A0A5K4EPU0_SCHMA Loading...

Putative synaptic ras gtpase activating protein, syngap

AlphaFold DB (A0A5K4EQF8), UniProt , Accession A0A5K4EPU0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,240 aa.

						>A0A5K4EPU0_SCHMA|A0A5K4EPU0
MLRSRKSAPVQSTNTKDELATGGLSSVDIGWVGPITLRRRAKPELENEQHKDVSLRISIQEVKNLSAKGRYFCEICLDRTLYARTTSKLSDGTVFWGEQFDLNNLPIISIMTINLFRQATSVKDKRQRNKNQNQFIGYVTIPLNDDSQQCEIQKWFIMQPPQINSNLNFLENLQVCHQQHQQQTDTNQTPSINSSTGVSGRLRKHSIPASCFGYSNSFSIIPNSQYTTNSNNKLNDDNELKYNHMELSKKKCSWTAGVTTDSNFNKTNKIISKSSSSTSTATSPNLSPNSNSVTNNFILSENSLPQLRMMIHYQTVDILPIACYNQLKEFIKTKYLDLIRNLEPKLSAKQKEELTSCFVNIFEKLPDLSVAEFLSVLLREDLSNNGKESMIFRANSAGSKAMECYIKLVGTDYLRYVLGPVIDQLLVIGDDFEIDPSRLGASNDSSTASNNRNTLSVILERNRTALLKNVAMIWQRIESSQCKLPKELRDVFTALALTIEETHGVQSAAHLISSCLFLRFICPAIHGPVLFGLASSIPENNRISRNLTLIAKVLQNLANLTLFEDKEIHMKALNSFIEPEIPTMYKFLRSVASNTDANYHLSTNSDCHEFIELGYEFAKLTQLLNHYVSKINITPQIAELPDLLQNISELLNNQTFTSWDHKNQTSFERNTNSNSHSSRSGIPRHHSLANNNSISVVDNRRPSEATTIIKPSLTKLHEVDRKLSPEASINVKTIRNQQEPNNNATSADSNECISSTRQEKSWDTFIIQKEYLPCKFNSTDMIFKQIHINDLEQPENMEELLSQYREQLRQLNDCIEKVEPNCYHNPNLSHTLSHSTQSVHKIRDPSNRTPNNNTNINGNNNHINNGKFDRNLSRQSTDEISYRQARRKIINSKSNNSTPVPLGRVLKKTQCSHQNSHNKTNNNSISKDDDDNNDDGDDGDNDNYTSECDIGKTLIPTHSTSITTDRSSTSNSDYDYDDYDDRITECTTEDTSEYTKKRTTKNNKPRRISTRQNHLSESPSLDQLAEKLQELKKMLQLERQEIEEVVASKTEVIKQQEKSIEQLESELDQLRKEHRPLKMKPPNGRHTSKSTSRTVSPASSLSSECYSSNLSDITQNCHSYNNPFYHNDIHNNKNSNNNTNNNNHFFDSSISNYHSNNQGLNNLSRGESVITENYRTESFQEKLLWKGQMSRCEPQVKCNSNLLYLSRASEGTGIPLGHLIEANRSVHIGRRESETKLLPH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29	Very low	28.6	Very low	200 Å²	200	162.2 Å²	162.2	99%	0.985	84%	0.838	S	S	*	*				0	76.9	0	-81.8	-177	155.6	0	0	110.2	L81	M1-L81 WeakPolarHBondContact CE-O 3.32Å
2	L	28.9	Very low	28.6	Very low	170 Å²	170	158.1 Å²	158.1	89%	0.89	83%	0.834	S	S	*	*			trans	-144	90.9	167.4	-73.3	171.9	0	0	0	107.3
3	R	24	Very low	28.8	Very low	248 Å²	248	156.1 Å²	156.1	94%	0.936	83%	0.832	S	S	*	*			trans	-119	95.8	168.1	-97.9	-171.6	176.9	-164.1	-1.8	107.6	R5	R3-R5 PolarHBondContact O-N 3.21Å
4	S	27.5	Very low	28.8	Very low	97 Å²	97	156.5 Å²	156.5	68%	0.678	83%	0.834	S	S	*	*			trans	-61.4	111.4	164.5	174.4	0	0	0	0	108.2
5	R	27.6	Very low	29	Very low	239 Å²	239	155 Å²	155	90%	0.902	83%	0.834	S	S	*	*			trans	-87.3	99.8	161.9	-80	-174.2	174.4	-168.7	-1.2	106.6	R3	R3-R5 PolarHBondContact O-N 3.21Å
6	K	29.2	Very low	29	Very low	180 Å²	180	158.1 Å²	158.1	78%	0.783	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-66.3	131.7	161.7	-84.2	-174.7	173.1	-176.9	0	108.4
7	S	28.5	Very low	29.1	Very low	115 Å²	115	158.2 Å²	158.2	80%	0.804	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-57.2	133	175.3	36.3	0	0	0	0	110.5
8	A	27.5	Very low	29	Very low	88 Å²	88	160.6 Å²	160.6	73%	0.727	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-66.9	139.1	175.6	0	0	0	0	0	110	V10	A8-V10 PolarHBondContact O-N 3.36Å
9	P	31.7	Very low	29	Very low	126 Å²	126	160.6 Å²	160.6	82%	0.818	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-70.4	123.2	-179.4	27.8	-31.4	0	0	0	110	Q11	P9-Q11 PolarHBondContact O-N 3.21Å
10	V	31.2	Very low	29	Very low	139 Å²	139	157.4 Å²	157.4	84%	0.842	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-67.1	120.2	172.3	177.5	0	0	0	0	107.9	A8 S12	A8-V10 PolarHBondContact O-N 3.36Å; V10-S12 PolarHBondContact O-N 3.15Å; V10-S12 VanDerWaalsContact O-N 3.15Å
11	Q	28.9	Very low	29	Very low	182 Å²	182	156.7 Å²	156.7	85%	0.85	84%	0.843	S	S	*	*			trans	-60.9	115	175.1	-83.5	176.6	-16.4	0	0	109.8	P9 T13	P9-Q11 PolarHBondContact O-N 3.21Å; Q11-T13 PolarHBondContact O-N 3.27Å
12	S	29.6	Very low	29	Very low	113 Å²	113	150.3 Å²	150.3	79%	0.79	83%	0.828	S	S	*	*			trans	-66.2	107.1	176.5	51.9	0	0	0	0	110.8	V10	V10-S12 PolarHBondContact O-N 3.15Å; V10-S12 VanDerWaalsContact O-N 3.15Å
13	T	30.7	Very low	28.9	Very low	132 Å²	132	145.9 Å²	145.9	81%	0.81	82%	0.824	S	S	*	*			trans	-83.5	122.6	161.8	48.3	0	0	0	0	108.9	Q11 T15	Q11-T13 PolarHBondContact O-N 3.27Å; T13-T15 PolarHBondContact O-N 3.38Å
14	N	29	Very low	29.2	Very low	162 Å²	162	142.5 Å²	142.5	87%	0.866	82%	0.823	S	S	*	*			trans	-51.2	111.6	179.4	-75.6	-32.7	0	0	0	113.3
15	T	32.5	Very low	29.2	Very low	134 Å²	134	143 Å²	143	82%	0.822	83%	0.827	S	S	*	*			trans	-146.3	115.6	145.3	43.5	0	0	0	0	108	T13 D17	T13-T15 PolarHBondContact O-N 3.38Å; T15-D17 PolarHBondContact O-N 3.36Å
16	K	28.9	Very low	29.3	Very low	205 Å²	205	137.1 Å²	137.1	89%	0.891	82%	0.822	S	S	*	*			trans	-62.4	119.5	170.8	-70.7	173.1	173.1	178.6	0	108.1
17	D	29.5	Very low	29.4	Very low	159 Å²	159	134.4 Å²	134.4	85%	0.85	82%	0.82	S	S	*	*			trans	-160.3	119.9	141.5	-89.4	-29.6	0	0	0	107.7	T15 L19	T15-D17 PolarHBondContact O-N 3.36Å; D17-L19 PolarHBondContact O-N 3.35Å
18	E	27.6	Very low	29.8	Very low	201 Å²	201	133.6 Å²	133.6	94%	0.939	81%	0.807	S	S	*	*			trans	-68.4	109.7	179.6	-72.1	174.3	142.1	0	0	109.7
19	L	29.2	Very low	30.2	Very low	162 Å²	162	135.7 Å²	135.7	85%	0.848	81%	0.805	S	S	*	*			trans	-142.7	113.8	162.4	-107.1	129	0	0	0	110.6	D17	D17-L19 PolarHBondContact O-N 3.35Å
20	A	29	Very low	30.6	Very low	95 Å²	95	130.8 Å²	130.8	79%	0.785	78%	0.777	S	S	*	*			trans	18.6	103.7	161.5	0	0	0	0	0	117.2	G22	A20-G22 PolarHBondContact O-N 2.91Å
21	T	28.8	Very low	31.4	Very low	144 Å²	144	129.6 Å²	129.6	88%	0.883	76%	0.758	S	S	*	*			trans	-63	91.4	165.3	50.9	0	0	0	0	110.5	G23	T21-G23 PolarHBondContact O-N 3.33Å
22	G	28.2	Very low	31.9	Very low	66 Å²	66	124.9 Å²	124.9	68%	0.68	74%	0.741	S	S	*	*			trans	-62.9	119.7	160.8	0	0	0	0	0	108.9	A20 L24	A20-G22 PolarHBondContact O-N 2.91Å; G22-L24 PolarHBondContact O-N 3.07Å
23	G	28.4	Very low	33	Very low	77 Å²	77	121 Å²	121	79%	0.794	72%	0.719	S	S	*	*			trans	-54.2	121.9	179.7	0	0	0	0	0	111.1	T21 S25	T21-G23 PolarHBondContact O-N 3.33Å; G23-S25 PolarHBondContact O-N 3.37Å
24	L	28.9	Very low	34.2	Very low	177 Å²	177	118.3 Å²	118.3	93%	0.927	70%	0.703	S	S	*	*			trans	-58.5	103.9	170.4	-76.6	147.8	0	0	0	108.5	G22 S26	G22-L24 PolarHBondContact O-N 3.07Å; L24-S26 PolarHBondContact O-N 3.35Å
25	S	28.8	Very low	35.9	Very low	108 Å²	108	111.5 Å²	111.5	76%	0.755	67%	0.667	S	S	*	*			trans	-59.3	121.9	169.1	50.8	0	0	0	0	108.2	G23 V27	G23-S25 PolarHBondContact O-N 3.37Å; S25-V27 PolarHBondContact O-N 3.2Å
26	S	28.6	Very low	37.3	Very low	114 Å²	114	107.3 Å²	107.3	80%	0.797	64%	0.641	S	S	*	*			trans	-55.5	110.7	171.8	177.3	0	0	0	0	108	L24 D28	L24-S26 PolarHBondContact O-N 3.35Å; S26-D28 PolarHBondContact O-N 3.03Å
27	V	31.9	Very low	39.1	Very low	123 Å²	123	102.5 Å²	102.5	75%	0.745	62%	0.624	S	S	*	*			trans	-60.9	106.8	174	177.9	0	0	0	0	107	S25 I29	S25-V27 PolarHBondContact O-N 3.2Å; V27-I29 PolarHBondContact O-N 3.02Å
28	D	36.1	Very low	41	Very low	99 Å²	99	96.2 Å²	96.2	53%	0.529	59%	0.589	S	S	.	*			trans	-67.3	98.6	177.8	-160	8.3	0	0	0	107.6	S26 G30 K42	S26-D28 PolarHBondContact O-N 3.03Å; D28-G30 VanDerWaalsContact C-N 3.27Å; D28-G30 PolarHBondContact O-N 2.92Å; D28-K42 IonicContact OD1-NZ 3.13Å; D28-K42 IonicContact OD2-NZ 2.92Å; D28-K42 PolarHBondContact OD2-NZ 2.93Å
29	I	37	Very low	43	Very low	131 Å²	131	90.5 Å²	90.5	67%	0.672	56%	0.559	S	S	*	*			trans	-70.9	92.1	176.7	-56.7	169.8	0	0	0	105.2	V27 W31	V27-I29 PolarHBondContact O-N 3.02Å; I29-W31 PolarHBondContact O-N 2.85Å
30	G	39.2	Very low	45.1	Very low	23 Å²	23	93.4 Å²	93.4	24%	0.237	56%	0.558	C	S	.	*			trans	-49.7	133.8	-171.4	0	0	0	0	0	112.2	D28	D28-G30 VanDerWaalsContact C-N 3.27Å; D28-G30 PolarHBondContact O-N 2.92Å
31	W	48.3	Very low	47.2	Very low	115 Å²	115	91 Å²	91	44%	0.436	54%	0.538	S	S	.	.			trans	-64.6	149.3	-174.4	-71.3	88.9	0	0	0	110.8	I29 A41	I29-W31 PolarHBondContact O-N 2.85Å; W31-A41 HydrophobicContact CD2-CB 4.2Å; W31-A41 HydrophobicContact CE3-CB 4.4Å; W31-A41 HydrophobicContact CH2-CB 3.73Å; W31-A41 HydrophobicContact CZ2-CB 3.49Å; W31-A41 VanDerWaalsContact CZ2-CB 3.49Å; W31-A41 HydrophobicContact CZ3-CB 4.18Å
32	V	40.7	Very low	49.5	Very low	83 Å²	83	86.8 Å²	86.8	50%	0.503	51%	0.508	S	S	.	.			trans	-134.9	106.8	167.8	-178.9	0	0	0	0	106.2	Y82 L105	V32-Y82 HydrophobicContact CG1-CE1 4.06Å; V32-Y82 HydrophobicContact CG2-CE1 3.84Å; V32-L105 HydrophobicContact CG2-CD2 4.49Å
33	G	50.7	Low	51.8	Low	31 Å²	31	87.9 Å²	87.9	32%	0.32	50%	0.503	S	S	.	.	S	Bend	trans	174.8	172.7	-178.4	0	0	0	0	0	113.4
34	P	57.1	Low	54.3	Low	75 Å²	75	88.7 Å²	88.7	49%	0.487	49%	0.486	S	S	.	.			trans	-49.6	142.1	172.2	-24.8	31.6	0	0	0	111.5	T36 L37 R38	P34-T36 PolarHBondContact O-N 3.21Å; P34-T36 VanDerWaalsContact O-N 3.1Å; P34-L37 HydrophobicContact CB-CD1 4.34Å; P34-L37 HydrophobicContact CG-CD1 3.95Å; P34-L37 WeakPolarHBondContact O-CB 3.29Å; P34-L37 PolarHBondContact O-N 3.28Å; P34-R38 PolarHBondContact O-N 3.41Å; P34-R38 VanDerWaalsContact O-N 3.15Å
35	I	64.9	Low	56.8	Low	20 Å²	20	80.6 Å²	80.6	10%	0.103	44%	0.443	C	S	.	.	H	α-helix	trans	-60.4	-24.6	-177.1	-165.1	167.2	0	0	0	112.9	R38 R39 E609 E612	I35-R38 PolarHBondContact O-N 3.37Å; I35-R39 WeakPolarHBondContact O-CB 3.31Å; I35-R39 PolarHBondContact O-N 3.13Å; I35-E609 WeakPolarHBondContact CG2-O 3.29Å; I35-E612 HydrophobicContact CD1-CB 3.52Å
36	T	62.3	Low	59.3	Low	46 Å²	46	80.3 Å²	80.3	28%	0.282	43%	0.43	S	S	.	.	H	α-helix	trans	-64	-40.9	171.8	51.2	0	0	0	0	112.6	P34 R40 E609	P34-T36 PolarHBondContact O-N 3.21Å; P34-T36 VanDerWaalsContact O-N 3.1Å; T36-R40 WeakPolarHBondContact O-CB 3.28Å; T36-R40 PolarHBondContact O-N 3.22Å; T36-E609 HydrophobicContact CG2-CB 3.6Å; T36-E609 HydrophobicContact CG2-CG 4.01Å; T36-E609 WeakPolarHBondContact CG2-OE2 3.45Å
37	L	66.6	Low	62.1	Low	103 Å²	103	77.6 Å²	77.6	54%	0.539	41%	0.407	S	S	.	.	H	α-helix	trans	-68.5	-38	173.6	-82.5	151.8	0	0	0	110.9	P34 R40 A41	P34-L37 HydrophobicContact CB-CD1 4.34Å; P34-L37 HydrophobicContact CG-CD1 3.95Å; P34-L37 WeakPolarHBondContact O-CB 3.29Å; P34-L37 PolarHBondContact O-N 3.28Å; L37-R40 PolarHBondContact O-N 2.81Å; L37-A41 WeakPolarHBondContact O-CB 3.33Å; L37-A41 PolarHBondContact O-N 3.5Å
38	R	69.6	Low	64.6	Low	28 Å²	28	76 Å²	76	11%	0.106	39%	0.391	C	S	.	.	H	α-helix	trans	-62.2	-48.2	174	-171.1	178.8	179.2	172.9	-3.9	111.3	P34 I35 R40 A41 K42 L45 H50 D52 N104	P34-R38 PolarHBondContact O-N 3.41Å; P34-R38 VanDerWaalsContact O-N 3.15Å; I35-R38 PolarHBondContact O-N 3.37Å; R38-R40 VanDerWaalsContact C-N 3.34Å; R38-R40 PolarHBondContact O-N 3.19Å; R38-A41 CarbonylContact O-C 3.58Å; R38-A41 PolarHBondContact O-N 3.11Å; R38-A41 VanDerWaalsContact O-N 3.16Å; R38-K42 PolarHBondContact O-N 3.16Å; R38-L45 HydrophobicContact CG-CD2 3.93Å; R38-H50 PolarHBondContact NH2-CD2 3.48Å; R38-D52 IonicContact CZ-OD2 2.8Å; R38-D52 IonicContact NH1-OD2 3.07Å; R38-D52 PolarHBondContact NH1-OD2 3.22Å; R38-N104 PolarHBondContact NH1-OD1 2.99Å
39	R	69.5	Low	67.1	Low	81 Å²	81	74.5 Å²	74.5	31%	0.306	38%	0.381	S	S	.	.	H	α-helix	trans	-61.1	-39.4	174.8	-79.6	-169.5	-89.3	178.5	-12.8	112.6	I35 A41 K42 P43 H608 E609	I35-R39 WeakPolarHBondContact O-CB 3.31Å; I35-R39 PolarHBondContact O-N 3.13Å; R39-A41 VanDerWaalsContact C-N 3.3Å; R39-A41 PolarHBondContact O-N 2.84Å; R39-K42 CarbonylContact O-C 3.58Å; R39-K42 PolarHBondContact O-N 3.04Å; R39-P43 WeakPolarHBondContact O-CA 3.43Å; R39-H608 PolarHBondContact NH2-O 3.49Å; R39-E609 PolarHBondContact NH2-O 2.79Å
40	R	72.7	Confident	69.5	Low	223 Å²	223	69.4 Å²	69.4	84%	0.842	35%	0.354	S	S	*	.	H	α-helix	trans	-68.5	-31	176.4	-158.9	174	-166	140	4.1	112.6	T36 L37 R38	T36-R40 WeakPolarHBondContact O-CB 3.28Å; T36-R40 PolarHBondContact O-N 3.22Å; L37-R40 PolarHBondContact O-N 2.81Å; R38-R40 VanDerWaalsContact C-N 3.34Å; R38-R40 PolarHBondContact O-N 3.19Å
41	A	73.6	Confident	71.7	Confident	43 Å²	43	71.6 Å²	71.6	36%	0.355	36%	0.357	S	S	.	.	H	α-helix	trans	-80.3	-33.9	176	0	0	0	0	0	113	W31 L37 R38 R39	W31-A41 HydrophobicContact CD2-CB 4.2Å; W31-A41 HydrophobicContact CE3-CB 4.4Å; W31-A41 HydrophobicContact CH2-CB 3.73Å; W31-A41 HydrophobicContact CZ2-CB 3.49Å; W31-A41 VanDerWaalsContact CZ2-CB 3.49Å; W31-A41 HydrophobicContact CZ3-CB 4.18Å; L37-A41 WeakPolarHBondContact O-CB 3.33Å; L37-A41 PolarHBondContact O-N 3.5Å; R38-A41 CarbonylContact O-C 3.58Å; R38-A41 PolarHBondContact O-N 3.11Å; R38-A41 VanDerWaalsContact O-N 3.16Å; R39-A41 VanDerWaalsContact C-N 3.3Å; R39-A41 PolarHBondContact O-N 2.84Å
42	K	75.6	Confident	73.6	Confident	56 Å²	56	66.5 Å²	66.5	24%	0.243	34%	0.339	C	S	.	.			trans	-133.4	79.2	179.5	-63.2	-169.4	176.9	-168.6	0	109.6	D28 R38 R39 E44 L45	D28-K42 IonicContact OD1-NZ 3.13Å; D28-K42 IonicContact OD2-NZ 2.92Å; D28-K42 PolarHBondContact OD2-NZ 2.93Å; R38-K42 PolarHBondContact O-N 3.16Å; R39-K42 CarbonylContact O-C 3.58Å; R39-K42 PolarHBondContact O-N 3.04Å; K42-E44 PolarHBondContact O-N 2.94Å; K42-L45 HydrophobicContact CB-CB 3.95Å; K42-L45 HydrophobicContact CD-CD1 4.08Å; K42-L45 VanDerWaalsContact O-CB 3.25Å; K42-L45 WeakPolarHBondContact O-CB 3.46Å; K42-L45 PolarHBondContact O-N 3.48Å
43	P	76.6	Confident	75.8	Confident	90 Å²	90	62.7 Å²	62.7	58%	0.584	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-28.7	-177.7	24.6	-33.4	0	0	0	112.8	R39 L45	R39-P43 WeakPolarHBondContact O-CA 3.43Å; P43-L45 VanDerWaalsContact C-N 3.3Å; P43-L45 PolarHBondContact O-N 3.21Å
44	E	80.5	Confident	77.6	Confident	93 Å²	93	61.4 Å²	61.4	44%	0.435	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	4.2	178.7	-60.9	-59	151.8	0	0	113.7	K42 E46 N47 E48	K42-E44 PolarHBondContact O-N 2.94Å; E44-E46 PolarHBondContact O-N 3.35Å; E44-E46 VanDerWaalsContact O-N 3.12Å; E44-N47 WeakPolarHBondContact O-CA 3.46Å; E44-N47 WeakPolarHBondContact O-CB 3.47Å; E44-N47 PolarHBondContact O-N 3Å; E44-N47 PolarHBondContact OE2-ND2 2.81Å; E44-E48 PolarHBondContact O-N 2.89Å
45	L	81.5	Confident	79	Confident	7 Å²	7	57.9 Å²	57.9	4%	0.037	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-56.8	-35.2	-172.4	-174.6	69.7	0	0	0	113.1	R38 K42 P43 N47 E48 H50	R38-L45 HydrophobicContact CG-CD2 3.93Å; K42-L45 HydrophobicContact CB-CB 3.95Å; K42-L45 HydrophobicContact CD-CD1 4.08Å; K42-L45 VanDerWaalsContact O-CB 3.25Å; K42-L45 WeakPolarHBondContact O-CB 3.46Å; K42-L45 PolarHBondContact O-N 3.48Å; P43-L45 VanDerWaalsContact C-N 3.3Å; P43-L45 PolarHBondContact O-N 3.21Å; L45-N47 PolarHBondContact O-N 3.15Å; L45-E48 PolarHBondContact O-N 3.5Å; L45-E48 VanDerWaalsContact O-O 3.1Å; L45-H50 HydrophobicContact CD1-CB 3.91Å; L45-H50 PolarHBondContact O-CE1 2.98Å; L45-H50 PolarHBondContact O-ND1 3.36Å; L45-H50 VanDerWaalsContact O-ND1 3.14Å
46	E	83.1	Confident	80.2	Confident	102 Å²	102	59.2 Å²	59.2	48%	0.477	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-69.9	-19.8	177.9	63.3	-176	-174.1	0	0	113.7	E44 I321	E44-E46 PolarHBondContact O-N 3.35Å; E44-E46 VanDerWaalsContact O-N 3.12Å; E46-I321 PolarHBondContact O-N 2.96Å
47	N	86.6	Confident	81.5	Confident	57 Å²	57	57.1 Å²	57.1	31%	0.305	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-96.3	-2.4	178.2	-63	-38.8	0	0	0	112.5	E44 L45 P320	E44-N47 WeakPolarHBondContact O-CA 3.46Å; E44-N47 WeakPolarHBondContact O-CB 3.47Å; E44-N47 PolarHBondContact O-N 3Å; E44-N47 PolarHBondContact OE2-ND2 2.81Å; L45-N47 PolarHBondContact O-N 3.15Å; N47-P320 WeakPolarHBondContact O-CB 3.41Å
48	E	85.2	Confident	82.7	Confident	89 Å²	89	52.5 Å²	52.5	42%	0.416	25%	0.246	S	C	.	.	S	Bend	trans	-115.9	144.8	-178	-69.1	179	-179.6	0	0	110.8	E44 L45 H50	E44-E48 PolarHBondContact O-N 2.89Å; L45-E48 PolarHBondContact O-N 3.5Å; L45-E48 VanDerWaalsContact O-O 3.1Å; E48-H50 PolarHBondContact O-N 2.96Å; E48-H50 PolarHBondContact O-ND1 3.43Å; E48-H50 VanDerWaalsContact O-ND1 3.14Å
49	Q	87.5	Confident	83.9	Confident	69 Å²	69	51.1 Å²	51.1	32%	0.322	24%	0.241	S	C	.	.			trans	-66.8	127.4	168.1	-171.7	-178.8	17.2	0	0	108.8	I318 L319	Q49-I318 CarbonylContact C-O 3.45Å; Q49-I318 VanDerWaalsContact CA-O 3.26Å; Q49-I318 WeakPolarHBondContact CA-O 3.35Å; Q49-I318 WeakPolarHBondContact CG-O 3.45Å; Q49-L319 HydrophobicContact CG-CD2 4.32Å
50	H	87.2	Confident	85	Confident	23 Å²	23	48.4 Å²	48.4	11%	0.106	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	165.6	177.8	68.9	-87.3	0	0	0	111.3	R38 L45 E48 I318 E612	R38-H50 PolarHBondContact NH2-CD2 3.48Å; L45-H50 HydrophobicContact CD1-CB 3.91Å; L45-H50 PolarHBondContact O-CE1 2.98Å; L45-H50 PolarHBondContact O-ND1 3.36Å; L45-H50 VanDerWaalsContact O-ND1 3.14Å; E48-H50 PolarHBondContact O-N 2.96Å; E48-H50 PolarHBondContact O-ND1 3.43Å; E48-H50 VanDerWaalsContact O-ND1 3.14Å; H50-I318 PolarHBondContact N-O 3.46Å; H50-I318 WeakPolarHBondContact NE2-CD1 3.3Å; H50-I318 WeakPolarHBondContact O-CA 3.28Å; H50-I318 WeakPolarHBondContact O-CB 3.46Å; H50-I318 PolarHBondContact O-N 2.98Å; H50-E612 IonicContact CE1-OE1 3.78Å; H50-E612 PolarHBondContact CE1-OE1 3.21Å; H50-E612 IonicContact NE2-OE1 3.9Å; H50-E612 PolarHBondContact NE2-OE1 2.95Å; H50-E612 VanDerWaalsContact NE2-OE1 3.09Å
51	K	86	Confident	86	Confident	70 Å²	70	39.8 Å²	39.8	30%	0.304	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	125.6	-179	-177.8	172.1	-96	-157.3	0	108.9	V53 D145 T315 V316 D317	K51-V53 HydrophobicContact CG-CG2 4.25Å; K51-D145 IonicContact NZ-OD2 3.44Å; K51-D145 PolarHBondContact NZ-OD2 3.48Å; K51-T315 HydrophobicContact CD-CG2 3.21Å; K51-T315 HydrophobicContact CG-CG2 3.34Å; K51-V316 WeakPolarHBondContact CA-O 3.34Å; K51-D317 WeakPolarHBondContact CE-OD1 3.39Å; K51-D317 IonicContact NZ-OD1 3.6Å
52	D	87	Confident	87.1	Confident	8 Å²	8	37.8 Å²	37.8	4%	0.043	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	132	169	-165	-99.7	0	0	0	110.4	R38 N104 T315 V316 I318 Y615	R38-D52 IonicContact CZ-OD2 2.8Å; R38-D52 IonicContact NH1-OD2 3.07Å; R38-D52 PolarHBondContact NH1-OD2 3.22Å; D52-N104 PolarHBondContact OD2-OD1 3.03Å; D52-T315 CarbonylContact O-C 3.14Å; D52-T315 WeakPolarHBondContact O-CA 3.29Å; D52-V316 PolarHBondContact N-O 3.42Å; D52-V316 PolarHBondContact O-N 2.7Å; D52-I318 HydrophobicContact CB-CD1 3.7Å; D52-Y615 HydrophobicContact CB-CD2 4.04Å; D52-Y615 HydrophobicContact CB-CE2 4.27Å
53	V	87.6	Confident	88	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.012	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	125.8	-178.4	-175.6	0	0	0	0	108.2	K51 N104 L105 I108 Y313 T315	K51-V53 HydrophobicContact CG-CG2 4.25Å; V53-N104 PolarHBondContact O-N 2.79Å; V53-L105 HydrophobicContact CB-CB 4.17Å; V53-L105 WeakPolarHBondContact CB-O 3.24Å; V53-L105 HydrophobicContact CG1-CB 4.12Å; V53-L105 PolarHBondContact O-N 3.32Å; V53-I108 HydrophobicContact CG1-CG1 4.46Å; V53-Y313 HydrophobicContact CG1-CD2 4.38Å; V53-Y313 HydrophobicContact CG1-CE2 3.43Å; V53-Y313 VanDerWaalsContact CG1-CE2 3.43Å; V53-T315 HydrophobicContact CG2-CG2 4.43Å
54	S	87.9	Confident	88.7	Confident	5 Å²	5	37.3 Å²	37.3	4%	0.035	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	145.9	177.1	62.7	0	0	0	0	111.5	L102 Y313 Q314	S54-L102 CarbonylContact C-O 3.49Å; S54-L102 WeakPolarHBondContact CA-O 3.48Å; S54-Y313 WeakPolarHBondContact O-CA 3.47Å; S54-Q314 PolarHBondContact N-O 2.92Å; S54-Q314 PolarHBondContact O-N 3.1Å
