContact O-CA 3.42Å; L798-L807 HydrophobicContact CD2-CB 3.85Å; L798-W808 HydrophobicContact CD1-CE3 4.38Å; L798-W808 HydrophobicContact CD1-CH2 4.35Å; L798-W808 HydrophobicContact CD1-CZ2 4.47Å; L798-W808 HydrophobicContact CD1-CZ3 4.32Å; L798-W808 HydrophobicContact CD2-CD2 3.87Å; L798-W808 HydrophobicContact CD2-CE3 4.48Å; L798-W808 HydrophobicContact CD2-CG 4.08Å; L798-W808 HydrophobicContact CD2-CZ2 4.19Å; L798-A811 HydrophobicContact CD1-CB 4.03Å
799	Q	91.4	Very high	91.8	Very high	157 Å²	157	43 Å²	43	73%	0.734	24%	0.239	S	C	*	.	H	α-helix	trans	-71.2	-41.3	171.4	-75	173.3	-3.3	0	0	111.6	S795 K796 A797	S795-Q799 WeakPolarHBondContact O-CG 3.47Å; S795-Q799 PolarHBondContact O-N 3.25Å; S795-Q799 VanDerWaalsContact O-N 3.16Å; K796-Q799 WeakPolarHBondContact O-CB 3.49Å; K796-Q799 PolarHBondContact O-N 3.45Å; K796-Q799 VanDerWaalsContact O-N 3.16Å; A797-Q799 VanDerWaalsContact C-N 3.31Å; A797-Q799 PolarHBondContact O-N 2.85Å
800	E	90.1	Very high	91.7	Very high	89 Å²	89	42.2 Å²	42.2	42%	0.416	23%	0.231	S	C	.	.	H	α-helix	trans	-74.8	-40.3	177.2	-69.6	-172.5	-171.9	0	0	112.8	W774 K796 A797 P802	W774-E800 WeakPolarHBondContact CZ2-OE1 3.43Å; W774-E800 WeakPolarHBondContact CZ2-OE2 3.25Å; W774-E800 PolarHBondContact NE1-OE2 3.4Å; K796-E800 PolarHBondContact O-N 3.06Å; K796-E800 VanDerWaalsContact O-N 3.13Å; A797-E800 PolarHBondContact O-N 3.46Å; E800-P802 WeakPolarHBondContact O-CD 3.29Å
801	C	88.8	Confident	91.7	Very high	12 Å²	12	42.2 Å²	42.2	8%	0.081	23%	0.231	C	C	.	.			trans	-128.6	69.1	-171.1	-61.3	0	0	0	0	111.6	K769 A797 T803 S804 L807	K769-C801 VanDerWaalsContact CA-SG 3.58Å; K769-C801 PolarHBondContact O-SG 3.22Å; A797-C801 PolarHBondContact O-N 3.06Å; C801-T803 VanDerWaalsContact C-N 3.27Å; C801-T803 PolarHBondContact O-N 2.81Å; C801-S804 PolarHBondContact O-N 2.78Å; C801-L807 HydrophobicContact CB-CD1 3.75Å
802	P	89	Confident	91.7	Very high	56 Å²	56	39 Å²	39	36%	0.364	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-18.2	-174.7	28.2	-36.1	0	0	0	114.2	L798 E800 W808	L798-P802 WeakPolarHBondContact O-CA 3.42Å; E800-P802 WeakPolarHBondContact O-CD 3.29Å; P802-W808 PolarHBondContact O-NE1 3.09Å
803	T	88.7	Confident	91.6	Very high	110 Å²	110	37.7 Å²	37.7	68%	0.675	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.5	2.2	-177.7	52.8	0	0	0	0	113.5	C801 G805 C831	C801-T803 VanDerWaalsContact C-N 3.27Å; C801-T803 PolarHBondContact O-N 2.81Å; T803-G805 PolarHBondContact O-N 3.1Å; T803-C831 PolarHBondContact O-SG 3.49Å
804	S	88.9	Confident	91.3	Very high	16 Å²	16	38.7 Å²	38.7	11%	0.112	21%	0.206	C	C	.	.			trans	-83.5	114.2	-175.8	-179.8	0	0	0	0	112.1	P771 C801 C806 L807 W808	P771-S804 WeakPolarHBondContact CB-OG 3.32Å; P771-S804 WeakPolarHBondContact CG-OG 3.48Å; C801-S804 PolarHBondContact O-N 2.78Å; S804-C806 VanDerWaalsContact C-N 3.33Å; S804-C806 PolarHBondContact O-N 3.1Å; S804-C806 PolarHBondContact OG-SG 3.42Å; S804-L807 PolarHBondContact O-N 2.96Å; S804-W808 PolarHBondContact O-N 2.75Å
805	G	90.1	Very high	91.1	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-66.6	-29.1	179	0	0	0	0	0	115	T803 W808 A809 D834 V837	T803-G805 PolarHBondContact O-N 3.1Å; G805-W808 PolarHBondContact O-N 2.76Å; G805-A809 VanDerWaalsContact O-CB 3.27Å; G805-A809 WeakPolarHBondContact O-CB 3.48Å; G805-A809 PolarHBondContact O-N 3Å; G805-D834 VanDerWaalsContact CA-CG 3.49Å; G805-D834 WeakPolarHBondContact CA-OD2 3.26Å; G805-V837 VanDerWaalsContact CA-CG2 3.45Å
806	C	90.6	Very high	91	Very high	21 Å²	21	40.1 Å²	40.1	14%	0.142	21%	0.214	C	C	.	.	H	α-helix	trans	-68.6	-38.9	177.9	66.8	0	0	0	0	112.3	L775 S804 A809 E810 L836	L775-C806 HydrophobicContact CD1-CB 3.67Å; S804-C806 VanDerWaalsContact C-N 3.33Å; S804-C806 PolarHBondContact O-N 3.1Å; S804-C806 PolarHBondContact OG-SG 3.42Å; C806-A809 PolarHBondContact O-N 3.49Å; C806-E810 PolarHBondContact O-N 3.21Å; C806-E810 VanDerWaalsContact O-N 3.17Å; C806-L836 HydrophobicContact CB-CD1 3.72Å
807	L	93.7	Very high	90.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.5	-41.7	174.2	-67.1	176.8	0	0	0	111.7	P771 W774 L775 I778 A797 L798 C801 S804 E810 A811	P771-L807 HydrophobicContact CB-CD1 3.86Å; P771-L807 HydrophobicContact CB-CG 3.95Å; W774-L807 HydrophobicContact CB-CD1 4.45Å; W774-L807 HydrophobicContact CB-CD2 3.8Å; L775-L807 HydrophobicContact CB-CD2 4.05Å; I778-L807 HydrophobicContact CD1-CD2 4.01Å; A797-L807 HydrophobicContact CB-CD1 3.84Å; A797-L807 HydrophobicContact CB-CD2 3.99Å; L798-L807 HydrophobicContact CD2-CB 3.85Å; C801-L807 HydrophobicContact CB-CD1 3.75Å; S804-L807 PolarHBondContact O-N 2.96Å; L807-E810 PolarHBondContact O-N 3.19Å; L807-A811 VanDerWaalsContact O-CB 3.3Å; L807-A811 WeakPolarHBondContact O-CB 3.36Å; L807-A811 PolarHBondContact O-N 3.01Å
808	W	94.4	Very high	90.6	Very high	19 Å²	19	46.4 Å²	46.4	7%	0.072	26%	0.256	C	S	.	.	H	α-helix	trans	-64.9	-38.7	175.1	-81.3	112.2	0	0	0	112.8	L798 P802 S804 G805 A811 I812 K823 D826 A827 K830 C831 V837	L798-W808 HydrophobicContact CD1-CE3 4.38Å; L798-W808 HydrophobicContact CD1-CH2 4.35Å; L798-W808 HydrophobicContact CD1-CZ2 4.47Å; L798-W808 HydrophobicContact CD1-CZ3 4.32Å; L798-W808 HydrophobicContact CD2-CD2 3.87Å; L798-W808 HydrophobicContact CD2-CE3 4.48Å; L798-W808 HydrophobicContact CD2-CG 4.08Å; L798-W808 HydrophobicContact CD2-CZ2 4.19Å; P802-W808 PolarHBondContact O-NE1 3.09Å; S804-W808 PolarHBondContact O-N 2.75Å; G805-W808 PolarHBondContact O-N 2.76Å; W808-A811 HydrophobicContact CE3-CB 4.49Å; W808-A811 PolarHBondContact O-N 3.44Å; W808-I812 VanDerWaalsContact O-CG1 3.32Å; W808-I812 WeakPolarHBondContact O-CG1 3.38Å; W808-I812 PolarHBondContact O-N 3.46Å; W808-K823 HydrophobicContact CZ3-CD 3.88Å; W808-K823 VanDerWaalsContact CZ3-CE 3.47Å; W808-K823 HydrophobicContact CZ3-CG 4.37Å; W808-D826 HydrophobicContact CH2-CB 4.11Å; W808-D826 HydrophobicContact CZ3-CB 4.05Å; W808-A827 HydrophobicContact CB-CB 3.83Å; W808-A827 HydrophobicContact CD2-CB 3.83Å; W808-A827 HydrophobicContact CE3-CB 3.61Å; W808-A827 HydrophobicContact CG-CB 3.93Å; W808-A827 HydrophobicContact CZ3-CB 4.39Å; W808-K830 HydrophobicContact CZ2-CB 4.25Å; W808-K830 HydrophobicContact CZ2-CG 3.83Å; W808-C831 VanDerWaalsContact CD1-SG 3.56Å; W808-V837 HydrophobicContact CB-CG2 4Å
809	A	92.6	Very high	90.6	Very high	12 Å²	12	51.1 Å²	51.1	10%	0.099	28%	0.278	C	S	.	.	H	α-helix	trans	-59.5	-46.8	175.8	0	0	0	0	0	111.3	G805 C806 F813 L836 A840	G805-A809 VanDerWaalsContact O-CB 3.27Å; G805-A809 WeakPolarHBondContact O-CB 3.48Å; G805-A809 PolarHBondContact O-N 3Å; C806-A809 PolarHBondContact O-N 3.49Å; A809-F813 WeakPolarHBondContact O-CD2 3.39Å; A809-L836 HydrophobicContact CB-CB 4.43Å; A809-A840 HydrophobicContact CB-CB 3.82Å
810	E	90.8	Very high	90.7	Very high	44 Å²	44	44.3 Å²	44.3	21%	0.206	25%	0.246	C	C	.	.	H	α-helix	trans	-66.6	-37.2	174	-68.9	-63.5	168.2	0	0	112	L775 R779 I794 C806 L807 I812 F813 M814	L775-E810 HydrophobicContact CD1-CG 3.85Å; L775-E810 HydrophobicContact CG-CG 4.1Å; R779-E810 IonicContact CZ-OE1 3.22Å; R779-E810 VanDerWaalsContact CZ-OE1 3.25Å; R779-E810 IonicContact NE-OE1 2.84Å; R779-E810 PolarHBondContact NE-OE1 3.27Å; R779-E810 IonicContact NH2-OE1 3.28Å; R779-E810 PolarHBondContact NH2-OE1 3.41Å; I794-E810 HydrophobicContact CD1-CB 4.18Å; C806-E810 PolarHBondContact O-N 3.21Å; C806-E810 VanDerWaalsContact O-N 3.17Å; L807-E810 PolarHBondContact O-N 3.19Å; E810-I812 VanDerWaalsContact C-N 3.3Å; E810-I812 PolarHBondContact O-N 3.08Å; E810-F813 PolarHBondContact O-N 3.07Å; E810-F813 VanDerWaalsContact O-N 3.1Å; E810-M814 WeakPolarHBondContact O-CG 3.42Å; E810-M814 PolarHBondContact O-N 3.42Å
811	A	92.7	Very high	90.8	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-62.8	-36.4	179.3	0	0	0	0	0	112.6	I794 L798 L807 W808 F813 T815	I794-A811 HydrophobicContact CD1-CB 3.62Å; I794-A811 HydrophobicContact CG1-CB 4.04Å; L798-A811 HydrophobicContact CD1-CB 4.03Å; L807-A811 VanDerWaalsContact O-CB 3.3Å; L807-A811 WeakPolarHBondContact O-CB 3.36Å; L807-A811 PolarHBondContact O-N 3.01Å; W808-A811 HydrophobicContact CE3-CB 4.49Å; W808-A811 PolarHBondContact O-N 3.44Å; A811-F813 VanDerWaalsContact C-N 3.34Å; A811-T815 WeakPolarHBondContact O-CG2 3.38Å; A811-T815 PolarHBondContact O-N 2.97Å; A811-T815 VanDerWaalsContact O-N 3.1Å; A811-T815 PolarHBondContact O-OG1 3Å
812	I	92.6	Very high	91	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61.2	-43.7	174.5	-67.5	161.9	0	0	0	110.2	W808 E810 T815 R820 K823 A827 A840	W808-I812 VanDerWaalsContact O-CG1 3.32Å; W808-I812 WeakPolarHBondContact O-CG1 3.38Å; W808-I812 PolarHBondContact O-N 3.46Å; E810-I812 VanDerWaalsContact C-N 3.3Å; E810-I812 PolarHBondContact O-N 3.08Å; I812-T815 PolarHBondContact O-OG1 3.36Å; I812-R820 HydrophobicContact CG2-CB 4.3Å; I812-R820 VanDerWaalsContact O-CG 3.3Å; I812-R820 WeakPolarHBondContact O-CG 3.32Å; I812-K823 HydrophobicContact CG1-CG 4.42Å; I812-A827 HydrophobicContact CD1-CB 4.05Å; I812-A840 HydrophobicContact CD1-CB 3.83Å
813	F	90.2	Very high	91.2	Very high	24 Å²	24	49.5 Å²	49.5	11%	0.105	27%	0.27	C	S	.	.	H	α-helix	trans	-78.2	-31.3	-178	-69.8	-69.8	0	0	0	114	A809 E810 A811 T815 R820 A840 K843 P934	A809-F813 WeakPolarHBondContact O-CD2 3.39Å; E810-F813 PolarHBondContact O-N 3.07Å; E810-F813 VanDerWaalsContact O-N 3.1Å; A811-F813 VanDerWaalsContact C-N 3.34Å; F813-T815 VanDerWaalsContact C-N 3.34Å; F813-R820 PolarHBondContact O-NH2 2.93Å; F813-A840 HydrophobicContact CE2-CB 3.87Å; F813-K843 HydrophobicContact CE1-CB 4.27Å; F813-K843 HydrophobicContact CE2-CB 4.4Å; F813-K843 HydrophobicContact CE2-CD 4.44Å; F813-K843 VanDerWaalsContact CE2-CE 3.42Å; F813-K843 HydrophobicContact CZ-CB 3.52Å; F813-K843 HydrophobicContact CZ-CD 4.21Å; F813-K843 HydrophobicContact CZ-CG 4.48Å; F813-P934 HydrophobicContact CD1-CB 3.71Å; F813-P934 HydrophobicContact CD1-CG 3.46Å; F813-P934 VanDerWaalsContact CD1-CG 3.46Å; F813-P934 HydrophobicContact CD2-CG 4.33Å; F813-P934 HydrophobicContact CE1-CB 4.23Å; F813-P934 HydrophobicContact CE1-CG 3.48Å; F813-P934 VanDerWaalsContact CE1-CG 3.48Å; F813-P934 HydrophobicContact CE2-CG 4.36Å; F813-P934 HydrophobicContact CG-CB 4.08Å; F813-P934 HydrophobicContact CG-CG 3.95Å; F813-P934 HydrophobicContact CZ-CG 3.99Å
814	M	88.5	Confident	91.4	Very high	40 Å²	40	44.4 Å²	44.4	20%	0.197	24%	0.239	C	C	.	.	H	α-helix	trans	-65.6	-35.6	172.8	-73.3	-64.6	-65.5	0	0	112.2	V782 A790 D791 I794 E810	V782-M814 HydrophobicContact CG2-CE 3.81Å; V782-M814 HydrophobicContact CG2-SD 3.45Å; V782-M814 WeakPolarHBondContact CG2-SD 3.41Å; A790-M814 HydrophobicContact CB-CE 3.59Å; D791-M814 VanDerWaalsContact OD1-CE 3.28Å; D791-M814 WeakPolarHBondContact OD1-CE 3.33Å; I794-M814 HydrophobicContact CD1-CG 4.22Å; E810-M814 WeakPolarHBondContact O-CG 3.42Å; E810-M814 PolarHBondContact O-N 3.42Å
815	T	88.6	Confident	91.6	Very high	24 Å²	24	47.6 Å²	47.6	15%	0.147	26%	0.257	C	S	.	.	S	Bend	trans	-65.9	143.1	176.3	54.5	0	0	0	0	112.5	A811 I812 F813 R820 K823	A811-T815 WeakPolarHBondContact O-CG2 3.38Å; A811-T815 PolarHBondContact O-N 2.97Å; A811-T815 VanDerWaalsContact O-N 3.1Å; A811-T815 PolarHBondContact O-OG1 3Å; I812-T815 PolarHBondContact O-OG1 3.36Å; F813-T815 VanDerWaalsContact C-N 3.34Å; T815-R820 PolarHBondContact O-NE 3.44Å; T815-R820 VanDerWaalsContact O-NE 3.14Å; T815-K823 HydrophobicContact CG2-CB 4.32Å; T815-K823 HydrophobicContact CG2-CD 4.15Å; T815-K823 HydrophobicContact CG2-CG 3.95Å
816	P	89.3	Confident	91.8	Very high	83 Å²	83	51 Å²	51	54%	0.539	28%	0.275	S	S	.	.			trans	-54.8	144.7	173.3	-25	33.8	0	0	0	112	A818 Q819 R820	P816-A818 PolarHBondContact O-N 2.97Å; P816-Q819 PolarHBondContact O-N 3.4Å; P816-R820 PolarHBondContact O-N 3.28Å
817	R	89.3	Confident	91.9	Very high	145 Å²	145	50 Å²	50	55%	0.547	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.3	-42.2	-172.5	-172.4	177.2	177.5	-173.9	2.1	114.6	Q819 R820 C847	R817-Q819 VanDerWaalsContact C-N 3.29Å; R817-Q819 PolarHBondContact O-N 2.86Å; R817-R820 PolarHBondContact O-N 3.14Å; R817-C847 PolarHBondContact NH2-O 3.32Å
818	A	90.8	Very high	91.8	Very high	100 Å²	100	51.5 Å²	51.5	83%	0.826	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-29.1	-178.6	0	0	0	0	0	114	P816	P816-A818 PolarHBondContact O-N 2.97Å