55	L	88.5	Confident	89.2	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	113.4	177.8	177.8	67.2	0	0	0	109	L77 L102 L105 I108 M111 L143 I311 Y313	L55-L77 HydrophobicContact CD2-CD1 4.03Å; L55-L77 HydrophobicContact CD2-CD2 3.5Å; L55-L77 HydrophobicContact CD2-CG 4.41Å; L55-L102 HydrophobicContact CB-CB 4.42Å; L55-L102 HydrophobicContact CD2-CD1 4.39Å; L55-L102 PolarHBondContact N-O 3.37Å; L55-L102 WeakPolarHBondContact O-CB 3.49Å; L55-L102 PolarHBondContact O-N 3.5Å; L55-L105 HydrophobicContact CB-CD1 3.6Å; L55-I108 HydrophobicContact CD2-CD1 4.35Å; L55-M111 HydrophobicContact CD2-SD 3.81Å; L55-L143 HydrophobicContact CD2-CD1 4.46Å; L55-I311 HydrophobicContact CD1-CG2 3.55Å; L55-Y313 HydrophobicContact CD1-CD2 4.34Å
56	R	88.6	Confident	89.4	Confident	49 Å²	49	35.9 Å²	35.9	19%	0.185	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123.4	167.9	-60	-172.3	-73.1	179.7	-6	108.8	D101 I311 H312	R56-D101 WeakPolarHBondContact CB-OD1 3.41Å; R56-D101 WeakPolarHBondContact CD-OD1 3.49Å; R56-D101 HydrophobicContact CG-CB 4.28Å; R56-D101 WeakPolarHBondContact CG-OD1 3.48Å; R56-I311 CarbonylContact O-C 3.59Å; R56-I311 WeakPolarHBondContact O-CA 3.3Å; R56-H312 HydrophobicContact CB-CB 4.3Å; R56-H312 PolarHBondContact N-O 3Å; R56-H312 PolarHBondContact NE-ND1 2.97Å; R56-H312 PolarHBondContact NH2-CE1 3.08Å; R56-H312 PolarHBondContact NH2-ND1 3.13Å; R56-H312 PolarHBondContact O-N 3.13Å
57	I	91.1	Very high	89.3	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	134.1	180	-179.2	163.7	0	0	0	110.4	I59 I75 Q99 F100 M111 I113 M309 M310 I311	I57-I59 HydrophobicContact CD1-CD1 3.8Å; I57-I59 HydrophobicContact CG1-CD1 3.97Å; I57-I75 HydrophobicContact CD1-CD1 4.34Å; I57-I75 HydrophobicContact CG2-CD1 3.83Å; I57-Q99 CarbonylContact O-C 3.55Å; I57-Q99 WeakPolarHBondContact O-CA 3.49Å; I57-F100 HydrophobicContact CG2-CB 3.82Å; I57-F100 HydrophobicContact CG2-CD2 4.22Å; I57-F100 HydrophobicContact CG2-CG 4.47Å; I57-F100 PolarHBondContact N-O 3.46Å; I57-F100 PolarHBondContact O-N 3.21Å; I57-M111 HydrophobicContact CD1-CE 3.87Å; I57-M111 HydrophobicContact CD1-SD 3.57Å; I57-M111 VanDerWaalsContact CD1-SD 3.57Å; I57-I113 HydrophobicContact CD1-CD1 3.81Å; I57-M309 HydrophobicContact CD1-SD 4.18Å; I57-M310 CarbonylContact C-O 3.47Å; I57-M310 WeakPolarHBondContact CA-O 3.31Å; I57-I311 HydrophobicContact CD1-CG1 4.45Å
58	S	91.8	Very high	89.1	Confident	6 Å²	6	39.6 Å²	39.6	4%	0.042	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	115.3	171.7	-176.6	0	0	0	0	111.1	Q60 E98 M309 M310	S58-Q60 PolarHBondContact O-N 3.49Å; S58-Q60 PolarHBondContact OG-NE2 2.72Å; S58-E98 CarbonylContact C-O 3.59Å; S58-E98 VanDerWaalsContact CA-O 3.23Å; S58-E98 WeakPolarHBondContact CA-O 3.46Å; S58-E98 PolarHBondContact OG-O 3.48Å; S58-M309 CarbonylContact O-C 3.57Å; S58-M309 WeakPolarHBondContact O-CA 3.37Å; S58-M309 VanDerWaalsContact O-CB 3.27Å; S58-M309 WeakPolarHBondContact O-CB 3.39Å; S58-M310 PolarHBondContact N-O 3.05Å; S58-M310 PolarHBondContact O-N 3.07Å
59	I	94	Very high	89.2	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	106.5	175.4	-55.4	-59.4	0	0	0	108.1	I57 I75 T85 W96 G97 E98 F100 I113 L307 M309	I57-I59 HydrophobicContact CD1-CD1 3.8Å; I57-I59 HydrophobicContact CG1-CD1 3.97Å; I59-I75 HydrophobicContact CD1-CD1 4.27Å; I59-I75 HydrophobicContact CG1-CD1 3.96Å; I59-T85 HydrophobicContact CB-CG2 3.87Å; I59-T85 HydrophobicContact CG1-CG2 3.98Å; I59-T85 HydrophobicContact CG2-CG2 3.92Å; I59-W96 HydrophobicContact CG2-CD2 4.39Å; I59-W96 HydrophobicContact CG2-CE3 3.86Å; I59-W96 HydrophobicContact CG2-CZ3 4.39Å; I59-G97 WeakPolarHBondContact O-CA 3.35Å; I59-G97 PolarHBondContact O-N 3.09Å; I59-E98 PolarHBondContact N-O 2.96Å; I59-E98 PolarHBondContact O-N 2.83Å; I59-F100 HydrophobicContact CG1-CD2 4.47Å; I59-F100 HydrophobicContact CG1-CE2 4.05Å; I59-I113 HydrophobicContact CD1-CD1 4.46Å; I59-I113 HydrophobicContact CD1-CG2 4.38Å; I59-L307 HydrophobicContact CG2-CD1 4.14Å; I59-M309 HydrophobicContact CD1-CB 4.23Å; I59-M309 HydrophobicContact CD1-CE 4.31Å
60	Q	92.9	Very high	89.4	Confident	24 Å²	24	38.4 Å²	38.4	11%	0.112	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-73.2	-172.1	-66.2	-70	-28.1	0	0	110.5	S58 F95 W96 G97 R308	S58-Q60 PolarHBondContact O-N 3.49Å; S58-Q60 PolarHBondContact OG-NE2 2.72Å; Q60-F95 CarbonylContact O-C 3.55Å; Q60-W96 PolarHBondContact O-N 3.46Å; Q60-G97 PolarHBondContact O-N 3.41Å; Q60-R308 HydrophobicContact CB-CB 4.22Å; Q60-R308 HydrophobicContact CB-CG 4.2Å; Q60-R308 WeakPolarHBondContact CB-O 3.21Å; Q60-R308 PolarHBondContact N-O 2.75Å
61	E	93.8	Very high	89.8	Confident	42 Å²	42	37.5 Å²	37.5	20%	0.196	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	159.1	-176.1	61.3	-179.6	-176.7	0	0	112.8	V94 F95 W155 L307 R308	E61-V94 CarbonylContact C-O 3.42Å; E61-V94 WeakPolarHBondContact CA-O 3.44Å; E61-V94 VanDerWaalsContact CB-O 3.28Å; E61-V94 WeakPolarHBondContact CB-O 3.49Å; E61-F95 HydrophobicContact CB-CB 4.17Å; E61-F95 HydrophobicContact CB-CD2 3.87Å; E61-F95 HydrophobicContact CB-CG 4.45Å; E61-F95 HydrophobicContact CG-CD2 4.47Å; E61-W155 HydrophobicContact CG-CH2 3.69Å; E61-W155 HydrophobicContact CG-CZ2 4.24Å; E61-W155 HydrophobicContact CG-CZ3 4.42Å; E61-W155 WeakPolarHBondContact OE1-CH2 3.47Å; E61-W155 VanDerWaalsContact OE1-CZ2 3.23Å; E61-W155 WeakPolarHBondContact OE1-CZ2 3.49Å; E61-L307 CarbonylContact O-C 3.52Å; E61-R308 VanDerWaalsContact CD-CZ 3.45Å; E61-R308 HydrophobicContact CG-CB 3.97Å; E61-R308 PolarHBondContact N-O 3.15Å; E61-R308 PolarHBondContact O-N 3.11Å; E61-R308 IonicContact OE1-CZ 2.98Å; E61-R308 IonicContact OE1-NE 2.68Å; E61-R308 PolarHBondContact OE1-NE 2.92Å; E61-R308 IonicContact OE1-NH1 3.6Å; E61-R308 PolarHBondContact OE1-NH1 3.11Å; E61-R308 IonicContact OE1-NH2 2.63Å; E61-R308 PolarHBondContact OE1-NH2 3.39Å; E61-R308 IonicContact OE2-NH2 3.09Å; E61-R308 PolarHBondContact OE2-NH2 3.37Å
62	V	95.7	Very high	90.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	146.4	171.1	65.8	0	0	0	0	109.9	L65 T93 V94 W96 L115 P305 Q306 L307	V62-L65 HydrophobicContact CB-CD1 4.44Å; V62-L65 HydrophobicContact CG1-CD1 3.32Å; V62-L65 HydrophobicContact CG1-CG 3.96Å; V62-L65 HydrophobicContact CG2-CD1 4.28Å; V62-L65 HydrophobicContact CG2-CD2 4.06Å; V62-L65 HydrophobicContact CG2-CG 4.14Å; V62-T93 CarbonylContact O-C 3.54Å; V62-T93 WeakPolarHBondContact O-CA 3.31Å; V62-T93 WeakPolarHBondContact O-CB 3.2Å; V62-V94 HydrophobicContact CG1-CB 3.85Å; V62-V94 HydrophobicContact CG1-CG2 4.43Å; V62-V94 PolarHBondContact N-O 3.28Å; V62-V94 PolarHBondContact O-N 3.07Å; V62-W96 HydrophobicContact CB-CH2 4.18Å; V62-W96 HydrophobicContact CB-CZ3 3.81Å; V62-W96 HydrophobicContact CG1-CH2 3.36Å; V62-W96 HydrophobicContact CG1-CZ3 3.37Å; V62-L115 HydrophobicContact CG2-CD2 4.26Å; V62-P305 HydrophobicContact CG2-CB 4.24Å; V62-Q306 CarbonylContact C-O 3.57Å; V62-Q306 WeakPolarHBondContact CA-O 3.48Å; V62-Q306 VanDerWaalsContact CG2-O 3.27Å; V62-Q306 WeakPolarHBondContact CG2-O 3.21Å; V62-L307 HydrophobicContact CB-CD1 3.93Å; V62-L307 HydrophobicContact CG2-CD1 4.49Å
63	K	94.1	Very high	90.8	Very high	65 Å²	65	33.8 Å²	33.8	28%	0.283	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	174.8	174.3	66.6	-178.1	178.9	179.8	0	111.3	L65 T93 W155 P305 Q306	K63-L65 VanDerWaalsContact C-N 3.33Å; K63-T93 HydrophobicContact CB-CG2 3.7Å; K63-W155 HydrophobicContact CB-CZ3 4.49Å; K63-W155 HydrophobicContact CD-CH2 3.79Å; K63-W155 HydrophobicContact CD-CZ2 4.45Å; K63-W155 HydrophobicContact CD-CZ3 3.83Å; K63-W155 HydrophobicContact CG-CH2 4.06Å; K63-W155 HydrophobicContact CG-CZ3 3.75Å; K63-P305 WeakPolarHBondContact O-CA 3.32Å; K63-Q306 HydrophobicContact CG-CB 4.01Å; K63-Q306 PolarHBondContact N-O 2.91Å; K63-Q306 PolarHBondContact O-N 3.21Å; K63-Q306 VanDerWaalsContact O-N 3.14Å
64	N	93.2	Very high	91.3	Very high	71 Å²	71	35 Å²	35	38%	0.38	18%	0.179	S	C	.	.	S	Bend	trans	63	38.5	-175	-56.2	-8.4	0	0	0	112.1	G92 L304	N64-G92 PolarHBondContact N-O 3.32Å; N64-L304 WeakPolarHBondContact CB-O 3.15Å; N64-L304 PolarHBondContact ND2-O 3.32Å
65	L	90.8	Very high	91.6	Very high	19 Å²	19	34.7 Å²	34.7	10%	0.099	18%	0.177	C	C	.	.			trans	-97.9	162.7	173.7	-63.4	-168.3	0	0	0	111.8	V62 K63 Y71 G92 V94 L115 P305	V62-L65 HydrophobicContact CB-CD1 4.44Å; V62-L65 HydrophobicContact CG1-CD1 3.32Å; V62-L65 HydrophobicContact CG1-CG 3.96Å; V62-L65 HydrophobicContact CG2-CD1 4.28Å; V62-L65 HydrophobicContact CG2-CD2 4.06Å; V62-L65 HydrophobicContact CG2-CG 4.14Å; K63-L65 VanDerWaalsContact C-N 3.33Å; L65-Y71 HydrophobicContact CB-CE2 4.46Å; L65-Y71 HydrophobicContact CD1-CD1 3.77Å; L65-Y71 HydrophobicContact CD1-CD2 3.94Å; L65-Y71 HydrophobicContact CD1-CE1 4.01Å; L65-Y71 HydrophobicContact CD1-CE2 4.2Å; L65-Y71 HydrophobicContact CD1-CG 3.71Å; L65-Y71 HydrophobicContact CD2-CE1 4.27Å; L65-G92 PolarHBondContact N-O 2.89Å; L65-V94 HydrophobicContact CD1-CG2 3.93Å; L65-L115 HydrophobicContact CD2-CD2 3.68Å; L65-P305 HydrophobicContact CD2-CB 3.87Å; L65-P305 HydrophobicContact CD2-CG 4.01Å
66	S	86.1	Confident	91.9	Very high	51 Å²	51	35.3 Å²	35.3	36%	0.357	18%	0.181	S	C	.	.			trans	-75.1	134.1	169.3	82.1	0	0	0	0	109.9	K68 Y71	S66-K68 PolarHBondContact O-N 3.06Å; S66-K68 PolarHBondContact OG-O 3.13Å; S66-Y71 PolarHBondContact O-OH 3.48Å; S66-Y71 PolarHBondContact OG-OH 3.1Å
67	A	80.9	Confident	92.1	Very high	66 Å²	66	33 Å²	33	55%	0.545	17%	0.173	S	C	.	.	S	Bend	trans	-66.9	12.7	176.6	0	0	0	0	0	114.5	S90	A67-S90 CarbonylContact C-O 3.45Å; A67-S90 WeakPolarHBondContact CA-O 3.26Å
68	K	81.5	Confident	92.1	Very high	172 Å²	172	35.7 Å²	35.7	75%	0.748	19%	0.187	S	C	*	.	S	Bend	trans	-122.5	99.4	-179	-68.5	-175.9	-178.6	176.6	0	110	S66	S66-K68 PolarHBondContact O-N 3.06Å; S66-K68 PolarHBondContact OG-O 3.13Å
69	G	86.6	Confident	91.9	Very high	20 Å²	20	44.2 Å²	44.2	21%	0.206	22%	0.218	C	C	.	.	S	Bend	trans	135	173.6	170.3	0	0	0	0	0	113.3	S90	G69-S90 PolarHBondContact O-N 3.14Å; G69-S90 VanDerWaalsContact O-N 3.15Å
70	R	92.9	Very high	91.8	Very high	112 Å²	112	47.9 Å²	47.9	42%	0.423	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	142.2	168.6	-61.7	-177.7	80.8	101.1	-3.6	109.4	S87 K88 L89 R117 Q118	R70-S87 VanDerWaalsContact CZ-O 3.25Å; R70-S87 PolarHBondContact NE-O 2.77Å; R70-S87 PolarHBondContact NH2-O 3.45Å; R70-K88 CarbonylContact C-O 3.54Å; R70-K88 WeakPolarHBondContact CA-O 3.34Å; R70-L89 HydrophobicContact CG-CD2 3.48Å; R70-L89 VanDerWaalsContact CG-CD2 3.48Å; R70-L89 HydrophobicContact CG-CG 3.84Å; R70-R117 CarbonylContact O-C 3.34Å; R70-R117 WeakPolarHBondContact O-CA 3.25Å; R70-Q118 HydrophobicContact CB-CB 4.1Å; R70-Q118 WeakPolarHBondContact O-CB 3.39Å; R70-Q118 PolarHBondContact O-N 2.96Å
71	Y	96	Very high	91.7	Very high	4 Å²	4	49.5 Å²	49.5	2%	0.016	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	149.6	-177.4	-66.6	-99.3	0	0	0	111	L65 S66 S87 K88 V94 L115 F116 R117 I136	L65-Y71 HydrophobicContact CB-CE2 4.46Å; L65-Y71 HydrophobicContact CD1-CD1 3.77Å; L65-Y71 HydrophobicContact CD1-CD2 3.94Å; L65-Y71 HydrophobicContact CD1-CE1 4.01Å; L65-Y71 HydrophobicContact CD1-CE2 4.2Å; L65-Y71 HydrophobicContact CD1-CG 3.71Å; L65-Y71 HydrophobicContact CD2-CE1 4.27Å; S66-Y71 PolarHBondContact O-OH 3.48Å; S66-Y71 PolarHBondContact OG-OH 3.1Å; Y71-S87 CarbonylContact O-C 3.56Å; Y71-S87 VanDerWaalsContact O-CA 3.31Å; Y71-S87 WeakPolarHBondContact O-CA 3.36Å; Y71-K88 PolarHBondContact N-O 3.48Å; Y71-K88 PolarHBondContact O-N 3.05Å; Y71-V94 HydrophobicContact CD2-CG2 4.36Å; Y71-L115 HydrophobicContact CD1-CD1 4.25Å; Y71-L115 HydrophobicContact CD1-CG 4.42Å; Y71-F116 VanDerWaalsContact CA-O 3.24Å; Y71-F116 WeakPolarHBondContact CA-O 3.42Å; Y71-R117 HydrophobicContact CD1-CB 4.03Å; Y71-R117 HydrophobicContact CD1-CG 4.49Å; Y71-R117 HydrophobicContact CE1-CB 3.77Å; Y71-R117 HydrophobicContact CE1-CG 4.1Å; Y71-R117 HydrophobicContact CE2-CG 4.44Å; Y71-I136 HydrophobicContact CD1-CG1 4.39Å; Y71-I136 HydrophobicContact CE1-CD1 4.37Å; Y71-I136 HydrophobicContact CE1-CG1 4.01Å
72	F	96.1	Very high	91.6	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	159.7	172.4	66.5	-88.2	0	0	0	110.1	E74 R84 S87 F116 Q118 N133	F72-E74 HydrophobicContact CD2-CG 4.3Å; F72-E74 HydrophobicContact CE2-CG 3.91Å; F72-R84 HydrophobicContact CD2-CG 3.58Å; F72-R84 HydrophobicContact CE2-CG 4.1Å; F72-R84 HydrophobicContact CG-CG 4.47Å; F72-S87 WeakPolarHBondContact CD1-OG 3.15Å; F72-F116 HydrophobicContact CD1-CB 4.14Å; F72-F116 HydrophobicContact CD2-CB 4.26Å; F72-F116 HydrophobicContact CD2-CD2 4.45Å; F72-F116 HydrophobicContact CE1-CB 3.54Å; F72-F116 HydrophobicContact CE1-CG 4.46Å; F72-F116 HydrophobicContact CE2-CB 3.71Å; F72-F116 AromaticContact CE2-CD2 3.72Å; F72-F116 HydrophobicContact CE2-CD2 3.72Å; F72-F116 AromaticContact CE2-CG 3.95Å; F72-F116 HydrophobicContact CE2-CG 3.95Å; F72-F116 HydrophobicContact CG-CB 4.46Å; F72-F116 HydrophobicContact CZ-CB 3.3Å; F72-F116 HydrophobicContact CZ-CD2 4.02Å; F72-F116 AromaticContact CZ-CG 3.76Å; F72-F116 HydrophobicContact CZ-CG 3.76Å; F72-F116 PolarHBondContact N-O 3.04Å; F72-F116 PolarHBondContact O-N 3.02Å; F72-Q118 HydrophobicContact CD1-CB 4.28Å; F72-Q118 HydrophobicContact CE1-CB 4.25Å; F72-N133 HydrophobicContact CE1-CB 4.24Å; F72-N133 WeakPolarHBondContact CE1-ND2 3.39Å; F72-N133 HydrophobicContact CZ-CB 4.12Å; F72-N133 WeakPolarHBondContact CZ-ND2 3.34Å
73	C	97.2	Very high	91.5	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	144.1	176.1	-67	0	0	0	0	110.5	R84 T85 I113 N114	C73-R84 CarbonylContact O-C 3.44Å; C73-R84 VanDerWaalsContact O-CA 3.26Å; C73-R84 WeakPolarHBondContact O-CA 3.45Å; C73-R84 VanDerWaalsContact O-CG 3.31Å; C73-R84 WeakPolarHBondContact O-CG 3.46Å; C73-T85 HydrophobicContact CB-CG2 4.08Å; C73-T85 PolarHBondContact N-OG1 3.3Å; C73-T85 PolarHBondContact O-N 2.92Å; C73-I113 HydrophobicContact CB-CG2 3.91Å; C73-N114 CarbonylContact C-O 3.59Å; C73-N114 VanDerWaalsContact CA-O 3.22Å; C73-N114 WeakPolarHBondContact CA-O 3.44Å
74	E	97.2	Very high	91.5	Very high	27 Å²	27	54 Å²	54	13%	0.126	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.3	167.4	-75.8	-177.9	174.7	0	0	109.5	F72 L81 R84 I113 N114 F116	F72-E74 HydrophobicContact CD2-CG 4.3Å; F72-E74 HydrophobicContact CE2-CG 3.91Å; E74-L81 HydrophobicContact CB-CD1 3.59Å; E74-L81 HydrophobicContact CG-CD1 3.8Å; E74-R84 HydrophobicContact CG-CB 4.43Å; E74-R84 HydrophobicContact CG-CG 3.99Å; E74-R84 IonicContact OE1-CZ 3.7Å; E74-R84 VanDerWaalsContact OE1-CZ 3.26Å; E74-R84 IonicContact OE1-NE 3.91Å; E74-R84 PolarHBondContact OE1-NE 3.15Å; E74-R84 VanDerWaalsContact OE1-NE 3.09Å; E74-R84 IonicContact OE1-NH2 3.59Å; E74-R84 PolarHBondContact OE1-NH2 3.43Å; E74-I113 CarbonylContact O-C 3.46Å; E74-I113 VanDerWaalsContact O-CA 3.3Å; E74-I113 WeakPolarHBondContact O-CA 3.1Å; E74-N114 HydrophobicContact CB-CB 4.23Å; E74-N114 PolarHBondContact N-O 2.83Å; E74-N114 PolarHBondContact O-N 3.35Å; E74-F116 HydrophobicContact CB-CE2 4.24Å; E74-F116 HydrophobicContact CG-CD2 4.21Å; E74-F116 HydrophobicContact CG-CE2 4.04Å; E74-F116 VanDerWaalsContact OE2-CE2 3.32Å; E74-F116 WeakPolarHBondContact OE2-CE2 3.37Å
75	I	95.5	Very high	91.6	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	110.6	178.9	-49.4	-171	0	0	0	107.7	I57 I59 Y82 A83 F100 M111 I113	I57-I75 HydrophobicContact CD1-CD1 4.34Å; I57-I75 HydrophobicContact CG2-CD1 3.83Å; I59-I75 HydrophobicContact CD1-CD1 4.27Å; I59-I75 HydrophobicContact CG1-CD1 3.96Å; I75-Y82 PolarHBondContact O-N 3.45Å; I75-A83 HydrophobicContact CB-CB 4.09Å; I75-A83 HydrophobicContact CD1-CB 4.02Å; I75-A83 HydrophobicContact CG1-CB 4.18Å; I75-A83 PolarHBondContact N-O 3.08Å; I75-A83 PolarHBondContact O-N 3.11Å; I75-F100 HydrophobicContact CD1-CB 4.49Å; I75-F100 HydrophobicContact CD1-CD2 3.33Å; I75-F100 HydrophobicContact CD1-CE2 3.6Å; I75-F100 HydrophobicContact CD1-CG 3.91Å; I75-F100 HydrophobicContact CD1-CZ 4.35Å; I75-M111 HydrophobicContact CG2-SD 4.4Å; I75-I113 HydrophobicContact CB-CD1 4.01Å; I75-I113 HydrophobicContact CG1-CD1 3.93Å; I75-I113 HydrophobicContact CG2-CD1 3.68Å
76	C	94.8	Very high	91.6	Very high	12 Å²	12	53.3 Å²	53.3	8%	0.081	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.5	179.2	-61.5	0	0	0	0	111	T80 M111 T112	C76-T80 CarbonylContact C-O 3.59Å; C76-T80 WeakPolarHBondContact CA-O 3.48Å; C76-M111 CarbonylContact O-C 3.53Å; C76-M111 WeakPolarHBondContact O-CA 3.31Å; C76-T112 PolarHBondContact N-O 3.07Å; C76-T112 PolarHBondContact O-N 2.78Å
77	L	92	Very high	91.9	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	125.5	172.2	-47.7	177.8	0	0	0	108.2	L55 R79 T80 Y82 L102 L105 I108 M111	L55-L77 HydrophobicContact CD2-CD1 4.03Å; L55-L77 HydrophobicContact CD2-CD2 3.5Å; L55-L77 HydrophobicContact CD2-CG 4.41Å; L77-R79 PolarHBondContact O-N 3.07Å; L77-R79 VanDerWaalsContact O-N 3.09Å; L77-T80 PolarHBondContact N-O 3.21Å; L77-T80 WeakPolarHBondContact O-CB 3.28Å; L77-T80 PolarHBondContact O-N 3.19Å; L77-Y82 HydrophobicContact CB-CD2 3.68Å; L77-Y82 HydrophobicContact CB-CE2 3.62Å; L77-Y82 HydrophobicContact CD1-CD1 4.04Å; L77-Y82 HydrophobicContact CD1-CD2 3.74Å; L77-Y82 HydrophobicContact CD1-CE1 4.19Å; L77-Y82 HydrophobicContact CD1-CE2 3.93Å; L77-Y82 HydrophobicContact CD1-CG 3.81Å; L77-Y82 HydrophobicContact CG-CD2 3.6Å; L77-Y82 HydrophobicContact CG-CE2 3.98Å; L77-Y82 HydrophobicContact CG-CG 4.03Å; L77-L102 HydrophobicContact CD1-CD1 3.88Å; L77-L105 HydrophobicContact CD1-CD1 3.89Å; L77-L105 HydrophobicContact CD1-CD2 4.06Å; L77-I108 HydrophobicContact CB-CG2 4.08Å; L77-I108 HydrophobicContact CD1-CD1 3.95Å; L77-I108 HydrophobicContact CD2-CD1 4.34Å; L77-M111 HydrophobicContact CD2-CB 3.85Å; L77-M111 HydrophobicContact CD2-CG 3.73Å; L77-M111 HydrophobicContact CD2-SD 4.1Å
78	D	91.3	Very high	92.3	Very high	57 Å²	57	51.8 Å²	51.8	31%	0.305	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.1	45.6	-173.4	-68.2	-20.9	0	0	0	112.8	T80 I108 S109 I110	D78-T80 PolarHBondContact O-N 2.97Å; D78-I108 VanDerWaalsContact OD2-CA 3.32Å; D78-I108 WeakPolarHBondContact OD2-CA 3.17Å; D78-S109 PolarHBondContact OD1-N 2.91Å; D78-S109 VanDerWaalsContact OD1-N 3.12Å; D78-S109 PolarHBondContact OD1-OG 3.19Å; D78-S109 PolarHBondContact OD2-N 2.86Å; D78-S109 VanDerWaalsContact OD2-N 3.11Å; D78-I110 PolarHBondContact N-O 3.18Å; D78-I110 WeakPolarHBondContact OD1-CG1 3.3Å; D78-I110 PolarHBondContact OD1-N 3.13Å
79	R	87.9	Confident	92.8	Very high	186 Å²	186	49.3 Å²	49.3	70%	0.702	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.1	3.5	-179.6	-46.5	173.5	-179.9	-172	-1.5	115.5	L77	L77-R79 PolarHBondContact O-N 3.07Å; L77-R79 VanDerWaalsContact O-N 3.09Å
80	T	90.4	Very high	92.9	Very high	77 Å²	77	48.8 Å²	48.8	47%	0.472	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130.2	173.7	-59	0	0	0	0	109.4	C76 L77 D78 Y82	C76-T80 CarbonylContact C-O 3.59Å; C76-T80 WeakPolarHBondContact CA-O 3.48Å; L77-T80 PolarHBondContact N-O 3.21Å; L77-T80 WeakPolarHBondContact O-CB 3.28Å; L77-T80 PolarHBondContact O-N 3.19Å; D78-T80 PolarHBondContact O-N 2.97Å; T80-Y82 HydrophobicContact CG2-CD2 4.32Å; T80-Y82 HydrophobicContact CG2-CE2 3.89Å; T80-Y82 VanDerWaalsContact O-CD2 3.27Å; T80-Y82 WeakPolarHBondContact O-CD2 3.4Å; T80-Y82 PolarHBondContact O-N 2.95Å