819	Q	92.5	Very high	91.7	Very high	119 Å²	119	58.2 Å²	58.2	56%	0.556	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-12	-177.1	-64.4	175.3	2.9	0	0	112.8	P816 R817 K821 S822 K823	P816-Q819 PolarHBondContact O-N 3.4Å; R817-Q819 VanDerWaalsContact C-N 3.29Å; R817-Q819 PolarHBondContact O-N 2.86Å; Q819-K821 PolarHBondContact O-N 2.86Å; Q819-S822 PolarHBondContact O-N 2.84Å; Q819-S822 VanDerWaalsContact O-N 3.14Å; Q819-K823 PolarHBondContact O-N 3.41Å
820	R	92.9	Very high	91.6	Very high	15 Å²	15	63.8 Å²	63.8	6%	0.057	33%	0.328	C	S	.	.	H	α-helix	trans	-53.7	-40.5	-178.9	-64.1	-170.5	176.8	162.9	-5.6	112.1	I812 F813 T815 P816 R817 K823 S824 M844 N935	I812-R820 HydrophobicContact CG2-CB 4.3Å; I812-R820 VanDerWaalsContact O-CG 3.3Å; I812-R820 WeakPolarHBondContact O-CG 3.32Å; F813-R820 PolarHBondContact O-NH2 2.93Å; T815-R820 PolarHBondContact O-NE 3.44Å; T815-R820 VanDerWaalsContact O-NE 3.14Å; P816-R820 PolarHBondContact O-N 3.28Å; R817-R820 PolarHBondContact O-N 3.14Å; R820-K823 PolarHBondContact O-N 3.19Å; R820-S824 VanDerWaalsContact O-CB 3.24Å; R820-S824 WeakPolarHBondContact O-CB 3.33Å; R820-S824 PolarHBondContact O-N 3.36Å; R820-S824 PolarHBondContact O-OG 3.42Å; R820-M844 HydrophobicContact CB-CG 4.16Å; R820-M844 HydrophobicContact CB-SD 3.83Å; R820-N935 PolarHBondContact NH1-OXT 2.95Å; R820-N935 PolarHBondContact NH2-O 3.38Å
821	K	91.8	Very high	91.4	Very high	132 Å²	132	62.2 Å²	62.2	57%	0.574	32%	0.322	S	S	*	.	H	α-helix	trans	-60.2	-49.4	178.9	-172.5	179	178	-174	0	112.2	Q819 S824 V825	Q819-K821 PolarHBondContact O-N 2.86Å; K821-S824 PolarHBondContact O-N 3.11Å; K821-S824 PolarHBondContact O-OG 3.46Å; K821-V825 WeakPolarHBondContact O-CG2 3.46Å; K821-V825 PolarHBondContact O-N 2.96Å; K821-V825 VanDerWaalsContact O-N 3.12Å
822	S	94.2	Very high	90.5	Very high	79 Å²	79	68.2 Å²	68.2	55%	0.552	35%	0.35	S	S	*	.	H	α-helix	trans	-62.5	-46.2	176.8	-167.3	0	0	0	0	111.1	Q819 S824 V825 D826	Q819-S822 PolarHBondContact O-N 2.84Å; Q819-S822 VanDerWaalsContact O-N 3.14Å; S822-S824 VanDerWaalsContact C-N 3.26Å; S822-S824 PolarHBondContact O-N 3.37Å; S822-V825 PolarHBondContact O-N 3.08Å; S822-V825 VanDerWaalsContact O-N 3.14Å; S822-D826 PolarHBondContact O-N 3.45Å
823	K	92.5	Very high	90	Very high	54 Å²	54	75.3 Å²	75.3	24%	0.235	38%	0.383	C	S	.	.	H	α-helix	trans	-61.6	-35.4	179.1	-165.6	69.5	173.9	177.9	0	112.3	W808 I812 T815 Q819 R820 D826 A827	W808-K823 HydrophobicContact CZ3-CD 3.88Å; W808-K823 VanDerWaalsContact CZ3-CE 3.47Å; W808-K823 HydrophobicContact CZ3-CG 4.37Å; I812-K823 HydrophobicContact CG1-CG 4.42Å; T815-K823 HydrophobicContact CG2-CB 4.32Å; T815-K823 HydrophobicContact CG2-CD 4.15Å; T815-K823 HydrophobicContact CG2-CG 3.95Å; Q819-K823 PolarHBondContact O-N 3.41Å; R820-K823 PolarHBondContact O-N 3.19Å; K823-D826 PolarHBondContact O-N 2.86Å; K823-A827 WeakPolarHBondContact O-CB 3.35Å; K823-A827 PolarHBondContact O-N 3.32Å
824	S	92.7	Very high	89.9	Confident	4 Å²	4	76.1 Å²	76.1	3%	0.028	39%	0.388	C	S	.	.	H	α-helix	trans	-70.6	-34.2	177.2	78.3	0	0	0	0	112.6	R820 K821 S822 A827 L828	R820-S824 VanDerWaalsContact O-CB 3.24Å; R820-S824 WeakPolarHBondContact O-CB 3.33Å; R820-S824 PolarHBondContact O-N 3.36Å; R820-S824 PolarHBondContact O-OG 3.42Å; K821-S824 PolarHBondContact O-N 3.11Å; K821-S824 PolarHBondContact O-OG 3.46Å; S822-S824 VanDerWaalsContact C-N 3.26Å; S822-S824 PolarHBondContact O-N 3.37Å; S824-A827 PolarHBondContact O-N 3.19Å; S824-L828 VanDerWaalsContact O-CG 3.29Å; S824-L828 WeakPolarHBondContact O-CG 3.37Å; S824-L828 PolarHBondContact O-N 3.42Å
825	V	93.8	Very high	90	Very high	83 Å²	83	75.4 Å²	75.4	50%	0.503	39%	0.386	S	S	.	.	H	α-helix	trans	-68.3	-41.2	172.8	173.7	0	0	0	0	110.4	K821 S822 A827 L828 K829	K821-V825 WeakPolarHBondContact O-CG2 3.46Å; K821-V825 PolarHBondContact O-N 2.96Å; K821-V825 VanDerWaalsContact O-N 3.12Å; S822-V825 PolarHBondContact O-N 3.08Å; S822-V825 VanDerWaalsContact O-N 3.14Å; V825-A827 VanDerWaalsContact C-N 3.34Å; V825-L828 PolarHBondContact O-N 3.44Å; V825-K829 WeakPolarHBondContact O-CB 3.3Å; V825-K829 PolarHBondContact O-N 3.29Å
826	D	92.5	Very high	90.2	Very high	71 Å²	71	76.9 Å²	76.9	38%	0.38	39%	0.393	S	S	.	.	H	α-helix	trans	-61.6	-43.8	173.4	-66.5	-26.8	0	0	0	111.5	W808 S822 K823 K829 K830	W808-D826 HydrophobicContact CH2-CB 4.11Å; W808-D826 HydrophobicContact CZ3-CB 4.05Å; S822-D826 PolarHBondContact O-N 3.45Å; K823-D826 PolarHBondContact O-N 2.86Å; D826-K829 PolarHBondContact O-N 3.31Å; D826-K830 VanDerWaalsContact O-CG 3.28Å; D826-K830 WeakPolarHBondContact O-CG 3.21Å; D826-K830 PolarHBondContact O-N 2.78Å
827	A	93.1	Very high	90.4	Very high	0 Å²	0	73 Å²	73	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-59.6	-46.6	176.1	0	0	0	0	0	111.7	W808 I812 K823 S824 V825 K830 C831 V837	W808-A827 HydrophobicContact CB-CB 3.83Å; W808-A827 HydrophobicContact CD2-CB 3.83Å; W808-A827 HydrophobicContact CE3-CB 3.61Å; W808-A827 HydrophobicContact CG-CB 3.93Å; W808-A827 HydrophobicContact CZ3-CB 4.39Å; I812-A827 HydrophobicContact CD1-CB 4.05Å; K823-A827 WeakPolarHBondContact O-CB 3.35Å; K823-A827 PolarHBondContact O-N 3.32Å; S824-A827 PolarHBondContact O-N 3.19Å; V825-A827 VanDerWaalsContact C-N 3.34Å; A827-K830 PolarHBondContact O-N 2.95Å; A827-C831 WeakPolarHBondContact O-CB 3.34Å; A827-C831 PolarHBondContact O-N 3.46Å; A827-V837 HydrophobicContact CB-CG1 3.73Å
828	L	92.8	Very high	90.6	Very high	33 Å²	33	66.4 Å²	66.4	17%	0.173	34%	0.343	C	S	.	.	H	α-helix	trans	-62	-47.5	176.3	-71.9	171.2	0	0	0	110.8	S824 V825 K830 C831 E832 V837 L838 V841 W857	S824-L828 VanDerWaalsContact O-CG 3.29Å; S824-L828 WeakPolarHBondContact O-CG 3.37Å; S824-L828 PolarHBondContact O-N 3.42Å; V825-L828 PolarHBondContact O-N 3.44Å; L828-K830 PolarHBondContact O-N 3.34Å; L828-C831 CarbonylContact O-C 3.54Å; L828-C831 PolarHBondContact O-N 3.21Å; L828-C831 VanDerWaalsContact O-N 3.13Å; L828-E832 WeakPolarHBondContact O-CA 3.46Å; L828-E832 WeakPolarHBondContact O-CG 3.34Å; L828-E832 PolarHBondContact O-N 3.29Å; L828-V837 HydrophobicContact CD2-CG1 3.96Å; L828-V837 HydrophobicContact CG-CG1 4.32Å; L828-L838 HydrophobicContact CD2-CD2 3.78Å; L828-V841 HydrophobicContact CD1-CG2 4.19Å; L828-V841 HydrophobicContact CD2-CG2 4.34Å; L828-V841 HydrophobicContact CG-CG2 4.24Å; L828-W857 HydrophobicContact CD1-CH2 3.68Å; L828-W857 HydrophobicContact CD1-CZ3 4.13Å; L828-W857 HydrophobicContact CD2-CH2 4.44Å; L828-W857 HydrophobicContact CD2-CZ3 4.15Å
829	K	92	Very high	90.7	Very high	160 Å²	160	61.9 Å²	61.9	70%	0.696	31%	0.305	S	S	*	.	H	α-helix	trans	-60.1	-29.8	178.7	-174.3	176.2	-178.6	178.1	0	113.3	V825 D826	V825-K829 WeakPolarHBondContact O-CB 3.3Å; V825-K829 PolarHBondContact O-N 3.29Å; D826-K829 PolarHBondContact O-N 3.31Å
830	K	90.4	Very high	90.7	Very high	128 Å²	128	56.2 Å²	56.2	56%	0.557	28%	0.279	S	S	*	.	H	α-helix	trans	-86.1	-31.1	176.9	-65.7	-65.3	-175.9	179.6	0	112.8	W808 D826 A827 L828	W808-K830 HydrophobicContact CZ2-CB 4.25Å; W808-K830 HydrophobicContact CZ2-CG 3.83Å; D826-K830 VanDerWaalsContact O-CG 3.28Å; D826-K830 WeakPolarHBondContact O-CG 3.21Å; D826-K830 PolarHBondContact O-N 2.78Å; A827-K830 PolarHBondContact O-N 2.95Å; L828-K830 PolarHBondContact O-N 3.34Å
831	C	86	Confident	90.8	Very high	11 Å²	11	55.6 Å²	55.6	7%	0.074	28%	0.276	C	S	.	.			trans	-137.9	65.4	-171.9	-57.2	0	0	0	0	110.9	T803 W808 A827 L828 H833 D834 V837	T803-C831 PolarHBondContact O-SG 3.49Å; W808-C831 VanDerWaalsContact CD1-SG 3.56Å; A827-C831 WeakPolarHBondContact O-CB 3.34Å; A827-C831 PolarHBondContact O-N 3.46Å; L828-C831 CarbonylContact O-C 3.54Å; L828-C831 PolarHBondContact O-N 3.21Å; L828-C831 VanDerWaalsContact O-N 3.13Å; C831-H833 PolarHBondContact O-N 3.16Å; C831-H833 VanDerWaalsContact O-N 3.08Å; C831-D834 HydrophobicContact CB-CB 3.98Å; C831-D834 PolarHBondContact O-N 2.84Å; C831-V837 HydrophobicContact CB-CG2 4.03Å
832	E	74.4	Confident	90.9	Very high	128 Å²	128	49.3 Å²	49.3	60%	0.598	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.1	-169.4	-73.2	-171.6	166.7	0	0	114.5	L828	L828-E832 WeakPolarHBondContact O-CA 3.46Å; L828-E832 WeakPolarHBondContact O-CG 3.34Å; L828-E832 PolarHBondContact O-N 3.29Å
833	H	81.1	Confident	90.8	Very high	149 Å²	149	46.7 Å²	46.7	69%	0.69	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-130.2	28.6	-176.4	-55.8	-36.8	0	0	0	113.1	C831 L864	C831-H833 PolarHBondContact O-N 3.16Å; C831-H833 VanDerWaalsContact O-N 3.08Å; H833-L864 WeakPolarHBondContact O-CD2 3.49Å
834	D	89	Confident	90.8	Very high	40 Å²	40	44.3 Å²	44.3	21%	0.214	22%	0.217	C	C	.	.			trans	-92.5	123.1	174.9	-170.7	-74.2	0	0	0	111.4	G805 C831 L836 V837 L838	G805-D834 VanDerWaalsContact CA-CG 3.49Å; G805-D834 WeakPolarHBondContact CA-OD2 3.26Å; C831-D834 HydrophobicContact CB-CB 3.98Å; C831-D834 PolarHBondContact O-N 2.84Å; D834-L836 VanDerWaalsContact C-N 3.28Å; D834-L836 PolarHBondContact O-N 3.44Å; D834-L836 WeakPolarHBondContact OD1-CA 3.5Å; D834-L836 VanDerWaalsContact OD1-CB 3.26Å; D834-L836 WeakPolarHBondContact OD1-CB 3.43Å; D834-L836 PolarHBondContact OD1-N 2.9Å; D834-V837 HydrophobicContact CB-CB 4.31Å; D834-V837 HydrophobicContact CB-CG2 3.98Å; D834-V837 PolarHBondContact O-N 3.44Å; D834-V837 PolarHBondContact OD1-N 3.14Å; D834-L838 WeakPolarHBondContact O-CG 3.43Å; D834-L838 PolarHBondContact O-N 2.9Å; D834-L838 VanDerWaalsContact O-N 3.12Å
835	P	91	Very high	90.9	Very high	26 Å²	26	45.3 Å²	45.3	17%	0.169	22%	0.221	C	C	.	.	H	α-helix	trans	-66.3	-27.6	-176.5	27.2	-34.9	0	0	0	113	L839 T861 E865 L868	P835-L839 VanDerWaalsContact O-CB 3.24Å; P835-L839 WeakPolarHBondContact O-CB 3.35Å; P835-L839 PolarHBondContact O-N 3.29Å; P835-T861 WeakPolarHBondContact O-CG2 3.16Å; P835-E865 HydrophobicContact CB-CB 3.84Å; P835-E865 HydrophobicContact CG-CB 4.05Å; P835-E865 HydrophobicContact CG-CG 4.42Å; P835-L868 HydrophobicContact CB-CD2 3.99Å; P835-L868 HydrophobicContact CG-CD2 4.44Å
836	L	91.6	Very high	90.9	Very high	55 Å²	55	41.8 Å²	41.8	29%	0.288	20%	0.199	S	C	.	.	H	α-helix	trans	-73.6	-35.1	177.9	-59.9	172.5	0	0	0	111.4	C806 A809 D834 L839 A840 L868	C806-L836 HydrophobicContact CB-CD1 3.72Å; A809-L836 HydrophobicContact CB-CB 4.43Å; D834-L836 VanDerWaalsContact C-N 3.28Å; D834-L836 PolarHBondContact O-N 3.44Å; D834-L836 WeakPolarHBondContact OD1-CA 3.5Å; D834-L836 VanDerWaalsContact OD1-CB 3.26Å; D834-L836 WeakPolarHBondContact OD1-CB 3.43Å; D834-L836 PolarHBondContact OD1-N 2.9Å; L836-L839 PolarHBondContact O-N 3.21Å; L836-A840 WeakPolarHBondContact O-CB 3.47Å; L836-A840 PolarHBondContact O-N 3.26Å; L836-L868 HydrophobicContact CD2-CD1 4.16Å; L836-L868 HydrophobicContact CD2-CD2 3.83Å
837	V	93.3	Very high	90.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-67.5	-45.2	173.3	179.4	0	0	0	0	110.5	G805 W808 A827 L828 C831 D834 L839 A840 V841	G805-V837 VanDerWaalsContact CA-CG2 3.45Å; W808-V837 HydrophobicContact CB-CG2 4Å; A827-V837 HydrophobicContact CB-CG1 3.73Å; L828-V837 HydrophobicContact CD2-CG1 3.96Å; L828-V837 HydrophobicContact CG-CG1 4.32Å; C831-V837 HydrophobicContact CB-CG2 4.03Å; D834-V837 HydrophobicContact CB-CB 4.31Å; D834-V837 HydrophobicContact CB-CG2 3.98Å; D834-V837 PolarHBondContact O-N 3.44Å; D834-V837 PolarHBondContact OD1-N 3.14Å; V837-L839 VanDerWaalsContact C-N 3.29Å; V837-L839 PolarHBondContact O-N 3.27Å; V837-A840 WeakPolarHBondContact O-CB 3.46Å; V837-A840 PolarHBondContact O-N 3.34Å; V837-A840 VanDerWaalsContact O-N 3.13Å; V837-V841 HydrophobicContact CG1-CG2 4.47Å; V837-V841 VanDerWaalsContact O-CG2 3.3Å; V837-V841 WeakPolarHBondContact O-CG2 3.46Å; V837-V841 PolarHBondContact O-N 2.85Å
838	L	93.7	Very high	90.6	Very high	7 Å²	7	42.6 Å²	42.6	4%	0.037	20%	0.203	C	C	.	.	H	α-helix	trans	-61.1	-39.8	174.8	-63	-177.5	0	0	0	111.9	L828 D834 V841 S842 W857 R860 T861 L864	L828-L838 HydrophobicContact CD2-CD2 3.78Å; D834-L838 WeakPolarHBondContact O-CG 3.43Å; D834-L838 PolarHBondContact O-N 2.9Å; D834-L838 VanDerWaalsContact O-N 3.12Å; L838-V841 PolarHBondContact O-N 3.32Å; L838-S842 WeakPolarHBondContact O-CB 3.31Å; L838-S842 PolarHBondContact O-N 3.08Å; L838-S842 PolarHBondContact O-OG 3.31Å; L838-W857 HydrophobicContact CD2-CE3 3.81Å; L838-W857 HydrophobicContact CD2-CZ3 3.44Å; L838-W857 VanDerWaalsContact CD2-CZ3 3.44Å; L838-R860 HydrophobicContact CD1-CG 4.29Å; L838-T861 HydrophobicContact CB-CG2 4.24Å; L838-T861 WeakPolarHBondContact CB-OG1 3.34Å; L838-L864 HydrophobicContact CD1-CB 4.44Å; L838-L864 HydrophobicContact CD1-CD2 3.55Å
839	L	93.7	Very high	90.4	Very high	6 Å²	6	51 Å²	51	3%	0.031	23%	0.233	C	C	.	.	H	α-helix	trans	-62.9	-42	173.6	-177.4	57.5	0	0	0	111.4	P835 L836 V837 S842 K843 F858 T861 L868 D870 A871 Y874	P835-L839 VanDerWaalsContact O-CB 3.24Å; P835-L839 WeakPolarHBondContact O-CB 3.35Å; P835-L839 PolarHBondContact O-N 3.29Å; L836-L839 PolarHBondContact O-N 3.21Å; V837-L839 VanDerWaalsContact C-N 3.29Å; V837-L839 PolarHBondContact O-N 3.27Å; L839-S842 PolarHBondContact O-N 2.93Å; L839-K843 WeakPolarHBondContact O-CB 3.34Å; L839-K843 VanDerWaalsContact O-CG 3.32Å; L839-K843 WeakPolarHBondContact O-CG 3.5Å; L839-K843 PolarHBondContact O-N 2.81Å; L839-F858 HydrophobicContact CD1-CD1 4.36Å; L839-F858 HydrophobicContact CD1-CE1 3.89Å; L839-T861 HydrophobicContact CB-CG2 4.06Å; L839-L868 HydrophobicContact CD2-CD2 4.34Å; L839-D870 HydrophobicContact CD2-CB 4.26Å; L839-A871 HydrophobicContact CD1-CB 4.21Å; L839-A871 HydrophobicContact CD2-CB 4.37Å; L839-Y874 HydrophobicContact CD1-CD2 3.94Å; L839-Y874 HydrophobicContact CD1-CG 4.19Å; L839-Y874 HydrophobicContact CD2-CD2 3.95Å; L839-Y874 HydrophobicContact CD2-CE2 4.3Å; L839-Y874 HydrophobicContact CG-CD2 4.25Å
840	A	93	Very high	90.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.8	-41.9	175.8	0	0	0	0	0	112.5	A809 I812 F813 L836 V837 K843 M844	A809-A840 HydrophobicContact CB-CB 3.82Å; I812-A840 HydrophobicContact CD1-CB 3.83Å; F813-A840 HydrophobicContact CE2-CB 3.87Å; L836-A840 WeakPolarHBondContact O-CB 3.47Å; L836-A840 PolarHBondContact O-N 3.26Å; V837-A840 WeakPolarHBondContact O-CB 3.46Å; V837-A840 PolarHBondContact O-N 3.34Å; V837-A840 VanDerWaalsContact O-N 3.13Å; A840-K843 PolarHBondContact O-N 3.4Å; A840-M844 WeakPolarHBondContact O-CB 3.19Å; A840-M844 PolarHBondContact O-N 3.43Å
841	V	93.7	Very high	90.6	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.006	20%	0.202	C	C	.	.	H	α-helix	trans	-63.6	-41.6	173.8	173.3	0	0	0	0	111.2	L828 V837 L838 M844 F845 W857	L828-V841 HydrophobicContact CD1-CG2 4.19Å; L828-V841 HydrophobicContact CD2-CG2 4.34Å; L828-V841 HydrophobicContact CG-CG2 4.24Å; V837-V841 HydrophobicContact CG1-CG2 4.47Å; V837-V841 VanDerWaalsContact O-CG2 3.3Å; V837-V841 WeakPolarHBondContact O-CG2 3.46Å; V837-V841 PolarHBondContact O-N 2.85Å; L838-V841 PolarHBondContact O-N 3.32Å; V841-M844 WeakPolarHBondContact O-CB 3.26Å; V841-M844 PolarHBondContact O-N 3.38Å; V841-F845 HydrophobicContact CG1-CD2 3.7Å; V841-F845 HydrophobicContact CG1-CE2 3.38Å; V841-F845 HydrophobicContact CG1-CZ 4.42Å; V841-F845 VanDerWaalsContact O-CD2 3.28Å; V841-F845 WeakPolarHBondContact O-CD2 3.48Å; V841-F845 PolarHBondContact O-N 3.39Å; V841-W857 HydrophobicContact CB-CE3 4.33Å; V841-W857 HydrophobicContact CG1-CD2 3.75Å; V841-W857 HydrophobicContact CG1-CE3 3.77Å; V841-W857 HydrophobicContact CG1-CG 4.23Å; V841-W857 HydrophobicContact CG1-CH2 4.29Å; V841-W857 HydrophobicContact CG1-CZ2 4.28Å; V841-W857 HydrophobicContact CG1-CZ3 4.03Å
842	S	93.6	Very high	90.9	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.2	-46.6	176.2	-55	0	0	0	0	111.2	L838 L839 F845 W846 W857 F858 T861	L838-S842 WeakPolarHBondContact O-CB 3.31Å; L838-S842 PolarHBondContact O-N 3.08Å; L838-S842 PolarHBondContact O-OG 3.31Å; L839-S842 PolarHBondContact O-N 2.93Å; S842-F845 PolarHBondContact O-N 2.91Å; S842-W846 WeakPolarHBondContact O-CB 3.49Å; S842-W846 PolarHBondContact O-N 3.24Å; S842-W857 VanDerWaalsContact OG-CB 3.28Å; S842-W857 WeakPolarHBondContact OG-CB 3.44Å; S842-W857 PolarHBondContact OG-O 3.14Å; S842-F858 PolarHBondContact OG-N 2.94Å; S842-T861 PolarHBondContact OG-OG1 3.02Å
843	K	93.2	Very high	91.9	Very high	25 Å²	25	47.8 Å²	47.8	11%	0.109	23%	0.226	C	C	.	.	H	α-helix	trans	-61.2	-40.9	173.3	-73.7	-175.8	-57.4	174.8	0	111.9	F813 L839 A840 W846 C847 Y874	F813-K843 HydrophobicContact CE1-CB 4.27Å; F813-K843 HydrophobicContact CE2-CB 4.4Å; F813-K843 HydrophobicContact CE2-CD 4.44Å; F813-K843 VanDerWaalsContact CE2-CE 3.42Å; F813-K843 HydrophobicContact CZ-CB 3.52Å; F813-K843 HydrophobicContact CZ-CD 4.21Å; F813-K843 HydrophobicContact CZ-CG 4.48Å; L839-K843 WeakPolarHBondContact O-CB 3.34Å; L839-K843 VanDerWaalsContact O-CG 3.32Å; L839-K843 WeakPolarHBondContact O-CG 3.5Å; L839-K843 PolarHBondContact O-N 2.81Å; A840-K843 PolarHBondContact O-N 3.4Å; K843-W846 WeakPolarHBondContact O-CB 3.42Å; K843-W846 PolarHBondContact O-N 3.4Å; K843-C847 PolarHBondContact O-N 3.08Å; K843-C847 PolarHBondContact O-SG 3.23Å; K843-Y874 HydrophobicContact CD-CD1 3.69Å; K843-Y874 HydrophobicContact CD-CD2 4.25Å; K843-Y874 HydrophobicContact CD-CE1 3.4Å; K843-Y874 VanDerWaalsContact CD-CE1 3.4Å; K843-Y874 HydrophobicContact CD-CE2 4.06Å; K843-Y874 HydrophobicContact CD-CG 4.12Å; K843-Y874 HydrophobicContact CG-CD1 3.95Å; K843-Y874 HydrophobicContact CG-CE1 4.14Å; K843-Y874 HydrophobicContact CG-CG 4.32Å
844	M	92.6	Very high	92.5	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.015	19%	0.193	C	C	.	.	H	α-helix	trans	-60.6	-49.2	176	-178.1	-167.8	74.3	0	0	111.7	R820 A840 V841 W846 C847 E848	R820-M844 HydrophobicContact CB-CG 4.16Å; R820-M844 HydrophobicContact CB-SD 3.83Å; A840-M844 WeakPolarHBondContact O-CB 3.19Å; A840-M844 PolarHBondContact O-N 3.43Å; V841-M844 WeakPolarHBondContact O-CB 3.26Å; V841-M844 PolarHBondContact O-N 3.38Å; M844-W846 PolarHBondContact O-N 3Å; M844-C847 PolarHBondContact O-N 3.34Å; M844-E848 PolarHBondContact O-N 3.38Å
845	F	93.6	Very high	92.8	Very high	25 Å²	25	40.4 Å²	40.4	11%	0.11	19%	0.189	C	C	.	.	H	α-helix	trans	-63.2	-32.3	176.6	-75.5	-53.7	0	0	0	112.7	V841 S842 E848 R849 L850 K853 A854 W857	V841-F845 HydrophobicContact CG1-CD2 3.7Å; V841-F845 HydrophobicContact CG1-CE2 3.38Å; V841-F845 HydrophobicContact CG1-CZ 4.42Å; V841-F845 VanDerWaalsContact O-CD2 3.28Å; V841-F845 WeakPolarHBondContact O-CD2 3.48Å; V841-F845 PolarHBondContact O-N 3.39Å; S842-F845 PolarHBondContact O-N 2.91Å; F845-E848 PolarHBondContact O-N 3.15Å; F845-R849 PolarHBondContact O-N 2.91Å; F845-L850 HydrophobicContact CD1-CB 4.29Å; F845-L850 HydrophobicContact CD1-CD1 3.86Å; F845-L850 HydrophobicContact CE1-CD1 4.22Å; F845-L850 PolarHBondContact O-N 3.16Å; F845-K853 HydrophobicContact CD1-CB 4.35Å; F845-K853 HydrophobicContact CE1-CD 4.3Å; F845-K853 HydrophobicContact CG-CB 4.26Å; F845-A854 HydrophobicContact CB-CB 3.91Å; F845-W857 AromaticContact CD2-CD1 3.42Å; F845-W857 VanDerWaalsContact CD2-CD1 3.42Å; F845-W857 HydrophobicContact CD2-CG 4.01Å; F845-W857 AromaticContact CD2-NE1 3.76Å; F845-W857 AromaticContact CE2-CD1 3.4Å; F845-W857 HydrophobicContact CE2-CD2 4.25Å; F845-W857 AromaticContact CE2-CE2 3.74Å; F845-W857 HydrophobicContact CE2-CG 4.09Å; F845-W857 HydrophobicContact CE2-CZ2 4.37Å; F845-W857 AromaticContact CE2-NE1 3.19Å
846	W	93.8	Very high	92.9	Very high	9 Å²	9	44 Å²	44	3%	0.034	21%	0.207	C	C	.	.	H	α-helix	trans	-66.3	-46.1	172.5	-176.1	16	0	0	0	111.7	S842 K843 M844 E848 R849 A854 F858 Y874 K877 F878 H882 L933	S842-W846 WeakPolarHBondContact O-CB 3.49Å; S842-W846 PolarHBondContact O-N 3.24Å; K843-W846 WeakPolarHBondContact O-CB 3.42Å; K843-W846 PolarHBondContact O-N 3.4Å; M844-W846 PolarHBondContact O-N 3Å; W846-E848 VanDerWaalsContact C-N 3.26Å; W846-E848 PolarHBondContact O-N 3.07Å; W846-R849 WeakPolarHBondContact O-CA 3.33Å; W846-R849 PolarHBondContact O-N 3.37Å; W846-A854 HydrophobicContact CB-CB 4.34Å; W846-F858 HydrophobicContact CE3-CE2 4.42Å; W846-F858 HydrophobicContact CE3-CZ 4.03Å; W846-Y874 HydrophobicContact CZ3-CD1 4.21Å; W846-K877 HydrophobicContact CH2-CB 4.04Å; W846-K877 HydrophobicContact CH2-CD 3.98Å; W846-K877 HydrophobicContact CH2-CG 3.88Å; W846-F878 HydrophobicContact CB-CD2 4.42Å; W846-F878 AromaticContact CD1-CD2 3.81Å; W846-F878 HydrophobicContact CD2-CB 4.3Å; W846-F878 AromaticContact CD2-CD2 3.96Å; W846-F878 HydrophobicContact CD2-CD2 3.96Å; W846-F878 HydrophobicContact CE3-CB 4.25Å; W846-F878 AromaticContact CG-CD2 3.83Å; W846-F878 HydrophobicContact CG-CD2 3.83Å; W846-F878 HydrophobicContact CG-CE2 4.44Å; W846-F878 HydrophobicContact CH2-CB 4.3Å; W846-F878 HydrophobicContact CZ2-CB 4.31Å; W846-F878 HydrophobicContact CZ3-CB 4.25Å; W846-F878 AromaticContact NE1-CD2 3.94Å; W846-H882 AromaticContact CD1-CD2 3.83Å; W846-H882 AromaticContact CD1-NE2 3.57Å; W846-H882 AromaticContact NE1-CD2 3.46Å; W846-H882 PolarHBondContact NE1-CD2 2.89Å; W846-H882 AromaticContact NE1-NE2 3.21Å; W846-H882 PolarHBondContact NE1-NE2 3.2Å; W846-L933 HydrophobicContact CD2-CD1 4.38Å; W846-L933 HydrophobicContact CD2-CD2 3.82Å; W846-L933 HydrophobicContact CE3-CD2 3.37Å; W846-L933 HydrophobicContact CE3-CG 4.41Å; W846-L933 HydrophobicContact CH2-CD1 3.9Å; W846-L933 HydrophobicContact CH2-CD2 3.7Å; W846-L933 HydrophobicContact CH2-CG 3.89Å; W846-L933 HydrophobicContact CZ2-CD1 3.68Å; W846-L933 HydrophobicContact CZ2-CD2 4.14Å; W846-L933 HydrophobicContact CZ2-CG 4.2Å; W846-L933 HydrophobicContact CZ3-CD1 4.37Å; W846-L933 HydrophobicContact CZ3-CD2 3.3Å; W846-L933 HydrophobicContact CZ3-CG 4.02Å
847	C	90.2	Very high	93.1	Very high	30 Å²	30	43.6 Å²	43.6	20%	0.203	20%	0.201	C	C	.	.	H	α-helix	trans	-61.4	-31.2	173.4	-63.9	0	0	0	0	112.8	R817 K843 M844 R849	R817-C847 PolarHBondContact NH2-O 3.32Å; K843-C847 PolarHBondContact O-N 3.08Å; K843-C847 PolarHBondContact O-SG 3.23Å; M844-C847 PolarHBondContact O-N 3.34Å; C847-R849 VanDerWaalsContact C-N 3.27Å; C847-R849 PolarHBondContact O-N 3.15Å
848	E	89.4	Confident	93.2	Very high	58 Å²	58	43.6 Å²	43.6	27%	0.271	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-4.1	172.8	-70.7	-176.8	175.1	0	0	114.1	M844 F845 W846 L850	M844-E848 PolarHBondContact O-N 3.38Å; F845-E848 PolarHBondContact O-N 3.15Å; W846-E848 VanDerWaalsContact C-N 3.26Å; W846-E848 PolarHBondContact O-N 3.07Å; E848-L850 HydrophobicContact CB-CD1 4.29Å; E848-L850 HydrophobicContact CB-CG 4.28Å; E848-L850 PolarHBondContact O-N 2.88Å
849	R	89.8	Confident	93.2	Very high	209 Å²	209	45.7 Å²	45.7	79%	0.789	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.3	23.1	-176.1	-56.2	-176.6	172.9	-175.8	-2.6	114.4	F845 W846 C847 V851	F845-R849 PolarHBondContact O-N 2.91Å; W846-R849 WeakPolarHBondContact O-CA 3.33Å; W846-R849 PolarHBondContact O-N 3.37Å; C847-R849 VanDerWaalsContact C-N 3.27Å; C847-R849 PolarHBondContact O-N 3.15Å; R849-V851 VanDerWaalsContact C-N 3.3Å; R849-V851 PolarHBondContact O-N 3.1Å; R849-V851 VanDerWaalsContact O-N 3.08Å
850	L	92.4	Very high	93.2	Very high	71 Å²	71	52.2 Å²	52.2	37%	0.372	24%	0.239	S	C	.	.			trans	-85.4	69.8	174	-66.5	174	0	0	0	110.4	F845 E848 M852 K853 A854	F845-L850 HydrophobicContact CD1-CB 4.29Å; F845-L850 HydrophobicContact CD1-CD1 3.86Å; F845-L850 HydrophobicContact CE1-CD1 4.22Å; F845-L850 PolarHBondContact O-N 3.16Å; E848-L850 HydrophobicContact CB-CD1 4.29Å; E848-L850 HydrophobicContact CB-CG 4.28Å; E848-L850 PolarHBondContact O-N 2.88Å; L850-M852 PolarHBondContact O-N 3.4Å; L850-K853 HydrophobicContact CB-CB 4.28Å; L850-K853 HydrophobicContact CD1-CD 4.35Å; L850-K853 PolarHBondContact O-N 3.04Å; L850-K853 VanDerWaalsContact O-N 3.14Å; L850-A854 PolarHBondContact O-N 3.44Å
851	V	93.5	Very high	93.2	Very high	39 Å²	39	52.2 Å²	52.2	24%	0.236	24%	0.239	C	C	.	.	H	α-helix	trans	-53.2	-49.7	-169.6	-178.5	0	0	0	0	113.2	R849 K853 A854 R855 F878 H882	R849-V851 VanDerWaalsContact C-N 3.3Å; R849-V851 PolarHBondContact O-N 3.1Å; R849-V851 VanDerWaalsContact O-N 3.08Å; V851-K853 VanDerWaalsContact C-N 3.33Å; V851-K853 PolarHBondContact O-N 3.41Å; V851-A854 PolarHBondContact O-N 3.31Å; V851-R855 PolarHBondContact O-N 3.39Å; V851-F878 HydrophobicContact CG1-CE2 4.12Å; V851-F878 HydrophobicContact CG1-CZ 3.73Å; V851-F878 WeakPolarHBondContact O-CZ 3.4Å; V851-H882 HydrophobicContact CG1-CB 3.82Å; V851-H882 HydrophobicContact CG2-CB 4.43Å