81	L	91.8	Very high	92.6	Very high	58 Å²	58	49.5 Å²	49.5	30%	0.304	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	122.6	177	178.3	67.7	0	0	0	110.1	M1 E74 A83	M1-L81 WeakPolarHBondContact CE-O 3.32Å; E74-L81 HydrophobicContact CB-CD1 3.59Å; E74-L81 HydrophobicContact CG-CD1 3.8Å; L81-A83 WeakPolarHBondContact CD1-O 3.13Å
82	Y	91	Very high	92.2	Very high	57 Å²	57	50.3 Å²	50.3	22%	0.224	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	-38	177.3	-84.5	-102.3	0	0	0	112.9	V32 I75 L77 T80 L102 L105	V32-Y82 HydrophobicContact CG1-CE1 4.06Å; V32-Y82 HydrophobicContact CG2-CE1 3.84Å; I75-Y82 PolarHBondContact O-N 3.45Å; L77-Y82 HydrophobicContact CB-CD2 3.68Å; L77-Y82 HydrophobicContact CB-CE2 3.62Å; L77-Y82 HydrophobicContact CD1-CD1 4.04Å; L77-Y82 HydrophobicContact CD1-CD2 3.74Å; L77-Y82 HydrophobicContact CD1-CE1 4.19Å; L77-Y82 HydrophobicContact CD1-CE2 3.93Å; L77-Y82 HydrophobicContact CD1-CG 3.81Å; L77-Y82 HydrophobicContact CG-CD2 3.6Å; L77-Y82 HydrophobicContact CG-CE2 3.98Å; L77-Y82 HydrophobicContact CG-CG 4.03Å; T80-Y82 HydrophobicContact CG2-CD2 4.32Å; T80-Y82 HydrophobicContact CG2-CE2 3.89Å; T80-Y82 VanDerWaalsContact O-CD2 3.27Å; T80-Y82 WeakPolarHBondContact O-CD2 3.4Å; T80-Y82 PolarHBondContact O-N 2.95Å; Y82-L102 HydrophobicContact CD1-CD1 4.25Å; Y82-L102 HydrophobicContact CD1-CD2 4.46Å; Y82-L102 HydrophobicContact CG-CD1 4.32Å; Y82-L105 HydrophobicContact CD1-CD2 4.03Å; Y82-L105 HydrophobicContact CE1-CD2 3.44Å; Y82-L105 VanDerWaalsContact CE1-CD2 3.44Å
83	A	93.6	Very high	92	Very high	14 Å²	14	53.4 Å²	53.4	12%	0.116	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	160.9	-176.7	0	0	0	0	0	112.2	I75 L81 F100	I75-A83 HydrophobicContact CB-CB 4.09Å; I75-A83 HydrophobicContact CD1-CB 4.02Å; I75-A83 HydrophobicContact CG1-CB 4.18Å; I75-A83 PolarHBondContact N-O 3.08Å; I75-A83 PolarHBondContact O-N 3.11Å; L81-A83 WeakPolarHBondContact CD1-O 3.13Å; A83-F100 HydrophobicContact CB-CB 4.45Å; A83-F100 HydrophobicContact CB-CD1 3.43Å; A83-F100 VanDerWaalsContact CB-CD1 3.43Å; A83-F100 HydrophobicContact CB-CE1 3.72Å; A83-F100 HydrophobicContact CB-CG 3.91Å; A83-F100 HydrophobicContact CB-CZ 4.41Å
84	R	94.7	Very high	91.7	Very high	130 Å²	130	53.6 Å²	53.6	49%	0.491	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	136.5	175.3	-173.3	-171.4	-77.7	157.6	-1.9	109.2	F72 C73 E74	F72-R84 HydrophobicContact CD2-CG 3.58Å; F72-R84 HydrophobicContact CE2-CG 4.1Å; F72-R84 HydrophobicContact CG-CG 4.47Å; C73-R84 CarbonylContact O-C 3.44Å; C73-R84 VanDerWaalsContact O-CA 3.26Å; C73-R84 WeakPolarHBondContact O-CA 3.45Å; C73-R84 VanDerWaalsContact O-CG 3.31Å; C73-R84 WeakPolarHBondContact O-CG 3.46Å; E74-R84 HydrophobicContact CG-CB 4.43Å; E74-R84 HydrophobicContact CG-CG 3.99Å; E74-R84 IonicContact OE1-CZ 3.7Å; E74-R84 VanDerWaalsContact OE1-CZ 3.26Å; E74-R84 IonicContact OE1-NE 3.91Å; E74-R84 PolarHBondContact OE1-NE 3.15Å; E74-R84 VanDerWaalsContact OE1-NE 3.09Å; E74-R84 IonicContact OE1-NH2 3.59Å; E74-R84 PolarHBondContact OE1-NH2 3.43Å
85	T	94.6	Very high	91.5	Very high	7 Å²	7	56.9 Å²	56.9	4%	0.043	29%	0.288	C	S	.	.			trans	-75.8	164.6	174.7	65.9	0	0	0	0	112.7	I59 C73 W96 E98 F100	I59-T85 HydrophobicContact CB-CG2 3.87Å; I59-T85 HydrophobicContact CG1-CG2 3.98Å; I59-T85 HydrophobicContact CG2-CG2 3.92Å; C73-T85 HydrophobicContact CB-CG2 4.08Å; C73-T85 PolarHBondContact N-OG1 3.3Å; C73-T85 PolarHBondContact O-N 2.92Å; T85-W96 HydrophobicContact CG2-CG 4.39Å; T85-W96 PolarHBondContact OG1-NE1 3Å; T85-E98 WeakPolarHBondContact CA-OE2 3.39Å; T85-E98 VanDerWaalsContact CB-OE2 3.27Å; T85-E98 WeakPolarHBondContact CB-OE2 3.25Å; T85-F100 HydrophobicContact CG2-CE2 3.88Å; T85-F100 HydrophobicContact CG2-CZ 3.87Å
86	T	91.3	Very high	91.3	Very high	68 Å²	68	57.2 Å²	57.2	42%	0.417	29%	0.289	S	S	.	.			trans	-63.1	153	170.1	67.5	0	0	0	0	111.5	K88 W96 E98	T86-K88 WeakPolarHBondContact OG1-CE 3.5Å; T86-W96 VanDerWaalsContact O-CD1 3.27Å; T86-W96 PolarHBondContact O-NE1 3.4Å; T86-E98 VanDerWaalsContact CB-OE1 3.26Å; T86-E98 WeakPolarHBondContact CB-OE1 3.27Å; T86-E98 VanDerWaalsContact CG2-OE1 3.29Å; T86-E98 WeakPolarHBondContact CG2-OE1 3.35Å; T86-E98 PolarHBondContact N-OE1 3.43Å; T86-E98 VanDerWaalsContact N-OE1 3.15Å; T86-E98 PolarHBondContact N-OE2 3.37Å; T86-E98 PolarHBondContact OG1-OE1 3.08Å
87	S	91.9	Very high	90.9	Very high	33 Å²	33	57.7 Å²	57.7	23%	0.231	30%	0.297	C	S	.	.			trans	-86.5	115.9	175.5	-69.7	0	0	0	0	110.8	R70 Y71 F72	R70-S87 VanDerWaalsContact CZ-O 3.25Å; R70-S87 PolarHBondContact NE-O 2.77Å; R70-S87 PolarHBondContact NH2-O 3.45Å; Y71-S87 CarbonylContact O-C 3.56Å; Y71-S87 VanDerWaalsContact O-CA 3.31Å; Y71-S87 WeakPolarHBondContact O-CA 3.36Å; F72-S87 WeakPolarHBondContact CD1-OG 3.15Å
88	K	90.6	Very high	90.8	Very high	53 Å²	53	59.2 Å²	59.2	23%	0.23	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	147.1	-178	-67.3	-171.4	-177.2	-169.7	0	112.5	R70 Y71 T86 V94 F95 W96	R70-K88 CarbonylContact C-O 3.54Å; R70-K88 WeakPolarHBondContact CA-O 3.34Å; Y71-K88 PolarHBondContact N-O 3.48Å; Y71-K88 PolarHBondContact O-N 3.05Å; T86-K88 WeakPolarHBondContact OG1-CE 3.5Å; K88-V94 HydrophobicContact CB-CG1 3.59Å; K88-V94 HydrophobicContact CD-CG1 4.39Å; K88-F95 WeakPolarHBondContact CD-O 3.48Å; K88-F95 WeakPolarHBondContact CE-O 2.77Å; K88-F95 PolarHBondContact NZ-O 3.45Å; K88-W96 HydrophobicContact CD-CG 4.48Å; K88-W96 PolarHBondContact NZ-O 2.98Å
89	L	90.8	Very high	90.6	Very high	119 Å²	119	58.5 Å²	58.5	62%	0.623	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.3	144.8	175.8	-74.8	165.2	0	0	0	110	R70	R70-L89 HydrophobicContact CG-CD2 3.48Å; R70-L89 VanDerWaalsContact CG-CD2 3.48Å; R70-L89 HydrophobicContact CG-CG 3.84Å
90	S	88.8	Confident	90.7	Very high	10 Å²	10	51.1 Å²	51.1	7%	0.07	27%	0.272	C	S	.	.			trans	-105.7	137.3	174.6	-171.2	0	0	0	0	111.9	A67 G69 G92 T93 V94	A67-S90 CarbonylContact C-O 3.45Å; A67-S90 WeakPolarHBondContact CA-O 3.26Å; G69-S90 PolarHBondContact O-N 3.14Å; G69-S90 VanDerWaalsContact O-N 3.15Å; S90-G92 PolarHBondContact OG-N 2.92Å; S90-G92 VanDerWaalsContact OG-N 3.08Å; S90-T93 WeakPolarHBondContact CA-O 3.48Å; S90-T93 PolarHBondContact OG-O 3.1Å; S90-V94 VanDerWaalsContact CB-CG2 3.46Å
91	D	86.9	Confident	90.5	Very high	127 Å²	127	48.5 Å²	48.5	68%	0.679	26%	0.255	S	S	*	.	S	Bend	trans	-104.8	11.7	166.6	62	-3.1	0	0	0	112.1	T93	D91-T93 PolarHBondContact N-O 3.48Å; D91-T93 PolarHBondContact OD1-N 3.38Å; D91-T93 VanDerWaalsContact OD1-O 3.1Å; D91-T93 PolarHBondContact OD1-OG1 3.43Å
92	G	88.1	Confident	90.2	Very high	21 Å²	21	47.1 Å²	47.1	22%	0.216	25%	0.247	C	C	.	.	S	Bend	trans	119.3	-28.3	-166.7	0	0	0	0	0	111.9	N64 L65 S90	N64-G92 PolarHBondContact N-O 3.32Å; L65-G92 PolarHBondContact N-O 2.89Å; S90-G92 PolarHBondContact OG-N 2.92Å; S90-G92 VanDerWaalsContact OG-N 3.08Å
93	T	90.6	Very high	89.9	Confident	64 Å²	64	47.2 Å²	47.2	39%	0.393	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	168.2	169.2	66.5	0	0	0	0	110	V62 K63 S90 D91	V62-T93 CarbonylContact O-C 3.54Å; V62-T93 WeakPolarHBondContact O-CA 3.31Å; V62-T93 WeakPolarHBondContact O-CB 3.2Å; K63-T93 HydrophobicContact CB-CG2 3.7Å; S90-T93 WeakPolarHBondContact CA-O 3.48Å; S90-T93 PolarHBondContact OG-O 3.1Å; D91-T93 PolarHBondContact N-O 3.48Å; D91-T93 PolarHBondContact OD1-N 3.38Å; D91-T93 VanDerWaalsContact OD1-O 3.1Å; D91-T93 PolarHBondContact OD1-OG1 3.43Å
94	V	92.3	Very high	89.2	Confident	5 Å²	5	47.8 Å²	47.8	3%	0.03	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	124.1	170.2	177.8	0	0	0	0	108.2	E61 V62 L65 Y71 K88 S90 W96	E61-V94 CarbonylContact C-O 3.42Å; E61-V94 WeakPolarHBondContact CA-O 3.44Å; E61-V94 VanDerWaalsContact CB-O 3.28Å; E61-V94 WeakPolarHBondContact CB-O 3.49Å; V62-V94 HydrophobicContact CG1-CB 3.85Å; V62-V94 HydrophobicContact CG1-CG2 4.43Å; V62-V94 PolarHBondContact N-O 3.28Å; V62-V94 PolarHBondContact O-N 3.07Å; L65-V94 HydrophobicContact CD1-CG2 3.93Å; Y71-V94 HydrophobicContact CD2-CG2 4.36Å; K88-V94 HydrophobicContact CB-CG1 3.59Å; K88-V94 HydrophobicContact CD-CG1 4.39Å; S90-V94 VanDerWaalsContact CB-CG2 3.46Å; V94-W96 HydrophobicContact CB-CH2 4.03Å; V94-W96 HydrophobicContact CB-CZ2 4.15Å; V94-W96 HydrophobicContact CB-CZ3 4.3Å; V94-W96 HydrophobicContact CG1-CD2 3.91Å; V94-W96 HydrophobicContact CG1-CE3 4.2Å; V94-W96 HydrophobicContact CG1-CH2 3.87Å; V94-W96 HydrophobicContact CG1-CZ2 3.51Å; V94-W96 HydrophobicContact CG1-CZ3 4.19Å
95	F	92	Very high	88.8	Confident	96 Å²	96	42.1 Å²	42.1	42%	0.421	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.1	174.6	179.8	-88.6	0	0	0	110.7	Q60 E61 K88	Q60-F95 CarbonylContact O-C 3.55Å; E61-F95 HydrophobicContact CB-CB 4.17Å; E61-F95 HydrophobicContact CB-CD2 3.87Å; E61-F95 HydrophobicContact CB-CG 4.45Å; E61-F95 HydrophobicContact CG-CD2 4.47Å; K88-F95 WeakPolarHBondContact CD-O 3.48Å; K88-F95 WeakPolarHBondContact CE-O 2.77Å; K88-F95 PolarHBondContact NZ-O 3.45Å
96	W	92.2	Very high	88.2	Confident	6 Å²	6	43.1 Å²	43.1	2%	0.023	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-55.1	173.1	-67.2	-83.9	0	0	0	111.8	I59 Q60 V62 T85 T86 K88 V94 E98 L115 L307	I59-W96 HydrophobicContact CG2-CD2 4.39Å; I59-W96 HydrophobicContact CG2-CE3 3.86Å; I59-W96 HydrophobicContact CG2-CZ3 4.39Å; Q60-W96 PolarHBondContact O-N 3.46Å; V62-W96 HydrophobicContact CB-CH2 4.18Å; V62-W96 HydrophobicContact CB-CZ3 3.81Å; V62-W96 HydrophobicContact CG1-CH2 3.36Å; V62-W96 HydrophobicContact CG1-CZ3 3.37Å; T85-W96 HydrophobicContact CG2-CG 4.39Å; T85-W96 PolarHBondContact OG1-NE1 3Å; T86-W96 VanDerWaalsContact O-CD1 3.27Å; T86-W96 PolarHBondContact O-NE1 3.4Å; K88-W96 HydrophobicContact CD-CG 4.48Å; K88-W96 PolarHBondContact NZ-O 2.98Å; V94-W96 HydrophobicContact CB-CH2 4.03Å; V94-W96 HydrophobicContact CB-CZ2 4.15Å; V94-W96 HydrophobicContact CB-CZ3 4.3Å; V94-W96 HydrophobicContact CG1-CD2 3.91Å; V94-W96 HydrophobicContact CG1-CE3 4.2Å; V94-W96 HydrophobicContact CG1-CH2 3.87Å; V94-W96 HydrophobicContact CG1-CZ2 3.51Å; V94-W96 HydrophobicContact CG1-CZ3 4.19Å; W96-E98 HydrophobicContact CB-CB 4.33Å; W96-E98 HydrophobicContact CB-CG 4.08Å; W96-E98 PolarHBondContact O-N 3.23Å; W96-L115 HydrophobicContact CH2-CD1 4.03Å; W96-L307 HydrophobicContact CZ3-CD1 4.15Å
97	G	86.5	Confident	87.7	Confident	23 Å²	23	46.3 Å²	46.3	24%	0.237	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	63.8	24.3	-172.1	0	0	0	0	0	113.2	I59 Q60	I59-G97 WeakPolarHBondContact O-CA 3.35Å; I59-G97 PolarHBondContact O-N 3.09Å; Q60-G97 PolarHBondContact O-N 3.41Å
98	E	88.7	Confident	87.3	Confident	32 Å²	32	45 Å²	45	15%	0.15	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	138.6	-174.1	-70.9	172.3	-146.2	0	0	110.3	S58 I59 T85 T86 W96 F100	S58-E98 CarbonylContact C-O 3.59Å; S58-E98 VanDerWaalsContact CA-O 3.23Å; S58-E98 WeakPolarHBondContact CA-O 3.46Å; S58-E98 PolarHBondContact OG-O 3.48Å; I59-E98 PolarHBondContact N-O 2.96Å; I59-E98 PolarHBondContact O-N 2.83Å; T85-E98 WeakPolarHBondContact CA-OE2 3.39Å; T85-E98 VanDerWaalsContact CB-OE2 3.27Å; T85-E98 WeakPolarHBondContact CB-OE2 3.25Å; T86-E98 VanDerWaalsContact CB-OE1 3.26Å; T86-E98 WeakPolarHBondContact CB-OE1 3.27Å; T86-E98 VanDerWaalsContact CG2-OE1 3.29Å; T86-E98 WeakPolarHBondContact CG2-OE1 3.35Å; T86-E98 PolarHBondContact N-OE1 3.43Å; T86-E98 VanDerWaalsContact N-OE1 3.15Å; T86-E98 PolarHBondContact N-OE2 3.37Å; T86-E98 PolarHBondContact OG1-OE1 3.08Å; W96-E98 HydrophobicContact CB-CB 4.33Å; W96-E98 HydrophobicContact CB-CG 4.08Å; W96-E98 PolarHBondContact O-N 3.23Å; E98-F100 HydrophobicContact CB-CE2 4.08Å; E98-F100 HydrophobicContact CB-CZ 4.15Å
99	Q	87.6	Confident	87.2	Confident	43 Å²	43	45.6 Å²	45.6	20%	0.201	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.3	179.1	178.7	-178.8	-17.3	0	0	109.8	I57 D101 Y1204	I57-Q99 CarbonylContact O-C 3.55Å; I57-Q99 WeakPolarHBondContact O-CA 3.49Å; Q99-D101 PolarHBondContact NE2-OD1 3.07Å; Q99-D101 PolarHBondContact NE2-OD2 3.03Å; Q99-Y1204 HydrophobicContact CB-CE1 3.69Å; Q99-Y1204 WeakPolarHBondContact CB-OH 3.44Å; Q99-Y1204 HydrophobicContact CG-CE1 4.3Å; Q99-Y1204 PolarHBondContact N-OH 3.01Å; Q99-Y1204 PolarHBondContact O-OH 3.34Å
100	F	89.9	Confident	87.1	Confident	31 Å²	31	42 Å²	42	14%	0.136	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	118.6	178.6	-52.5	-87.8	0	0	0	107.8	I57 I59 I75 A83 T85 E98	I57-F100 HydrophobicContact CG2-CB 3.82Å; I57-F100 HydrophobicContact CG2-CD2 4.22Å; I57-F100 HydrophobicContact CG2-CG 4.47Å; I57-F100 PolarHBondContact N-O 3.46Å; I57-F100 PolarHBondContact O-N 3.21Å; I59-F100 HydrophobicContact CG1-CD2 4.47Å; I59-F100 HydrophobicContact CG1-CE2 4.05Å; I75-F100 HydrophobicContact CD1-CB 4.49Å; I75-F100 HydrophobicContact CD1-CD2 3.33Å; I75-F100 HydrophobicContact CD1-CE2 3.6Å; I75-F100 HydrophobicContact CD1-CG 3.91Å; I75-F100 HydrophobicContact CD1-CZ 4.35Å; A83-F100 HydrophobicContact CB-CB 4.45Å; A83-F100 HydrophobicContact CB-CD1 3.43Å; A83-F100 VanDerWaalsContact CB-CD1 3.43Å; A83-F100 HydrophobicContact CB-CE1 3.72Å; A83-F100 HydrophobicContact CB-CG 3.91Å; A83-F100 HydrophobicContact CB-CZ 4.41Å; T85-F100 HydrophobicContact CG2-CE2 3.88Å; T85-F100 HydrophobicContact CG2-CZ 3.87Å; E98-F100 HydrophobicContact CB-CE2 4.08Å; E98-F100 HydrophobicContact CB-CZ 4.15Å
101	D	85.9	Confident	87.3	Confident	22 Å²	22	41.6 Å²	41.6	12%	0.118	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	107.9	176.3	-62.4	-35.6	0	0	0	108.2	R56 Q99	R56-D101 WeakPolarHBondContact CB-OD1 3.41Å; R56-D101 WeakPolarHBondContact CD-OD1 3.49Å; R56-D101 HydrophobicContact CG-CB 4.28Å; R56-D101 WeakPolarHBondContact CG-OD1 3.48Å; Q99-D101 PolarHBondContact NE2-OD1 3.07Å; Q99-D101 PolarHBondContact NE2-OD2 3.03Å
102	L	87.1	Confident	87.7	Confident	28 Å²	28	36.5 Å²	36.5	15%	0.147	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	99.2	-176.5	-57.5	177.6	0	0	0	108.6	S54 L55 L77 Y82 L105	S54-L102 CarbonylContact C-O 3.49Å; S54-L102 WeakPolarHBondContact CA-O 3.48Å; L55-L102 HydrophobicContact CB-CB 4.42Å; L55-L102 HydrophobicContact CD2-CD1 4.39Å; L55-L102 PolarHBondContact N-O 3.37Å; L55-L102 WeakPolarHBondContact O-CB 3.49Å; L55-L102 PolarHBondContact O-N 3.5Å; L77-L102 HydrophobicContact CD1-CD1 3.88Å; Y82-L102 HydrophobicContact CD1-CD1 4.25Å; Y82-L102 HydrophobicContact CD1-CD2 4.46Å; Y82-L102 HydrophobicContact CG-CD1 4.32Å; L102-L105 HydrophobicContact CB-CD1 3.83Å; L102-L105 HydrophobicContact CB-CD2 4.12Å; L102-L105 HydrophobicContact CB-CG 4.22Å; L102-L105 WeakPolarHBondContact O-CD1 3.32Å
103	N	83.9	Confident	88.2	Confident	60 Å²	60	35.5 Å²	35.5	32%	0.321	19%	0.194	S	C	.	.			trans	-101.6	162.9	-178.5	-57.1	-36.2	0	0	0	111.1	L105	N103-L105 VanDerWaalsContact C-N 3.34Å; N103-L105 PolarHBondContact O-N 3.3Å
104	N	79.4	Confident	88.5	Confident	25 Å²	25	33.6 Å²	33.6	13%	0.134	18%	0.182	C	C	.	.	S	Bend	trans	54	48.6	179.5	-53.7	-86.7	0	0	0	111.6	R38 D52 V53	R38-N104 PolarHBondContact NH1-OD1 2.99Å; D52-N104 PolarHBondContact OD2-OD1 3.03Å; V53-N104 PolarHBondContact O-N 2.79Å
105	L	84.7	Confident	88.7	Confident	12 Å²	12	33.3 Å²	33.3	6%	0.063	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-81	152	179.5	-68.8	171.9	0	0	0	111	V32 V53 L55 L77 Y82 L102 N103 I108	V32-L105 HydrophobicContact CG2-CD2 4.49Å; V53-L105 HydrophobicContact CB-CB 4.17Å; V53-L105 WeakPolarHBondContact CB-O 3.24Å; V53-L105 HydrophobicContact CG1-CB 4.12Å; V53-L105 PolarHBondContact O-N 3.32Å; L55-L105 HydrophobicContact CB-CD1 3.6Å; L77-L105 HydrophobicContact CD1-CD1 3.89Å; L77-L105 HydrophobicContact CD1-CD2 4.06Å; Y82-L105 HydrophobicContact CD1-CD2 4.03Å; Y82-L105 HydrophobicContact CE1-CD2 3.44Å; Y82-L105 VanDerWaalsContact CE1-CD2 3.44Å; L102-L105 HydrophobicContact CB-CD1 3.83Å; L102-L105 HydrophobicContact CB-CD2 4.12Å; L102-L105 HydrophobicContact CB-CG 4.22Å; L102-L105 WeakPolarHBondContact O-CD1 3.32Å; N103-L105 VanDerWaalsContact C-N 3.34Å; N103-L105 PolarHBondContact O-N 3.3Å; L105-I108 HydrophobicContact CD1-CD1 3.93Å
106	P	82.2	Confident	88.9	Confident	28 Å²	28	30.3 Å²	30.3	18%	0.182	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-55.8	162.8	157.6	24.5	-32.4	0	0	0	110.3	I108	P106-I108 HydrophobicContact CG-CG2 4.27Å; P106-I108 WeakPolarHBondContact O-CG2 3.45Å; P106-I108 PolarHBondContact O-N 3.44Å; P106-I108 VanDerWaalsContact O-N 3.09Å
107	I	81.3	Confident	89	Confident	135 Å²	135	33.9 Å²	33.9	69%	0.692	18%	0.18	S	C	*	.	P	Polyproline II helix	trans	-58.8	119.1	166.6	-59.6	172.6	0	0	0	107.5
108	I	84.8	Confident	89.2	Confident	5 Å²	5	36 Å²	36	3%	0.026	18%	0.184	C	C	.	.			trans	-114.8	140.8	-177.5	52.8	179.1	0	0	0	110.3	V53 L55 L77 D78 L105 P106 L143 Y313	V53-I108 HydrophobicContact CG1-CG1 4.46Å; L55-I108 HydrophobicContact CD2-CD1 4.35Å; L77-I108 HydrophobicContact CB-CG2 4.08Å; L77-I108 HydrophobicContact CD1-CD1 3.95Å; L77-I108 HydrophobicContact CD2-CD1 4.34Å; D78-I108 VanDerWaalsContact OD2-CA 3.32Å; D78-I108 WeakPolarHBondContact OD2-CA 3.17Å; L105-I108 HydrophobicContact CD1-CD1 3.93Å; P106-I108 HydrophobicContact CG-CG2 4.27Å; P106-I108 WeakPolarHBondContact O-CG2 3.45Å; P106-I108 PolarHBondContact O-N 3.44Å; P106-I108 VanDerWaalsContact O-N 3.09Å; I108-L143 HydrophobicContact CD1-CD1 3.39Å; I108-L143 HydrophobicContact CG1-CD1 3.81Å; I108-Y313 HydrophobicContact CD1-CD2 4.27Å; I108-Y313 HydrophobicContact CD1-CE2 3.94Å; I108-Y313 HydrophobicContact CG1-CE2 3.78Å
109	S	86.9	Confident	89.1	Confident	66 Å²	66	35.6 Å²	35.6	46%	0.462	19%	0.187	S	C	.	.			trans	-104.8	-35.2	-177.6	68.8	0	0	0	0	113.4	D78 L143	D78-S109 PolarHBondContact OD1-N 2.91Å; D78-S109 VanDerWaalsContact OD1-N 3.12Å; D78-S109 PolarHBondContact OD1-OG 3.19Å; D78-S109 PolarHBondContact OD2-N 2.86Å; D78-S109 VanDerWaalsContact OD2-N 3.11Å; S109-L143 PolarHBondContact O-N 3.47Å
110	I	90.2	Very high	88.3	Confident	44 Å²	44	38.4 Å²	38.4	23%	0.226	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	135.8	-175.2	58.9	165.2	0	0	0	111.5	D78 T140	D78-I110 PolarHBondContact N-O 3.18Å; D78-I110 WeakPolarHBondContact OD1-CG1 3.3Å; D78-I110 PolarHBondContact OD1-N 3.13Å; I110-T140 HydrophobicContact CB-CG2 4.41Å
111	M	92.6	Very high	86.6	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	134.9	166.3	176	170.8	65.7	0	0	109.5	L55 I57 I75 C76 L77 I113 T140 I141 L143 I311	L55-M111 HydrophobicContact CD2-SD 3.81Å; I57-M111 HydrophobicContact CD1-CE 3.87Å; I57-M111 HydrophobicContact CD1-SD 3.57Å; I57-M111 VanDerWaalsContact CD1-SD 3.57Å; I75-M111 HydrophobicContact CG2-SD 4.4Å; C76-M111 CarbonylContact O-C 3.53Å; C76-M111 WeakPolarHBondContact O-CA 3.31Å; L77-M111 HydrophobicContact CD2-CB 3.85Å; L77-M111 HydrophobicContact CD2-CG 3.73Å; L77-M111 HydrophobicContact CD2-SD 4.1Å; M111-I113 HydrophobicContact CG-CD1 3.98Å; M111-I113 HydrophobicContact SD-CD1 4.05Å; M111-T140 CarbonylContact O-C 3.6Å; M111-T140 VanDerWaalsContact O-CA 3.31Å; M111-T140 WeakPolarHBondContact O-CA 3.49Å; M111-I141 HydrophobicContact CE-CB 4.34Å; M111-I141 HydrophobicContact CE-CD1 4.01Å; M111-I141 PolarHBondContact N-O 2.93Å; M111-I141 PolarHBondContact O-N 2.81Å; M111-L143 HydrophobicContact CB-CD1 3.92Å; M111-L143 HydrophobicContact CB-CG 4.22Å; M111-I311 HydrophobicContact CE-CD1 3.6Å; M111-I311 HydrophobicContact CE-CG1 4.05Å; M111-I311 HydrophobicContact CE-CG2 3.85Å