852	M	93	Very high	93.2	Very high	133 Å²	133	52.2 Å²	52.2	66%	0.655	24%	0.239	S	C	*	.	H	α-helix	trans	-64.2	-37.7	-178.3	-68.5	-57.9	-71.9	0	0	112.6	L850 N856	L850-M852 PolarHBondContact O-N 3.4Å; M852-N856 PolarHBondContact O-N 2.92Å; M852-N856 PolarHBondContact O-ND2 3.2Å
853	K	93.8	Very high	93.1	Very high	118 Å²	118	60.3 Å²	60.3	51%	0.513	27%	0.274	S	S	.	.	H	α-helix	trans	-68.9	-48.3	174.8	-70.2	-176.5	179.6	176.8	0	110	F845 L850 V851 R855 N856 W857	F845-K853 HydrophobicContact CD1-CB 4.35Å; F845-K853 HydrophobicContact CE1-CD 4.3Å; F845-K853 HydrophobicContact CG-CB 4.26Å; L850-K853 HydrophobicContact CB-CB 4.28Å; L850-K853 HydrophobicContact CD1-CD 4.35Å; L850-K853 PolarHBondContact O-N 3.04Å; L850-K853 VanDerWaalsContact O-N 3.14Å; V851-K853 VanDerWaalsContact C-N 3.33Å; V851-K853 PolarHBondContact O-N 3.41Å; K853-R855 VanDerWaalsContact C-N 3.3Å; K853-R855 PolarHBondContact O-N 3.09Å; K853-N856 PolarHBondContact O-N 3.05Å; K853-N856 VanDerWaalsContact O-N 3.12Å; K853-W857 PolarHBondContact O-N 3.29Å
854	A	94.6	Very high	92.9	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-53.9	-46.1	178.5	0	0	0	0	0	111.8	F845 W846 L850 V851 N856 W857 F858 F878	F845-A854 HydrophobicContact CB-CB 3.91Å; W846-A854 HydrophobicContact CB-CB 4.34Å; L850-A854 PolarHBondContact O-N 3.44Å; V851-A854 PolarHBondContact O-N 3.31Å; A854-N856 PolarHBondContact O-N 2.89Å; A854-W857 PolarHBondContact O-N 2.89Å; A854-F858 HydrophobicContact CB-CD2 4.46Å; A854-F858 HydrophobicContact CB-CE2 4.37Å; A854-F858 WeakPolarHBondContact O-CD2 3.4Å; A854-F858 PolarHBondContact O-N 3.3Å; A854-F878 HydrophobicContact CB-CE2 3.8Å; A854-F878 HydrophobicContact CB-CZ 4.02Å
855	R	94.6	Very high	92.7	Very high	33 Å²	33	66.3 Å²	66.3	13%	0.125	30%	0.304	C	S	.	.	H	α-helix	trans	-58.8	-44.4	176.6	-174	171.1	-69.2	115.5	-1.5	113.2	V851 K853 W857 F858 T859 F878 E879 H882	V851-R855 PolarHBondContact O-N 3.39Å; K853-R855 VanDerWaalsContact C-N 3.3Å; K853-R855 PolarHBondContact O-N 3.09Å; R855-W857 VanDerWaalsContact C-N 3.34Å; R855-W857 PolarHBondContact O-N 3.1Å; R855-F858 PolarHBondContact O-N 3.16Å; R855-T859 WeakPolarHBondContact O-CB 3.29Å; R855-T859 PolarHBondContact O-N 3.36Å; R855-T859 PolarHBondContact O-OG1 3.2Å; R855-F878 HydrophobicContact CB-CE1 3.8Å; R855-F878 HydrophobicContact CB-CZ 4.06Å; R855-F878 HydrophobicContact CG-CE1 4.31Å; R855-E879 WeakPolarHBondContact CD-OE1 3.46Å; R855-E879 IonicContact CZ-OE1 2.78Å; R855-E879 IonicContact CZ-OE2 2.85Å; R855-E879 IonicContact NE-OE1 2.79Å; R855-E879 PolarHBondContact NE-OE1 3.2Å; R855-E879 IonicContact NE-OE2 2.71Å; R855-E879 PolarHBondContact NE-OE2 3.44Å; R855-E879 IonicContact NH2-OE1 3.08Å; R855-E879 IonicContact NH2-OE2 2.92Å; R855-E879 PolarHBondContact NH2-OE2 3.31Å; R855-H882 PolarHBondContact NH2-O 3.15Å
856	N	94.8	Very high	92.5	Very high	103 Å²	103	67.7 Å²	67.7	55%	0.551	32%	0.316	S	S	*	.	H	α-helix	trans	-64	-40.2	177.4	-71.7	-13.7	0	0	0	111.6	M852 K853 A854 R860	M852-N856 PolarHBondContact O-N 2.92Å; M852-N856 PolarHBondContact O-ND2 3.2Å; K853-N856 PolarHBondContact O-N 3.05Å; K853-N856 VanDerWaalsContact O-N 3.12Å; A854-N856 PolarHBondContact O-N 2.89Å; N856-R860 WeakPolarHBondContact O-CB 3.37Å; N856-R860 PolarHBondContact O-N 3.19Å
857	W	94.5	Very high	92.4	Very high	46 Å²	46	69.2 Å²	69.2	17%	0.174	32%	0.324	C	S	.	.	H	α-helix	trans	-71	-39	177.1	-76.7	98.2	0	0	0	112.6	L828 L838 V841 S842 F845 K853 A854 R855 R860 T861	L828-W857 HydrophobicContact CD1-CH2 3.68Å; L828-W857 HydrophobicContact CD1-CZ3 4.13Å; L828-W857 HydrophobicContact CD2-CH2 4.44Å; L828-W857 HydrophobicContact CD2-CZ3 4.15Å; L838-W857 HydrophobicContact CD2-CE3 3.81Å; L838-W857 HydrophobicContact CD2-CZ3 3.44Å; L838-W857 VanDerWaalsContact CD2-CZ3 3.44Å; V841-W857 HydrophobicContact CB-CE3 4.33Å; V841-W857 HydrophobicContact CG1-CD2 3.75Å; V841-W857 HydrophobicContact CG1-CE3 3.77Å; V841-W857 HydrophobicContact CG1-CG 4.23Å; V841-W857 HydrophobicContact CG1-CH2 4.29Å; V841-W857 HydrophobicContact CG1-CZ2 4.28Å; V841-W857 HydrophobicContact CG1-CZ3 4.03Å; S842-W857 VanDerWaalsContact OG-CB 3.28Å; S842-W857 WeakPolarHBondContact OG-CB 3.44Å; S842-W857 PolarHBondContact OG-O 3.14Å; F845-W857 AromaticContact CD2-CD1 3.42Å; F845-W857 VanDerWaalsContact CD2-CD1 3.42Å; F845-W857 HydrophobicContact CD2-CG 4.01Å; F845-W857 AromaticContact CD2-NE1 3.76Å; F845-W857 AromaticContact CE2-CD1 3.4Å; F845-W857 HydrophobicContact CE2-CD2 4.25Å; F845-W857 AromaticContact CE2-CE2 3.74Å; F845-W857 HydrophobicContact CE2-CG 4.09Å; F845-W857 HydrophobicContact CE2-CZ2 4.37Å; F845-W857 AromaticContact CE2-NE1 3.19Å; K853-W857 PolarHBondContact O-N 3.29Å; A854-W857 PolarHBondContact O-N 2.89Å; R855-W857 VanDerWaalsContact C-N 3.34Å; R855-W857 PolarHBondContact O-N 3.1Å; W857-R860 WeakPolarHBondContact O-CB 3.34Å; W857-R860 PolarHBondContact O-N 3.29Å; W857-T861 WeakPolarHBondContact O-CB 3.36Å; W857-T861 PolarHBondContact O-N 3.39Å; W857-T861 PolarHBondContact O-OG1 3.26Å
858	F	95	Very high	92.4	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.1	-46.7	171.5	-80.5	-60.3	0	0	0	111.2	L839 S842 W846 A854 R855 R860 T861 V862 F875 F878	L839-F858 HydrophobicContact CD1-CD1 4.36Å; L839-F858 HydrophobicContact CD1-CE1 3.89Å; S842-F858 PolarHBondContact OG-N 2.94Å; W846-F858 HydrophobicContact CE3-CE2 4.42Å; W846-F858 HydrophobicContact CE3-CZ 4.03Å; A854-F858 HydrophobicContact CB-CD2 4.46Å; A854-F858 HydrophobicContact CB-CE2 4.37Å; A854-F858 WeakPolarHBondContact O-CD2 3.4Å; A854-F858 PolarHBondContact O-N 3.3Å; R855-F858 PolarHBondContact O-N 3.16Å; F858-R860 VanDerWaalsContact C-N 3.28Å; F858-R860 PolarHBondContact O-N 2.91Å; F858-T861 WeakPolarHBondContact O-CB 3.17Å; F858-T861 PolarHBondContact O-N 3.35Å; F858-T861 VanDerWaalsContact O-N 3.07Å; F858-V862 WeakPolarHBondContact O-CG2 3.33Å; F858-V862 PolarHBondContact O-N 3.31Å; F858-F875 HydrophobicContact CB-CB 4.34Å; F858-F875 HydrophobicContact CB-CD1 4.43Å; F858-F875 HydrophobicContact CB-CD2 3.41Å; F858-F875 VanDerWaalsContact CB-CD2 3.41Å; F858-F875 HydrophobicContact CB-CE2 3.68Å; F858-F875 HydrophobicContact CB-CG 3.84Å; F858-F875 HydrophobicContact CB-CZ 4.29Å; F858-F875 HydrophobicContact CD1-CB 4Å; F858-F875 HydrophobicContact CD1-CD2 4.36Å; F858-F875 HydrophobicContact CD1-CG 4.41Å; F858-F875 HydrophobicContact CD2-CD2 4.09Å; F858-F875 HydrophobicContact CG-CB 4.24Å; F858-F875 AromaticContact CG-CD2 3.73Å; F858-F875 HydrophobicContact CG-CD2 3.73Å; F858-F875 HydrophobicContact CG-CE2 4.38Å; F858-F875 HydrophobicContact CG-CG 4.18Å; F858-F878 HydrophobicContact CD2-CB 4.26Å; F858-F878 AromaticContact CD2-CD1 3.8Å; F858-F878 HydrophobicContact CD2-CD1 3.8Å; F858-F878 HydrophobicContact CD2-CD2 4.4Å; F858-F878 HydrophobicContact CD2-CE1 4.25Å; F858-F878 AromaticContact CD2-CG 3.88Å; F858-F878 HydrophobicContact CD2-CG 3.88Å; F858-F878 HydrophobicContact CE2-CB 3.72Å; F858-F878 HydrophobicContact CE2-CD1 4Å; F858-F878 AromaticContact CE2-CD2 3.87Å; F858-F878 HydrophobicContact CE2-CD2 3.87Å; F858-F878 AromaticContact CE2-CG 3.57Å; F858-F878 HydrophobicContact CE2-CG 3.57Å; F858-F878 HydrophobicContact CZ-CB 4.21Å
859	T	94.5	Very high	92.4	Very high	51 Å²	51	65.7 Å²	65.7	31%	0.313	31%	0.305	S	S	.	.	H	α-helix	trans	-58.9	-40.4	176.5	-59.3	0	0	0	0	111.8	R855 V862 K863	R855-T859 WeakPolarHBondContact O-CB 3.29Å; R855-T859 PolarHBondContact O-N 3.36Å; R855-T859 PolarHBondContact O-OG1 3.2Å; T859-V862 WeakPolarHBondContact O-CG2 3.34Å; T859-K863 VanDerWaalsContact O-CB 3.28Å; T859-K863 WeakPolarHBondContact O-CB 3.45Å; T859-K863 PolarHBondContact O-N 3.25Å; T859-K863 VanDerWaalsContact O-N 3.1Å
860	R	93.1	Very high	92.5	Very high	143 Å²	143	56.4 Å²	56.4	54%	0.54	27%	0.271	S	S	.	.	H	α-helix	trans	-64.2	-43.7	173.9	-174.5	-178.6	-70	-176.6	-5.7	111.6	L838 N856 W857 F858 K863 L864	L838-R860 HydrophobicContact CD1-CG 4.29Å; N856-R860 WeakPolarHBondContact O-CB 3.37Å; N856-R860 PolarHBondContact O-N 3.19Å; W857-R860 WeakPolarHBondContact O-CB 3.34Å; W857-R860 PolarHBondContact O-N 3.29Å; F858-R860 VanDerWaalsContact C-N 3.28Å; F858-R860 PolarHBondContact O-N 2.91Å; R860-K863 PolarHBondContact O-N 3.28Å; R860-L864 PolarHBondContact O-N 3.41Å
861	T	93.1	Very high	92.5	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59.5	-51.8	179.3	-53.9	0	0	0	0	111.1	P835 L838 L839 S842 W857 F858 K863 L864 E865 A871	P835-T861 WeakPolarHBondContact O-CG2 3.16Å; L838-T861 HydrophobicContact CB-CG2 4.24Å; L838-T861 WeakPolarHBondContact CB-OG1 3.34Å; L839-T861 HydrophobicContact CB-CG2 4.06Å; S842-T861 PolarHBondContact OG-OG1 3.02Å; W857-T861 WeakPolarHBondContact O-CB 3.36Å; W857-T861 PolarHBondContact O-N 3.39Å; W857-T861 PolarHBondContact O-OG1 3.26Å; F858-T861 WeakPolarHBondContact O-CB 3.17Å; F858-T861 PolarHBondContact O-N 3.35Å; F858-T861 VanDerWaalsContact O-N 3.07Å; T861-K863 VanDerWaalsContact C-N 3.28Å; T861-K863 PolarHBondContact O-N 3.36Å; T861-L864 PolarHBondContact O-N 3.47Å; T861-E865 PolarHBondContact O-N 3.46Å; T861-E865 VanDerWaalsContact O-N 3.15Å; T861-A871 HydrophobicContact CG2-CB 3.83Å
862	V	93.3	Very high	92.5	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.006	24%	0.243	C	C	.	.	H	α-helix	trans	-72.8	-18.8	-178.9	-60.8	0	0	0	0	113.8	F858 T859 P866 A871 W872 F875	F858-V862 WeakPolarHBondContact O-CG2 3.33Å; F858-V862 PolarHBondContact O-N 3.31Å; T859-V862 WeakPolarHBondContact O-CG2 3.34Å; V862-P866 WeakPolarHBondContact O-CA 3.23Å; V862-P866 WeakPolarHBondContact O-CG 3.23Å; V862-A871 HydrophobicContact CG1-CB 4.28Å; V862-W872 HydrophobicContact CB-CH2 3.7Å; V862-W872 HydrophobicContact CB-CZ2 3.7Å; V862-W872 HydrophobicContact CB-CZ3 4.14Å; V862-W872 HydrophobicContact CG1-CD2 3.96Å; V862-W872 HydrophobicContact CG1-CE3 3.99Å; V862-W872 HydrophobicContact CG1-CH2 4.07Å; V862-W872 HydrophobicContact CG1-CZ2 4.08Å; V862-W872 HydrophobicContact CG1-CZ3 4.04Å; V862-W872 HydrophobicContact CG2-CH2 3.91Å; V862-W872 HydrophobicContact CG2-CZ2 4.39Å; V862-W872 HydrophobicContact CG2-CZ3 4.24Å; V862-F875 HydrophobicContact CG1-CD1 4Å; V862-F875 HydrophobicContact CG2-CD1 4.34Å; V862-F875 HydrophobicContact CG2-CE1 4.18Å
863	K	91.4	Very high	92.5	Very high	170 Å²	170	45 Å²	45	74%	0.739	21%	0.212	S	C	*	.	H	α-helix	trans	-80	-35.4	173.5	-175.8	174.9	-179.6	178.8	0	111.4	T859 R860 T861	T859-K863 VanDerWaalsContact O-CB 3.28Å; T859-K863 WeakPolarHBondContact O-CB 3.45Å; T859-K863 PolarHBondContact O-N 3.25Å; T859-K863 VanDerWaalsContact O-N 3.1Å; R860-K863 PolarHBondContact O-N 3.28Å; T861-K863 VanDerWaalsContact C-N 3.28Å; T861-K863 PolarHBondContact O-N 3.36Å
864	L	90.8	Very high	92.5	Very high	71 Å²	71	40.6 Å²	40.6	37%	0.372	19%	0.192	S	C	.	.	H	α-helix	trans	-68.4	-51.7	177.6	-175.3	69.5	0	0	0	110.8	H833 L838 R860 T861	H833-L864 WeakPolarHBondContact O-CD2 3.49Å; L838-L864 HydrophobicContact CD1-CB 4.44Å; L838-L864 HydrophobicContact CD1-CD2 3.55Å; R860-L864 PolarHBondContact O-N 3.41Å; T861-L864 PolarHBondContact O-N 3.47Å
865	E	88	Confident	92.4	Very high	82 Å²	82	40.8 Å²	40.8	38%	0.383	19%	0.193	S	C	.	.			trans	-134.4	91.9	179.5	-168	61.7	-117.7	0	0	110.4	P835 T861 D867 L868	P835-E865 HydrophobicContact CB-CB 3.84Å; P835-E865 HydrophobicContact CG-CB 4.05Å; P835-E865 HydrophobicContact CG-CG 4.42Å; T861-E865 PolarHBondContact O-N 3.46Å; T861-E865 VanDerWaalsContact O-N 3.15Å; E865-D867 HydrophobicContact CG-CB 4.41Å; E865-D867 PolarHBondContact O-N 3.41Å; E865-D867 WeakPolarHBondContact OE1-CB 3.15Å; E865-L868 HydrophobicContact CG-CB 4.28Å
866	P	89.7	Confident	92.4	Very high	55 Å²	55	40.7 Å²	40.7	36%	0.357	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-17	175.6	-19.3	31.3	0	0	0	113.5	V862 L868 W872 A898	V862-P866 WeakPolarHBondContact O-CA 3.23Å; V862-P866 WeakPolarHBondContact O-CG 3.23Å; P866-L868 VanDerWaalsContact C-N 3.34Å; P866-W872 PolarHBondContact O-NE1 3.43Å; P866-A898 HydrophobicContact CB-CB 3.89Å
867	D	90.5	Very high	92.3	Very high	40 Å²	40	38.2 Å²	38.2	21%	0.214	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-12.8	-175.8	-163.5	14.5	0	0	0	113.6	E865 G869 P900 H901 H902	E865-D867 HydrophobicContact CG-CB 4.41Å; E865-D867 PolarHBondContact O-N 3.41Å; E865-D867 WeakPolarHBondContact OE1-CB 3.15Å; D867-G869 PolarHBondContact O-N 3.38Å; D867-G869 VanDerWaalsContact O-N 3.13Å; D867-P900 VanDerWaalsContact O-CB 3.27Å; D867-P900 WeakPolarHBondContact O-CB 3.34Å; D867-H901 PolarHBondContact O-N 3.36Å; D867-H901 VanDerWaalsContact O-N 3.15Å; D867-H901 WeakPolarHBondContact OD1-CB 2.87Å; D867-H901 IonicContact OD1-CG 3.72Å; D867-H901 PolarHBondContact OD1-N 2.85Å; D867-H902 PolarHBondContact O-N 2.89Å; D867-H902 IonicContact OD1-ND1 2.8Å; D867-H902 IonicContact OD2-CE1 2.72Å; D867-H902 PolarHBondContact OD2-CE1 3.14Å; D867-H902 IonicContact OD2-CG 3.67Å; D867-H902 IonicContact OD2-ND1 3.9Å; D867-H902 PolarHBondContact OD2-ND1 2.93Å
868	L	90.8	Very high	92.3	Very high	14 Å²	14	36 Å²	36	7%	0.073	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-79.4	97	179.4	-173.9	65.7	0	0	0	111.1	P835 L836 L839 E865 P866 D870 A871	P835-L868 HydrophobicContact CB-CD2 3.99Å; P835-L868 HydrophobicContact CG-CD2 4.44Å; L836-L868 HydrophobicContact CD2-CD1 4.16Å; L836-L868 HydrophobicContact CD2-CD2 3.83Å; L839-L868 HydrophobicContact CD2-CD2 4.34Å; E865-L868 HydrophobicContact CG-CB 4.28Å; P866-L868 VanDerWaalsContact C-N 3.34Å; L868-D870 VanDerWaalsContact C-N 3.3Å; L868-D870 PolarHBondContact O-N 3.23Å; L868-A871 HydrophobicContact CB-CB 4.29Å; L868-A871 HydrophobicContact CD2-CB 3.98Å; L868-A871 HydrophobicContact CG-CB 4.12Å; L868-A871 WeakPolarHBondContact O-CB 3.18Å; L868-A871 PolarHBondContact O-N 2.96Å; L868-A871 VanDerWaalsContact O-N 3.11Å
869	G	90	Very high	92.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.3	-32.6	-179.2	0	0	0	0	0	114.4	D867 A871 W872 A873 H902	D867-G869 PolarHBondContact O-N 3.38Å; D867-G869 VanDerWaalsContact O-N 3.13Å; G869-A871 VanDerWaalsContact C-N 3.29Å; G869-A871 PolarHBondContact O-N 3.01Å; G869-W872 PolarHBondContact O-N 3.47Å; G869-A873 PolarHBondContact O-N 3.2Å; G869-H902 WeakPolarHBondContact CA-O 3.43Å; G869-H902 PolarHBondContact N-O 3.36Å
870	D	90.1	Very high	92.1	Very high	14 Å²	14	37.8 Å²	37.8	8%	0.075	18%	0.176	C	C	.	.	H	α-helix	trans	-62.2	-39.1	175.5	-67	-8.9	0	0	0	111	L839 L868 W872 A873 Y874 G903 E904 V905 W906	L839-D870 HydrophobicContact CD2-CB 4.26Å; L868-D870 VanDerWaalsContact C-N 3.3Å; L868-D870 PolarHBondContact O-N 3.23Å; D870-W872 VanDerWaalsContact C-N 3.33Å; D870-W872 PolarHBondContact O-N 3.38Å; D870-A873 PolarHBondContact O-N 3.3Å; D870-Y874 WeakPolarHBondContact O-CD2 3.38Å; D870-Y874 PolarHBondContact O-N 3.48Å; D870-G903 VanDerWaalsContact CG-CA 3.47Å; D870-G903 VanDerWaalsContact OD2-CA 3.31Å; D870-G903 WeakPolarHBondContact OD2-CA 3.42Å; D870-E904 PolarHBondContact OD1-N 3.38Å; D870-E904 PolarHBondContact OD2-N 2.85Å; D870-V905 WeakPolarHBondContact OD1-CB 3.47Å; D870-V905 PolarHBondContact OD1-N 3.16Å; D870-V905 VanDerWaalsContact OD1-N 3.11Å; D870-W906 PolarHBondContact OD1-N 3.24Å
871	A	92.7	Very high	92	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63	-41.2	178.3	0	0	0	0	0	111.6	L839 T861 V862 L868 G869 F875	L839-A871 HydrophobicContact CD1-CB 4.21Å; L839-A871 HydrophobicContact CD2-CB 4.37Å; T861-A871 HydrophobicContact CG2-CB 3.83Å; V862-A871 HydrophobicContact CG1-CB 4.28Å; L868-A871 HydrophobicContact CB-CB 4.29Å; L868-A871 HydrophobicContact CD2-CB 3.98Å; L868-A871 HydrophobicContact CG-CB 4.12Å; L868-A871 WeakPolarHBondContact O-CB 3.18Å; L868-A871 PolarHBondContact O-N 2.96Å; L868-A871 VanDerWaalsContact O-N 3.11Å; G869-A871 VanDerWaalsContact C-N 3.29Å; G869-A871 PolarHBondContact O-N 3.01Å; A871-F875 WeakPolarHBondContact O-CB 3.47Å; A871-F875 PolarHBondContact O-N 3.42Å
872	W	94	Very high	91.9	Very high	3 Å²	3	39.6 Å²	39.6	1%	0.011	19%	0.19	C	C	.	.	H	α-helix	trans	-64.4	-40.9	173.9	-68.7	107.7	0	0	0	112.6	V862 P866 G869 D870 F875 Y876 V891 R894 C895 A898 L924	V862-W872 HydrophobicContact CB-CH2 3.7Å; V862-W872 HydrophobicContact CB-CZ2 3.7Å; V862-W872 HydrophobicContact CB-CZ3 4.14Å; V862-W872 HydrophobicContact CG1-CD2 3.96Å; V862-W872 HydrophobicContact CG1-CE3 3.99Å; V862-W872 HydrophobicContact CG1-CH2 4.07Å; V862-W872 HydrophobicContact CG1-CZ2 4.08Å; V862-W872 HydrophobicContact CG1-CZ3 4.04Å; V862-W872 HydrophobicContact CG2-CH2 3.91Å; V862-W872 HydrophobicContact CG2-CZ2 4.39Å; V862-W872 HydrophobicContact CG2-CZ3 4.24Å; P866-W872 PolarHBondContact O-NE1 3.43Å; G869-W872 PolarHBondContact O-N 3.47Å; D870-W872 VanDerWaalsContact C-N 3.33Å; D870-W872 PolarHBondContact O-N 3.38Å; W872-F875 HydrophobicContact CE3-CD1 4.3Å; W872-F875 HydrophobicContact CZ3-CD1 4.23Å; W872-F875 PolarHBondContact O-N 2.78Å; W872-Y876 VanDerWaalsContact O-CB 3.3Å; W872-Y876 WeakPolarHBondContact O-CB 3.47Å; W872-Y876 PolarHBondContact O-N 2.85Å; W872-V891 HydrophobicContact CE3-CG1 3.88Å; W872-V891 HydrophobicContact CZ3-CG1 4.13Å; W872-R894 HydrophobicContact CH2-CB 3.5Å; W872-R894 VanDerWaalsContact CH2-CB 3.5Å; W872-R894 HydrophobicContact CZ2-CB 4.49Å; W872-R894 HydrophobicContact CZ3-CB 3.72Å; W872-C895 HydrophobicContact CB-CB 4.39Å; W872-C895 HydrophobicContact CD2-CB 3.84Å; W872-C895 HydrophobicContact CE3-CB 3.81Å; W872-C895 HydrophobicContact CG-CB 4.11Å; W872-C895 HydrophobicContact CZ3-CB 4.43Å; W872-A898 HydrophobicContact CZ2-CB 4.14Å; W872-L924 HydrophobicContact CB-CD1 3.91Å
873	A	92.8	Very high	91.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-68.1	-42.6	-178.8	0	0	0	0	0	112.1	G869 D870 K877 L924 A927 I931	G869-A873 PolarHBondContact O-N 3.2Å; D870-A873 PolarHBondContact O-N 3.3Å; A873-K877 WeakPolarHBondContact O-CB 3.45Å; A873-K877 PolarHBondContact O-N 3.21Å; A873-L924 HydrophobicContact CB-CD1 4.38Å; A873-A927 HydrophobicContact CB-CB 3.59Å; A873-I931 HydrophobicContact CB-CD1 3.26Å
874	Y	93.5	Very high	91.8	Very high	26 Å²	26	36.2 Å²	36.2	10%	0.102	19%	0.188	C	C	.	.	H	α-helix	trans	-64.6	-40.4	170.6	-77.9	-76	0	0	0	112	L839 K843 W846 D870 K877 F878 I931	L839-Y874 HydrophobicContact CD1-CD2 3.94Å; L839-Y874 HydrophobicContact CD1-CG 4.19Å; L839-Y874 HydrophobicContact CD2-CD2 3.95Å; L839-Y874 HydrophobicContact CD2-CE2 4.3Å; L839-Y874 HydrophobicContact CG-CD2 4.25Å; K843-Y874 HydrophobicContact CD-CD1 3.69Å; K843-Y874 HydrophobicContact CD-CD2 4.25Å; K843-Y874 HydrophobicContact CD-CE1 3.4Å; K843-Y874 VanDerWaalsContact CD-CE1 3.4Å; K843-Y874 HydrophobicContact CD-CE2 4.06Å; K843-Y874 HydrophobicContact CD-CG 4.12Å; K843-Y874 HydrophobicContact CG-CD1 3.95Å; K843-Y874 HydrophobicContact CG-CE1 4.14Å; K843-Y874 HydrophobicContact CG-CG 4.32Å; W846-Y874 HydrophobicContact CZ3-CD1 4.21Å; D870-Y874 WeakPolarHBondContact O-CD2 3.38Å; D870-Y874 PolarHBondContact O-N 3.48Å; Y874-K877 PolarHBondContact O-N 3.05Å; Y874-F878 WeakPolarHBondContact O-CB 3.22Å; Y874-F878 PolarHBondContact O-N 3.38Å; Y874-I931 HydrophobicContact CD1-CG2 3.53Å; Y874-I931 HydrophobicContact CD2-CD1 4.15Å; Y874-I931 HydrophobicContact CE1-CG2 3.08Å; Y874-I931 HydrophobicContact CE2-CD1 4.13Å; Y874-I931 HydrophobicContact CE2-CG2 4.2Å; Y874-I931 HydrophobicContact CG-CD1 4.38Å; Y874-I931 HydrophobicContact CG-CG2 4.26Å; Y874-I931 VanDerWaalsContact CZ-CG2 3.45Å
875	F	93.9	Very high	91.8	Very high	5 Å²	5	39 Å²	39	2%	0.022	20%	0.199	C	C	.	.	H	α-helix	trans	-67.6	-42	-178.8	-173.5	-157.1	0	0	0	111.9	F858 V862 A871 W872 F878 E879 V891	F858-F875 HydrophobicContact CB-CB 4.34Å; F858-F875 HydrophobicContact CB-CD1 4.43Å; F858-F875 HydrophobicContact CB-CD2 3.41Å; F858-F875 VanDerWaalsContact CB-CD2 3.41Å; F858-F875 HydrophobicContact CB-CE2 3.68Å; F858-F875 HydrophobicContact CB-CG 3.84Å; F858-F875 HydrophobicContact CB-CZ 4.29Å; F858-F875 HydrophobicContact CD1-CB 4Å; F858-F875 HydrophobicContact CD1-CD2 4.36Å; F858-F875 HydrophobicContact CD1-CG 4.41Å; F858-F875 HydrophobicContact CD2-CD2 4.09Å; F858-F875 HydrophobicContact CG-CB 4.24Å; F858-F875 AromaticContact CG-CD2 3.73Å; F858-F875 HydrophobicContact CG-CD2 3.73Å; F858-F875 HydrophobicContact CG-CE2 4.38Å; F858-F875 HydrophobicContact CG-CG 4.18Å; V862-F875 HydrophobicContact CG1-CD1 4Å; V862-F875 HydrophobicContact CG2-CD1 4.34Å; V862-F875 HydrophobicContact CG2-CE1 4.18Å; A871-F875 WeakPolarHBondContact O-CB 3.47Å; A871-F875 PolarHBondContact O-N 3.42Å; W872-F875 HydrophobicContact CE3-CD1 4.3Å; W872-F875 HydrophobicContact CZ3-CD1 4.23Å; W872-F875 PolarHBondContact O-N 2.78Å; F875-F878 HydrophobicContact CD2-CD1 4.1Å; F875-F878 HydrophobicContact CE2-CD1 4.29Å; F875-F878 WeakPolarHBondContact O-CB 3.47Å; F875-F878 PolarHBondContact O-N 3.12Å; F875-E879 HydrophobicContact CD2-CG 4.06Å; F875-E879 HydrophobicContact CE2-CG 3.81Å; F875-E879 WeakPolarHBondContact CE2-OE1 3.47Å; F875-E879 PolarHBondContact O-N 2.74Å; F875-V891 HydrophobicContact CB-CG1 4.4Å; F875-V891 HydrophobicContact CD1-CB 4.31Å; F875-V891 HydrophobicContact CD1-CG1 3.64Å; F875-V891 HydrophobicContact CD1-CG2 3.66Å; F875-V891 HydrophobicContact CD2-CG2 4.3Å; F875-V891 HydrophobicContact CE1-CB 4.34Å; F875-V891 HydrophobicContact CE1-CG1 4.14Å; F875-V891 HydrophobicContact CE1-CG2 3.32Å; F875-V891 HydrophobicContact CE2-CG2 4Å; F875-V891 HydrophobicContact CG-CG1 4.06Å; F875-V891 HydrophobicContact CG-CG2 4.14Å; F875-V891 HydrophobicContact CZ-CG2 3.51Å
876	Y	93.4	Very high	92	Very high	31 Å²	31	40.7 Å²	40.7	12%	0.122	21%	0.211	C	C	.	.	H	α-helix	trans	-64.3	-43.3	175.1	-174	-119.1	0	0	0	111.2	W872 F878 E879 L880 Q888 V891 L924 K925 A928	W872-Y876 VanDerWaalsContact O-CB 3.3Å; W872-Y876 WeakPolarHBondContact O-CB 3.47Å; W872-Y876 PolarHBondContact O-N 2.85Å; Y876-F878 VanDerWaalsContact C-N 3.32Å; Y876-F878 PolarHBondContact O-N 3.04Å; Y876-E879 PolarHBondContact O-N 2.81Å; Y876-L880 HydrophobicContact CD1-CD1 3.9Å; Y876-L880 HydrophobicContact CD1-CG 4.45Å; Y876-L880 HydrophobicContact CE1-CD1 3.63Å; Y876-L880 HydrophobicContact CE1-CD2 4.49Å; Y876-L880 HydrophobicContact CE1-CG 4.19Å; Y876-L880 HydrophobicContact CE2-CD2 4.44Å; Y876-L880 HydrophobicContact CE2-CG 4.4Å; Y876-L880 VanDerWaalsContact O-CG 3.31Å; Y876-L880 WeakPolarHBondContact O-CG 3.16Å; Y876-L880 PolarHBondContact O-N 3.28Å; Y876-Q888 HydrophobicContact CE2-CB 4.35Å; Y876-V891 HydrophobicContact CD2-CG1 4.48Å; Y876-L924 HydrophobicContact CD1-CD2 4.34Å; Y876-L924 HydrophobicContact CD1-CG 4.12Å; Y876-L924 HydrophobicContact CD2-CD2 4.47Å; Y876-L924 HydrophobicContact CG-CD2 4.14Å; Y876-L924 HydrophobicContact CG-CG 4.27Å; Y876-K925 HydrophobicContact CE1-CG 4.44Å; Y876-A928 HydrophobicContact CD1-CB 3.75Å; Y876-A928 HydrophobicContact CE1-CB 4.47Å
877	K	92.9	Very high	92.1	Very high	51 Å²	51	41.2 Å²	41.2	22%	0.222	21%	0.208	C	C	.	.	H	α-helix	trans	-61.2	-39.2	174.3	-164.9	-178.9	-171.6	118.6	0	112.5	W846 A873 Y874 L880 Q881 A928 I931	W846-K877 HydrophobicContact CH2-CB 4.04Å; W846-K877 HydrophobicContact CH2-CD 3.98Å; W846-K877 HydrophobicContact CH2-CG 3.88Å; A873-K877 WeakPolarHBondContact O-CB 3.45Å; A873-K877 PolarHBondContact O-N 3.21Å; Y874-K877 PolarHBondContact O-N 3.05Å; K877-L880 PolarHBondContact O-N 2.79Å; K877-Q881 PolarHBondContact O-N 3.39Å; K877-A928 HydrophobicContact CB-CB 4.31Å; K877-A928 WeakPolarHBondContact CD-O 3.25Å; K877-A928 PolarHBondContact NZ-O 2.88Å; K877-I931 HydrophobicContact CD-CG2 4.41Å; K877-I931 WeakPolarHBondContact CE-O 3.43Å; K877-I931 PolarHBondContact NZ-O 3.41Å