112	T	95.6	Very high	84.9	Confident	20 Å²	20	45.4 Å²	45.4	12%	0.123	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	124.6	175	-58.9	0	0	0	0	110.1	C76 N114 Y138 V139 T140	C76-T112 PolarHBondContact N-O 3.07Å; C76-T112 PolarHBondContact O-N 2.78Å; T112-N114 WeakPolarHBondContact CG2-OD1 3.35Å; T112-Y138 HydrophobicContact CG2-CD2 4.21Å; T112-V139 CarbonylContact C-O 3.59Å; T112-V139 VanDerWaalsContact CA-O 3.27Å; T112-V139 WeakPolarHBondContact CA-O 3.27Å; T112-T140 PolarHBondContact OG1-OG1 3.45Å; T112-T140 VanDerWaalsContact OG1-OG1 3.13Å
113	I	96.8	Very high	82.8	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	116.8	174	-46.2	-59.8	0	0	0	108.8	I57 I59 C73 E74 I75 M111 Y138 V139 L307 M309	I57-I113 HydrophobicContact CD1-CD1 3.81Å; I59-I113 HydrophobicContact CD1-CD1 4.46Å; I59-I113 HydrophobicContact CD1-CG2 4.38Å; C73-I113 HydrophobicContact CB-CG2 3.91Å; E74-I113 CarbonylContact O-C 3.46Å; E74-I113 VanDerWaalsContact O-CA 3.3Å; E74-I113 WeakPolarHBondContact O-CA 3.1Å; I75-I113 HydrophobicContact CB-CD1 4.01Å; I75-I113 HydrophobicContact CG1-CD1 3.93Å; I75-I113 HydrophobicContact CG2-CD1 3.68Å; M111-I113 HydrophobicContact CG-CD1 3.98Å; M111-I113 HydrophobicContact SD-CD1 4.05Å; I113-Y138 CarbonylContact O-C 3.6Å; I113-Y138 WeakPolarHBondContact O-CA 3.4Å; I113-Y138 WeakPolarHBondContact O-CB 3.44Å; I113-V139 HydrophobicContact CB-CG1 3.73Å; I113-V139 HydrophobicContact CG1-CG1 4.04Å; I113-V139 PolarHBondContact N-O 3.21Å; I113-V139 PolarHBondContact O-N 3.07Å; I113-L307 HydrophobicContact CB-CD2 4.27Å; I113-L307 HydrophobicContact CG2-CD2 3.75Å; I113-M309 HydrophobicContact CB-CE 4.45Å; I113-M309 HydrophobicContact CG1-CE 3.92Å; I113-M309 HydrophobicContact CG1-SD 4.28Å
114	N	96.9	Very high	80.6	Confident	24 Å²	24	56.7 Å²	56.7	13%	0.128	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	125.9	-179.6	-64.8	-41.5	0	0	0	110.2	C73 E74 T112 F116 F135 Y138	C73-N114 CarbonylContact C-O 3.59Å; C73-N114 VanDerWaalsContact CA-O 3.22Å; C73-N114 WeakPolarHBondContact CA-O 3.44Å; E74-N114 HydrophobicContact CB-CB 4.23Å; E74-N114 PolarHBondContact N-O 2.83Å; E74-N114 PolarHBondContact O-N 3.35Å; T112-N114 WeakPolarHBondContact CG2-OD1 3.35Å; N114-F116 HydrophobicContact CB-CD2 4.2Å; N114-F116 HydrophobicContact CB-CE2 3.49Å; N114-F116 VanDerWaalsContact CB-CE2 3.49Å; N114-F116 HydrophobicContact CB-CZ 4.18Å; N114-F135 HydrophobicContact CB-CD2 4.5Å; N114-F135 HydrophobicContact CB-CE2 3.76Å; N114-Y138 VanDerWaalsContact OD1-CB 3.3Å; N114-Y138 WeakPolarHBondContact OD1-CB 3.38Å
115	L	97.2	Very high	78.9	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	129.5	174.3	177.6	70.5	0	0	0	110.5	V62 L65 Y71 W96 I136 G137 M158 P305	V62-L115 HydrophobicContact CG2-CD2 4.26Å; L65-L115 HydrophobicContact CD2-CD2 3.68Å; Y71-L115 HydrophobicContact CD1-CD1 4.25Å; Y71-L115 HydrophobicContact CD1-CG 4.42Å; W96-L115 HydrophobicContact CH2-CD1 4.03Å; L115-I136 HydrophobicContact CB-CB 4.49Å; L115-I136 HydrophobicContact CD2-CB 4.06Å; L115-I136 HydrophobicContact CD2-CG2 3.78Å; L115-I136 HydrophobicContact CG-CB 4.09Å; L115-I136 HydrophobicContact CG-CG2 4.37Å; L115-I136 WeakPolarHBondContact O-CB 3.4Å; L115-I136 PolarHBondContact O-N 3.44Å; L115-G137 PolarHBondContact N-O 3.3Å; L115-M158 HydrophobicContact CB-CE 3.59Å; L115-M158 HydrophobicContact CB-SD 3.8Å; L115-M158 HydrophobicContact CD2-SD 3.87Å; L115-M158 HydrophobicContact CG-SD 4.43Å; L115-P305 HydrophobicContact CD2-CB 4.26Å
116	F	95.6	Very high	77	Confident	32 Å²	32	76.5 Å²	76.5	14%	0.14	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	146.3	177.5	-69.8	-87.5	0	0	0	111.9	Y71 F72 E74 N114 N133 Q134 F135	Y71-F116 VanDerWaalsContact CA-O 3.24Å; Y71-F116 WeakPolarHBondContact CA-O 3.42Å; F72-F116 HydrophobicContact CD1-CB 4.14Å; F72-F116 HydrophobicContact CD2-CB 4.26Å; F72-F116 HydrophobicContact CD2-CD2 4.45Å; F72-F116 HydrophobicContact CE1-CB 3.54Å; F72-F116 HydrophobicContact CE1-CG 4.46Å; F72-F116 HydrophobicContact CE2-CB 3.71Å; F72-F116 AromaticContact CE2-CD2 3.72Å; F72-F116 HydrophobicContact CE2-CD2 3.72Å; F72-F116 AromaticContact CE2-CG 3.95Å; F72-F116 HydrophobicContact CE2-CG 3.95Å; F72-F116 HydrophobicContact CG-CB 4.46Å; F72-F116 HydrophobicContact CZ-CB 3.3Å; F72-F116 HydrophobicContact CZ-CD2 4.02Å; F72-F116 AromaticContact CZ-CG 3.76Å; F72-F116 HydrophobicContact CZ-CG 3.76Å; F72-F116 PolarHBondContact N-O 3.04Å; F72-F116 PolarHBondContact O-N 3.02Å; E74-F116 HydrophobicContact CB-CE2 4.24Å; E74-F116 HydrophobicContact CG-CD2 4.21Å; E74-F116 HydrophobicContact CG-CE2 4.04Å; E74-F116 VanDerWaalsContact OE2-CE2 3.32Å; E74-F116 WeakPolarHBondContact OE2-CE2 3.37Å; N114-F116 HydrophobicContact CB-CD2 4.2Å; N114-F116 HydrophobicContact CB-CE2 3.49Å; N114-F116 VanDerWaalsContact CB-CE2 3.49Å; N114-F116 HydrophobicContact CB-CZ 4.18Å; F116-N133 HydrophobicContact CB-CB 4.47Å; F116-N133 HydrophobicContact CD1-CB 4.25Å; F116-Q134 CarbonylContact C-O 3.55Å; F116-Q134 WeakPolarHBondContact CA-O 3.22Å; F116-F135 HydrophobicContact CD1-CB 4.05Å; F116-F135 HydrophobicContact CD1-CD2 4.13Å; F116-F135 HydrophobicContact CE1-CB 3.71Å; F116-F135 AromaticContact CE1-CD2 3.67Å; F116-F135 HydrophobicContact CE1-CD2 3.67Å; F116-F135 AromaticContact CE1-CG 3.99Å; F116-F135 HydrophobicContact CE1-CG 3.99Å; F116-F135 HydrophobicContact CE2-CD2 4.25Å; F116-F135 AromaticContact CZ-CD2 3.74Å; F116-F135 HydrophobicContact CZ-CD2 3.74Å; F116-F135 HydrophobicContact CZ-CE2 4.32Å; F116-F135 HydrophobicContact CZ-CG 4.37Å
117	R	94.3	Very high	75	Confident	81 Å²	81	80.6 Å²	80.6	31%	0.306	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	118.9	162	-175	170.6	71.9	173.2	4.6	108.8	R70 Y71 Q134 I136	R70-R117 CarbonylContact O-C 3.34Å; R70-R117 WeakPolarHBondContact O-CA 3.25Å; Y71-R117 HydrophobicContact CD1-CB 4.03Å; Y71-R117 HydrophobicContact CD1-CG 4.49Å; Y71-R117 HydrophobicContact CE1-CB 3.77Å; Y71-R117 HydrophobicContact CE1-CG 4.1Å; Y71-R117 HydrophobicContact CE2-CG 4.44Å; R117-Q134 HydrophobicContact CB-CB 4.35Å; R117-Q134 PolarHBondContact N-O 3.16Å; R117-Q134 VanDerWaalsContact NE-OE1 3.09Å; R117-Q134 PolarHBondContact O-N 3.45Å; R117-I136 HydrophobicContact CB-CD1 3.79Å; R117-I136 HydrophobicContact CB-CG1 3.87Å
118	Q	91.7	Very high	73.2	Confident	68 Å²	68	85.1 Å²	85.1	32%	0.318	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-61.9	134.1	-179.8	-175.5	67.4	36.6	0	0	110.8	R70 F72 N133	R70-Q118 HydrophobicContact CB-CB 4.1Å; R70-Q118 WeakPolarHBondContact O-CB 3.39Å; R70-Q118 PolarHBondContact O-N 2.96Å; F72-Q118 HydrophobicContact CD1-CB 4.28Å; F72-Q118 HydrophobicContact CE1-CB 4.25Å; Q118-N133 WeakPolarHBondContact CA-OD1 3.49Å; Q118-N133 VanDerWaalsContact CD-OD1 3.26Å; Q118-N133 PolarHBondContact NE2-OD1 3.37Å; Q118-N133 PolarHBondContact OE1-ND2 2.94Å; Q118-N133 PolarHBondContact OE1-OD1 2.79Å
119	A	85.9	Confident	71.3	Confident	24 Å²	24	92.3 Å²	92.3	20%	0.198	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-64.4	133.8	174.2	0	0	0	0	0	110.9	S121 K130 N133	A119-S121 PolarHBondContact O-N 3.03Å; A119-K130 WeakPolarHBondContact CB-O 3.42Å; A119-N133 PolarHBondContact N-OD1 3.29Å
120	T	70.5	Confident	69.5	Low	102 Å²	102	95.7 Å²	95.7	63%	0.626	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-83.7	116.2	172.3	47.4	0	0	0	0	108.6	V122	T120-V122 PolarHBondContact O-N 3.07Å
121	S	55.9	Low	67.8	Low	105 Å²	105	99.1 Å²	99.1	73%	0.734	48%	0.475	S	S	*	.			trans	-72.8	72.8	171.4	-173.1	0	0	0	0	109.3	A119	A119-S121 PolarHBondContact O-N 3.03Å
122	V	50.2	Low	67.3	Low	95 Å²	95	106 Å²	106	58%	0.576	51%	0.507	S	S	*	.			trans	-80	118.7	165.6	-174.2	0	0	0	0	106.3	T120 D124	T120-V122 PolarHBondContact O-N 3.07Å; V122-D124 PolarHBondContact O-N 3.41Å
123	K	41.6	Very low	67.1	Low	201 Å²	201	107.1 Å²	107.1	87%	0.874	51%	0.512	S	S	*	.			trans	-62	35.3	-180	-91.7	-176.2	175.4	176.5	0	114.6	K125	K123-K125 PolarHBondContact O-N 2.88Å
124	D	39	Very low	66.8	Low	123 Å²	123	111.7 Å²	111.7	66%	0.658	53%	0.533	S	S	*	.			trans	-90.1	103	173.3	-79.2	-30.2	0	0	0	110.5	V122 R126	V122-D124 PolarHBondContact O-N 3.41Å; D124-R126 PolarHBondContact O-N 3.35Å
125	K	43.5	Very low	66.7	Low	210 Å²	210	112.8 Å²	112.8	91%	0.913	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-3.9	-179.4	-73.6	-179	174.6	178.6	0	115.7	K123	K123-K125 PolarHBondContact O-N 2.88Å
126	R	43.5	Very low	66.5	Low	244 Å²	244	114.6 Å²	114.6	92%	0.921	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-3.1	-172.7	-73.5	-172.5	174.7	-173.5	-1.1	116	D124	D124-R126 PolarHBondContact O-N 3.35Å
127	Q	41	Very low	66.4	Low	114 Å²	114	113.1 Å²	113.1	53%	0.533	54%	0.54	S	S	.	.			trans	-139.2	81.9	176.7	-70	-175.4	0.1	0	0	113	N129 K130	Q127-N129 PolarHBondContact O-N 3.29Å; Q127-K130 PolarHBondContact O-N 2.92Å; Q127-K130 VanDerWaalsContact OE1-CE 3.26Å
128	R	42.7	Very low	66.5	Low	229 Å²	229	110.3 Å²	110.3	86%	0.864	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-56.8	-17.4	176.6	-88	180	170.8	164.8	-3	115
129	N	46.8	Very low	66.7	Low	157 Å²	157	107.5 Å²	107.5	84%	0.84	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-87.8	-0.6	-177.3	-71.7	2.7	0	0	0	114.9	Q127	Q127-N129 PolarHBondContact O-N 3.29Å
130	K	48.7	Very low	67	Low	136 Å²	136	109 Å²	109	59%	0.591	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-91.3	1.5	-178.6	-94.9	177.6	177.9	162.4	0	115.5	A119 Q127 Q132	A119-K130 WeakPolarHBondContact CB-O 3.42Å; Q127-K130 PolarHBondContact O-N 2.92Å; Q127-K130 VanDerWaalsContact OE1-CE 3.26Å; K130-Q132 VanDerWaalsContact C-N 3.29Å; K130-Q132 PolarHBondContact O-N 3Å
131	N	54.8	Low	68	Low	117 Å²	117	104.8 Å²	104.8	63%	0.626	50%	0.497	S	S	*	.			trans	-83.8	0.9	-177	-67.2	-2.7	0	0	0	114
132	Q	82.3	Confident	69.6	Low	145 Å²	145	103.7 Å²	103.7	68%	0.678	49%	0.488	S	S	*	.	S	Bend	trans	-97	134.9	-178.3	-167.1	172.9	7.4	0	0	111.1	K130 Q134	K130-Q132 VanDerWaalsContact C-N 3.29Å; K130-Q132 PolarHBondContact O-N 3Å; Q132-Q134 PolarHBondContact O-N 2.64Å
133	N	89.7	Confident	71.2	Confident	43 Å²	43	99.4 Å²	99.4	23%	0.23	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-60.5	134.4	174.5	-67.8	-21.7	0	0	0	110.1	F72 F116 Q118 A119	F72-N133 HydrophobicContact CE1-CB 4.24Å; F72-N133 WeakPolarHBondContact CE1-ND2 3.39Å; F72-N133 HydrophobicContact CZ-CB 4.12Å; F72-N133 WeakPolarHBondContact CZ-ND2 3.34Å; F116-N133 HydrophobicContact CB-CB 4.47Å; F116-N133 HydrophobicContact CD1-CB 4.25Å; Q118-N133 WeakPolarHBondContact CA-OD1 3.49Å; Q118-N133 VanDerWaalsContact CD-OD1 3.26Å; Q118-N133 PolarHBondContact NE2-OD1 3.37Å; Q118-N133 PolarHBondContact OE1-ND2 2.94Å; Q118-N133 PolarHBondContact OE1-OD1 2.79Å; A119-N133 PolarHBondContact N-OD1 3.29Å
134	Q	91.8	Very high	72.9	Confident	96 Å²	96	94.4 Å²	94.4	45%	0.449	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	126.3	-178.8	-179.2	179.6	6.8	0	0	109.9	F116 R117 Q132 I136	F116-Q134 CarbonylContact C-O 3.55Å; F116-Q134 WeakPolarHBondContact CA-O 3.22Å; R117-Q134 HydrophobicContact CB-CB 4.35Å; R117-Q134 PolarHBondContact N-O 3.16Å; R117-Q134 VanDerWaalsContact NE-OE1 3.09Å; R117-Q134 PolarHBondContact O-N 3.45Å; Q132-Q134 PolarHBondContact O-N 2.64Å; Q134-I136 HydrophobicContact CG-CD1 4.08Å
135	F	93.2	Very high	74.3	Confident	47 Å²	47	92.2 Å²	92.2	21%	0.206	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	126.8	175.1	-172.9	-142.5	0	0	0	110.4	N114 F116 G137 Y138 P161	N114-F135 HydrophobicContact CB-CD2 4.5Å; N114-F135 HydrophobicContact CB-CE2 3.76Å; F116-F135 HydrophobicContact CD1-CB 4.05Å; F116-F135 HydrophobicContact CD1-CD2 4.13Å; F116-F135 HydrophobicContact CE1-CB 3.71Å; F116-F135 AromaticContact CE1-CD2 3.67Å; F116-F135 HydrophobicContact CE1-CD2 3.67Å; F116-F135 AromaticContact CE1-CG 3.99Å; F116-F135 HydrophobicContact CE1-CG 3.99Å; F116-F135 HydrophobicContact CE2-CD2 4.25Å; F116-F135 AromaticContact CZ-CD2 3.74Å; F116-F135 HydrophobicContact CZ-CD2 3.74Å; F116-F135 HydrophobicContact CZ-CE2 4.32Å; F116-F135 HydrophobicContact CZ-CG 4.37Å; F135-G137 VanDerWaalsContact CE2-O 3.24Å; F135-G137 WeakPolarHBondContact CE2-O 3.41Å; F135-Y138 HydrophobicContact CE1-CD1 4.21Å; F135-Y138 AromaticContact CZ-CD1 3.71Å; F135-Y138 HydrophobicContact CZ-CD1 3.71Å; F135-Y138 HydrophobicContact CZ-CG 4.16Å; F135-P161 HydrophobicContact CD1-CB 3.56Å; F135-P161 HydrophobicContact CD1-CG 3.65Å; F135-P161 HydrophobicContact CE1-CB 3.81Å; F135-P161 HydrophobicContact CE1-CG 4.05Å; F135-P161 HydrophobicContact CG-CB 4.47Å; F135-P161 HydrophobicContact CG-CG 4.12Å
136	I	93.3	Very high	75	Confident	38 Å²	38	89.7 Å²	89.7	20%	0.195	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	-36.8	-171.2	-58.5	-63.6	0	0	0	111.9	Y71 L115 R117 Q134 P161 P305	Y71-I136 HydrophobicContact CD1-CG1 4.39Å; Y71-I136 HydrophobicContact CE1-CD1 4.37Å; Y71-I136 HydrophobicContact CE1-CG1 4.01Å; L115-I136 HydrophobicContact CB-CB 4.49Å; L115-I136 HydrophobicContact CD2-CB 4.06Å; L115-I136 HydrophobicContact CD2-CG2 3.78Å; L115-I136 HydrophobicContact CG-CB 4.09Å; L115-I136 HydrophobicContact CG-CG2 4.37Å; L115-I136 WeakPolarHBondContact O-CB 3.4Å; L115-I136 PolarHBondContact O-N 3.44Å; R117-I136 HydrophobicContact CB-CD1 3.79Å; R117-I136 HydrophobicContact CB-CG1 3.87Å; Q134-I136 HydrophobicContact CG-CD1 4.08Å; I136-P161 VanDerWaalsContact O-CD 3.32Å; I136-P161 WeakPolarHBondContact O-CD 3.44Å; I136-P305 HydrophobicContact CG2-CG 4.23Å
137	G	94.9	Very high	75.2	Confident	1 Å²	1	80.9 Å²	80.9	1%	0.01	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.5	174.6	178.3	0	0	0	0	0	111.4	L115 F135 Q159	L115-G137 PolarHBondContact N-O 3.3Å; F135-G137 VanDerWaalsContact CE2-O 3.24Å; F135-G137 WeakPolarHBondContact CE2-O 3.41Å; G137-Q159 CarbonylContact C-O 3.59Å; G137-Q159 WeakPolarHBondContact CA-O 3.46Å
138	Y	95.9	Very high	75.8	Confident	21 Å²	21	76.6 Å²	76.6	8%	0.082	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	161.1	179.3	65.1	-80.5	0	0	0	112	T112 I113 N114 F135 M158 Q159 P160	T112-Y138 HydrophobicContact CG2-CD2 4.21Å; I113-Y138 CarbonylContact O-C 3.6Å; I113-Y138 WeakPolarHBondContact O-CA 3.4Å; I113-Y138 WeakPolarHBondContact O-CB 3.44Å; N114-Y138 VanDerWaalsContact OD1-CB 3.3Å; N114-Y138 WeakPolarHBondContact OD1-CB 3.38Å; F135-Y138 HydrophobicContact CE1-CD1 4.21Å; F135-Y138 AromaticContact CZ-CD1 3.71Å; F135-Y138 HydrophobicContact CZ-CD1 3.71Å; F135-Y138 HydrophobicContact CZ-CG 4.16Å; Y138-M158 CarbonylContact O-C 3.4Å; Y138-M158 WeakPolarHBondContact O-CA 2.79Å; Y138-Q159 HydrophobicContact CD1-CB 4.44Å; Y138-Q159 HydrophobicContact CE1-CB 4.01Å; Y138-Q159 HydrophobicContact CE2-CB 4.22Å; Y138-Q159 VanDerWaalsContact CE2-OE1 3.23Å; Y138-Q159 VanDerWaalsContact CZ-OE1 3.24Å; Y138-Q159 PolarHBondContact N-O 3.35Å; Y138-Q159 PolarHBondContact O-N 3.48Å; Y138-Q159 PolarHBondContact OH-OE1 3.32Å; Y138-P160 WeakPolarHBondContact CE1-O 3.29Å
139	V	94.9	Very high	76.3	Confident	10 Å²	10	72.2 Å²	72.2	6%	0.061	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	134.2	164.5	57	0	0	0	0	108.2	T112 I113 I141 F156 M158 L307 M309	T112-V139 CarbonylContact C-O 3.59Å; T112-V139 VanDerWaalsContact CA-O 3.27Å; T112-V139 WeakPolarHBondContact CA-O 3.27Å; I113-V139 HydrophobicContact CB-CG1 3.73Å; I113-V139 HydrophobicContact CG1-CG1 4.04Å; I113-V139 PolarHBondContact N-O 3.21Å; I113-V139 PolarHBondContact O-N 3.07Å; V139-I141 HydrophobicContact CG2-CD1 4.42Å; V139-I141 HydrophobicContact CG2-CG1 4.06Å; V139-F156 HydrophobicContact CG2-CB 3.91Å; V139-F156 HydrophobicContact CG2-CD1 4.14Å; V139-F156 HydrophobicContact CG2-CG 4.25Å; V139-M158 HydrophobicContact CG1-CE 4.46Å; V139-L307 HydrophobicContact CG1-CD2 4.29Å; V139-M309 HydrophobicContact CG1-CE 3.96Å
140	T	93.7	Very high	76.6	Confident	54 Å²	54	69.1 Å²	69.1	33%	0.331	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	131.4	174.9	-60	0	0	0	0	109.3	I110 M111 T112	I110-T140 HydrophobicContact CB-CG2 4.41Å; M111-T140 CarbonylContact O-C 3.6Å; M111-T140 VanDerWaalsContact O-CA 3.31Å; M111-T140 WeakPolarHBondContact O-CA 3.49Å; T112-T140 PolarHBondContact OG1-OG1 3.45Å; T112-T140 VanDerWaalsContact OG1-OG1 3.13Å
141	I	90.4	Very high	77.1	Confident	14 Å²	14	65.8 Å²	65.8	7%	0.072	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	115.8	-176.1	-57	179.5	0	0	0	107	M111 V139 F156 M309 I311	M111-I141 HydrophobicContact CE-CB 4.34Å; M111-I141 HydrophobicContact CE-CD1 4.01Å; M111-I141 PolarHBondContact N-O 2.93Å; M111-I141 PolarHBondContact O-N 2.81Å; V139-I141 HydrophobicContact CG2-CD1 4.42Å; V139-I141 HydrophobicContact CG2-CG1 4.06Å; I141-F156 HydrophobicContact CD1-CD1 4.11Å; I141-F156 HydrophobicContact CD1-CE1 3.7Å; I141-F156 HydrophobicContact CD1-CE2 4.3Å; I141-F156 HydrophobicContact CD1-CZ 3.8Å; I141-F156 HydrophobicContact CG1-CE1 4.29Å; I141-M309 HydrophobicContact CD1-SD 4.09Å; I141-I311 HydrophobicContact CD1-CD1 3.4Å
142	P	89.4	Confident	77.5	Confident	83 Å²	83	64.3 Å²	64.3	54%	0.539	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	139.4	170.8	28.7	-32.5	0	0	0	109.7
143	L	85	Confident	77.4	Confident	4 Å²	4	61.5 Å²	61.5	2%	0.021	33%	0.329	C	S	.	.			trans	-113.3	113.8	178.1	-62	178.9	0	0	0	108.4	L55 I108 S109 M111 Q148 Y313	L55-L143 HydrophobicContact CD2-CD1 4.46Å; I108-L143 HydrophobicContact CD1-CD1 3.39Å; I108-L143 HydrophobicContact CG1-CD1 3.81Å; S109-L143 PolarHBondContact O-N 3.47Å; M111-L143 HydrophobicContact CB-CD1 3.92Å; M111-L143 HydrophobicContact CB-CG 4.22Å; L143-Q148 VanDerWaalsContact CD2-NE2 3.35Å; L143-Y313 HydrophobicContact CB-CD2 4.46Å; L143-Y313 HydrophobicContact CB-CE2 4.42Å; L143-Y313 HydrophobicContact CD1-CD2 4.11Å; L143-Y313 HydrophobicContact CD1-CE2 4.39Å; L143-Y313 HydrophobicContact CD2-CG 4.38Å
144	N	76.4	Confident	77.3	Confident	97 Å²	97	64.7 Å²	64.7	52%	0.519	34%	0.34	S	S	.	.			trans	-126.1	156.1	173.8	-61.7	0.7	0	0	0	109.2	D146 S147	N144-D146 PolarHBondContact O-N 3.35Å; N144-D146 VanDerWaalsContact O-N 3.11Å; N144-S147 PolarHBondContact N-OG 3.21Å; N144-S147 PolarHBondContact O-N 2.92Å; N144-S147 PolarHBondContact O-OG 2.88Å
145	D	67.8	Low	77.3	Confident	77 Å²	77	65 Å²	65	41%	0.412	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-36.2	-178.9	-69	-0.5	0	0	0	112.9	K51 T315	K51-D145 IonicContact NZ-OD2 3.44Å; K51-D145 PolarHBondContact NZ-OD2 3.48Å; D145-T315 PolarHBondContact OD1-OG1 3.31Å
146	D	58.2	Low	77.3	Confident	156 Å²	156	65.1 Å²	65.1	83%	0.834	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-22.5	178.8	-61.9	-39.6	0	0	0	114.5	N144 Q148	N144-D146 PolarHBondContact O-N 3.35Å; N144-D146 VanDerWaalsContact O-N 3.11Å; D146-Q148 PolarHBondContact O-N 3.12Å
147	S	48.9	Very low	77.3	Confident	60 Å²	60	68.1 Å²	68.1	42%	0.42	35%	0.353	S	S	.	.	S	Bend	trans	-82.8	-14.5	-151.7	59.2	0	0	0	0	115.4	N144	N144-S147 PolarHBondContact N-OG 3.21Å; N144-S147 PolarHBondContact O-N 2.92Å; N144-S147 PolarHBondContact O-OG 2.88Å
148	Q	53.2	Low	77.3	Confident	24 Å²	24	68.1 Å²	68.1	11%	0.112	35%	0.353	C	S	.	.			trans	-152	25.6	-161.1	-73.1	-166.8	14.3	0	0	118	L143 D146 C150 Y313	L143-Q148 VanDerWaalsContact CD2-NE2 3.35Å; D146-Q148 PolarHBondContact O-N 3.12Å; Q148-C150 PolarHBondContact O-N 2.91Å; Q148-Y313 CarbonylContact C-O 3.54Å; Q148-Y313 PolarHBondContact O-N 3.48Å