878	F	93.9	Very high	92.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63.2	-46.1	175.4	165.7	-98.6	0	0	0	112.1	W846 V851 A854 R855 F858 Y874 F875 Y876 L880 Q881 H882	W846-F878 HydrophobicContact CB-CD2 4.42Å; W846-F878 AromaticContact CD1-CD2 3.81Å; W846-F878 HydrophobicContact CD2-CB 4.3Å; W846-F878 AromaticContact CD2-CD2 3.96Å; W846-F878 HydrophobicContact CD2-CD2 3.96Å; W846-F878 HydrophobicContact CE3-CB 4.25Å; W846-F878 AromaticContact CG-CD2 3.83Å; W846-F878 HydrophobicContact CG-CD2 3.83Å; W846-F878 HydrophobicContact CG-CE2 4.44Å; W846-F878 HydrophobicContact CH2-CB 4.3Å; W846-F878 HydrophobicContact CZ2-CB 4.31Å; W846-F878 HydrophobicContact CZ3-CB 4.25Å; W846-F878 AromaticContact NE1-CD2 3.94Å; V851-F878 HydrophobicContact CG1-CE2 4.12Å; V851-F878 HydrophobicContact CG1-CZ 3.73Å; V851-F878 WeakPolarHBondContact O-CZ 3.4Å; A854-F878 HydrophobicContact CB-CE2 3.8Å; A854-F878 HydrophobicContact CB-CZ 4.02Å; R855-F878 HydrophobicContact CB-CE1 3.8Å; R855-F878 HydrophobicContact CB-CZ 4.06Å; R855-F878 HydrophobicContact CG-CE1 4.31Å; F858-F878 HydrophobicContact CD2-CB 4.26Å; F858-F878 AromaticContact CD2-CD1 3.8Å; F858-F878 HydrophobicContact CD2-CD1 3.8Å; F858-F878 HydrophobicContact CD2-CD2 4.4Å; F858-F878 HydrophobicContact CD2-CE1 4.25Å; F858-F878 AromaticContact CD2-CG 3.88Å; F858-F878 HydrophobicContact CD2-CG 3.88Å; F858-F878 HydrophobicContact CE2-CB 3.72Å; F858-F878 HydrophobicContact CE2-CD1 4Å; F858-F878 AromaticContact CE2-CD2 3.87Å; F858-F878 HydrophobicContact CE2-CD2 3.87Å; F858-F878 AromaticContact CE2-CG 3.57Å; F858-F878 HydrophobicContact CE2-CG 3.57Å; F858-F878 HydrophobicContact CZ-CB 4.21Å; Y874-F878 WeakPolarHBondContact O-CB 3.22Å; Y874-F878 PolarHBondContact O-N 3.38Å; F875-F878 HydrophobicContact CD2-CD1 4.1Å; F875-F878 HydrophobicContact CE2-CD1 4.29Å; F875-F878 WeakPolarHBondContact O-CB 3.47Å; F875-F878 PolarHBondContact O-N 3.12Å; Y876-F878 VanDerWaalsContact C-N 3.32Å; Y876-F878 PolarHBondContact O-N 3.04Å; F878-L880 VanDerWaalsContact C-N 3.34Å; F878-Q881 PolarHBondContact O-N 3.11Å; F878-Q881 VanDerWaalsContact O-N 3.16Å; F878-H882 AromaticContact CD2-CD2 3.79Å; F878-H882 HydrophobicContact CE2-CB 4.29Å; F878-H882 AromaticContact CE2-CD2 3.73Å; F878-H882 HydrophobicContact CZ-CB 4.49Å; F878-H882 PolarHBondContact O-N 3.35Å
879	E	94	Very high	92.2	Very high	3 Å²	3	46.4 Å²	46.4	1%	0.014	23%	0.229	C	C	.	.	H	α-helix	trans	-72.7	-25.7	178.2	-64.3	-62.1	179	0	0	113	R855 F875 Y876 Q881 G883 Q887 Q888 V891	R855-E879 WeakPolarHBondContact CD-OE1 3.46Å; R855-E879 IonicContact CZ-OE1 2.78Å; R855-E879 IonicContact CZ-OE2 2.85Å; R855-E879 IonicContact NE-OE1 2.79Å; R855-E879 PolarHBondContact NE-OE1 3.2Å; R855-E879 IonicContact NE-OE2 2.71Å; R855-E879 PolarHBondContact NE-OE2 3.44Å; R855-E879 IonicContact NH2-OE1 3.08Å; R855-E879 IonicContact NH2-OE2 2.92Å; R855-E879 PolarHBondContact NH2-OE2 3.31Å; F875-E879 HydrophobicContact CD2-CG 4.06Å; F875-E879 HydrophobicContact CE2-CG 3.81Å; F875-E879 WeakPolarHBondContact CE2-OE1 3.47Å; F875-E879 PolarHBondContact O-N 2.74Å; Y876-E879 PolarHBondContact O-N 2.81Å; E879-Q881 VanDerWaalsContact C-N 3.26Å; E879-Q881 PolarHBondContact O-N 3.13Å; E879-G883 WeakPolarHBondContact O-CA 3.46Å; E879-G883 PolarHBondContact O-N 3.29Å; E879-G883 WeakPolarHBondContact OE2-CA 3.42Å; E879-Q887 PolarHBondContact OE2-OE1 3.03Å; E879-Q888 HydrophobicContact CB-CG 4.02Å; E879-Q888 WeakPolarHBondContact O-CG 3.21Å; E879-Q888 PolarHBondContact O-NE2 3.38Å; E879-V891 HydrophobicContact CG-CG2 3.95Å
880	L	91.9	Very high	92.2	Very high	85 Å²	85	49.8 Å²	49.8	45%	0.445	25%	0.245	S	C	.	.	H	α-helix	trans	-64.3	-32.3	168.4	-75.1	173.4	0	0	0	112	Y876 K877 F878 Q888	Y876-L880 HydrophobicContact CD1-CD1 3.9Å; Y876-L880 HydrophobicContact CD1-CG 4.45Å; Y876-L880 HydrophobicContact CE1-CD1 3.63Å; Y876-L880 HydrophobicContact CE1-CD2 4.49Å; Y876-L880 HydrophobicContact CE1-CG 4.19Å; Y876-L880 HydrophobicContact CE2-CD2 4.44Å; Y876-L880 HydrophobicContact CE2-CG 4.4Å; Y876-L880 VanDerWaalsContact O-CG 3.31Å; Y876-L880 WeakPolarHBondContact O-CG 3.16Å; Y876-L880 PolarHBondContact O-N 3.28Å; K877-L880 PolarHBondContact O-N 2.79Å; F878-L880 VanDerWaalsContact C-N 3.34Å; L880-Q888 HydrophobicContact CD2-CG 4.44Å
881	Q	90.6	Very high	92.3	Very high	115 Å²	115	49.3 Å²	49.3	54%	0.537	24%	0.243	S	C	.	.	H	α-helix	trans	-88.7	-34.5	-178.8	-170.6	176.1	-7.6	0	0	113.7	K877 F878 E879	K877-Q881 PolarHBondContact O-N 3.39Å; F878-Q881 PolarHBondContact O-N 3.11Å; F878-Q881 VanDerWaalsContact O-N 3.16Å; E879-Q881 VanDerWaalsContact C-N 3.26Å; E879-Q881 PolarHBondContact O-N 3.13Å
882	H	91.5	Very high	92.2	Very high	66 Å²	66	52.3 Å²	52.3	31%	0.306	25%	0.254	S	S	.	.	H	α-helix	trans	-130.5	-3.7	-169.5	-61.6	-58.9	0	0	0	115.1	W846 V851 R855 F878	W846-H882 AromaticContact CD1-CD2 3.83Å; W846-H882 AromaticContact CD1-NE2 3.57Å; W846-H882 AromaticContact NE1-CD2 3.46Å; W846-H882 PolarHBondContact NE1-CD2 2.89Å; W846-H882 AromaticContact NE1-NE2 3.21Å; W846-H882 PolarHBondContact NE1-NE2 3.2Å; V851-H882 HydrophobicContact CG1-CB 3.82Å; V851-H882 HydrophobicContact CG2-CB 4.43Å; R855-H882 PolarHBondContact NH2-O 3.15Å; F878-H882 AromaticContact CD2-CD2 3.79Å; F878-H882 HydrophobicContact CE2-CB 4.29Å; F878-H882 AromaticContact CE2-CD2 3.73Å; F878-H882 HydrophobicContact CZ-CB 4.49Å; F878-H882 PolarHBondContact O-N 3.35Å
883	G	89.2	Confident	92	Very high	20 Å²	20	59.5 Å²	59.5	21%	0.206	28%	0.282	C	S	.	.	S	Bend	trans	-100.3	164.3	-173.7	0	0	0	0	0	114	E879 Q887	E879-G883 WeakPolarHBondContact O-CA 3.46Å; E879-G883 PolarHBondContact O-N 3.29Å; E879-G883 WeakPolarHBondContact OE2-CA 3.42Å; G883-Q887 VanDerWaalsContact CA-OE1 3.25Å
884	T	93.2	Very high	91.9	Very high	79 Å²	79	63 Å²	63	49%	0.485	30%	0.295	S	S	.	.			trans	-78.6	161.1	166.8	60.2	0	0	0	0	110.8	D886 Q887 Q888	T884-D886 PolarHBondContact O-N 2.85Å; T884-Q887 WeakPolarHBondContact O-CB 3.23Å; T884-Q887 PolarHBondContact O-N 3.28Å; T884-Q887 VanDerWaalsContact O-N 3.08Å; T884-Q887 WeakPolarHBondContact OG1-CG 3.42Å; T884-Q888 WeakPolarHBondContact O-CG 3.4Å; T884-Q888 PolarHBondContact O-N 3.05Å; T884-Q888 VanDerWaalsContact O-N 3.11Å
885	E	91.9	Very high	91.7	Very high	131 Å²	131	61.9 Å²	61.9	61%	0.612	29%	0.29	S	S	*	.	H	α-helix	trans	-56.6	-34.4	176.8	-67.5	-168	177.7	0	0	112.9	Q888 K889	E885-Q888 WeakPolarHBondContact O-CB 3.48Å; E885-Q888 PolarHBondContact O-N 3.13Å; E885-K889 WeakPolarHBondContact O-CG 3.48Å; E885-K889 PolarHBondContact O-N 3.31Å; E885-K889 IonicContact OE2-NZ 3.79Å
886	D	92.3	Very high	91.5	Very high	116 Å²	116	63.7 Å²	63.7	62%	0.62	30%	0.302	S	S	*	.	H	α-helix	trans	-67.7	-38.1	178.2	-65.2	-29.8	0	0	0	112.1	T884 Q888 K889 E890	T884-D886 PolarHBondContact O-N 2.85Å; D886-Q888 VanDerWaalsContact C-N 3.34Å; D886-K889 PolarHBondContact O-N 3.36Å; D886-E890 WeakPolarHBondContact O-CB 3.49Å; D886-E890 PolarHBondContact O-N 3.29Å
887	Q	91.2	Very high	91.1	Very high	66 Å²	66	67.7 Å²	67.7	31%	0.308	33%	0.329	S	S	.	.	H	α-helix	trans	-65.1	-40.6	174.6	-70.8	171.2	-11.3	0	0	110.8	E879 G883 T884 E890 V891	E879-Q887 PolarHBondContact OE2-OE1 3.03Å; G883-Q887 VanDerWaalsContact CA-OE1 3.25Å; T884-Q887 WeakPolarHBondContact O-CB 3.23Å; T884-Q887 PolarHBondContact O-N 3.28Å; T884-Q887 VanDerWaalsContact O-N 3.08Å; T884-Q887 WeakPolarHBondContact OG1-CG 3.42Å; Q887-E890 PolarHBondContact O-N 3.47Å; Q887-V891 WeakPolarHBondContact O-CG2 2.77Å; Q887-V891 PolarHBondContact O-N 3.11Å
888	Q	91.3	Very high	90.7	Very high	42 Å²	42	67 Å²	67	20%	0.196	33%	0.333	C	S	.	.	H	α-helix	trans	-62.9	-45.5	175.9	-63.3	167.8	15	0	0	111.6	Y876 E879 L880 T884 E885 D886 E890 V891 Y892	Y876-Q888 HydrophobicContact CE2-CB 4.35Å; E879-Q888 HydrophobicContact CB-CG 4.02Å; E879-Q888 WeakPolarHBondContact O-CG 3.21Å; E879-Q888 PolarHBondContact O-NE2 3.38Å; L880-Q888 HydrophobicContact CD2-CG 4.44Å; T884-Q888 WeakPolarHBondContact O-CG 3.4Å; T884-Q888 PolarHBondContact O-N 3.05Å; T884-Q888 VanDerWaalsContact O-N 3.11Å; E885-Q888 WeakPolarHBondContact O-CB 3.48Å; E885-Q888 PolarHBondContact O-N 3.13Å; D886-Q888 VanDerWaalsContact C-N 3.34Å; Q888-E890 VanDerWaalsContact C-N 3.27Å; Q888-E890 PolarHBondContact O-N 2.87Å; Q888-V891 PolarHBondContact O-N 3.42Å; Q888-Y892 VanDerWaalsContact O-CB 3.25Å; Q888-Y892 WeakPolarHBondContact O-CB 3.5Å; Q888-Y892 PolarHBondContact O-N 2.89Å
889	K	91.7	Very high	90.3	Very high	122 Å²	122	70.9 Å²	70.9	53%	0.53	35%	0.352	S	S	.	.	H	α-helix	trans	-61.6	-37	175.1	-72.9	169.9	-169.4	160.4	0	111.4	E885 D886 Y892 R893	E885-K889 WeakPolarHBondContact O-CG 3.48Å; E885-K889 PolarHBondContact O-N 3.31Å; E885-K889 IonicContact OE2-NZ 3.79Å; D886-K889 PolarHBondContact O-N 3.36Å; K889-Y892 PolarHBondContact O-N 3.2Å; K889-R893 VanDerWaalsContact O-CB 3.31Å; K889-R893 WeakPolarHBondContact O-CB 3.32Å; K889-R893 PolarHBondContact O-N 3.09Å
890	E	90.5	Very high	90.1	Very high	71 Å²	71	70.9 Å²	70.9	33%	0.332	35%	0.352	S	S	.	.	H	α-helix	trans	-67.9	-48.5	178.5	179	56.6	-167.3	0	0	112.4	D886 Q887 Q888 Y892 R893 R894	D886-E890 WeakPolarHBondContact O-CB 3.49Å; D886-E890 PolarHBondContact O-N 3.29Å; Q887-E890 PolarHBondContact O-N 3.47Å; Q888-E890 VanDerWaalsContact C-N 3.27Å; Q888-E890 PolarHBondContact O-N 2.87Å; E890-Y892 VanDerWaalsContact C-N 3.25Å; E890-Y892 PolarHBondContact O-N 3.29Å; E890-R893 VanDerWaalsContact CD-NH2 3.35Å; E890-R893 PolarHBondContact O-N 3.16Å; E890-R893 IonicContact OE1-NH2 3.58Å; E890-R893 PolarHBondContact OE1-NH2 3.47Å; E890-R893 IonicContact OE2-CZ 3.44Å; E890-R893 IonicContact OE2-NE 3.43Å; E890-R893 PolarHBondContact OE2-NE 3.29Å; E890-R893 IonicContact OE2-NH2 3.39Å; E890-R893 PolarHBondContact OE2-NH2 2.94Å; E890-R894 WeakPolarHBondContact O-CB 3.28Å; E890-R894 VanDerWaalsContact O-CG 3.32Å; E890-R894 WeakPolarHBondContact O-CG 3.23Å; E890-R894 PolarHBondContact O-N 2.84Å; E890-R894 VanDerWaalsContact OE1-CD 3.23Å; E890-R894 WeakPolarHBondContact OE1-CD 3.48Å; E890-R894 WeakPolarHBondContact OE1-CG 3.42Å
891	V	91	Very high	89.7	Confident	4 Å²	4	72.7 Å²	72.7	2%	0.024	36%	0.358	C	S	.	.	H	α-helix	trans	-59.3	-42.3	175.3	176.8	0	0	0	0	110.5	W872 F875 Y876 E879 Q887 Q888 R894 C895	W872-V891 HydrophobicContact CE3-CG1 3.88Å; W872-V891 HydrophobicContact CZ3-CG1 4.13Å; F875-V891 HydrophobicContact CB-CG1 4.4Å; F875-V891 HydrophobicContact CD1-CB 4.31Å; F875-V891 HydrophobicContact CD1-CG1 3.64Å; F875-V891 HydrophobicContact CD1-CG2 3.66Å; F875-V891 HydrophobicContact CD2-CG2 4.3Å; F875-V891 HydrophobicContact CE1-CB 4.34Å; F875-V891 HydrophobicContact CE1-CG1 4.14Å; F875-V891 HydrophobicContact CE1-CG2 3.32Å; F875-V891 HydrophobicContact CE2-CG2 4Å; F875-V891 HydrophobicContact CG-CG1 4.06Å; F875-V891 HydrophobicContact CG-CG2 4.14Å; F875-V891 HydrophobicContact CZ-CG2 3.51Å; Y876-V891 HydrophobicContact CD2-CG1 4.48Å; E879-V891 HydrophobicContact CG-CG2 3.95Å; Q887-V891 WeakPolarHBondContact O-CG2 2.77Å; Q887-V891 PolarHBondContact O-N 3.11Å; Q888-V891 PolarHBondContact O-N 3.42Å; V891-R894 PolarHBondContact O-N 3.23Å; V891-C895 WeakPolarHBondContact O-CB 3.22Å; V891-C895 PolarHBondContact O-N 3.44Å
892	Y	90.5	Very high	89.5	Confident	63 Å²	63	72.7 Å²	72.7	25%	0.247	36%	0.357	C	S	.	.	H	α-helix	trans	-61	-48.7	176.3	-179.6	-96.3	0	0	0	112.3	Q888 K889 E890 R894 C895 V896 K921 L924	Q888-Y892 VanDerWaalsContact O-CB 3.25Å; Q888-Y892 WeakPolarHBondContact O-CB 3.5Å; Q888-Y892 PolarHBondContact O-N 2.89Å; K889-Y892 PolarHBondContact O-N 3.2Å; E890-Y892 VanDerWaalsContact C-N 3.25Å; E890-Y892 PolarHBondContact O-N 3.29Å; Y892-R894 PolarHBondContact O-N 3.31Å; Y892-C895 PolarHBondContact O-N 2.89Å; Y892-V896 HydrophobicContact CE1-CG2 4.37Å; Y892-V896 VanDerWaalsContact O-CG2 3.3Å; Y892-V896 WeakPolarHBondContact O-CG2 3.33Å; Y892-V896 PolarHBondContact O-N 3.5Å; Y892-K921 HydrophobicContact CE1-CG 4.4Å; Y892-K921 HydrophobicContact CE2-CB 4.12Å; Y892-K921 HydrophobicContact CE2-CG 4.2Å; Y892-K921 WeakPolarHBondContact OH-CB 3.39Å; Y892-K921 VanDerWaalsContact OH-CD 3.26Å; Y892-K921 WeakPolarHBondContact OH-CD 3.42Å; Y892-K921 VanDerWaalsContact OH-CG 3.23Å; Y892-K921 WeakPolarHBondContact OH-CG 3.4Å; Y892-L924 HydrophobicContact CD2-CD2 4.14Å
893	R	90.5	Very high	89.2	Confident	154 Å²	154	70.2 Å²	70.2	58%	0.581	35%	0.35	S	S	*	.	H	α-helix	trans	-59	-48.1	177.5	-177.2	175.9	68.6	140.8	3.4	111	K889 E890 C895 V896 T897	K889-R893 VanDerWaalsContact O-CB 3.31Å; K889-R893 WeakPolarHBondContact O-CB 3.32Å; K889-R893 PolarHBondContact O-N 3.09Å; E890-R893 VanDerWaalsContact CD-NH2 3.35Å; E890-R893 PolarHBondContact O-N 3.16Å; E890-R893 IonicContact OE1-NH2 3.58Å; E890-R893 PolarHBondContact OE1-NH2 3.47Å; E890-R893 IonicContact OE2-CZ 3.44Å; E890-R893 IonicContact OE2-NE 3.43Å; E890-R893 PolarHBondContact OE2-NE 3.29Å; E890-R893 IonicContact OE2-NH2 3.39Å; E890-R893 PolarHBondContact OE2-NH2 2.94Å; R893-C895 PolarHBondContact O-N 3Å; R893-V896 PolarHBondContact O-N 3.28Å; R893-T897 PolarHBondContact O-N 3.24Å; R893-T897 PolarHBondContact O-OG1 2.95Å; R893-T897 VanDerWaalsContact O-OG1 3.09Å
894	R	90.7	Very high	89	Confident	74 Å²	74	72.6 Å²	72.6	28%	0.279	36%	0.356	S	S	.	.	H	α-helix	trans	-63.7	-41	-179.9	-70.3	178.7	62.7	-171.2	-1.4	112.6	W872 E890 V891 Y892 V896 T897 A898	W872-R894 HydrophobicContact CH2-CB 3.5Å; W872-R894 VanDerWaalsContact CH2-CB 3.5Å; W872-R894 HydrophobicContact CZ2-CB 4.49Å; W872-R894 HydrophobicContact CZ3-CB 3.72Å; E890-R894 WeakPolarHBondContact O-CB 3.28Å; E890-R894 VanDerWaalsContact O-CG 3.32Å; E890-R894 WeakPolarHBondContact O-CG 3.23Å; E890-R894 PolarHBondContact O-N 2.84Å; E890-R894 VanDerWaalsContact OE1-CD 3.23Å; E890-R894 WeakPolarHBondContact OE1-CD 3.48Å; E890-R894 WeakPolarHBondContact OE1-CG 3.42Å; V891-R894 PolarHBondContact O-N 3.23Å; Y892-R894 PolarHBondContact O-N 3.31Å; R894-V896 VanDerWaalsContact C-N 3.32Å; R894-V896 PolarHBondContact O-N 2.82Å; R894-T897 PolarHBondContact O-N 3.47Å; R894-A898 WeakPolarHBondContact O-CB 3.44Å; R894-A898 PolarHBondContact O-N 3.13Å
895	C	90.2	Very high	88.7	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.007	34%	0.341	C	S	.	.	H	α-helix	trans	-62.4	-40.4	175.7	-177.9	0	0	0	0	111.7	W872 V891 Y892 R893 A898 E899 P900 L924	W872-C895 HydrophobicContact CB-CB 4.39Å; W872-C895 HydrophobicContact CD2-CB 3.84Å; W872-C895 HydrophobicContact CE3-CB 3.81Å; W872-C895 HydrophobicContact CG-CB 4.11Å; W872-C895 HydrophobicContact CZ3-CB 4.43Å; V891-C895 WeakPolarHBondContact O-CB 3.22Å; V891-C895 PolarHBondContact O-N 3.44Å; Y892-C895 PolarHBondContact O-N 2.89Å; R893-C895 PolarHBondContact O-N 3Å; C895-A898 PolarHBondContact O-N 3.23Å; C895-E899 PolarHBondContact O-N 3.48Å; C895-P900 WeakPolarHBondContact O-CD 3.19Å; C895-L924 HydrophobicContact CB-CD2 3.96Å
896	V	88.1	Confident	88.7	Confident	43 Å²	43	64.2 Å²	64.2	26%	0.261	31%	0.313	S	S	.	.	H	α-helix	trans	-66.3	-39.7	177.2	173.6	0	0	0	0	111.3	Y892 R893 R894 E899 K921	Y892-V896 HydrophobicContact CE1-CG2 4.37Å; Y892-V896 VanDerWaalsContact O-CG2 3.3Å; Y892-V896 WeakPolarHBondContact O-CG2 3.33Å; Y892-V896 PolarHBondContact O-N 3.5Å; R893-V896 PolarHBondContact O-N 3.28Å; R894-V896 VanDerWaalsContact C-N 3.32Å; R894-V896 PolarHBondContact O-N 2.82Å; V896-E899 WeakPolarHBondContact O-CG 3.32Å; V896-K921 HydrophobicContact CG2-CD 4.32Å; V896-K921 HydrophobicContact CG2-CG 3.48Å; V896-K921 VanDerWaalsContact CG2-CG 3.48Å
897	T	85.5	Confident	88.5	Confident	115 Å²	115	60 Å²	60	71%	0.706	29%	0.292	S	S	*	.	H	α-helix	trans	-67.3	-36.7	175.7	-56.3	0	0	0	0	112.3	R893 R894	R893-T897 PolarHBondContact O-N 3.24Å; R893-T897 PolarHBondContact O-OG1 2.95Å; R893-T897 VanDerWaalsContact O-OG1 3.09Å; R894-T897 PolarHBondContact O-N 3.47Å
898	A	84.6	Confident	88.3	Confident	37 Å²	37	63.2 Å²	63.2	31%	0.306	31%	0.307	S	S	.	.	H	α-helix	trans	-74.9	-30	-179	0	0	0	0	0	113.6	P866 W872 R894 C895	P866-A898 HydrophobicContact CB-CB 3.89Å; W872-A898 HydrophobicContact CZ2-CB 4.14Å; R894-A898 WeakPolarHBondContact O-CB 3.44Å; R894-A898 PolarHBondContact O-N 3.13Å; C895-A898 PolarHBondContact O-N 3.23Å
899	E	85.8	Confident	88.2	Confident	82 Å²	82	61.9 Å²	61.9	38%	0.383	30%	0.301	S	S	.	.			trans	49.4	61.3	-175.4	-63.3	-175	165.3	0	0	113.2	K599 C895 V896 H901	K599-E899 IonicContact NZ-OE1 2.66Å; K599-E899 PolarHBondContact NZ-OE1 3.18Å; K599-E899 IonicContact NZ-OE2 3.35Å; K599-E899 PolarHBondContact NZ-OE2 3.42Å; K599-E899 VanDerWaalsContact NZ-OE2 3.09Å; C895-E899 PolarHBondContact O-N 3.48Å; V896-E899 WeakPolarHBondContact O-CG 3.32Å; E899-H901 PolarHBondContact O-CE1 3.38Å; E899-H901 PolarHBondContact O-ND1 2.82Å
900	P	89.2	Confident	87.9	Confident	3 Å²	3	58.4 Å²	58.4	2%	0.019	29%	0.292	C	S	.	.			trans	-62.7	146.9	-174.3	25.8	-35.1	0	0	0	114	D867 C895 W906 T920	D867-P900 VanDerWaalsContact O-CB 3.27Å; D867-P900 WeakPolarHBondContact O-CB 3.34Å; C895-P900 WeakPolarHBondContact O-CD 3.19Å; P900-W906 HydrophobicContact CG-CH2 4.02Å; P900-W906 HydrophobicContact CG-CZ2 3.74Å; P900-W906 PolarHBondContact O-NE1 3.16Å; P900-T920 HydrophobicContact CG-CG2 4.47Å
901	H	83.9	Confident	87.6	Confident	123 Å²	123	61.5 Å²	61.5	57%	0.569	30%	0.304	S	S	*	.			trans	-125.1	-27.6	-176.9	-65.1	-10.8	0	0	0	113.3	D867 E899 C907	D867-H901 PolarHBondContact O-N 3.36Å; D867-H901 VanDerWaalsContact O-N 3.15Å; D867-H901 WeakPolarHBondContact OD1-CB 2.87Å; D867-H901 IonicContact OD1-CG 3.72Å; D867-H901 PolarHBondContact OD1-N 2.85Å; E899-H901 PolarHBondContact O-CE1 3.38Å; E899-H901 PolarHBondContact O-ND1 2.82Å; H901-C907 PolarHBondContact O-SG 2.85Å
902	H	86.8	Confident	87.3	Confident	114 Å²	114	64.2 Å²	64.2	53%	0.528	32%	0.318	S	S	.	.	B	Isolated β-bridge	trans	-95.9	167.3	-177.9	-64.9	98.3	0	0	0	111.9	D867 G869	D867-H902 PolarHBondContact O-N 2.89Å; D867-H902 IonicContact OD1-ND1 2.8Å; D867-H902 IonicContact OD2-CE1 2.72Å; D867-H902 PolarHBondContact OD2-CE1 3.14Å; D867-H902 IonicContact OD2-CG 3.67Å; D867-H902 IonicContact OD2-ND1 3.9Å; D867-H902 PolarHBondContact OD2-ND1 2.93Å; G869-H902 WeakPolarHBondContact CA-O 3.43Å; G869-H902 PolarHBondContact N-O 3.36Å
903	G	85.3	Confident	86.9	Confident	14 Å²	14	62.3 Å²	62.3	14%	0.144	31%	0.314	C	S	.	.			trans	116.4	140.7	-173.7	0	0	0	0	0	110.9	D870 C907	D870-G903 VanDerWaalsContact CG-CA 3.47Å; D870-G903 VanDerWaalsContact OD2-CA 3.31Å; D870-G903 WeakPolarHBondContact OD2-CA 3.42Å; G903-C907 WeakPolarHBondContact O-CB 3.32Å; G903-C907 PolarHBondContact O-N 3.12Å; G903-C907 PolarHBondContact O-SG 2.88Å
904	E	84.8	Confident	86.6	Confident	70 Å²	70	63.3 Å²	63.3	33%	0.327	32%	0.322	S	S	.	.	H	α-helix	trans	-71.4	-50.9	-175.4	-177.6	176.4	-170.8	0	0	111.2	R745 R779 D870 C907 Q908	R745-E904 IonicContact CZ-OE1 3.72Å; R745-E904 IonicContact NH2-OE1 2.73Å; R745-E904 PolarHBondContact NH2-OE1 2.82Å; R779-E904 IonicContact CZ-OE1 3.46Å; R779-E904 IonicContact CZ-OE2 2.94Å; R779-E904 VanDerWaalsContact CZ-OE2 3.22Å; R779-E904 IonicContact NH1-OE1 3.21Å; R779-E904 PolarHBondContact NH1-OE1 3.29Å; R779-E904 IonicContact NH1-OE2 2.76Å; R779-E904 PolarHBondContact NH1-OE2 3.47Å; R779-E904 IonicContact NH2-OE2 3.19Å; R779-E904 PolarHBondContact NH2-OE2 3.18Å; D870-E904 PolarHBondContact OD1-N 3.38Å; D870-E904 PolarHBondContact OD2-N 2.85Å; E904-C907 PolarHBondContact O-N 3.16Å; E904-Q908 WeakPolarHBondContact O-CB 3.24Å; E904-Q908 PolarHBondContact O-N 3.42Å
905	V	87.1	Confident	86.3	Confident	29 Å²	29	61.3 Å²	61.3	18%	0.176	32%	0.317	C	S	.	.	H	α-helix	trans	-69.5	-42.6	179.2	-178.5	0	0	0	0	109.3	D870 C907 Q908 I909 T930 I931	D870-V905 WeakPolarHBondContact OD1-CB 3.47Å; D870-V905 PolarHBondContact OD1-N 3.16Å; D870-V905 VanDerWaalsContact OD1-N 3.11Å; V905-C907 PolarHBondContact O-N 2.75Å; V905-Q908 PolarHBondContact O-N 2.82Å; V905-I909 HydrophobicContact CG1-CD1 3.8Å; V905-I909 HydrophobicContact CG1-CG1 4.5Å; V905-I909 WeakPolarHBondContact O-CG1 3.17Å; V905-I909 PolarHBondContact O-N 3.5Å; V905-T930 HydrophobicContact CG1-CG2 4.46Å; V905-I931 HydrophobicContact CG1-CG1 4.02Å; V905-I931 HydrophobicContact CG2-CG1 4.49Å
906	W	91.1	Very high	85.8	Confident	6 Å²	6	65.5 Å²	65.5	2%	0.023	33%	0.333	C	S	.	.	H	α-helix	trans	-57.7	-47.9	175.4	-169	-94.8	0	0	0	112.2	D870 P900 Q908 I909 S910 T920 L923 L924 A927	D870-W906 PolarHBondContact OD1-N 3.24Å; P900-W906 HydrophobicContact CG-CH2 4.02Å; P900-W906 HydrophobicContact CG-CZ2 3.74Å; P900-W906 PolarHBondContact O-NE1 3.16Å; W906-Q908 PolarHBondContact O-N 3.37Å; W906-I909 PolarHBondContact O-N 3.06Å; W906-S910 WeakPolarHBondContact O-CB 3.44Å; W906-S910 PolarHBondContact O-N 3.21Å; W906-T920 HydrophobicContact CH2-CG2 4Å; W906-T920 HydrophobicContact CZ2-CG2 3.9Å; W906-L923 HydrophobicContact CH2-CB 3.9Å; W906-L923 HydrophobicContact CZ2-CB 4.01Å; W906-L923 HydrophobicContact CZ2-CD1 4.33Å; W906-L923 HydrophobicContact CZ3-CB 4.48Å; W906-L924 HydrophobicContact CH2-CB 4.18Å; W906-L924 HydrophobicContact CZ3-CB 4.12Å; W906-L924 HydrophobicContact CZ3-CD1 4.02Å; W906-A927 HydrophobicContact CE3-CB 4.15Å; W906-A927 HydrophobicContact CZ3-CB 4.35Å
907	C	89.1	Confident	85.3	Confident	26 Å²	26	71.4 Å²	71.4	18%	0.176	35%	0.351	C	S	.	.	H	α-helix	trans	-64.6	-39	176.5	-81	0	0	0	0	112.4	H901 G903 E904 V905 K911	H901-C907 PolarHBondContact O-SG 2.85Å; G903-C907 WeakPolarHBondContact O-CB 3.32Å; G903-C907 PolarHBondContact O-N 3.12Å; G903-C907 PolarHBondContact O-SG 2.88Å; E904-C907 PolarHBondContact O-N 3.16Å; V905-C907 PolarHBondContact O-N 2.75Å; C907-K911 HydrophobicContact CB-CD 4.26Å; C907-K911 WeakPolarHBondContact O-CB 3.38Å; C907-K911 WeakPolarHBondContact O-CD 3.31Å; C907-K911 WeakPolarHBondContact O-CG 3.24Å; C907-K911 PolarHBondContact O-N 3.47Å
908	Q	86.7	Confident	85.2	Confident	135 Å²	135	68.7 Å²	68.7	63%	0.631	33%	0.332	S	S	*	.	H	α-helix	trans	-60.6	-46.9	178.5	-176.3	177.2	0.3	0	0	110.8	E904 V905 W906 D912	E904-Q908 WeakPolarHBondContact O-CB 3.24Å; E904-Q908 PolarHBondContact O-N 3.42Å; V905-Q908 PolarHBondContact O-N 2.82Å; W906-Q908 PolarHBondContact O-N 3.37Å; Q908-D912 PolarHBondContact O-N 3.3Å
909	I	88.8	Confident	85.1	Confident	13 Å²	13	72.1 Å²	72.1	7%	0.067	34%	0.34	C	S	.	.	H	α-helix	trans	-70	-43.7	-179.7	-62.9	166.8	0	0	0	110.9	V905 W906 D912 N915 L923 I926 A927	V905-I909 HydrophobicContact CG1-CD1 3.8Å; V905-I909 HydrophobicContact CG1-CG1 4.5Å; V905-I909 WeakPolarHBondContact O-CG1 3.17Å; V905-I909 PolarHBondContact O-N 3.5Å; W906-I909 PolarHBondContact O-N 3.06Å; I909-D912 PolarHBondContact O-N 2.84Å; I909-N915 VanDerWaalsContact O-CB 3.29Å; I909-N915 WeakPolarHBondContact O-CB 3.34Å; I909-N915 PolarHBondContact O-ND2 2.8Å; I909-L923 HydrophobicContact CG2-CD2 3.86Å; I909-I926 HydrophobicContact CD1-CG2 4.21Å; I909-I926 HydrophobicContact CG2-CB 4.29Å; I909-I926 HydrophobicContact CG2-CG2 3.79Å; I909-A927 VanDerWaalsContact CD1-CA 3.4Å; I909-A927 HydrophobicContact CD1-CB 3.71Å
910	S	85.5	Confident	85	Confident	49 Å²	49	69.8 Å²	69.8	34%	0.343	33%	0.331	S	S	.	.	H	α-helix	trans	-69.1	-33.7	-178.4	-179.3	0	0	0	0	113.1	W906	W906-S910 WeakPolarHBondContact O-CB 3.44Å; W906-S910 PolarHBondContact O-N 3.21Å
911	K	84.9	Confident	84.8	Confident	137 Å²	137	74 Å²	74	60%	0.596	35%	0.349	S	S	*	.	H	α-helix	trans	-84.7	-9.9	179.8	-66.4	171.1	-174.3	169.7	0	113.3	R666 C907 P913	R666-K911 PolarHBondContact NH1-O 3.21Å; R666-K911 VanDerWaalsContact NH1-O 3.15Å; R666-K911 PolarHBondContact NH2-O 2.96Å; C907-K911 HydrophobicContact CB-CD 4.26Å; C907-K911 WeakPolarHBondContact O-CB 3.38Å; C907-K911 WeakPolarHBondContact O-CD 3.31Å; C907-K911 WeakPolarHBondContact O-CG 3.24Å; C907-K911 PolarHBondContact O-N 3.47Å; K911-P913 WeakPolarHBondContact O-CD 3.43Å
912	D	84.8	Confident	85	Confident	60 Å²	60	71.2 Å²	71.2	32%	0.321	34%	0.338	S	S	.	.	S	Bend	trans	-60.5	122.3	170.4	-170.1	-25	0	0	0	109.4	Q908 I909 K914 N915 W916	Q908-D912 PolarHBondContact O-N 3.3Å; I909-D912 PolarHBondContact O-N 2.84Å; D912-K914 PolarHBondContact O-N 3.47Å; D912-K914 VanDerWaalsContact O-N 3.13Å; D912-K914 WeakPolarHBondContact OD1-CB 3.35Å; D912-K914 PolarHBondContact OD1-N 3.42Å; D912-N915 HydrophobicContact CB-CB 4.4Å; D912-N915 PolarHBondContact O-N 3.3Å; D912-W916 PolarHBondContact O-N 2.85Å
913	P	82.2	Confident	85	Confident	24 Å²	24	66.4 Å²	66.4	16%	0.156	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-51.7	-31.9	176.8	-25.2	32.9	0	0	0	113.8	W669 K911 N915 W916	W669-P913 HydrophobicContact CD2-CG 4.18Å; W669-P913 HydrophobicContact CH2-CG 4.49Å; W669-P913 HydrophobicContact CZ2-CG 3.76Å; K911-P913 WeakPolarHBondContact O-CD 3.43Å; P913-N915 VanDerWaalsContact C-N 3.32Å; P913-N915 PolarHBondContact O-N 3.32Å; P913-W916 WeakPolarHBondContact O-CB 3.49Å; P913-W916 PolarHBondContact O-N 2.95Å
914	K	83.5	Confident	85.2	Confident	174 Å²	174	65.8 Å²	65.8	76%	0.757	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-65.4	-35.5	179.7	-64.5	175.8	-177.8	172.9	0	112.3	D912	D912-K914 PolarHBondContact O-N 3.47Å; D912-K914 VanDerWaalsContact O-N 3.13Å; D912-K914 WeakPolarHBondContact OD1-CB 3.35Å; D912-K914 PolarHBondContact OD1-N 3.42Å