149	Q	52.7	Low	77.2	Confident	136 Å²	136	72 Å²	72	64%	0.636	37%	0.372	S	S	*	.	S	Bend	trans	-64.7	-17.3	171.4	-72.3	-177.9	-2.2	0	0	113.8
150	C	52.7	Low	77	Confident	92 Å²	92	74.7 Å²	74.7	62%	0.622	39%	0.39	S	S	*	.	S	Bend	trans	-98.4	113	178.6	-74	0	0	0	0	112.1	Q148 I152	Q148-C150 PolarHBondContact O-N 2.91Å; C150-I152 HydrophobicContact CB-CD1 3.78Å; C150-I152 HydrophobicContact CB-CG1 3.9Å; C150-I152 PolarHBondContact O-N 3.07Å
151	E	59.1	Low	76.5	Confident	67 Å²	67	74 Å²	74	31%	0.313	39%	0.387	S	S	.	.			trans	-66.9	88.1	171	-169.8	-177.3	-171.3	0	0	110.3	M310 H312 K349	E151-M310 HydrophobicContact CG-CB 4.45Å; E151-M310 HydrophobicContact CG-CE 4.36Å; E151-M310 HydrophobicContact CG-SD 4.23Å; E151-M310 WeakPolarHBondContact OE1-CE 3.26Å; E151-H312 HydrophobicContact CB-CB 4.39Å; E151-H312 HydrophobicContact CG-CB 4.49Å; E151-K349 IonicContact OE2-NZ 3.2Å; E151-K349 PolarHBondContact OE2-NZ 3.26Å
152	I	64.7	Low	75.7	Confident	85 Å²	85	79.3 Å²	79.3	44%	0.436	41%	0.411	S	S	.	.			trans	-114.8	127.7	-178.9	-57.1	169.2	0	0	0	109.4	C150 K154	C150-I152 HydrophobicContact CB-CD1 3.78Å; C150-I152 HydrophobicContact CB-CG1 3.9Å; C150-I152 PolarHBondContact O-N 3.07Å; I152-K154 HydrophobicContact CB-CG 4.38Å; I152-K154 HydrophobicContact CG2-CD 4.39Å; I152-K154 HydrophobicContact CG2-CG 3.86Å; I152-K154 PolarHBondContact O-N 3.45Å
153	Q	80.5	Confident	74	Confident	86 Å²	86	82.3 Å²	82.3	40%	0.402	42%	0.421	S	S	.	.			trans	-65.9	119.2	167.5	-75.1	-176.6	13.4	0	0	110.3	M310	Q153-M310 HydrophobicContact CB-CG 4.21Å; Q153-M310 HydrophobicContact CG-CG 3.19Å; Q153-M310 HydrophobicContact CG-SD 3.26Å; Q153-M310 WeakPolarHBondContact CG-SD 3.23Å; Q153-M310 PolarHBondContact NE2-SD 3.08Å
154	K	86.8	Confident	72.1	Confident	110 Å²	110	87 Å²	87	48%	0.478	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	146.9	-179.4	-68.2	-179.8	177.4	170.8	0	111.6	I152 F156 R308 M309	I152-K154 HydrophobicContact CB-CG 4.38Å; I152-K154 HydrophobicContact CG2-CD 4.39Å; I152-K154 HydrophobicContact CG2-CG 3.86Å; I152-K154 PolarHBondContact O-N 3.45Å; K154-F156 HydrophobicContact CB-CD2 4.37Å; K154-F156 HydrophobicContact CB-CE2 3.64Å; K154-F156 HydrophobicContact CB-CZ 3.94Å; K154-F156 HydrophobicContact CD-CZ 4.43Å; K154-R308 WeakPolarHBondContact O-CA 3.39Å; K154-M309 PolarHBondContact N-O 3.5Å; K154-M309 PolarHBondContact O-N 3.39Å; K154-M309 VanDerWaalsContact O-N 3.07Å
155	W	92.1	Very high	70.1	Confident	104 Å²	104	87 Å²	87	39%	0.394	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	130.4	169	-75.7	97	0	0	0	109.6	E61 K63 Q306 R308	E61-W155 HydrophobicContact CG-CH2 3.69Å; E61-W155 HydrophobicContact CG-CZ2 4.24Å; E61-W155 HydrophobicContact CG-CZ3 4.42Å; E61-W155 WeakPolarHBondContact OE1-CH2 3.47Å; E61-W155 VanDerWaalsContact OE1-CZ2 3.23Å; E61-W155 WeakPolarHBondContact OE1-CZ2 3.49Å; K63-W155 HydrophobicContact CB-CZ3 4.49Å; K63-W155 HydrophobicContact CD-CH2 3.79Å; K63-W155 HydrophobicContact CD-CZ2 4.45Å; K63-W155 HydrophobicContact CD-CZ3 3.83Å; K63-W155 HydrophobicContact CG-CH2 4.06Å; K63-W155 HydrophobicContact CG-CZ3 3.75Å; W155-Q306 HydrophobicContact CE3-CB 3.88Å; W155-Q306 HydrophobicContact CZ3-CB 4.25Å; W155-Q306 WeakPolarHBondContact CZ3-O 3.49Å; W155-R308 HydrophobicContact CD2-CB 3.79Å; W155-R308 HydrophobicContact CD2-CG 4.25Å; W155-R308 HydrophobicContact CE3-CB 3.77Å; W155-R308 HydrophobicContact CG-CB 4.47Å; W155-R308 HydrophobicContact CH2-CB 3.94Å; W155-R308 HydrophobicContact CZ2-CB 3.97Å; W155-R308 HydrophobicContact CZ2-CG 4.4Å; W155-R308 HydrophobicContact CZ3-CB 3.83Å
156	F	92.4	Very high	68.6	Low	48 Å²	48	89.7 Å²	89.7	21%	0.211	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	132.1	176.4	-63.5	-92.6	0	0	0	109.6	V139 I141 K154 Q306 L307 M309 I311	V139-F156 HydrophobicContact CG2-CB 3.91Å; V139-F156 HydrophobicContact CG2-CD1 4.14Å; V139-F156 HydrophobicContact CG2-CG 4.25Å; I141-F156 HydrophobicContact CD1-CD1 4.11Å; I141-F156 HydrophobicContact CD1-CE1 3.7Å; I141-F156 HydrophobicContact CD1-CE2 4.3Å; I141-F156 HydrophobicContact CD1-CZ 3.8Å; I141-F156 HydrophobicContact CG1-CE1 4.29Å; K154-F156 HydrophobicContact CB-CD2 4.37Å; K154-F156 HydrophobicContact CB-CE2 3.64Å; K154-F156 HydrophobicContact CB-CZ 3.94Å; K154-F156 HydrophobicContact CD-CZ 4.43Å; F156-Q306 CarbonylContact O-C 3.56Å; F156-Q306 VanDerWaalsContact O-CA 3.32Å; F156-Q306 WeakPolarHBondContact O-CA 2.97Å; F156-L307 PolarHBondContact N-O 3.36Å; F156-L307 PolarHBondContact O-N 3.39Å; F156-M309 HydrophobicContact CD2-CE 4.26Å; F156-M309 HydrophobicContact CD2-CG 3.78Å; F156-M309 HydrophobicContact CD2-SD 4.17Å; F156-M309 HydrophobicContact CE2-CG 3.59Å; F156-M309 HydrophobicContact CE2-SD 4.13Å; F156-I311 HydrophobicContact CE2-CD1 4.33Å; F156-I311 HydrophobicContact CZ-CD1 4.14Å
157	I	94.3	Very high	67.6	Low	101 Å²	101	89 Å²	89	52%	0.518	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	127.9	172.3	-55.5	177.7	0	0	0	107.6	L304 Q306	I157-L304 HydrophobicContact CG2-CB 3.94Å; I157-L304 HydrophobicContact CG2-CD1 4.4Å; I157-Q306 HydrophobicContact CG1-CG 4.19Å
158	M	94.8	Very high	66.9	Low	2 Å²	2	91.6 Å²	91.6	1%	0.01	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-83.7	136.3	179	-55.6	-162.7	76.3	0	0	110.5	L115 Y138 V139 P305 L307	L115-M158 HydrophobicContact CB-CE 3.59Å; L115-M158 HydrophobicContact CB-SD 3.8Å; L115-M158 HydrophobicContact CD2-SD 3.87Å; L115-M158 HydrophobicContact CG-SD 4.43Å; Y138-M158 CarbonylContact O-C 3.4Å; Y138-M158 WeakPolarHBondContact O-CA 2.79Å; V139-M158 HydrophobicContact CG1-CE 4.46Å; M158-P305 HydrophobicContact CB-CB 4.24Å; M158-P305 WeakPolarHBondContact CB-O 3.22Å; M158-P305 HydrophobicContact CG-CB 4.32Å; M158-P305 PolarHBondContact N-O 3.21Å; M158-P305 HydrophobicContact SD-CB 4.31Å; M158-L307 HydrophobicContact CE-CD2 4.18Å; M158-L307 HydrophobicContact CG-CB 4.06Å; M158-L307 HydrophobicContact SD-CB 3.95Å; M158-L307 HydrophobicContact SD-CD2 4.22Å
159	Q	92.8	Very high	66	Low	101 Å²	101	98 Å²	98	47%	0.472	50%	0.5	S	S	.	.	B	Isolated β-bridge	trans	-79.3	141.3	174.1	-64.5	-178.1	-11.7	0	0	110.2	G137 Y138	G137-Q159 CarbonylContact C-O 3.59Å; G137-Q159 WeakPolarHBondContact CA-O 3.46Å; Y138-Q159 HydrophobicContact CD1-CB 4.44Å; Y138-Q159 HydrophobicContact CE1-CB 4.01Å; Y138-Q159 HydrophobicContact CE2-CB 4.22Å; Y138-Q159 VanDerWaalsContact CE2-OE1 3.23Å; Y138-Q159 VanDerWaalsContact CZ-OE1 3.24Å; Y138-Q159 PolarHBondContact N-O 3.35Å; Y138-Q159 PolarHBondContact O-N 3.48Å; Y138-Q159 PolarHBondContact OH-OE1 3.32Å
160	P	90.4	Very high	65.1	Low	68 Å²	68	97.4 Å²	97.4	44%	0.442	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-69.3	156.7	175.6	30.2	-33.9	0	0	0	111	Y138 Q162 L304	Y138-P160 WeakPolarHBondContact CE1-O 3.29Å; P160-Q162 PolarHBondContact O-N 3.41Å; P160-L304 HydrophobicContact CG-CD2 4.4Å
161	P	84.5	Confident	64.2	Low	40 Å²	40	99.6 Å²	99.6	26%	0.26	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-59.5	127.5	173.8	-20.2	32.6	0	0	0	110.5	F135 I136 I163	F135-P161 HydrophobicContact CD1-CB 3.56Å; F135-P161 HydrophobicContact CD1-CG 3.65Å; F135-P161 HydrophobicContact CE1-CB 3.81Å; F135-P161 HydrophobicContact CE1-CG 4.05Å; F135-P161 HydrophobicContact CG-CB 4.47Å; F135-P161 HydrophobicContact CG-CG 4.12Å; I136-P161 VanDerWaalsContact O-CD 3.32Å; I136-P161 WeakPolarHBondContact O-CD 3.44Å; P161-I163 PolarHBondContact O-N 3.08Å; P161-I163 VanDerWaalsContact O-N 3.1Å
162	Q	72.5	Confident	63	Low	124 Å²	124	102.5 Å²	102.5	58%	0.579	52%	0.52	S	S	*	.			trans	-69.6	107.3	173	-59.7	-62	-23.5	0	0	108.9	P160	P160-Q162 PolarHBondContact O-N 3.41Å
163	I	54.8	Low	61.5	Low	147 Å²	147	103.4 Å²	103.4	75%	0.754	53%	0.525	S	S	*	.			trans	-85.5	109.6	172.6	-57.5	169.8	0	0	0	106.4	P161 S165	P161-I163 PolarHBondContact O-N 3.08Å; P161-I163 VanDerWaalsContact O-N 3.1Å; I163-S165 PolarHBondContact O-N 3.34Å
164	N	43.7	Very low	59.3	Low	103 Å²	103	106.7 Å²	106.7	55%	0.551	54%	0.54	S	S	*	.			trans	-56.8	98.5	173.3	-79	-15.1	0	0	0	110.4	N166	N164-N166 PolarHBondContact O-N 3.38Å
165	S	36.1	Very low	56.9	Low	96 Å²	96	107 Å²	107	67%	0.671	55%	0.551	S	S	*	*			trans	-79.2	7.5	172.3	39.5	0	0	0	0	113.5	I163 L167	I163-S165 PolarHBondContact O-N 3.34Å; S165-L167 PolarHBondContact O-N 3.46Å
166	N	34.8	Very low	54	Low	134 Å²	134	107 Å²	107	72%	0.717	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	11.7	177.6	-77.7	-15.5	0	0	0	115.2	N164	N164-N166 PolarHBondContact O-N 3.38Å
167	L	37.9	Very low	51	Low	140 Å²	140	112.5 Å²	112.5	73%	0.733	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-5.4	169.5	-78.3	176.1	0	0	0	114.6	S165	S165-L167 PolarHBondContact O-N 3.46Å
168	N	33.7	Very low	48.1	Very low	116 Å²	116	116.4 Å²	116.4	62%	0.62	61%	0.608	S	S	*	*	S	Bend	trans	-92.4	-7.3	174.8	-72.5	-3.7	0	0	0	114.1
169	F	34.5	Very low	44.9	Very low	157 Å²	157	124.4 Å²	124.4	69%	0.689	65%	0.645	S	S	*	*	H	α-helix	trans	-79.1	-20.7	175.4	-124.9	-87.2	0	0	0	112.9
170	L	33.5	Very low	41.9	Very low	124 Å²	124	128.6 Å²	128.6	65%	0.649	66%	0.664	S	S	*	*	H	α-helix	trans	-81.4	-26.8	-180	-155.8	70.5	0	0	0	113
171	E	35.1	Very low	38.9	Very low	139 Å²	139	134.6 Å²	134.6	65%	0.65	69%	0.687	S	S	*	*	H	α-helix	trans	-74.6	-32	176	-102.5	-178.8	167.5	0	0	112.8	L173 Q174	E171-L173 VanDerWaalsContact C-N 3.34Å; E171-L173 PolarHBondContact O-N 2.84Å; E171-Q174 PolarHBondContact O-N 2.94Å
172	N	33.5	Very low	36.1	Very low	128 Å²	128	140.9 Å²	140.9	68%	0.684	71%	0.713	S	S	*	*	H	α-helix	trans	-77.9	-17.6	177.7	-77	-24.2	0	0	0	113.9	Q174	N172-Q174 VanDerWaalsContact C-N 3.32Å
173	L	33.8	Very low	33.8	Very low	103 Å²	103	143.4 Å²	143.4	54%	0.539	72%	0.724	S	S	.	*	H	α-helix	trans	-78.9	-17.6	169	-94.7	151.9	0	0	0	112.6	E171 V175	E171-L173 VanDerWaalsContact C-N 3.34Å; E171-L173 PolarHBondContact O-N 2.84Å; L173-V175 VanDerWaalsContact C-N 3.34Å
174	Q	33.9	Very low	32.4	Very low	155 Å²	155	141.8 Å²	141.8	72%	0.724	72%	0.721	S	S	*	*	S	Bend	trans	-85.4	-4.5	-179.5	-137.8	168	-15.6	0	0	114	E171 N172	E171-Q174 PolarHBondContact O-N 2.94Å; N172-Q174 VanDerWaalsContact C-N 3.32Å
175	V	35.3	Very low	31.5	Very low	118 Å²	118	143.5 Å²	143.5	72%	0.715	73%	0.731	S	S	*	*	S	Bend	trans	-98.6	-16.5	174.8	-174.8	0	0	0	0	113	L173 H177	L173-V175 VanDerWaalsContact C-N 3.34Å; V175-H177 PolarHBondContact O-N 2.99Å
176	C	31.3	Very low	30.9	Very low	104 Å²	104	144.4 Å²	144.4	70%	0.703	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	5.6	-180	-106.7	0	0	0	0	115.8
177	H	29.9	Very low	30.6	Very low	162 Å²	162	145 Å²	145	75%	0.75	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.9	16.9	179.6	-77.7	-41.4	0	0	0	115.9	V175	V175-H177 PolarHBondContact O-N 2.99Å
178	Q	32.6	Very low	30.1	Very low	183 Å²	183	146.5 Å²	146.5	86%	0.855	74%	0.739	S	S	*	*	S	Bend	trans	-100.3	18.2	172	-107.1	-180	26.1	0	0	115.3
179	Q	29.3	Very low	29.7	Very low	170 Å²	170	147.2 Å²	147.2	79%	0.794	75%	0.748	S	S	*	*	S	Bend	trans	-135.1	96.7	164.9	-69.2	-178.4	6	0	0	107.7
180	H	29.7	Very low	29.9	Very low	189 Å²	189	145.6 Å²	145.6	88%	0.875	75%	0.753	S	S	*	*			trans	160.4	69.1	152.1	-89.7	78.5	0	0	0	108.7
181	Q	26	Very low	29.3	Very low	195 Å²	195	144.5 Å²	144.5	91%	0.911	76%	0.756	S	S	*	*			trans	-134.5	90.6	157.1	-80.5	-175.1	10.9	0	0	107.8
182	Q	25.8	Very low	29	Very low	172 Å²	172	146 Å²	146	80%	0.804	77%	0.766	S	S	*	*			trans	-134.4	126.2	162.8	-74	-176.7	14.3	0	0	107.5
183	Q	24.9	Very low	28.7	Very low	176 Å²	176	146.5 Å²	146.5	82%	0.822	77%	0.769	S	S	*	*			trans	69.2	131.6	156.2	-73.9	168.9	-3.6	0	0	116
184	T	26.2	Very low	28.2	Very low	113 Å²	113	146.5 Å²	146.5	69%	0.693	78%	0.778	S	S	*	*			cis	-168.1	130	25.1	35	0	0	0	0	106.2
185	D	23.3	Very low	27.7	Very low	139 Å²	139	144 Å²	144	74%	0.743	78%	0.777	S	S	*	*				99.1	122.2	99.5	-78.2	-33	0	0	0	117.3
186	T	24.2	Very low	27.3	Very low	116 Å²	116	144.4 Å²	144.4	71%	0.712	78%	0.78	S	S	*	*			trans	71.2	105.9	149.7	60.6	0	0	0	0	121.4
187	N	29	Very low	27	Very low	145 Å²	145	143.4 Å²	143.4	78%	0.775	79%	0.787	S	S	*	*				177.8	108.9	111	-84.1	-27.5	0	0	0	113.1
188	Q	27.6	Very low	26.8	Very low	172 Å²	172	142.2 Å²	142.2	80%	0.804	79%	0.791	S	S	*	*			trans	29.4	104	141.7	-60.9	175.7	13.7	0	0	119.1
189	T	24.8	Very low	26.5	Very low	132 Å²	132	139.3 Å²	139.3	81%	0.81	79%	0.791	S	S	*	*				64.5	145	91.6	59.6	0	0	0	0	117.1
190	P	37.9	Very low	26.3	Very low	123 Å²	123	134.1 Å²	134.1	80%	0.799	78%	0.783	S	S	*	*			cis	-134.9	163	16.9	37	-16.5	0	0	0	117.7
191	S	22.4	Very low	26.1	Very low	101 Å²	101	136.6 Å²	136.6	71%	0.706	79%	0.785	S	S	*	*			trans	-59	143.5	174.6	49.9	0	0	0	0	117.4
192	I	27.5	Very low	26.2	Very low	169 Å²	169	135.2 Å²	135.2	87%	0.867	78%	0.783	S	S	*	*			trans	-129.6	102.4	144.6	-60.8	-179.5	0	0	0	109.5
193	N	28.5	Very low	26.1	Very low	140 Å²	140	137.8 Å²	137.8	75%	0.749	79%	0.785	S	S	*	*			trans	22.9	110.3	148.3	-63.6	-11.8	0	0	0	122
194	S	22.9	Very low	26.2	Very low	103 Å²	103	139.3 Å²	139.3	72%	0.72	79%	0.789	S	S	*	*			trans	-5.6	145.9	135.7	57.9	0	0	0	0	122.5
195	S	23.8	Very low	26.2	Very low	101 Å²	101	141.7 Å²	141.7	71%	0.706	79%	0.792	S	S	*	*			trans	89.4	111.4	141.2	76.1	0	0	0	0	118.3
196	T	26.9	Very low	26.2	Very low	128 Å²	128	139.7 Å²	139.7	79%	0.785	79%	0.789	S	S	*	*				-170	120.2	92.9	31.3	0	0	0	0	108.8	V198	T196-V198 PolarHBondContact O-N 2.71Å
197	G	23.7	Very low	26.3	Very low	83 Å²	83	141.4 Å²	141.4	86%	0.856	79%	0.792	S	S	*	*			trans	-72.2	118.7	174.6	0	0	0	0	0	110.2
198	V	26.6	Very low	26.3	Very low	137 Å²	137	140 Å²	140	83%	0.83	79%	0.791	S	S	*	*			trans	-109.4	101.5	159.5	-177.8	0	0	0	0	106.4	T196 G200	T196-V198 PolarHBondContact O-N 2.71Å; V198-G200 PolarHBondContact O-N 3.5Å
199	S	24.7	Very low	26.5	Very low	122 Å²	122	135.7 Å²	135.7	85%	0.853	78%	0.784	S	S	*	*			trans	-65.4	82.4	176.9	-178	0	0	0	0	110	R201	S199-R201 PolarHBondContact O-N 2.98Å; S199-R201 VanDerWaalsContact O-N 3.15Å
200	G	25.5	Very low	26.9	Very low	61 Å²	61	133.8 Å²	133.8	63%	0.629	78%	0.776	S	S	*	*			trans	-67.7	102.8	173.5	0	0	0	0	0	111	V198 L202	V198-G200 PolarHBondContact O-N 3.5Å; G200-L202 PolarHBondContact O-N 2.8Å
201	R	25.4	Very low	26.6	Very low	241 Å²	241	130.3 Å²	130.3	91%	0.909	76%	0.755	S	S	*	*			trans	-70.4	89.7	-178.3	-154.2	179.2	-162.8	-175.5	6.4	110.3	S199 R203	S199-R201 PolarHBondContact O-N 2.98Å; S199-R201 VanDerWaalsContact O-N 3.15Å; R201-R203 PolarHBondContact O-N 3Å
202	L	28.2	Very low	27	Very low	165 Å²	165	132.2 Å²	132.2	86%	0.864	75%	0.75	S	S	*	*			trans	-56.4	113.5	173.6	-80.7	153.7	0	0	0	111	G200 K204	G200-L202 PolarHBondContact O-N 2.8Å; L202-K204 PolarHBondContact O-N 2.83Å
203	R	24.5	Very low	27	Very low	227 Å²	227	126.7 Å²	126.7	86%	0.857	74%	0.735	S	S	*	*			trans	-70.6	106.2	170.1	-80.4	-178.5	-177.1	150.8	3.1	108.6	R201 H205	R201-R203 PolarHBondContact O-N 3Å; R203-H205 PolarHBondContact O-N 3.22Å
204	K	27.3	Very low	26.8	Very low	208 Å²	208	130.8 Å²	130.8	90%	0.904	74%	0.742	S	S	*	*			trans	-65.6	104.2	170.1	-69.5	-176	177.4	-177.8	0	109.3	L202	L202-K204 PolarHBondContact O-N 2.83Å
205	H	24.9	Very low	26.8	Very low	163 Å²	163	129.9 Å²	129.9	76%	0.755	74%	0.735	S	S	*	*			trans	-65.8	141.1	165.7	-76.4	-86.5	0	0	0	109.7	R203 I207	R203-H205 PolarHBondContact O-N 3.22Å; H205-I207 PolarHBondContact O-N 3.1Å
206	S	24.1	Very low	26.9	Very low	96 Å²	96	132.9 Å²	132.9	67%	0.671	74%	0.743	S	S	*	*			trans	-62.9	101	178.3	52.1	0	0	0	0	110.7
207	I	27.3	Very low	26.8	Very low	153 Å²	153	131.1 Å²	131.1	79%	0.785	74%	0.737	S	S	*	*			trans	-78.5	131.2	166.8	-58.3	172	0	0	0	106.9	H205 A209	H205-I207 PolarHBondContact O-N 3.1Å; I207-A209 PolarHBondContact O-N 2.85Å
208	P	28.5	Very low	26.8	Very low	115 Å²	115	136.3 Å²	136.3	75%	0.747	74%	0.736	S	S	*	*			trans	-60.7	133.6	176.3	24.3	-31.1	0	0	0	109.6	S210	P208-S210 PolarHBondContact O-N 3.46Å; P208-S210 VanDerWaalsContact O-N 3.07Å
209	A	31.7	Very low	26.7	Very low	81 Å²	81	134.8 Å²	134.8	67%	0.669	73%	0.731	S	S	*	*			trans	-52.9	115.1	-176.2	0	0	0	0	0	110.4	I207 C211	I207-A209 PolarHBondContact O-N 2.85Å; A209-C211 PolarHBondContact O-N 3.32Å; A209-C211 PolarHBondContact O-SG 3.05Å
210	S	32.3	Very low	26.7	Very low	92 Å²	92	136.1 Å²	136.1	64%	0.643	73%	0.727	S	S	*	*			trans	-76.1	107.9	175.6	54.8	0	0	0	0	109.1	P208 F212	P208-S210 PolarHBondContact O-N 3.46Å; P208-S210 VanDerWaalsContact O-N 3.07Å; S210-F212 VanDerWaalsContact C-N 3.33Å; S210-F212 PolarHBondContact O-N 3.36Å
211	C	31.5	Very low	26.6	Very low	51 Å²	51	140.6 Å²	140.6	35%	0.345	74%	0.735	S	S	.	*			trans	-84.1	13.1	-173.8	-52.6	0	0	0	0	115.7	A209	A209-C211 PolarHBondContact O-N 3.32Å; A209-C211 PolarHBondContact O-SG 3.05Å
212	F	31.1	Very low	26.6	Very low	140 Å²	140	134.2 Å²	134.2	61%	0.614	73%	0.725	S	S	*	*			trans	-131.7	106.7	-179.6	-72.1	-81.4	0	0	0	111.1	S210	S210-F212 VanDerWaalsContact C-N 3.33Å; S210-F212 PolarHBondContact O-N 3.36Å
213	G	27.1	Very low	26.4	Very low	53 Å²	53	133.9 Å²	133.9	55%	0.546	72%	0.724	S	S	.	*			trans	-80.4	137	154.9	0	0	0	0	0	108.8	S215	G213-S215 PolarHBondContact O-N 3.21Å
214	Y	24.1	Very low	26.4	Very low	227 Å²	227	127.7 Å²	127.7	89%	0.89	72%	0.716	S	S	*	*			trans	-59.7	100.2	175.4	-76.3	-95.1	0	0	0	110.2
215	S	24.4	Very low	26.3	Very low	83 Å²	83	125.9 Å²	125.9	58%	0.58	71%	0.711	S	S	*	*			trans	-83.4	107.3	161	44.4	0	0	0	0	108.1	G213 S217	G213-S215 PolarHBondContact O-N 3.21Å; S215-S217 PolarHBondContact O-N 2.84Å
216	N	26.1	Very low	26.2	Very low	164 Å²	164	128.9 Å²	128.9	88%	0.877	72%	0.717	S	S	*	*			trans	-69.8	56.5	174.7	-92.4	-5.5	0	0	0	112.2
217	S	24.3	Very low	26.2	Very low	92 Å²	92	129.6 Å²	129.6	64%	0.643	72%	0.717	S	S	*	*			trans	-133.5	53	175	19.4	0	0	0	0	110.4	S215	S215-S217 PolarHBondContact O-N 2.84Å
218	F	24.2	Very low	25.9	Very low	191 Å²	191	128.7 Å²	128.7	84%	0.838	72%	0.719	S	S	*	*			trans	-107.6	79.1	151	-72.9	-79.8	0	0	0	106.9	I220	F218-I220 VanDerWaalsContact C-N 3.33Å; F218-I220 PolarHBondContact O-N 3.09Å
219	S	24.4	Very low	25.7	Very low	106 Å²	106	130.8 Å²	130.8	74%	0.741	72%	0.724	S	S	*	*			trans	-67.5	99.9	163.3	48.8	0	0	0	0	107.2	I221	S219-I221 PolarHBondContact O-N 2.86Å
220	I	23.7	Very low	25.3	Very low	150 Å²	150	131.6 Å²	131.6	77%	0.769	72%	0.724	S	S	*	*			trans	-54.1	107.4	167.6	-63.2	167.3	0	0	0	106.7	F218 P222	F218-I220 VanDerWaalsContact C-N 3.33Å; F218-I220 PolarHBondContact O-N 3.09Å; I220-P222 VanDerWaalsContact O-CD 3.28Å; I220-P222 WeakPolarHBondContact O-CD 3.5Å
221	I	24.3	Very low	24.9	Very low	155 Å²	155	134.2 Å²	134.2	80%	0.795	73%	0.731	S	S	*	*			trans	-67.1	113.8	165.5	-62.2	173.5	0	0	0	105.1	S219 N223	S219-I221 PolarHBondContact O-N 2.86Å; I221-N223 PolarHBondContact O-N 2.76Å
222	P	24.2	Very low	24.9	Very low	107 Å²	107	140 Å²	140	70%	0.695	76%	0.759	S	S	*	*			trans	-71.5	134	-175.4	-6.9	22	0	0	0	109.9	I220 S224	I220-P222 VanDerWaalsContact O-CD 3.28Å; I220-P222 WeakPolarHBondContact O-CD 3.5Å; P222-S224 PolarHBondContact O-N 2.87Å
223	N	23.4	Very low	24.5	Very low	157 Å²	157	142.8 Å²	142.8	84%	0.84	77%	0.771	S	S	*	*			trans	-30.8	105.3	168.9	-78.5	-20.2	0	0	0	113.3	I221 Q225	I221-N223 PolarHBondContact O-N 2.76Å; N223-Q225 PolarHBondContact O-N 3.11Å; N223-Q225 VanDerWaalsContact O-N 3.1Å