915	N	85.1	Confident	85.4	Confident	32 Å²	32	66.8 Å²	66.8	17%	0.171	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-91.4	1.1	-175	-64.4	-21.9	0	0	0	113.4	I909 D912 P913 R917 L918 L923	I909-N915 VanDerWaalsContact O-CB 3.29Å; I909-N915 WeakPolarHBondContact O-CB 3.34Å; I909-N915 PolarHBondContact O-ND2 2.8Å; D912-N915 HydrophobicContact CB-CB 4.4Å; D912-N915 PolarHBondContact O-N 3.3Å; P913-N915 VanDerWaalsContact C-N 3.32Å; P913-N915 PolarHBondContact O-N 3.32Å; N915-R917 PolarHBondContact O-N 2.94Å; N915-L918 HydrophobicContact CB-CD1 3.96Å; N915-L918 HydrophobicContact CB-CG 4.49Å; N915-L918 WeakPolarHBondContact O-CB 3.4Å; N915-L918 PolarHBondContact O-N 2.79Å; N915-L923 HydrophobicContact CB-CD2 4.29Å
916	W	79.6	Confident	85.6	Confident	89 Å²	89	67.8 Å²	67.8	34%	0.337	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-31.7	-176.4	167.6	-98.7	0	0	0	114.2	C670 D912 P913	C670-W916 HydrophobicContact CB-CG 4.23Å; C670-W916 VanDerWaalsContact SG-CG 3.51Å; D912-W916 PolarHBondContact O-N 2.85Å; P913-W916 WeakPolarHBondContact O-CB 3.49Å; P913-W916 PolarHBondContact O-N 2.95Å
917	R	77.5	Confident	85.4	Confident	167 Å²	167	67.5 Å²	67.5	63%	0.63	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-13.8	-178	-61.9	-178.4	-176.8	170.3	4.1	113.6	N915	N915-R917 PolarHBondContact O-N 2.94Å
918	L	82.2	Confident	85.4	Confident	59 Å²	59	66.5 Å²	66.5	31%	0.309	31%	0.31	S	S	.	.			trans	-75.5	141.6	-174.4	-62.4	-177.9	0	0	0	110.5	N915 D922 L923 I926	N915-L918 HydrophobicContact CB-CD1 3.96Å; N915-L918 HydrophobicContact CB-CG 4.49Å; N915-L918 WeakPolarHBondContact O-CB 3.4Å; N915-L918 PolarHBondContact O-N 2.79Å; L918-D922 HydrophobicContact CB-CB 4.14Å; L918-D922 HydrophobicContact CD2-CB 4.18Å; L918-L923 HydrophobicContact CB-CD2 4.14Å; L918-L923 HydrophobicContact CB-CG 4.27Å; L918-I926 HydrophobicContact CD1-CD1 3.33Å
919	K	82.9	Confident	85.5	Confident	108 Å²	108	67.4 Å²	67.4	47%	0.47	31%	0.314	S	S	.	.			trans	-84.3	165.1	175.2	-59.1	-64.3	-179.4	167.9	0	109.5	E637 K921 D922 L923	E637-K919 IonicContact OE2-NZ 2.8Å; E637-K919 PolarHBondContact OE2-NZ 2.97Å; K919-K921 PolarHBondContact O-N 3.26Å; K919-D922 PolarHBondContact O-N 3.29Å; K919-L923 PolarHBondContact O-N 3.47Å
920	T	83.4	Confident	85.4	Confident	33 Å²	33	70.5 Å²	70.5	20%	0.202	33%	0.333	C	S	.	.	H	α-helix	trans	-47.1	-35.5	175.7	-44.3	0	0	0	0	112.9	P900 W906 D922 L924	P900-T920 HydrophobicContact CG-CG2 4.47Å; W906-T920 HydrophobicContact CH2-CG2 4Å; W906-T920 HydrophobicContact CZ2-CG2 3.9Å; T920-D922 PolarHBondContact O-N 2.75Å; T920-L924 WeakPolarHBondContact O-CB 3.35Å; T920-L924 PolarHBondContact O-N 3.28Å
921	K	86	Confident	85.3	Confident	93 Å²	93	68.4 Å²	68.4	40%	0.404	32%	0.318	S	S	.	.	H	α-helix	trans	-58.6	-44.2	177.1	-69.8	177.1	172.4	-177.3	0	113.5	Y892 V896 K919	Y892-K921 HydrophobicContact CE1-CG 4.4Å; Y892-K921 HydrophobicContact CE2-CB 4.12Å; Y892-K921 HydrophobicContact CE2-CG 4.2Å; Y892-K921 WeakPolarHBondContact OH-CB 3.39Å; Y892-K921 VanDerWaalsContact OH-CD 3.26Å; Y892-K921 WeakPolarHBondContact OH-CD 3.42Å; Y892-K921 VanDerWaalsContact OH-CG 3.23Å; Y892-K921 WeakPolarHBondContact OH-CG 3.4Å; V896-K921 HydrophobicContact CG2-CD 4.32Å; V896-K921 HydrophobicContact CG2-CG 3.48Å; V896-K921 VanDerWaalsContact CG2-CG 3.48Å; K919-K921 PolarHBondContact O-N 3.26Å
922	D	87.5	Confident	85	Confident	63 Å²	63	67.5 Å²	67.5	34%	0.337	32%	0.324	S	S	.	.	H	α-helix	trans	-83.9	-36.7	-176.8	-51.8	-45.3	0	0	0	110.1	L918 K919 T920 L924 K925 I926	L918-D922 HydrophobicContact CB-CB 4.14Å; L918-D922 HydrophobicContact CD2-CB 4.18Å; K919-D922 PolarHBondContact O-N 3.29Å; T920-D922 PolarHBondContact O-N 2.75Å; D922-L924 VanDerWaalsContact C-N 3.27Å; D922-L924 PolarHBondContact O-N 2.99Å; D922-K925 PolarHBondContact O-N 3.03Å; D922-I926 WeakPolarHBondContact O-CG1 3.34Å; D922-I926 PolarHBondContact O-N 2.92Å; D922-I926 VanDerWaalsContact O-N 3.09Å
923	L	88	Confident	84.3	Confident	13 Å²	13	66.9 Å²	66.9	7%	0.068	32%	0.321	C	S	.	.	H	α-helix	trans	-57.2	-40.4	173.5	-67.4	175.3	0	0	0	111.8	W906 I909 N915 L918 K919 K925 I926 A927	W906-L923 HydrophobicContact CH2-CB 3.9Å; W906-L923 HydrophobicContact CZ2-CB 4.01Å; W906-L923 HydrophobicContact CZ2-CD1 4.33Å; W906-L923 HydrophobicContact CZ3-CB 4.48Å; I909-L923 HydrophobicContact CG2-CD2 3.86Å; N915-L923 HydrophobicContact CB-CD2 4.29Å; L918-L923 HydrophobicContact CB-CD2 4.14Å; L918-L923 HydrophobicContact CB-CG 4.27Å; K919-L923 PolarHBondContact O-N 3.47Å; L923-K925 PolarHBondContact O-N 3.46Å; L923-I926 PolarHBondContact O-N 3.09Å; L923-A927 WeakPolarHBondContact O-CB 3.37Å; L923-A927 PolarHBondContact O-N 3.5Å
924	L	89.3	Confident	83.4	Confident	1 Å²	1	67.5 Å²	67.5	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-62.7	-40.9	177.7	-178.3	66	0	0	0	112.8	W872 A873 Y876 Y892 C895 W906 T920 D922 A927 A928	W872-L924 HydrophobicContact CB-CD1 3.91Å; A873-L924 HydrophobicContact CB-CD1 4.38Å; Y876-L924 HydrophobicContact CD1-CD2 4.34Å; Y876-L924 HydrophobicContact CD1-CG 4.12Å; Y876-L924 HydrophobicContact CD2-CD2 4.47Å; Y876-L924 HydrophobicContact CG-CD2 4.14Å; Y876-L924 HydrophobicContact CG-CG 4.27Å; Y892-L924 HydrophobicContact CD2-CD2 4.14Å; C895-L924 HydrophobicContact CB-CD2 3.96Å; W906-L924 HydrophobicContact CH2-CB 4.18Å; W906-L924 HydrophobicContact CZ3-CB 4.12Å; W906-L924 HydrophobicContact CZ3-CD1 4.02Å; T920-L924 WeakPolarHBondContact O-CB 3.35Å; T920-L924 PolarHBondContact O-N 3.28Å; D922-L924 VanDerWaalsContact C-N 3.27Å; D922-L924 PolarHBondContact O-N 2.99Å; L924-A927 PolarHBondContact O-N 3.38Å; L924-A928 WeakPolarHBondContact O-CB 3.38Å; L924-A928 PolarHBondContact O-N 3.44Å
925	K	89	Confident	82.2	Confident	92 Å²	92	68 Å²	68	40%	0.4	34%	0.335	S	S	.	.	H	α-helix	trans	-66	-47.7	178.8	-66.9	178.8	179.9	179.6	0	110.8	Y876 D922 L923 A927 A928 E929	Y876-K925 HydrophobicContact CE1-CG 4.44Å; D922-K925 PolarHBondContact O-N 3.03Å; L923-K925 PolarHBondContact O-N 3.46Å; K925-A927 VanDerWaalsContact C-N 3.29Å; K925-A927 PolarHBondContact O-N 3.16Å; K925-A928 PolarHBondContact O-N 3.4Å; K925-E929 WeakPolarHBondContact O-CG 3.48Å; K925-E929 PolarHBondContact O-N 2.97Å
926	I	89.8	Confident	82	Confident	49 Å²	49	69.8 Å²	69.8	25%	0.251	34%	0.343	S	S	.	.	H	α-helix	trans	-61.5	-41.1	177.2	-62.1	168.5	0	0	0	110.5	I909 L918 D922 L923 E929 T930	I909-I926 HydrophobicContact CD1-CG2 4.21Å; I909-I926 HydrophobicContact CG2-CB 4.29Å; I909-I926 HydrophobicContact CG2-CG2 3.79Å; L918-I926 HydrophobicContact CD1-CD1 3.33Å; D922-I926 WeakPolarHBondContact O-CG1 3.34Å; D922-I926 PolarHBondContact O-N 2.92Å; D922-I926 VanDerWaalsContact O-N 3.09Å; L923-I926 PolarHBondContact O-N 3.09Å; I926-E929 PolarHBondContact O-N 2.68Å; I926-T930 WeakPolarHBondContact O-CB 3.31Å; I926-T930 PolarHBondContact O-N 3.29Å; I926-T930 PolarHBondContact O-OG1 3.03Å
927	A	88.6	Confident	82.2	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.008	34%	0.344	C	S	.	.	H	α-helix	trans	-64.2	-43.6	177	0	0	0	0	0	112.1	A873 W906 I909 L923 L924 K925 E929 T930 I931	A873-A927 HydrophobicContact CB-CB 3.59Å; W906-A927 HydrophobicContact CE3-CB 4.15Å; W906-A927 HydrophobicContact CZ3-CB 4.35Å; I909-A927 VanDerWaalsContact CD1-CA 3.4Å; I909-A927 HydrophobicContact CD1-CB 3.71Å; L923-A927 WeakPolarHBondContact O-CB 3.37Å; L923-A927 PolarHBondContact O-N 3.5Å; L924-A927 PolarHBondContact O-N 3.38Å; K925-A927 VanDerWaalsContact C-N 3.29Å; K925-A927 PolarHBondContact O-N 3.16Å; A927-E929 VanDerWaalsContact C-N 3.31Å; A927-E929 PolarHBondContact O-N 3.19Å; A927-T930 PolarHBondContact O-N 3.1Å; A927-I931 WeakPolarHBondContact O-CB 3.46Å; A927-I931 WeakPolarHBondContact O-CD1 3.46Å; A927-I931 WeakPolarHBondContact O-CG1 3.33Å; A927-I931 PolarHBondContact O-N 2.88Å; A927-I931 VanDerWaalsContact O-N 3.08Å
928	A	88.9	Confident	82.4	Confident	5 Å²	5	63.3 Å²	63.3	4%	0.041	33%	0.328	C	S	.	.	H	α-helix	trans	-65.5	-33	177.6	0	0	0	0	0	113.1	Y876 K877 L924 K925	Y876-A928 HydrophobicContact CD1-CB 3.75Å; Y876-A928 HydrophobicContact CE1-CB 4.47Å; K877-A928 HydrophobicContact CB-CB 4.31Å; K877-A928 WeakPolarHBondContact CD-O 3.25Å; K877-A928 PolarHBondContact NZ-O 2.88Å; L924-A928 WeakPolarHBondContact O-CB 3.38Å; L924-A928 PolarHBondContact O-N 3.44Å; K925-A928 PolarHBondContact O-N 3.4Å
929	E	88.7	Confident	82.4	Confident	153 Å²	153	63.5 Å²	63.5	72%	0.715	33%	0.329	S	S	*	.	H	α-helix	trans	-70.6	-44.1	173.7	-73	173	-171.5	0	0	111.9	K925 I926 A927 I931	K925-E929 WeakPolarHBondContact O-CG 3.48Å; K925-E929 PolarHBondContact O-N 2.97Å; I926-E929 PolarHBondContact O-N 2.68Å; A927-E929 VanDerWaalsContact C-N 3.31Å; A927-E929 PolarHBondContact O-N 3.19Å; E929-I931 PolarHBondContact O-N 3.48Å
930	T	86.4	Confident	82.4	Confident	78 Å²	78	60.8 Å²	60.8	48%	0.479	32%	0.32	S	S	.	.	H	α-helix	trans	-68.9	-32.3	-176.1	-54.9	0	0	0	0	112.8	V905 I926 A927 V932	V905-T930 HydrophobicContact CG1-CG2 4.46Å; I926-T930 WeakPolarHBondContact O-CB 3.31Å; I926-T930 PolarHBondContact O-N 3.29Å; I926-T930 PolarHBondContact O-OG1 3.03Å; A927-T930 PolarHBondContact O-N 3.1Å; T930-V932 PolarHBondContact O-N 3.34Å
931	I	83.9	Confident	82.3	Confident	5 Å²	5	62.6 Å²	62.6	3%	0.026	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-68.8	125.9	-175.5	-75.8	168.6	0	0	0	111.1	A873 Y874 K877 V905 A927 E929	A873-I931 HydrophobicContact CB-CD1 3.26Å; Y874-I931 HydrophobicContact CD1-CG2 3.53Å; Y874-I931 HydrophobicContact CD2-CD1 4.15Å; Y874-I931 HydrophobicContact CE1-CG2 3.08Å; Y874-I931 HydrophobicContact CE2-CD1 4.13Å; Y874-I931 HydrophobicContact CE2-CG2 4.2Å; Y874-I931 HydrophobicContact CG-CD1 4.38Å; Y874-I931 HydrophobicContact CG-CG2 4.26Å; Y874-I931 VanDerWaalsContact CZ-CG2 3.45Å; K877-I931 HydrophobicContact CD-CG2 4.41Å; K877-I931 WeakPolarHBondContact CE-O 3.43Å; K877-I931 PolarHBondContact NZ-O 3.41Å; V905-I931 HydrophobicContact CG1-CG1 4.02Å; V905-I931 HydrophobicContact CG2-CG1 4.49Å; A927-I931 WeakPolarHBondContact O-CB 3.46Å; A927-I931 WeakPolarHBondContact O-CD1 3.46Å; A927-I931 WeakPolarHBondContact O-CG1 3.33Å; A927-I931 PolarHBondContact O-N 2.88Å; A927-I931 VanDerWaalsContact O-N 3.08Å; E929-I931 PolarHBondContact O-N 3.48Å
932	V	77.2	Confident	82.1	Confident	118 Å²	118	60.4 Å²	60.4	72%	0.715	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-100.6	136	171.1	-176.2	0	0	0	0	109.1	T930 P934	T930-V932 PolarHBondContact O-N 3.34Å; V932-P934 WeakPolarHBondContact O-CD 3.31Å
933	L	71.8	Confident	81.7	Confident	48 Å²	48	60.2 Å²	60.2	25%	0.251	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-65.9	123.7	171.5	-85.1	171.3	0	0	0	109.4	W846 N935	W846-L933 HydrophobicContact CD2-CD1 4.38Å; W846-L933 HydrophobicContact CD2-CD2 3.82Å; W846-L933 HydrophobicContact CE3-CD2 3.37Å; W846-L933 HydrophobicContact CE3-CG 4.41Å; W846-L933 HydrophobicContact CH2-CD1 3.9Å; W846-L933 HydrophobicContact CH2-CD2 3.7Å; W846-L933 HydrophobicContact CH2-CG 3.89Å; W846-L933 HydrophobicContact CZ2-CD1 3.68Å; W846-L933 HydrophobicContact CZ2-CD2 4.14Å; W846-L933 HydrophobicContact CZ2-CG 4.2Å; W846-L933 HydrophobicContact CZ3-CD1 4.37Å; W846-L933 HydrophobicContact CZ3-CD2 3.3Å; W846-L933 HydrophobicContact CZ3-CG 4.02Å; L933-N935 PolarHBondContact O-N 3.19Å
934	P	62.8	Low	81.1	Confident	37 Å²	37	64.2 Å²	64.2	24%	0.24	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-65	127.2	171.2	24.8	-30.7	0	0	0	109.6	F813 V932	F813-P934 HydrophobicContact CD1-CB 3.71Å; F813-P934 HydrophobicContact CD1-CG 3.46Å; F813-P934 VanDerWaalsContact CD1-CG 3.46Å; F813-P934 HydrophobicContact CD2-CG 4.33Å; F813-P934 HydrophobicContact CE1-CB 4.23Å; F813-P934 HydrophobicContact CE1-CG 3.48Å; F813-P934 VanDerWaalsContact CE1-CG 3.48Å; F813-P934 HydrophobicContact CE2-CG 4.36Å; F813-P934 HydrophobicContact CG-CB 4.08Å; F813-P934 HydrophobicContact CG-CG 3.95Å; F813-P934 HydrophobicContact CZ-CG 3.99Å; V932-P934 WeakPolarHBondContact O-CD 3.31Å
935	N	57.4	Low	80.4	Confident	183 Å²	183	69.9 Å²	69.9	98%	0.979	37%	0.373	S	S	*	.			trans	-65.4	0	177.5	-73.6	-26.4	0	0	0	112	R820 L933	R820-N935 PolarHBondContact NH1-OXT 2.95Å; R820-N935 PolarHBondContact NH2-O 3.38Å; L933-N935 PolarHBondContact O-N 3.19Å

Retrieved 935 of 935 residues in 393.7 ms (Link to these results)

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