224	S	24.7	Very low	24.3	Very low	97 Å²	97	146.7 Å²	146.7	68%	0.678	78%	0.778	S	S	*	*			trans	-71.8	100.9	157.2	56.4	0	0	0	0	107.4	P222 Y226	P222-S224 PolarHBondContact O-N 2.87Å; S224-Y226 PolarHBondContact O-N 3.12Å; S224-Y226 VanDerWaalsContact O-N 3.15Å
225	Q	25.2	Very low	24.5	Very low	171 Å²	171	144 Å²	144	80%	0.799	78%	0.779	S	S	*	*			trans	-52.7	114.8	171.6	-69.2	171	-22.5	0	0	109.3	N223 T227	N223-Q225 PolarHBondContact O-N 3.11Å; N223-Q225 VanDerWaalsContact O-N 3.1Å; Q225-T227 VanDerWaalsContact C-N 3.25Å; Q225-T227 PolarHBondContact O-N 3.46Å
226	Y	23.6	Very low	24.7	Very low	225 Å²	225	146 Å²	146	88%	0.882	78%	0.783	S	S	*	*			trans	-68.3	87.9	165.8	-77.9	-88.6	0	0	0	108.3	S224 T228	S224-Y226 PolarHBondContact O-N 3.12Å; S224-Y226 VanDerWaalsContact O-N 3.15Å; Y226-T228 PolarHBondContact O-N 2.8Å
227	T	24	Very low	24.8	Very low	112 Å²	112	144.9 Å²	144.9	69%	0.687	78%	0.778	S	S	*	*			trans	-76.1	113.5	163.1	51.5	0	0	0	0	108.1	Q225 N229	Q225-T227 VanDerWaalsContact C-N 3.25Å; Q225-T227 PolarHBondContact O-N 3.46Å; T227-N229 PolarHBondContact O-N 3.09Å; T227-N229 VanDerWaalsContact O-N 3.08Å
228	T	21.9	Very low	25	Very low	133 Å²	133	147.9 Å²	147.9	82%	0.816	79%	0.786	S	S	*	*			trans	-57.2	104.1	170.4	50.1	0	0	0	0	109.9	Y226	Y226-T228 PolarHBondContact O-N 2.8Å
229	N	24.4	Very low	24.8	Very low	160 Å²	160	148.1 Å²	148.1	86%	0.856	79%	0.79	S	S	*	*			trans	-104.2	87.2	167.6	-120.9	12.5	0	0	0	108.7	T227 N231	T227-N229 PolarHBondContact O-N 3.09Å; T227-N229 VanDerWaalsContact O-N 3.08Å; N229-N231 PolarHBondContact O-N 3.44Å
230	S	22.7	Very low	24.9	Very low	97 Å²	97	150.5 Å²	150.5	68%	0.678	79%	0.794	S	S	*	*			trans	-59.9	111.6	158	49.2	0	0	0	0	108.6
231	N	23.8	Very low	24.9	Very low	147 Å²	147	152.5 Å²	152.5	79%	0.786	80%	0.797	S	S	*	*			trans	168.4	99.5	147.8	-85.9	-21.7	0	0	0	107.3	N229	N229-N231 PolarHBondContact O-N 3.44Å
232	N	30.4	Very low	24.8	Very low	172 Å²	172	156.4 Å²	156.4	92%	0.92	80%	0.803	S	S	*	*			trans	-163.1	130.2	131	-91.9	-25.7	0	0	0	110.7
233	K	24.7	Very low	24.9	Very low	200 Å²	200	158.6 Å²	158.6	87%	0.87	81%	0.809	S	S	*	*			trans	-60.5	151.3	-173.6	-106.5	167.3	166.1	175.9	0	113
234	L	21.9	Very low	24.9	Very low	134 Å²	134	159.5 Å²	159.5	70%	0.702	81%	0.808	S	S	*	*			trans	-32.4	134.1	159.4	-83.3	81.6	0	0	0	112.9
235	N	29.5	Very low	24.8	Very low	171 Å²	171	163.6 Å²	163.6	91%	0.914	82%	0.818	S	S	*	*			trans	-133.1	117	137.9	-86.7	-26.3	0	0	0	107
236	D	26.6	Very low	24.7	Very low	124 Å²	124	163 Å²	163	66%	0.663	82%	0.816	S	S	*	*			trans	-66.2	166.4	171.7	-77.8	-47.2	0	0	0	111.6
237	D	28.6	Very low	24.8	Very low	142 Å²	142	160.7 Å²	160.7	76%	0.759	82%	0.818	S	S	*	*			trans	78.6	86.6	164	-52.3	-28.5	0	0	0	117.2
238	N	28.4	Very low	24.8	Very low	154 Å²	154	159.7 Å²	159.7	82%	0.824	82%	0.815	S	S	*	*			trans	-158.9	98	134.6	-91.1	-42.9	0	0	0	111.1	L240	N238-L240 PolarHBondContact O-N 3.07Å
239	E	21.4	Very low	25	Very low	197 Å²	197	163.4 Å²	163.4	92%	0.921	82%	0.82	S	S	*	*			trans	-63.9	102.7	166.9	-168.1	-179.7	-154.1	0	0	109.8
240	L	25.4	Very low	25	Very low	155 Å²	155	164.2 Å²	164.2	81%	0.812	82%	0.816	S	S	*	*			trans	-130.1	101.6	174.2	-86.6	162.9	0	0	0	111.6	N238	N238-L240 PolarHBondContact O-N 3.07Å
241	K	23.7	Very low	25	Very low	192 Å²	192	169.4 Å²	169.4	84%	0.835	83%	0.826	S	S	*	*			trans	-15.4	122.3	163.5	-73.1	170.5	174	174.1	0	116.3	N243	K241-N243 PolarHBondContact O-N 3.06Å
242	Y	22.3	Very low	25	Very low	238 Å²	238	167.5 Å²	167.5	93%	0.933	82%	0.823	S	S	*	*			trans	-56.4	108.7	163.2	-84.2	-98.7	0	0	0	111.2
243	N	26	Very low	24.6	Very low	153 Å²	153	163.8 Å²	163.8	82%	0.818	81%	0.811	S	S	*	*			trans	-97.9	116.1	161.7	-81.9	-27.4	0	0	0	109.2	K241 M245	K241-N243 PolarHBondContact O-N 3.06Å; N243-M245 PolarHBondContact O-N 3.23Å; N243-M245 VanDerWaalsContact O-N 3.15Å
244	H	23.1	Very low	24.5	Very low	176 Å²	176	165.7 Å²	165.7	82%	0.815	81%	0.813	S	S	*	*			trans	-55.2	101.6	176.3	-168.5	-88.9	0	0	0	111.1	E246	H244-E246 PolarHBondContact O-N 3.45Å
245	M	23.7	Very low	24.8	Very low	182 Å²	182	165.1 Å²	165.1	90%	0.897	82%	0.815	S	S	*	*			trans	-88.6	98.5	175	-167	116.8	74	0	0	109.4	N243 L247	N243-M245 PolarHBondContact O-N 3.23Å; N243-M245 VanDerWaalsContact O-N 3.15Å; M245-L247 PolarHBondContact O-N 3.21Å
246	E	23.5	Very low	24.5	Very low	159 Å²	159	161.9 Å²	161.9	74%	0.743	81%	0.812	S	S	*	*			trans	-56.3	129.6	167.4	-93.2	-179.3	136.1	0	0	110.9	H244 S248	H244-E246 PolarHBondContact O-N 3.45Å; E246-S248 PolarHBondContact O-N 2.73Å
247	L	24.9	Very low	24.3	Very low	177 Å²	177	159.4 Å²	159.4	93%	0.927	82%	0.816	S	S	*	*			trans	-64.3	79.7	174.2	-74.5	155.6	0	0	0	110.5	M245 K249	M245-L247 PolarHBondContact O-N 3.21Å; L247-K249 PolarHBondContact O-N 2.77Å
248	S	24.8	Very low	24.1	Very low	90 Å²	90	158.6 Å²	158.6	63%	0.629	82%	0.815	S	S	*	*			trans	-61.2	122.5	166	61.5	0	0	0	0	108.8	E246 K250	E246-S248 PolarHBondContact O-N 2.73Å; S248-K250 PolarHBondContact O-N 3.44Å
249	K	25.5	Very low	23.8	Very low	211 Å²	211	157.6 Å²	157.6	92%	0.917	82%	0.815	S	S	*	*			trans	-61.1	74.7	-178.9	-65	170.1	-179.9	169.4	0	110.8	L247 K251	L247-K249 PolarHBondContact O-N 2.77Å; K249-K251 PolarHBondContact O-N 2.82Å
250	K	24.1	Very low	24.1	Very low	177 Å²	177	153.5 Å²	153.5	77%	0.77	80%	0.804	S	S	*	*			trans	-76.4	115.8	171.2	-83.2	-175.6	178.8	175.2	0	108.9	S248 C252	S248-K250 PolarHBondContact O-N 3.44Å; K250-C252 VanDerWaalsContact C-N 3.31Å; K250-C252 PolarHBondContact O-N 3.34Å
251	K	22.1	Very low	24	Very low	206 Å²	206	154 Å²	154	90%	0.896	81%	0.808	S	S	*	*			trans	-56.4	84.5	175.4	-139.7	173	-175.8	174.2	0	109.4	K249 S253	K249-K251 PolarHBondContact O-N 2.82Å; K251-S253 VanDerWaalsContact C-N 3.29Å; K251-S253 PolarHBondContact O-N 2.96Å
252	C	24.1	Very low	24.2	Very low	107 Å²	107	149 Å²	149	72%	0.723	80%	0.796	S	S	*	*			trans	-73.3	85.6	173.5	-75.3	0	0	0	0	109.8	K250 W254	K250-C252 VanDerWaalsContact C-N 3.31Å; K250-C252 PolarHBondContact O-N 3.34Å; C252-W254 PolarHBondContact O-N 3.03Å
253	S	22.9	Very low	24.3	Very low	94 Å²	94	145.7 Å²	145.7	66%	0.657	80%	0.795	S	S	*	*			trans	-81.1	92	165.6	158.1	0	0	0	0	108.4	K251 T255	K251-S253 VanDerWaalsContact C-N 3.29Å; K251-S253 PolarHBondContact O-N 2.96Å; S253-T255 PolarHBondContact O-N 2.97Å
254	W	23	Very low	24.3	Very low	241 Å²	241	147.7 Å²	147.7	91%	0.913	80%	0.797	S	S	*	*			trans	-80	100.5	161	-69.4	90.6	0	0	0	107.8	C252	C252-W254 PolarHBondContact O-N 3.03Å
255	T	26.8	Very low	24.3	Very low	121 Å²	121	146.5 Å²	146.5	74%	0.742	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-81.6	122.1	162	35.9	0	0	0	0	107.3	S253 G257	S253-T255 PolarHBondContact O-N 2.97Å; T255-G257 PolarHBondContact O-N 3.05Å
256	A	23.9	Very low	24.4	Very low	104 Å²	104	146.4 Å²	146.4	86%	0.86	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-58.9	119.4	176.6	0	0	0	0	0	109.3
257	G	22.1	Very low	24.5	Very low	72 Å²	72	144.4 Å²	144.4	74%	0.742	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-66.1	135.7	-177.1	0	0	0	0	0	112.6	T255	T255-G257 PolarHBondContact O-N 3.05Å
258	V	25.5	Very low	24.5	Very low	124 Å²	124	143.6 Å²	143.6	75%	0.752	79%	0.786	S	S	*	*			trans	-130.4	98.3	142.6	-175.6	0	0	0	0	105	T260	V258-T260 HydrophobicContact CG1-CG2 4Å; V258-T260 PolarHBondContact O-N 3.26Å
259	T	22.3	Very low	24.5	Very low	134 Å²	134	149 Å²	149	82%	0.822	80%	0.798	S	S	*	*			trans	-65.1	101	167.9	43.9	0	0	0	0	107.5	D261	T259-D261 PolarHBondContact O-N 3.15Å
260	T	25.8	Very low	24.5	Very low	111 Å²	111	146.5 Å²	146.5	68%	0.681	79%	0.794	S	S	*	*			trans	-92	91.3	167.8	46.1	0	0	0	0	107.7	V258 S262	V258-T260 HydrophobicContact CG1-CG2 4Å; V258-T260 PolarHBondContact O-N 3.26Å; T260-S262 PolarHBondContact O-N 3.29Å
261	D	25	Very low	24.6	Very low	166 Å²	166	144.9 Å²	144.9	89%	0.888	79%	0.792	S	S	*	*			trans	-62.8	102.9	163.1	-80	-30.4	0	0	0	107.9	T259	T259-D261 PolarHBondContact O-N 3.15Å
262	S	27.5	Very low	24.6	Very low	86 Å²	86	140.2 Å²	140.2	60%	0.601	79%	0.785	S	S	*	*			trans	-147.7	96.7	164.3	56.9	0	0	0	0	111	T260 F264	T260-S262 PolarHBondContact O-N 3.29Å; S262-F264 PolarHBondContact O-N 2.93Å
263	N	24.4	Very low	24.8	Very low	169 Å²	169	144.6 Å²	144.6	90%	0.904	79%	0.792	S	S	*	*			trans	-52.8	101	155.7	-86.3	-33.1	0	0	0	109.3
264	F	25.9	Very low	24.7	Very low	194 Å²	194	145.7 Å²	145.7	85%	0.851	80%	0.8	S	S	*	*			trans	-125.7	97.3	161.5	-98.8	-82.6	0	0	0	110.2	S262	S262-F264 PolarHBondContact O-N 2.93Å
265	N	22.9	Very low	25	Very low	152 Å²	152	139 Å²	139	81%	0.813	79%	0.79	S	S	*	*			trans	-74.8	147.4	170.3	-105.1	-34.8	0	0	0	111.3
266	K	25.5	Very low	24.8	Very low	179 Å²	179	139.1 Å²	139.1	78%	0.778	80%	0.796	S	S	*	*			trans	80.2	100.4	153.4	-84.4	177.7	176.7	173.7	0	120.1
267	T	24.9	Very low	25.1	Very low	118 Å²	118	139.2 Å²	139.2	72%	0.724	79%	0.79	S	S	*	*				51.1	102.1	119.3	60.9	0	0	0	0	117.9
268	N	26.5	Very low	25.1	Very low	159 Å²	159	142.4 Å²	142.4	85%	0.85	80%	0.795	S	S	*	*			trans	-133.4	99.5	145.3	-91.9	-26.9	0	0	0	109.8	I270	N268-I270 PolarHBondContact O-N 3.1Å
269	K	23.6	Very low	25.2	Very low	203 Å²	203	141.3 Å²	141.3	88%	0.883	79%	0.793	S	S	*	*			trans	-64.8	116.6	159.3	-86.3	176.4	170.7	175.6	0	107.7
270	I	26.8	Very low	25.3	Very low	160 Å²	160	141.2 Å²	141.2	82%	0.821	79%	0.792	S	S	*	*			trans	-132.9	123.4	152.9	-59.3	-177.6	0	0	0	108.5	N268	N268-I270 PolarHBondContact O-N 3.1Å
271	I	25.8	Very low	25.1	Very low	143 Å²	143	140.1 Å²	140.1	73%	0.733	80%	0.795	S	S	*	*			trans	-72.4	137.2	-168.4	-72.9	158.2	0	0	0	110.9	K273	I271-K273 PolarHBondContact O-N 3.09Å
272	S	22.1	Very low	25.1	Very low	108 Å²	108	139 Å²	139	76%	0.755	79%	0.794	S	S	*	*			trans	-49.9	121.4	164.5	36.9	0	0	0	0	112.1
273	K	27.3	Very low	25.1	Very low	199 Å²	199	140.3 Å²	140.3	87%	0.865	80%	0.803	S	S	*	*			trans	-112.3	93.1	158.1	-79.5	-175.1	177.1	178.1	0	108.7	I271	I271-K273 PolarHBondContact O-N 3.09Å
274	S	22.1	Very low	26.1	Very low	117 Å²	117	137.2 Å²	137.2	82%	0.818	79%	0.792	S	S	*	*			trans	-69.8	116.7	156.4	49.2	0	0	0	0	108.6
275	S	28.1	Very low	26	Very low	101 Å²	101	134.9 Å²	134.9	71%	0.706	79%	0.788	S	S	*	*			trans	-145.6	92.1	158.8	54.8	0	0	0	0	108.5	S277	S275-S277 PolarHBondContact O-N 3.13Å
276	S	23.7	Very low	26.2	Very low	123 Å²	123	135.8 Å²	135.8	86%	0.86	79%	0.792	S	S	*	*			trans	-46.9	120.2	153.1	47.3	0	0	0	0	110.3
277	S	28.5	Very low	26.1	Very low	105 Å²	105	132.9 Å²	132.9	73%	0.734	80%	0.795	S	S	*	*			trans	-153	107.9	152	44	0	0	0	0	109.9	S275	S275-S277 PolarHBondContact O-N 3.13Å
278	T	23.9	Very low	26.1	Very low	140 Å²	140	132.6 Å²	132.6	86%	0.859	80%	0.795	S	S	*	*			trans	-54	128.8	156.7	17.5	0	0	0	0	111.3
279	S	25.8	Very low	26	Very low	100 Å²	100	132.1 Å²	132.1	70%	0.699	79%	0.792	S	S	*	*			trans	171.5	104.5	147.1	32.3	0	0	0	0	109.1
280	T	24.3	Very low	25.9	Very low	133 Å²	133	126.9 Å²	126.9	82%	0.816	78%	0.781	S	S	*	*				65.6	105.2	105.3	57.2	0	0	0	0	116.1
281	A	22	Very low	25.8	Very low	88 Å²	88	127 Å²	127	73%	0.727	78%	0.784	S	S	*	*				81.7	144.6	128.1	0	0	0	0	0	120.8
282	T	25.7	Very low	25.6	Very low	141 Å²	141	125 Å²	125	87%	0.865	78%	0.783	S	S	*	*			trans	81.5	108.4	158.4	49.8	0	0	0	0	119.7
283	S	27	Very low	25.8	Very low	115 Å²	115	125.7 Å²	125.7	80%	0.804	78%	0.782	S	S	*	*			trans	-54.1	-178.1	158	-31.8	0	0	0	0	113
284	P	45.5	Very low	25.7	Very low	103 Å²	103	122.1 Å²	122.1	67%	0.669	78%	0.777	S	S	*	*			cis	-136.2	-176.4	-9.1	38.3	-19.3	0	0	0	114.4
285	N	24.1	Very low	25.9	Very low	145 Å²	145	122.2 Å²	122.2	78%	0.775	77%	0.768	S	S	*	*			trans	68.3	91.5	150.6	-69.1	-20.1	0	0	0	118.8
286	L	26.8	Very low	25.8	Very low	171 Å²	171	124.2 Å²	124.2	90%	0.895	77%	0.771	S	S	*	*				-148.6	104.6	129.1	-78.4	-178.5	0	0	0	108.7	P288	L286-P288 WeakPolarHBondContact O-CD 3.32Å
287	S	22.7	Very low	26.1	Very low	119 Å²	119	126.5 Å²	126.5	83%	0.832	77%	0.766	S	S	*	*			trans	-79.8	124.1	154.5	44.1	0	0	0	0	108.6
288	P	26.2	Very low	26.1	Very low	112 Å²	112	129.1 Å²	129.1	73%	0.727	77%	0.77	S	S	*	*			trans	-130	124.8	141.5	28.6	-12.8	0	0	0	111.4	L286	L286-P288 WeakPolarHBondContact O-CD 3.32Å
289	N	23.4	Very low	26.4	Very low	149 Å²	149	127.8 Å²	127.8	80%	0.797	76%	0.757	S	S	*	*			trans	34.6	109.8	146.8	-87.3	-3.6	0	0	0	119.5	N291	N289-N291 PolarHBondContact O-N 3.46Å
290	S	22.4	Very low	26.8	Very low	93 Å²	93	127.1 Å²	127.1	65%	0.65	75%	0.752	S	S	*	*				6.6	105.4	124.6	57.3	0	0	0	0	115.1
291	N	23.2	Very low	27.8	Very low	163 Å²	163	128.8 Å²	128.8	87%	0.872	75%	0.751	S	S	*	*			trans	177	87	136.9	-85.2	-14.8	0	0	0	108.4	N289	N289-N291 PolarHBondContact O-N 3.46Å
292	S	22.6	Very low	29.3	Very low	101 Å²	101	131.8 Å²	131.8	71%	0.706	76%	0.755	S	S	*	*			trans	-155.4	96.1	157.3	63.8	0	0	0	0	107
293	V	26.4	Very low	31.6	Very low	122 Å²	122	126.9 Å²	126.9	74%	0.739	73%	0.726	S	S	*	*				60	109.9	103.1	180	0	0	0	0	110	N295	V293-N295 PolarHBondContact O-N 3.14Å
294	T	25.6	Very low	34.5	Very low	124 Å²	124	123.3 Å²	123.3	76%	0.761	70%	0.698	S	S	*	*			trans	-39.6	93.8	172.5	44.3	0	0	0	0	111.7	N296	T294-N296 VanDerWaalsContact C-N 3.34Å; T294-N296 PolarHBondContact O-N 3.14Å
295	N	25.1	Very low	36.8	Very low	119 Å²	119	119.3 Å²	119.3	64%	0.636	67%	0.672	S	S	*	*			trans	-70.7	98	165.3	-80.9	-21.5	0	0	0	107.1	V293 F297	V293-N295 PolarHBondContact O-N 3.14Å; N295-F297 HydrophobicContact CB-CD2 3.96Å; N295-F297 HydrophobicContact CB-CE2 3.88Å; N295-F297 WeakPolarHBondContact O-CD2 3.49Å; N295-F297 PolarHBondContact O-N 3.38Å
296	N	25.9	Very low	40.1	Very low	142 Å²	142	114.4 Å²	114.4	76%	0.759	64%	0.644	S	S	*	*			trans	-59.4	89.3	159.1	-77.5	-16.5	0	0	0	107.3	T294 I298	T294-N296 VanDerWaalsContact C-N 3.34Å; T294-N296 PolarHBondContact O-N 3.14Å; N296-I298 VanDerWaalsContact C-N 3.25Å; N296-I298 PolarHBondContact O-N 3.03Å
297	F	30.3	Very low	43.4	Very low	172 Å²	172	106.3 Å²	106.3	75%	0.754	60%	0.602	S	S	*	*			trans	-67.7	88.5	169.6	-88.3	-88.6	0	0	0	108	N295 L299	N295-F297 HydrophobicContact CB-CD2 3.96Å; N295-F297 HydrophobicContact CB-CE2 3.88Å; N295-F297 WeakPolarHBondContact O-CD2 3.49Å; N295-F297 PolarHBondContact O-N 3.38Å; F297-L299 VanDerWaalsContact C-N 3.27Å; F297-L299 PolarHBondContact O-N 2.89Å
298	I	29.3	Very low	46.8	Very low	159 Å²	159	103.3 Å²	103.3	82%	0.815	57%	0.572	S	S	*	*			trans	-71.4	93.3	162.3	-59.5	171.7	0	0	0	105.5	N296 S300	N296-I298 VanDerWaalsContact C-N 3.25Å; N296-I298 PolarHBondContact O-N 3.03Å; I298-S300 PolarHBondContact O-N 3.44Å
299	L	30.7	Very low	50	Low	112 Å²	112	98 Å²	98	59%	0.586	54%	0.538	S	S	*	.			trans	-61.6	120.3	169.9	-79.6	175.8	0	0	0	108	F297 E301 S303	F297-L299 VanDerWaalsContact C-N 3.27Å; F297-L299 PolarHBondContact O-N 2.89Å; L299-E301 PolarHBondContact O-N 2.88Å; L299-S303 WeakPolarHBondContact CB-OG 3.01Å
300	S	32.8	Very low	53.2	Low	87 Å²	87	91.5 Å²	91.5	61%	0.608	50%	0.502	S	S	*	.			trans	-51.9	135.8	174.1	55.3	0	0	0	0	109.8	I298 N302 S303	I298-S300 PolarHBondContact O-N 3.44Å; S300-N302 PolarHBondContact O-N 2.83Å; S300-S303 WeakPolarHBondContact O-CB 3.43Å; S300-S303 PolarHBondContact O-N 2.92Å; S300-S303 PolarHBondContact O-OG 3.39Å
301	E	47	Very low	56.3	Low	167 Å²	167	87.7 Å²	87.7	78%	0.78	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-47.9	-26.7	-170.2	-70.5	-175.8	151.2	0	0	115.2	L299 S303	L299-E301 PolarHBondContact O-N 2.88Å; E301-S303 PolarHBondContact O-N 3.19Å; E301-S303 VanDerWaalsContact O-N 3.15Å
302	N	53.4	Low	59.4	Low	152 Å²	152	80.6 Å²	80.6	81%	0.813	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-70.5	-0.4	175.4	-73.6	-13.3	0	0	0	115.7	S300	S300-N302 PolarHBondContact O-N 2.83Å
303	S	72.9	Confident	62.4	Low	38 Å²	38	76 Å²	76	27%	0.266	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-113.6	0.9	-174.7	63	0	0	0	0	115.3	L299 S300 E301	L299-S303 WeakPolarHBondContact CB-OG 3.01Å; S300-S303 WeakPolarHBondContact O-CB 3.43Å; S300-S303 PolarHBondContact O-N 2.92Å; S300-S303 PolarHBondContact O-OG 3.39Å; E301-S303 PolarHBondContact O-N 3.19Å; E301-S303 VanDerWaalsContact O-N 3.15Å
304	L	87.8	Confident	65.3	Low	40 Å²	40	71.7 Å²	71.7	21%	0.209	38%	0.375	C	S	.	.	S	Bend	trans	-67.9	146.2	176.1	-75.7	143.7	0	0	0	111.3	N64 I157 P160 Q306	N64-L304 WeakPolarHBondContact CB-O 3.15Å; N64-L304 PolarHBondContact ND2-O 3.32Å; I157-L304 HydrophobicContact CG2-CB 3.94Å; I157-L304 HydrophobicContact CG2-CD1 4.4Å; P160-L304 HydrophobicContact CG-CD2 4.4Å; L304-Q306 PolarHBondContact O-N 3.24Å
305	P	93.3	Very high	68.2	Low	19 Å²	19	66.6 Å²	66.6	12%	0.123	34%	0.344	C	S	.	.			trans	-56.2	136.2	172.7	-24.1	34	0	0	0	111.3	V62 K63 L65 L115 I136 M158	V62-P305 HydrophobicContact CG2-CB 4.24Å; K63-P305 WeakPolarHBondContact O-CA 3.32Å; L65-P305 HydrophobicContact CD2-CB 3.87Å; L65-P305 HydrophobicContact CD2-CG 4.01Å; L115-P305 HydrophobicContact CD2-CB 4.26Å; I136-P305 HydrophobicContact CG2-CG 4.23Å; M158-P305 HydrophobicContact CB-CB 4.24Å; M158-P305 WeakPolarHBondContact CB-O 3.22Å; M158-P305 HydrophobicContact CG-CB 4.32Å; M158-P305 PolarHBondContact N-O 3.21Å; M158-P305 HydrophobicContact SD-CB 4.31Å
306	Q	95.1	Very high	71.2	Confident	42 Å²	42	61 Å²	61	20%	0.196	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	129.7	175.2	-61.5	-172.1	-18.4	0	0	109.1	V62 K63 W155 F156 I157 L304	V62-Q306 CarbonylContact C-O 3.57Å; V62-Q306 WeakPolarHBondContact CA-O 3.48Å; V62-Q306 VanDerWaalsContact CG2-O 3.27Å; V62-Q306 WeakPolarHBondContact CG2-O 3.21Å; K63-Q306 HydrophobicContact CG-CB 4.01Å; K63-Q306 PolarHBondContact N-O 2.91Å; K63-Q306 PolarHBondContact O-N 3.21Å; K63-Q306 VanDerWaalsContact O-N 3.14Å; W155-Q306 HydrophobicContact CE3-CB 3.88Å; W155-Q306 HydrophobicContact CZ3-CB 4.25Å; W155-Q306 WeakPolarHBondContact CZ3-O 3.49Å; F156-Q306 CarbonylContact O-C 3.56Å; F156-Q306 VanDerWaalsContact O-CA 3.32Å; F156-Q306 WeakPolarHBondContact O-CA 2.97Å; I157-Q306 HydrophobicContact CG1-CG 4.19Å; L304-Q306 PolarHBondContact O-N 3.24Å
307	L	95.4	Very high	74.3	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	125.6	-175.7	-178.1	63.5	0	0	0	110	I59 E61 V62 W96 I113 V139 F156 M158 M309	I59-L307 HydrophobicContact CG2-CD1 4.14Å; E61-L307 CarbonylContact O-C 3.52Å; V62-L307 HydrophobicContact CB-CD1 3.93Å; V62-L307 HydrophobicContact CG2-CD1 4.49Å; W96-L307 HydrophobicContact CZ3-CD1 4.15Å; I113-L307 HydrophobicContact CB-CD2 4.27Å; I113-L307 HydrophobicContact CG2-CD2 3.75Å; V139-L307 HydrophobicContact CG1-CD2 4.29Å; F156-L307 PolarHBondContact N-O 3.36Å; F156-L307 PolarHBondContact O-N 3.39Å; M158-L307 HydrophobicContact CE-CD2 4.18Å; M158-L307 HydrophobicContact CG-CB 4.06Å; M158-L307 HydrophobicContact SD-CB 3.95Å; M158-L307 HydrophobicContact SD-CD2 4.22Å; L307-M309 HydrophobicContact CB-CE 4.34Å; L307-M309 HydrophobicContact CD2-CE 3.18Å; L307-M309 HydrophobicContact CG-CE 3.53Å
308	R	95	Very high	77.3	Confident	57 Å²	57	49.2 Å²	49.2	22%	0.215	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	130.6	172.6	-169.4	172.6	67	-175.3	-5.2	109.7	Q60 E61 K154 W155	Q60-R308 HydrophobicContact CB-CB 4.22Å; Q60-R308 HydrophobicContact CB-CG 4.2Å; Q60-R308 WeakPolarHBondContact CB-O 3.21Å; Q60-R308 PolarHBondContact N-O 2.75Å; E61-R308 VanDerWaalsContact CD-CZ 3.45Å; E61-R308 HydrophobicContact CG-CB 3.97Å; E61-R308 PolarHBondContact N-O 3.15Å; E61-R308 PolarHBondContact O-N 3.11Å; E61-R308 IonicContact OE1-CZ 2.98Å; E61-R308 IonicContact OE1-NE 2.68Å; E61-R308 PolarHBondContact OE1-NE 2.92Å; E61-R308 IonicContact OE1-NH1 3.6Å; E61-R308 PolarHBondContact OE1-NH1 3.11Å; E61-R308 IonicContact OE1-NH2 2.63Å; E61-R308 PolarHBondContact OE1-NH2 3.39Å; E61-R308 IonicContact OE2-NH2 3.09Å; E61-R308 PolarHBondContact OE2-NH2 3.37Å; K154-R308 WeakPolarHBondContact O-CA 3.39Å; W155-R308 HydrophobicContact CD2-CB 3.79Å; W155-R308 HydrophobicContact CD2-CG 4.25Å; W155-R308 HydrophobicContact CE3-CB 3.77Å; W155-R308 HydrophobicContact CG-CB 4.47Å; W155-R308 HydrophobicContact CH2-CB 3.94Å; W155-R308 HydrophobicContact CZ2-CB 3.97Å; W155-R308 HydrophobicContact CZ2-CG 4.4Å; W155-R308 HydrophobicContact CZ3-CB 3.83Å
309	M	92.8	Very high	80.4	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	161	174.9	63.7	-175	73.8	0	0	112.3	I57 S58 I59 I113 V139 I141 K154 F156 L307 I311	I57-M309 HydrophobicContact CD1-SD 4.18Å; S58-M309 CarbonylContact O-C 3.57Å; S58-M309 WeakPolarHBondContact O-CA 3.37Å; S58-M309 VanDerWaalsContact O-CB 3.27Å; S58-M309 WeakPolarHBondContact O-CB 3.39Å; I59-M309 HydrophobicContact CD1-CB 4.23Å; I59-M309 HydrophobicContact CD1-CE 4.31Å; I113-M309 HydrophobicContact CB-CE 4.45Å; I113-M309 HydrophobicContact CG1-CE 3.92Å; I113-M309 HydrophobicContact CG1-SD 4.28Å; V139-M309 HydrophobicContact CG1-CE 3.96Å; I141-M309 HydrophobicContact CD1-SD 4.09Å; K154-M309 PolarHBondContact N-O 3.5Å; K154-M309 PolarHBondContact O-N 3.39Å; K154-M309 VanDerWaalsContact O-N 3.07Å; F156-M309 HydrophobicContact CD2-CE 4.26Å; F156-M309 HydrophobicContact CD2-CG 3.78Å; F156-M309 HydrophobicContact CD2-SD 4.17Å; F156-M309 HydrophobicContact CE2-CG 3.59Å; F156-M309 HydrophobicContact CE2-SD 4.13Å; L307-M309 HydrophobicContact CB-CE 4.34Å; L307-M309 HydrophobicContact CD2-CE 3.18Å; L307-M309 HydrophobicContact CG-CE 3.53Å; M309-I311 HydrophobicContact CG-CD1 4.15Å; M309-I311 HydrophobicContact CG-CG1 4.02Å; M309-I311 HydrophobicContact SD-CD1 3.8Å; M309-I311 HydrophobicContact SD-CG1 4.01Å
310	M	90.5	Very high	83.4	Confident	12 Å²	12	36.5 Å²	36.5	6%	0.059	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	141.6	162.8	-61.8	-158.5	-52.6	0	0	109.2	I57 S58 E151 Q153	I57-M310 CarbonylContact C-O 3.47Å; I57-M310 WeakPolarHBondContact CA-O 3.31Å; S58-M310 PolarHBondContact N-O 3.05Å; S58-M310 PolarHBondContact O-N 3.07Å; E151-M310 HydrophobicContact CG-CB 4.45Å; E151-M310 HydrophobicContact CG-CE 4.36Å; E151-M310 HydrophobicContact CG-SD 4.23Å; E151-M310 WeakPolarHBondContact OE1-CE 3.26Å; Q153-M310 HydrophobicContact CB-CG 4.21Å; Q153-M310 HydrophobicContact CG-CG 3.19Å; Q153-M310 HydrophobicContact CG-SD 3.26Å; Q153-M310 WeakPolarHBondContact CG-SD 3.23Å; Q153-M310 PolarHBondContact NE2-SD 3.08Å
311	I	88.5	Confident	86.2	Confident	13 Å²	13	34.1 Å²	34.1	7%	0.067	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	133.4	177.6	-42.9	162.7	0	0	0	107.7	L55 R56 I57 M111 I141 F156 M309	L55-I311 HydrophobicContact CD1-CG2 3.55Å; R56-I311 CarbonylContact O-C 3.59Å; R56-I311 WeakPolarHBondContact O-CA 3.3Å; I57-I311 HydrophobicContact CD1-CG1 4.45Å; M111-I311 HydrophobicContact CE-CD1 3.6Å; M111-I311 HydrophobicContact CE-CG1 4.05Å; M111-I311 HydrophobicContact CE-CG2 3.85Å; I141-I311 HydrophobicContact CD1-CD1 3.4Å; F156-I311 HydrophobicContact CE2-CD1 4.33Å; F156-I311 HydrophobicContact CZ-CD1 4.14Å; M309-I311 HydrophobicContact CG-CD1 4.15Å; M309-I311 HydrophobicContact CG-CG1 4.02Å; M309-I311 HydrophobicContact SD-CD1 3.8Å; M309-I311 HydrophobicContact SD-CG1 4.01Å
312	H	86.5	Confident	88.4	Confident	15 Å²	15	28.8 Å²	28.8	7%	0.069	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	102.1	172	177.7	-99.1	0	0	0	107.5	R56 E151	R56-H312 HydrophobicContact CB-CB 4.3Å; R56-H312 PolarHBondContact N-O 3Å; R56-H312 PolarHBondContact NE-ND1 2.97Å; R56-H312 PolarHBondContact NH2-CE1 3.08Å; R56-H312 PolarHBondContact NH2-ND1 3.13Å; R56-H312 PolarHBondContact O-N 3.13Å; E151-H312 HydrophobicContact CB-CB 4.39Å; E151-H312 HydrophobicContact CG-CB 4.49Å
313	Y	87.3	Confident	90.4	Very high	4 Å²	4	22.9 Å²	22.9	2%	0.016	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	127.2	174.9	170.5	-95.6	0	0	0	107.9	V53 S54 L55 I108 L143 Q148 T315	V53-Y313 HydrophobicContact CG1-CD2 4.38Å; V53-Y313 HydrophobicContact CG1-CE2 3.43Å; V53-Y313 VanDerWaalsContact CG1-CE2 3.43Å; S54-Y313 WeakPolarHBondContact O-CA 3.47Å; L55-Y313 HydrophobicContact CD1-CD2 4.34Å; I108-Y313 HydrophobicContact CD1-CD2 4.27Å; I108-Y313 HydrophobicContact CD1-CE2 3.94Å; I108-Y313 HydrophobicContact CG1-CE2 3.78Å; L143-Y313 HydrophobicContact CB-CD2 4.46Å; L143-Y313 HydrophobicContact CB-CE2 4.42Å; L143-Y313 HydrophobicContact CD1-CD2 4.11Å; L143-Y313 HydrophobicContact CD1-CE2 4.39Å; L143-Y313 HydrophobicContact CD2-CG 4.38Å; Q148-Y313 CarbonylContact C-O 3.54Å; Q148-Y313 PolarHBondContact O-N 3.48Å; Y313-T315 WeakPolarHBondContact CE1-OG1 3.41Å; Y313-T315 PolarHBondContact OH-OG1 2.88Å
314	Q	85.5	Confident	91.5	Very high	31 Å²	31	21.1 Å²	21.1	15%	0.145	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	139.8	-177.9	-174.8	177.3	13.6	0	0	109.9	S54 V316	S54-Q314 PolarHBondContact N-O 2.92Å; S54-Q314 PolarHBondContact O-N 3.1Å; Q314-V316 HydrophobicContact CG-CG2 3.9Å
315	T	86.9	Confident	91.9	Very high	18 Å²	18	23.6 Å²	23.6	11%	0.11	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128	174.9	-58.2	0	0	0	0	107.9	K51 D52 V53 D145 Y313	K51-T315 HydrophobicContact CD-CG2 3.21Å; K51-T315 HydrophobicContact CG-CG2 3.34Å; D52-T315 CarbonylContact O-C 3.14Å; D52-T315 WeakPolarHBondContact O-CA 3.29Å; V53-T315 HydrophobicContact CG2-CG2 4.43Å; D145-T315 PolarHBondContact OD1-OG1 3.31Å; Y313-T315 WeakPolarHBondContact CE1-OG1 3.41Å; Y313-T315 PolarHBondContact OH-OG1 2.88Å
316	V	89.4	Confident	92	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	116.2	-177.1	-175.6	0	0	0	0	108.4	K51 D52 Q314 I318 Y615 A618	K51-V316 WeakPolarHBondContact CA-O 3.34Å; D52-V316 PolarHBondContact N-O 3.42Å; D52-V316 PolarHBondContact O-N 2.7Å; Q314-V316 HydrophobicContact CG-CG2 3.9Å; V316-I318 HydrophobicContact CG1-CG1 4.16Å; V316-Y615 HydrophobicContact CB-CD2 4.33Å; V316-Y615 HydrophobicContact CB-CE2 4.11Å; V316-Y615 HydrophobicContact CG1-CD2 4.28Å; V316-Y615 HydrophobicContact CG1-CE2 4.37Å; V316-Y615 HydrophobicContact CG2-CE2 3.9Å; V316-A618 HydrophobicContact CG1-CB 3.55Å
317	D	90.5	Very high	92.1	Very high	65 Å²	65	26.3 Å²	26.3	35%	0.348	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	121.8	171.5	-66.6	-48.4	0	0	0	109.5	K51 L651	K51-D317 WeakPolarHBondContact CE-OD1 3.39Å; K51-D317 IonicContact NZ-OD1 3.6Å; D317-L651 HydrophobicContact CB-CD2 3.78Å
318	I	92.5	Very high	92.1	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.01	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123.4	-174.6	-58.9	159.9	0	0	0	107.8	Q49 H50 D52 V316 Y615 A618	Q49-I318 CarbonylContact C-O 3.45Å; Q49-I318 VanDerWaalsContact CA-O 3.26Å; Q49-I318 WeakPolarHBondContact CA-O 3.35Å; Q49-I318 WeakPolarHBondContact CG-O 3.45Å; H50-I318 PolarHBondContact N-O 3.46Å; H50-I318 WeakPolarHBondContact NE2-CD1 3.3Å; H50-I318 WeakPolarHBondContact O-CA 3.28Å; H50-I318 WeakPolarHBondContact O-CB 3.46Å; H50-I318 PolarHBondContact O-N 2.98Å; D52-I318 HydrophobicContact CB-CD1 3.7Å; V316-I318 HydrophobicContact CG1-CG1 4.16Å; I318-Y615 HydrophobicContact CD1-CD2 4.02Å; I318-Y615 HydrophobicContact CD1-CG 4.48Å; I318-A618 HydrophobicContact CB-CB 4.43Å; I318-A618 HydrophobicContact CG1-CB 3.88Å
319	L	94.1	Very high	92.2	Very high	1 Å²	1	30 Å²	30	1%	0.005	16%	0.16	C	C	.	.			trans	-81.8	161.2	173	-66.1	173.9	0	0	0	110.7	Q49 I321 C323 Y324 I647 L650 L651	Q49-L319 HydrophobicContact CG-CD2 4.32Å; L319-I321 PolarHBondContact O-N 3.41Å; L319-C323 HydrophobicContact CB-CB 3.87Å; L319-C323 HydrophobicContact CD1-CB 4Å; L319-Y324 HydrophobicContact CB-CE2 3.84Å; L319-Y324 PolarHBondContact N-OH 2.79Å; L319-Y324 WeakPolarHBondContact O-CE2 3.46Å; L319-I647 HydrophobicContact CD1-CG2 3.93Å; L319-L650 HydrophobicContact CD1-CB 3.7Å; L319-L650 HydrophobicContact CD1-CD1 4.27Å; L319-L650 HydrophobicContact CD2-CB 4.38Å; L319-L651 HydrophobicContact CD1-CD2 4.25Å; L319-L651 HydrophobicContact CD1-CG 4.13Å; L319-L651 HydrophobicContact CD2-CD2 3.8Å; L319-L651 HydrophobicContact CD2-CG 4.3Å; L319-L651 HydrophobicContact CG-CD2 3.73Å; L319-L651 HydrophobicContact CG-CG 4.17Å
320	P	94.2	Very high	92.3	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.019	16%	0.16	C	C	.	.			trans	-48.7	138.9	165.5	-27.8	36.2	0	0	0	111.3	N47 A322 C323 W659	N47-P320 WeakPolarHBondContact O-CB 3.41Å; P320-A322 PolarHBondContact O-N 3.32Å; P320-C323 VanDerWaalsContact O-CB 3.25Å; P320-C323 WeakPolarHBondContact O-CB 3.32Å; P320-C323 PolarHBondContact O-N 3.41Å; P320-W659 HydrophobicContact CB-CE3 4.43Å; P320-W659 HydrophobicContact CB-CH2 4.32Å; P320-W659 HydrophobicContact CB-CZ3 3.73Å; P320-W659 HydrophobicContact CG-CE3 3.99Å; P320-W659 HydrophobicContact CG-CH2 4.4Å; P320-W659 HydrophobicContact CG-CZ3 3.73Å
321	I	92.5	Very high	92.6	Very high	38 Å²	38	29.7 Å²	29.7	20%	0.195	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-54.7	-34.4	-172.2	-171.6	59.4	0	0	0	113.5	E46 L319 C323 Y324 L613 F617	E46-I321 PolarHBondContact O-N 2.96Å; L319-I321 PolarHBondContact O-N 3.41Å; I321-C323 PolarHBondContact O-N 3.09Å; I321-Y324 HydrophobicContact CD1-CD2 4.39Å; I321-Y324 PolarHBondContact O-N 3.48Å; I321-L613 HydrophobicContact CD1-CB 4.18Å; I321-L613 HydrophobicContact CD1-CD2 3.92Å; I321-L613 HydrophobicContact CD1-CG 3.82Å; I321-L613 HydrophobicContact CG1-CD2 4.42Å; I321-F617 HydrophobicContact CD1-CD2 3.79Å; I321-F617 HydrophobicContact CD1-CE2 4.05Å
322	A	93.1	Very high	92.8	Very high	55 Å²	55	32.7 Å²	32.7	46%	0.455	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-60.3	-26.2	178	0	0	0	0	0	113.6	P320 Y324 N325	P320-A322 PolarHBondContact O-N 3.32Å; A322-Y324 PolarHBondContact O-N 3.13Å; A322-N325 VanDerWaalsContact O-CG 3.3Å; A322-N325 PolarHBondContact O-N 2.77Å; A322-N325 PolarHBondContact O-ND2 2.86Å
323	C	95	Very high	93.2	Very high	27 Å²	27	36.4 Å²	36.4	18%	0.182	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-68.5	-18.8	176.9	-63.8	0	0	0	0	112.9	L319 P320 I321 L650	L319-C323 HydrophobicContact CB-CB 3.87Å; L319-C323 HydrophobicContact CD1-CB 4Å; P320-C323 VanDerWaalsContact O-CB 3.25Å; P320-C323 WeakPolarHBondContact O-CB 3.32Å; P320-C323 PolarHBondContact O-N 3.41Å; I321-C323 PolarHBondContact O-N 3.09Å; C323-L650 HydrophobicContact CB-CD1 4.05Å
324	Y	96.5	Very high	93.6	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.008	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-94.1	2.7	179.6	-60.7	-71	0	0	0	113.9	L319 I321 A322 Q326 L327 K328 F617 A618 I647	L319-Y324 HydrophobicContact CB-CE2 3.84Å; L319-Y324 PolarHBondContact N-OH 2.79Å; L319-Y324 WeakPolarHBondContact O-CE2 3.46Å; I321-Y324 HydrophobicContact CD1-CD2 4.39Å; I321-Y324 PolarHBondContact O-N 3.48Å; A322-Y324 PolarHBondContact O-N 3.13Å; Y324-Q326 VanDerWaalsContact C-N 3.32Å; Y324-Q326 PolarHBondContact O-N 2.84Å; Y324-L327 HydrophobicContact CD1-CD2 4.48Å; Y324-L327 CarbonylContact O-C 3.52Å; Y324-L327 WeakPolarHBondContact O-CA 3.44Å; Y324-L327 WeakPolarHBondContact O-CB 3.49Å; Y324-L327 PolarHBondContact O-N 2.64Å; Y324-K328 PolarHBondContact O-N 2.84Å; Y324-F617 HydrophobicContact CD1-CB 3.71Å; Y324-F617 HydrophobicContact CD1-CG 4.35Å; Y324-F617 HydrophobicContact CD2-CB 3.85Å; Y324-F617 HydrophobicContact CD2-CG 4.39Å; Y324-F617 HydrophobicContact CE1-CB 4.04Å; Y324-F617 HydrophobicContact CE2-CB 4.17Å; Y324-F617 HydrophobicContact CG-CB 3.61Å; Y324-F617 HydrophobicContact CG-CD2 4.37Å; Y324-F617 AromaticContact CG-CG 3.97Å; Y324-F617 HydrophobicContact CG-CG 3.97Å; Y324-A618 WeakPolarHBondContact OH-CB 3.39Å; Y324-I647 HydrophobicContact CD1-CD1 4Å; Y324-I647 HydrophobicContact CE1-CD1 4.35Å; Y324-I647 HydrophobicContact CE1-CG2 4.04Å
325	N	95.4	Very high	94	Very high	92 Å²	92	37.7 Å²	37.7	49%	0.492	20%	0.199	S	C	.	.	H	α-helix	trans	-55.8	-40.6	-173.7	-78.3	-17.9	0	0	0	114.1	A322 K328 E329	A322-N325 VanDerWaalsContact O-CG 3.3Å; A322-N325 PolarHBondContact O-N 2.77Å; A322-N325 PolarHBondContact O-ND2 2.86Å; N325-K328 WeakPolarHBondContact O-CB 3.29Å; N325-K328 PolarHBondContact O-N 2.95Å; N325-E329 PolarHBondContact O-N 2.76Å; N325-E329 VanDerWaalsContact O-N 3.08Å
326	Q	96	Very high	94.4	Very high	115 Å²	115	38.7 Å²	38.7	54%	0.537	20%	0.203	S	C	.	.	H	α-helix	trans	-67	-38.6	177.7	-62.5	-178	-20.4	0	0	111.9	Y324 E329 F330 L643	Y324-Q326 VanDerWaalsContact C-N 3.32Å; Y324-Q326 PolarHBondContact O-N 2.84Å; Q326-E329 PolarHBondContact O-N 2.84Å; Q326-F330 WeakPolarHBondContact O-CB 3.19Å; Q326-F330 PolarHBondContact O-N 2.68Å; Q326-L643 HydrophobicContact CB-CD2 3.49Å; Q326-L643 VanDerWaalsContact CB-CD2 3.49Å; Q326-L643 HydrophobicContact CG-CD2 4.38Å
327	L	96.2	Very high	94.7	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-68.5	-37	175	-179.9	61.5	0	0	0	111.5	Y324 F330 I331 F617 T621 L624 I647	Y324-L327 HydrophobicContact CD1-CD2 4.48Å; Y324-L327 CarbonylContact O-C 3.52Å; Y324-L327 WeakPolarHBondContact O-CA 3.44Å; Y324-L327 WeakPolarHBondContact O-CB 3.49Å; Y324-L327 PolarHBondContact O-N 2.64Å; L327-F330 HydrophobicContact CD1-CD1 4.49Å; L327-F330 PolarHBondContact O-N 2.91Å; L327-I331 HydrophobicContact CD1-CD1 4.31Å; L327-I331 HydrophobicContact CD1-CG1 4.32Å; L327-I331 HydrophobicContact CG-CD1 4.09Å; L327-I331 WeakPolarHBondContact O-CG1 3.34Å; L327-I331 PolarHBondContact O-N 3.11Å; L327-F617 HydrophobicContact CD2-CD1 3.95Å; L327-F617 HydrophobicContact CG-CD1 4.22Å; L327-F617 HydrophobicContact CG-CE1 4.41Å; L327-T621 WeakPolarHBondContact CD2-OG1 3.5Å; L327-L624 HydrophobicContact CD1-CD1 4.47Å; L327-I647 HydrophobicContact CB-CD1 4.14Å; L327-I647 HydrophobicContact CD2-CD1 3.88Å
328	K	96.1	Very high	94.8	Very high	41 Å²	41	37.4 Å²	37.4	18%	0.178	20%	0.196	C	C	.	.	H	α-helix	trans	-56.6	-52.2	172.9	178.5	-174.6	168.8	-178.4	0	110.9	Y324 N325 F330 I331 K332 L365 D367 F617	Y324-K328 PolarHBondContact O-N 2.84Å; N325-K328 WeakPolarHBondContact O-CB 3.29Å; N325-K328 PolarHBondContact O-N 2.95Å; K328-F330 VanDerWaalsContact C-N 3.31Å; K328-F330 PolarHBondContact O-N 3.39Å; K328-I331 PolarHBondContact O-N 3.25Å; K328-K332 WeakPolarHBondContact O-CB 3.36Å; K328-K332 PolarHBondContact O-N 3.33Å; K328-L365 HydrophobicContact CD-CD1 4.02Å; K328-L365 HydrophobicContact CD-CD2 4Å; K328-L365 HydrophobicContact CG-CD1 3.91Å; K328-D367 WeakPolarHBondContact CE-OD1 3.19Å; K328-D367 IonicContact NZ-OD1 2.77Å; K328-D367 PolarHBondContact NZ-OD1 2.85Å; K328-D367 IonicContact NZ-OD2 3.85Å; K328-F617 HydrophobicContact CB-CE1 4.13Å; K328-F617 HydrophobicContact CB-CZ 3.72Å; K328-F617 HydrophobicContact CG-CZ 4.09Å
329	E	96.2	Very high	94.9	Very high	95 Å²	95	37.4 Å²	37.4	44%	0.444	20%	0.196	S	C	.	.	H	α-helix	trans	-64.2	-36.5	179.3	-71	-55.1	126.8	0	0	112.3	N325 Q326 K332 T333	N325-E329 PolarHBondContact O-N 2.76Å; N325-E329 VanDerWaalsContact O-N 3.08Å; Q326-E329 PolarHBondContact O-N 2.84Å; E329-K332 PolarHBondContact O-N 3.31Å; E329-T333 WeakPolarHBondContact O-CG2 3.45Å; E329-T333 PolarHBondContact O-N 2.89Å; E329-T333 PolarHBondContact O-OG1 3.15Å
330	F	96.2	Very high	94.8	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.018	22%	0.216	C	C	.	.	H	α-helix	trans	-61.5	-48.4	173.3	179.4	-86.6	0	0	0	112	Q326 L327 K328 K332 T333 K334 L338 I637 E639 L640 L643	Q326-F330 WeakPolarHBondContact O-CB 3.19Å; Q326-F330 PolarHBondContact O-N 2.68Å; L327-F330 HydrophobicContact CD1-CD1 4.49Å; L327-F330 PolarHBondContact O-N 2.91Å; K328-F330 VanDerWaalsContact C-N 3.31Å; K328-F330 PolarHBondContact O-N 3.39Å; F330-K332 PolarHBondContact O-N 2.99Å; F330-T333 PolarHBondContact O-N 3.1Å; F330-T333 PolarHBondContact O-OG1 2.81Å; F330-K334 HydrophobicContact CD2-CD 3.74Å; F330-K334 HydrophobicContact CE1-CB 4.33Å; F330-K334 HydrophobicContact CE2-CB 4.25Å; F330-K334 HydrophobicContact CE2-CD 3.52Å; F330-K334 HydrophobicContact CZ-CB 4.12Å; F330-K334 HydrophobicContact CZ-CD 4.2Å; F330-K334 WeakPolarHBondContact O-CB 3.34Å; F330-K334 PolarHBondContact O-N 3.45Å; F330-L338 HydrophobicContact CE1-CB 4.48Å; F330-L338 HydrophobicContact CE1-CD2 3.95Å; F330-I637 HydrophobicContact CZ-CB 4.12Å; F330-I637 HydrophobicContact CZ-CG2 4.06Å; F330-E639 HydrophobicContact CD2-CB 4.44Å; F330-E639 HydrophobicContact CE2-CB 4.45Å; F330-L640 HydrophobicContact CD1-CD1 4.48Å; F330-L640 HydrophobicContact CE1-CB 4.45Å; F330-L640 HydrophobicContact CE1-CD1 4.04Å; F330-L640 HydrophobicContact CE2-CB 4.16Å; F330-L640 HydrophobicContact CZ-CB 3.85Å; F330-L640 HydrophobicContact CZ-CD1 4.29Å; F330-L643 HydrophobicContact CB-CD1 3.55Å; F330-L643 HydrophobicContact CD2-CD1 3.76Å; F330-L643 HydrophobicContact CG-CD1 3.74Å
331	I	95.8	Very high	94.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.1	-47.5	178.7	-72.4	169.3	0	0	0	110.5	L327 K328 T333 K334 Y335 F358 I361 F362 F617 L620	L327-I331 HydrophobicContact CD1-CD1 4.31Å; L327-I331 HydrophobicContact CD1-CG1 4.32Å; L327-I331 HydrophobicContact CG-CD1 4.09Å; L327-I331 WeakPolarHBondContact O-CG1 3.34Å; L327-I331 PolarHBondContact O-N 3.11Å; K328-I331 PolarHBondContact O-N 3.25Å; I331-T333 PolarHBondContact O-N 3.4Å; I331-K334 PolarHBondContact O-N 2.91Å; I331-Y335 VanDerWaalsContact O-CB 3.22Å; I331-Y335 WeakPolarHBondContact O-CB 3.48Å; I331-Y335 PolarHBondContact O-N 2.86Å; I331-F358 HydrophobicContact CG1-CE1 4.35Å; I331-F358 HydrophobicContact CG2-CD1 4.09Å; I331-F358 HydrophobicContact CG2-CE1 3.84Å; I331-I361 HydrophobicContact CD1-CD1 4.18Å; I331-F362 HydrophobicContact CG2-CE2 3.72Å; I331-F362 HydrophobicContact CG2-CZ 4.4Å; I331-F617 HydrophobicContact CD1-CD1 4.27Å; I331-F617 HydrophobicContact CD1-CE1 3.79Å; I331-L620 HydrophobicContact CD1-CD2 3.24Å; I331-L620 HydrophobicContact CG1-CD2 4.22Å
332	K	94.5	Very high	94.6	Very high	76 Å²	76	42.4 Å²	42.4	33%	0.33	22%	0.215	S	C	.	.	H	α-helix	trans	-53.2	-40.2	179.1	175.7	169.6	-177.1	178.9	0	112.7	K328 E329 F330 D367 L368	K328-K332 WeakPolarHBondContact O-CB 3.36Å; K328-K332 PolarHBondContact O-N 3.33Å; E329-K332 PolarHBondContact O-N 3.31Å; F330-K332 PolarHBondContact O-N 2.99Å; K332-D367 WeakPolarHBondContact CE-OD2 3.35Å; K332-D367 IonicContact NZ-OD2 3.38Å; K332-D367 PolarHBondContact NZ-OD2 3.17Å; K332-L368 HydrophobicContact CB-CD2 3.95Å; K332-L368 HydrophobicContact CD-CD2 4.04Å; K332-L368 HydrophobicContact CG-CD2 3.65Å
333	T	94	Very high	94.5	Very high	93 Å²	93	41.3 Å²	41.3	57%	0.571	20%	0.2	S	C	*	.	H	α-helix	trans	-94.3	-29.6	-173.4	53.9	0	0	0	0	114	E329 F330 I331	E329-T333 WeakPolarHBondContact O-CG2 3.45Å; E329-T333 PolarHBondContact O-N 2.89Å; E329-T333 PolarHBondContact O-OG1 3.15Å; F330-T333 PolarHBondContact O-N 3.1Å; F330-T333 PolarHBondContact O-OG1 2.81Å; I331-T333 PolarHBondContact O-N 3.4Å
334	K	94.9	Very high	94.2	Very high	36 Å²	36	45.1 Å²	45.1	16%	0.157	23%	0.225	C	C	.	.	H	α-helix	trans	-130	13	-165.8	-65	167	172.9	-175.6	0	114.3	F330 I331 L336 D337 L338 Q636 E639	F330-K334 HydrophobicContact CD2-CD 3.74Å; F330-K334 HydrophobicContact CE1-CB 4.33Å; F330-K334 HydrophobicContact CE2-CB 4.25Å; F330-K334 HydrophobicContact CE2-CD 3.52Å; F330-K334 HydrophobicContact CZ-CB 4.12Å; F330-K334 HydrophobicContact CZ-CD 4.2Å; F330-K334 WeakPolarHBondContact O-CB 3.34Å; F330-K334 PolarHBondContact O-N 3.45Å; I331-K334 PolarHBondContact O-N 2.91Å; K334-L336 PolarHBondContact O-N 2.85Å; K334-D337 PolarHBondContact O-N 2.94Å; K334-L338 WeakPolarHBondContact O-CB 3.44Å; K334-L338 PolarHBondContact O-N 2.89Å; K334-Q636 WeakPolarHBondContact CD-O 3.25Å; K334-Q636 WeakPolarHBondContact CE-O 3.37Å; K334-Q636 PolarHBondContact NZ-O 3.15Å; K334-E639 IonicContact NZ-OE1 3.52Å; K334-E639 PolarHBondContact NZ-OE1 2.72Å; K334-E639 IonicContact NZ-OE2 3.01Å; K334-E639 PolarHBondContact NZ-OE2 3.41Å
335	Y	95.5	Very high	93.7	Very high	27 Å²	27	49.5 Å²	49.5	11%	0.106	24%	0.244	C	C	.	.	H	α-helix	trans	-54.4	-39.5	-179.3	72.4	-87.6	0	0	0	113.1	I331 L338 I339 F362 F373	I331-Y335 VanDerWaalsContact O-CB 3.22Å; I331-Y335 WeakPolarHBondContact O-CB 3.48Å; I331-Y335 PolarHBondContact O-N 2.86Å; Y335-L338 PolarHBondContact O-N 3.37Å; Y335-I339 HydrophobicContact CD2-CD1 4.28Å; Y335-I339 WeakPolarHBondContact O-CG1 3.45Å; Y335-I339 PolarHBondContact O-N 3.45Å; Y335-F362 HydrophobicContact CD1-CE1 4.36Å; Y335-F362 AromaticContact CD1-CZ 3.64Å; Y335-F362 HydrophobicContact CD1-CZ 3.64Å; Y335-F362 HydrophobicContact CD2-CZ 4.4Å; Y335-F362 HydrophobicContact CE1-CE1 4.32Å; Y335-F362 HydrophobicContact CE1-CZ 4.04Å; Y335-F362 HydrophobicContact CG-CE2 4.43Å; Y335-F362 AromaticContact CG-CZ 3.82Å; Y335-F362 HydrophobicContact CG-CZ 3.82Å; Y335-F373 AromaticContact CD2-CD2 3.61Å; Y335-F373 HydrophobicContact CD2-CD2 3.61Å; Y335-F373 AromaticContact CD2-CE2 3.61Å; Y335-F373 HydrophobicContact CD2-CE2 3.61Å; Y335-F373 AromaticContact CE2-CD2 3.43Å; Y335-F373 HydrophobicContact CE2-CD2 3.43Å; Y335-F373 VanDerWaalsContact CE2-CD2 3.43Å; Y335-F373 AromaticContact CE2-CE2 3.8Å; Y335-F373 HydrophobicContact CE2-CE2 3.8Å; Y335-F373 HydrophobicContact CG-CD2 4.41Å
336	L	95	Very high	93.5	Very high	38 Å²	38	45.8 Å²	45.8	20%	0.199	22%	0.224	C	C	.	.	H	α-helix	trans	-68.8	-47.4	-173.9	-167.1	65.4	0	0	0	111.1	K334 L338 I339 R340 V376 L377 E380	K334-L336 PolarHBondContact O-N 2.85Å; L336-L338 VanDerWaalsContact C-N 3.28Å; L336-L338 PolarHBondContact O-N 3.39Å; L336-I339 PolarHBondContact O-N 3.15Å; L336-R340 WeakPolarHBondContact O-CB 3.5Å; L336-R340 PolarHBondContact O-N 3.45Å; L336-V376 HydrophobicContact CD1-CG1 4.13Å; L336-V376 HydrophobicContact CD2-CG1 3.87Å; L336-L377 HydrophobicContact CD1-CD1 4.13Å; L336-E380 WeakPolarHBondContact CD1-OE2 3.4Å; L336-E380 WeakPolarHBondContact CD2-OE2 3.49Å; L336-E380 WeakPolarHBondContact CG-OE2 3.42Å
337	D	94.1	Very high	93.2	Very high	39 Å²	39	43.1 Å²	43.1	21%	0.209	22%	0.218	C	C	.	.	H	α-helix	trans	-63.8	-36.4	175.4	-65	-51	0	0	0	111.5	K334 R340 N341 Q636 I637	K334-D337 PolarHBondContact O-N 2.94Å; D337-R340 IonicContact OD1-CZ 3.04Å; D337-R340 IonicContact OD1-NH1 3.65Å; D337-R340 PolarHBondContact OD1-NH1 3.39Å; D337-N341 PolarHBondContact O-N 2.92Å; D337-N341 VanDerWaalsContact O-N 3.15Å; D337-N341 PolarHBondContact O-ND2 3.45Å; D337-Q636 HydrophobicContact CB-CB 4.12Å; D337-I637 HydrophobicContact CB-CG2 4.18Å
338	L	94	Very high	92.8	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.7	-50.2	175.1	178.1	58.4	0	0	0	111.6	F330 K334 Y335 L336 N341 L342 F358 L624 I637 L640	F330-L338 HydrophobicContact CE1-CB 4.48Å; F330-L338 HydrophobicContact CE1-CD2 3.95Å; K334-L338 WeakPolarHBondContact O-CB 3.44Å; K334-L338 PolarHBondContact O-N 2.89Å; Y335-L338 PolarHBondContact O-N 3.37Å; L336-L338 VanDerWaalsContact C-N 3.28Å; L336-L338 PolarHBondContact O-N 3.39Å; L338-N341 PolarHBondContact O-N 3.44Å; L338-L342 HydrophobicContact CD1-CD1 3.55Å; L338-L342 HydrophobicContact CD1-CG 4.07Å; L338-L342 HydrophobicContact CG-CD1 3.75Å; L338-L342 WeakPolarHBondContact O-CB 3.37Å; L338-L342 WeakPolarHBondContact O-CG 3.42Å; L338-L342 PolarHBondContact O-N 2.92Å; L338-F358 HydrophobicContact CD2-CZ 3.85Å; L338-L624 HydrophobicContact CD1-CD2 4.14Å; L338-L624 HydrophobicContact CD2-CD1 4.21Å; L338-L624 HydrophobicContact CD2-CD2 3.99Å; L338-L624 HydrophobicContact CG-CD2 4.43Å; L338-I637 HydrophobicContact CB-CG2 4.47Å; L338-L640 HydrophobicContact CD1-CD2 3.69Å
339	I	94.4	Very high	92.3	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-62.4	-45	178.9	-68.7	170.9	0	0	0	110.3	Y335 L336 N341 L342 E343 F358 F373 L377 A397	Y335-I339 HydrophobicContact CD2-CD1 4.28Å; Y335-I339 WeakPolarHBondContact O-CG1 3.45Å; Y335-I339 PolarHBondContact O-N 3.45Å; L336-I339 PolarHBondContact O-N 3.15Å; I339-N341 VanDerWaalsContact C-N 3.27Å; I339-N341 PolarHBondContact O-N 3.16Å; I339-L342 PolarHBondContact O-N 3.48Å; I339-L342 VanDerWaalsContact O-N 3.15Å; I339-E343 HydrophobicContact CG2-CB 4.48Å; I339-E343 WeakPolarHBondContact O-CB 3.43Å; I339-E343 PolarHBondContact O-N 3.39Å; I339-F358 HydrophobicContact CD1-CD2 4.18Å; I339-F358 HydrophobicContact CD1-CE2 4.18Å; I339-F358 HydrophobicContact CD1-CG 4.41Å; I339-F358 HydrophobicContact CD1-CZ 4.41Å; I339-F358 HydrophobicContact CG1-CD2 4.4Å; I339-F358 HydrophobicContact CG1-CE2 3.96Å; I339-F358 HydrophobicContact CG1-CZ 4.17Å; I339-F373 HydrophobicContact CD1-CE2 3.91Å; I339-F373 HydrophobicContact CD1-CZ 4.21Å; I339-L377 HydrophobicContact CD1-CD1 4.3Å; I339-L377 HydrophobicContact CD1-CD2 4.34Å; I339-L377 HydrophobicContact CG2-CD1 4.04Å; I339-A397 HydrophobicContact CG2-CB 3.54Å
340	R	92.1	Very high	92	Very high	111 Å²	111	43.5 Å²	43.5	42%	0.419	23%	0.225	S	C	.	.	H	α-helix	trans	-55.4	-40.2	178	-173.1	-175.6	-64.2	136	6.6	112.8	L336 D337 P344 E380	L336-R340 WeakPolarHBondContact O-CB 3.5Å; L336-R340 PolarHBondContact O-N 3.45Å; D337-R340 IonicContact OD1-CZ 3.04Å; D337-R340 IonicContact OD1-NH1 3.65Å; D337-R340 PolarHBondContact OD1-NH1 3.39Å; R340-P344 VanDerWaalsContact O-CD 3.28Å; R340-P344 WeakPolarHBondContact O-CD 3.45Å; R340-E380 IonicContact CZ-OE1 3.44Å; R340-E380 IonicContact CZ-OE2 2.63Å; R340-E380 IonicContact NE-OE1 3.2Å; R340-E380 PolarHBondContact NE-OE1 3.37Å; R340-E380 IonicContact NE-OE2 3.71Å; R340-E380 VanDerWaalsContact NH2-CD 3.31Å; R340-E380 IonicContact NH2-OE1 3.46Å; R340-E380 PolarHBondContact NH2-OE1 2.81Å; R340-E380 VanDerWaalsContact NH2-OE1 3.13Å; R340-E380 IonicContact NH2-OE2 3.3Å; R340-E380 PolarHBondContact NH2-OE2 2.78Å
341	N	90.3	Very high	91.8	Very high	34 Å²	34	44.7 Å²	44.7	18%	0.182	23%	0.23	C	C	.	.	H	α-helix	trans	-78	-32.3	179.4	-80.7	-74	0	0	0	113.6	D337 L338 I339 T634 I637	D337-N341 PolarHBondContact O-N 2.92Å; D337-N341 VanDerWaalsContact O-N 3.15Å; D337-N341 PolarHBondContact O-ND2 3.45Å; L338-N341 PolarHBondContact O-N 3.44Å; I339-N341 VanDerWaalsContact C-N 3.27Å; I339-N341 PolarHBondContact O-N 3.16Å; N341-T634 VanDerWaalsContact OD1-CG2 3.31Å; N341-T634 WeakPolarHBondContact OD1-CG2 3.44Å; N341-I637 HydrophobicContact CB-CD1 4.02Å
342	L	91	Very high	91.6	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-80.3	-46.1	-179.2	-75.6	168.8	0	0	0	112	L338 I339 P344 K345 L346 L354 L624 Y627 I631	L338-L342 HydrophobicContact CD1-CD1 3.55Å; L338-L342 HydrophobicContact CD1-CG 4.07Å; L338-L342 HydrophobicContact CG-CD1 3.75Å; L338-L342 WeakPolarHBondContact O-CB 3.37Å; L338-L342 WeakPolarHBondContact O-CG 3.42Å; L338-L342 PolarHBondContact O-N 2.92Å; I339-L342 PolarHBondContact O-N 3.48Å; I339-L342 VanDerWaalsContact O-N 3.15Å; L342-P344 VanDerWaalsContact C-CD 3.46Å; L342-K345 PolarHBondContact O-N 3.35Å; L342-L346 HydrophobicContact CB-CD1 4.1Å; L342-L346 WeakPolarHBondContact O-CG 3.15Å; L342-L354 HydrophobicContact CB-CD2 4.37Å; L342-L354 HydrophobicContact CD1-CD1 4.31Å; L342-L354 HydrophobicContact CD1-CD2 3.99Å; L342-L624 HydrophobicContact CD1-CD2 3.59Å; L342-Y627 HydrophobicContact CD2-CG 4.3Å; L342-I631 HydrophobicContact CD2-CD1 4.43Å; L342-I631 HydrophobicContact CD2-CG2 3.54Å; L342-I631 HydrophobicContact CG-CG2 4.27Å
343	E	91.4	Very high	91.5	Very high	32 Å²	32	43.4 Å²	43.4	15%	0.15	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-50.8	-46.2	-165.7	-178.6	178.6	177.3	0	0	114.5	I339 K345 L346 K351 S396 A397	I339-E343 HydrophobicContact CG2-CB 4.48Å; I339-E343 WeakPolarHBondContact O-CB 3.43Å; I339-E343 PolarHBondContact O-N 3.39Å; E343-K345 PolarHBondContact O-N 2.65Å; E343-L346 PolarHBondContact O-N 2.73Å; E343-K351 HydrophobicContact CG-CD 4.06Å; E343-K351 VanDerWaalsContact CG-CE 3.46Å; E343-K351 WeakPolarHBondContact O-CE 3.32Å; E343-K351 IonicContact OE1-NZ 2.64Å; E343-K351 PolarHBondContact OE1-NZ 3.08Å; E343-S396 WeakPolarHBondContact OE1-CA 3.42Å; E343-A397 HydrophobicContact CG-CB 4.32Å; E343-A397 PolarHBondContact OE1-N 3.34Å; E343-A397 VanDerWaalsContact OE2-CB 3.29Å; E343-A397 WeakPolarHBondContact OE2-CB 3.44Å
344	P	88.4	Confident	91.5	Very high	108 Å²	108	39.2 Å²	39.2	70%	0.701	20%	0.199	S	C	*	.	G	3₁₀ helix	trans	-62.1	-18.3	-178.9	-23.6	35.2	0	0	0	114.1	R340 L342	R340-P344 VanDerWaalsContact O-CD 3.28Å; R340-P344 WeakPolarHBondContact O-CD 3.45Å; L342-P344 VanDerWaalsContact C-CD 3.46Å
345	K	87.3	Confident	91.5	Very high	93 Å²	93	37.5 Å²	37.5	40%	0.404	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-101.7	-4.5	-175.8	-62.2	179	176.7	179.9	0	113	L342 E343 K630 I631	L342-K345 PolarHBondContact O-N 3.35Å; E343-K345 PolarHBondContact O-N 2.65Å; K345-K630 VanDerWaalsContact CD-O 3.27Å; K345-K630 WeakPolarHBondContact CD-O 3.37Å; K345-K630 WeakPolarHBondContact CE-O 3.38Å; K345-K630 PolarHBondContact NZ-O 3.4Å; K345-I631 HydrophobicContact CD-CG2 4.22Å
346	L	89.6	Confident	91.5	Very high	14 Å²	14	37.2 Å²	37.2	7%	0.073	19%	0.194	C	C	.	.			trans	-100.7	137.3	-176.3	-61.9	-177.2	0	0	0	111.8	L342 E343 Q350 K351 L354 Y627	L342-L346 HydrophobicContact CB-CD1 4.1Å; L342-L346 WeakPolarHBondContact O-CG 3.15Å; E343-L346 PolarHBondContact O-N 2.73Å; L346-Q350 HydrophobicContact CB-CB 4.1Å; L346-Q350 HydrophobicContact CD2-CB 4.11Å; L346-K351 HydrophobicContact CB-CG 3.63Å; L346-K351 HydrophobicContact CD1-CG 4.38Å; L346-K351 WeakPolarHBondContact O-CE 3.24Å; L346-L354 HydrophobicContact CD1-CB 4.41Å; L346-L354 HydrophobicContact CD1-CD2 3.64Å; L346-Y627 HydrophobicContact CD2-CD1 3.47Å; L346-Y627 VanDerWaalsContact CD2-CD1 3.47Å; L346-Y627 HydrophobicContact CD2-CD2 3.78Å; L346-Y627 HydrophobicContact CD2-CE1 3.27Å; L346-Y627 HydrophobicContact CD2-CE2 3.65Å; L346-Y627 HydrophobicContact CD2-CG 3.75Å; L346-Y627 VanDerWaalsContact CD2-CZ 3.41Å
347	S	89.6	Confident	91.5	Very high	59 Å²	59	35.4 Å²	35.4	41%	0.413	18%	0.184	S	C	.	.			trans	-67.8	161.8	165.6	66.5	0	0	0	0	111.4	K349 Q350 K351	S347-K349 PolarHBondContact O-N 2.84Å; S347-Q350 PolarHBondContact O-N 3.24Å; S347-Q350 VanDerWaalsContact OG-CG 3.26Å; S347-Q350 WeakPolarHBondContact OG-CG 3.26Å; S347-Q350 PolarHBondContact OG-N 3.02Å; S347-Q350 PolarHBondContact OG-OE1 3.36Å; S347-K351 WeakPolarHBondContact O-CG 3.08Å; S347-K351 PolarHBondContact O-N 3.09Å
348	A	88	Confident	91.7	Very high	31 Å²	31	33.5 Å²	33.5	26%	0.256	17%	0.174	S	C	.	.	H	α-helix	trans	-54.1	-39.3	-179.6	0	0	0	0	0	113.4	K351 E352 N395	A348-K351 PolarHBondContact O-N 3.04Å; A348-E352 PolarHBondContact O-N 3.22Å; A348-E352 VanDerWaalsContact O-N 3.13Å; A348-N395 HydrophobicContact CB-CB 4.14Å
349	K	85.7	Confident	91.9	Very high	64 Å²	64	33.5 Å²	33.5	28%	0.278	17%	0.174	S	C	.	.	H	α-helix	trans	-67.1	-41.8	176.3	-176.7	178.6	173.7	-174	0	112.2	E151 S347 K351 E352 E353	E151-K349 IonicContact OE2-NZ 3.2Å; E151-K349 PolarHBondContact OE2-NZ 3.26Å; S347-K349 PolarHBondContact O-N 2.84Å; K349-K351 VanDerWaalsContact C-N 3.33Å; K349-K351 PolarHBondContact O-N 3.01Å; K349-E352 WeakPolarHBondContact O-CB 3.31Å; K349-E352 PolarHBondContact O-N 3.35Å; K349-E353 VanDerWaalsContact CE-OE1 3.23Å; K349-E353 WeakPolarHBondContact CE-OE1 3.36Å; K349-E353 PolarHBondContact O-N 3.18Å
350	Q	89.9	Confident	91.9	Very high	51 Å²	51	34.3 Å²	34.3	24%	0.238	18%	0.178	C	C	.	.	H	α-helix	trans	-69.1	-34.4	179.5	-66.2	164.3	-40.3	0	0	111.5	L346 S347 E352 E353 L354 Y627	L346-Q350 HydrophobicContact CB-CB 4.1Å; L346-Q350 HydrophobicContact CD2-CB 4.11Å; S347-Q350 PolarHBondContact O-N 3.24Å; S347-Q350 VanDerWaalsContact OG-CG 3.26Å; S347-Q350 WeakPolarHBondContact OG-CG 3.26Å; S347-Q350 PolarHBondContact OG-N 3.02Å; S347-Q350 PolarHBondContact OG-OE1 3.36Å; Q350-E352 VanDerWaalsContact C-N 3.34Å; Q350-E353 PolarHBondContact O-N 2.95Å; Q350-L354 WeakPolarHBondContact O-CB 3.27Å; Q350-L354 PolarHBondContact O-N 3.26Å; Q350-Y627 WeakPolarHBondContact CG-OH 3.14Å; Q350-Y627 PolarHBondContact NE2-OH 2.84Å
351	K	92.5	Very high	92.1	Very high	29 Å²	29	29.1 Å²	29.1	13%	0.126	16%	0.159	C	C	.	.	H	α-helix	trans	-61.9	-41.3	171	-66.9	-176.4	-176.4	-161.3	0	111.6	E343 L346 S347 A348 K349 L354 T355 N395	E343-K351 HydrophobicContact CG-CD 4.06Å; E343-K351 VanDerWaalsContact CG-CE 3.46Å; E343-K351 WeakPolarHBondContact O-CE 3.32Å; E343-K351 IonicContact OE1-NZ 2.64Å; E343-K351 PolarHBondContact OE1-NZ 3.08Å; L346-K351 HydrophobicContact CB-CG 3.63Å; L346-K351 HydrophobicContact CD1-CG 4.38Å; L346-K351 WeakPolarHBondContact O-CE 3.24Å; S347-K351 WeakPolarHBondContact O-CG 3.08Å; S347-K351 PolarHBondContact O-N 3.09Å; A348-K351 PolarHBondContact O-N 3.04Å; K349-K351 VanDerWaalsContact C-N 3.33Å; K349-K351 PolarHBondContact O-N 3.01Å; K351-L354 PolarHBondContact O-N 3.17Å; K351-T355 WeakPolarHBondContact O-CB 3.27Å; K351-T355 VanDerWaalsContact O-CG2 3.23Å; K351-T355 WeakPolarHBondContact O-CG2 3.39Å; K351-T355 PolarHBondContact O-N 3.31Å; K351-T355 PolarHBondContact O-OG1 3.01Å; K351-N395 WeakPolarHBondContact CD-O 2.94Å; K351-N395 WeakPolarHBondContact CE-O 3.49Å; K351-N395 PolarHBondContact NZ-O 3.23Å
352	E	91.7	Very high	92.5	Very high	11 Å²	11	27.9 Å²	27.9	5%	0.051	15%	0.152	C	C	.	.	H	α-helix	trans	-59.4	-50.2	173.7	-171.9	178.6	133.6	0	0	112.1	A348 K349 Q350 L354 T355 S356 K400 L1205 S1206	A348-E352 PolarHBondContact O-N 3.22Å; A348-E352 VanDerWaalsContact O-N 3.13Å; K349-E352 WeakPolarHBondContact O-CB 3.31Å; K349-E352 PolarHBondContact O-N 3.35Å; Q350-E352 VanDerWaalsContact C-N 3.34Å; E352-L354 VanDerWaalsContact C-N 3.33Å; E352-L354 PolarHBondContact O-N 2.87Å; E352-T355 PolarHBondContact O-N 3.32Å; E352-T355 PolarHBondContact O-OG1 2.96Å; E352-S356 VanDerWaalsContact O-CB 3.23Å; E352-S356 WeakPolarHBondContact O-CB 3.37Å; E352-S356 PolarHBondContact O-N 3.08Å; E352-K400 VanDerWaalsContact CA-CG 3.49Å; E352-K400 HydrophobicContact CB-CD 4.22Å; E352-K400 HydrophobicContact CB-CG 3.74Å; E352-K400 VanDerWaalsContact CD-CE 3.5Å; E352-K400 HydrophobicContact CG-CD 4.33Å; E352-K400 VanDerWaalsContact CG-CE 3.41Å; E352-K400 HydrophobicContact CG-CG 4.1Å; E352-K400 WeakPolarHBondContact OE2-CE 3.23Å; E352-K400 IonicContact OE2-NZ 3.35Å; E352-K400 PolarHBondContact OE2-NZ 3.35Å; E352-L1205 WeakPolarHBondContact OE1-CB 3.35Å; E352-L1205 VanDerWaalsContact OE1-O 3.08Å; E352-S1206 WeakPolarHBondContact OE1-CA 3.45Å
353	E	91	Very high	92.7	Very high	39 Å²	39	29.2 Å²	29.2	18%	0.182	16%	0.158	C	C	.	.	H	α-helix	trans	-62.6	-41.3	-179.2	-70.7	175.1	-178.8	0	0	111.8	K349 Q350 C357 L623	K349-E353 VanDerWaalsContact CE-OE1 3.23Å; K349-E353 WeakPolarHBondContact CE-OE1 3.36Å; K349-E353 PolarHBondContact O-N 3.18Å; Q350-E353 PolarHBondContact O-N 2.95Å; E353-C357 PolarHBondContact O-N 2.85Å; E353-C357 PolarHBondContact O-SG 3Å; E353-L623 HydrophobicContact CB-CD1 4.16Å; E353-L623 HydrophobicContact CB-CD2 4.49Å
354	L	94.9	Very high	92.6	Very high	4 Å²	4	30 Å²	30	2%	0.021	16%	0.161	C	C	.	.	H	α-helix	trans	-63.3	-54.3	176	-176.5	72.3	0	0	0	111.4	L342 L346 Q350 K351 E352 S356 C357 F358 L620 L624	L342-L354 HydrophobicContact CB-CD2 4.37Å; L342-L354 HydrophobicContact CD1-CD1 4.31Å; L342-L354 HydrophobicContact CD1-CD2 3.99Å; L346-L354 HydrophobicContact CD1-CB 4.41Å; L346-L354 HydrophobicContact CD1-CD2 3.64Å; Q350-L354 WeakPolarHBondContact O-CB 3.27Å; Q350-L354 PolarHBondContact O-N 3.26Å; K351-L354 PolarHBondContact O-N 3.17Å; E352-L354 VanDerWaalsContact C-N 3.33Å; E352-L354 PolarHBondContact O-N 2.87Å; L354-S356 VanDerWaalsContact C-N 3.31Å; L354-S356 PolarHBondContact O-N 3.33Å; L354-C357 WeakPolarHBondContact O-CB 3.4Å; L354-C357 PolarHBondContact O-N 3.01Å; L354-C357 VanDerWaalsContact O-N 3.11Å; L354-F358 HydrophobicContact CD1-CD2 4.29Å; L354-F358 HydrophobicContact CD1-CE2 3.73Å; L354-F358 HydrophobicContact CD2-CE2 4.28Å; L354-F358 HydrophobicContact CG-CD2 4.01Å; L354-F358 HydrophobicContact CG-CE2 3.77Å; L354-F358 WeakPolarHBondContact O-CD2 3.48Å; L354-F358 PolarHBondContact O-N 3.15Å; L354-L620 HydrophobicContact CD1-CD1 3.68Å; L354-L624 HydrophobicContact CD1-CD2 4.46Å
355	T	95.4	Very high	92.9	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.006	13%	0.131	C	C	.	.	H	α-helix	trans	-66.2	-33.5	-175.7	52.8	0	0	0	0	112.2	K351 E352 C357 F358 V359 A397 A401	K351-T355 WeakPolarHBondContact O-CB 3.27Å; K351-T355 VanDerWaalsContact O-CG2 3.23Å; K351-T355 WeakPolarHBondContact O-CG2 3.39Å; K351-T355 PolarHBondContact O-N 3.31Å; K351-T355 PolarHBondContact O-OG1 3.01Å; E352-T355 PolarHBondContact O-N 3.32Å; E352-T355 PolarHBondContact O-OG1 2.96Å; T355-C357 VanDerWaalsContact C-N 3.32Å; T355-C357 PolarHBondContact O-N 2.84Å; T355-F358 PolarHBondContact O-N 2.9Å; T355-V359 WeakPolarHBondContact O-CB 3.42Å; T355-V359 VanDerWaalsContact O-CG2 3.28Å; T355-V359 WeakPolarHBondContact O-CG2 2.91Å; T355-V359 PolarHBondContact O-N 3.2Å; T355-A397 HydrophobicContact CG2-CB 4.01Å; T355-A397 WeakPolarHBondContact CG2-O 3.16Å; T355-A401 HydrophobicContact CG2-CB 4.09Å
356	S	94.8	Very high	93	Very high	20 Å²	20	27 Å²	27	14%	0.14	15%	0.151	C	C	.	.	H	α-helix	trans	-58.8	-42.1	171.3	-178.1	0	0	0	0	112	E352 L354 N360	E352-S356 VanDerWaalsContact O-CB 3.23Å; E352-S356 WeakPolarHBondContact O-CB 3.37Å; E352-S356 PolarHBondContact O-N 3.08Å; L354-S356 VanDerWaalsContact C-N 3.31Å; L354-S356 PolarHBondContact O-N 3.33Å; S356-N360 WeakPolarHBondContact O-CB 3.24Å; S356-N360 PolarHBondContact O-N 2.76Å; S356-N360 VanDerWaalsContact O-N 3.09Å; S356-N360 PolarHBondContact O-ND2 2.87Å
357	C	96.2	Very high	93.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.1	-46.3	177.1	-59.5	0	0	0	0	110.6	E353 L354 T355 N360 I361 L620	E353-C357 PolarHBondContact O-N 2.85Å; E353-C357 PolarHBondContact O-SG 3Å; L354-C357 WeakPolarHBondContact O-CB 3.4Å; L354-C357 PolarHBondContact O-N 3.01Å; L354-C357 VanDerWaalsContact O-N 3.11Å; T355-C357 VanDerWaalsContact C-N 3.32Å; T355-C357 PolarHBondContact O-N 2.84Å; C357-N360 PolarHBondContact O-N 2.74Å; C357-I361 WeakPolarHBondContact O-CB 3.43Å; C357-I361 WeakPolarHBondContact O-CD1 3.36Å; C357-I361 WeakPolarHBondContact O-CG1 3.29Å; C357-I361 PolarHBondContact O-N 2.89Å; C357-L620 HydrophobicContact CB-CB 4.1Å; C357-L620 HydrophobicContact CB-CD1 4.34Å
358	F	97.8	Very high	93.4	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.3	-48.6	177.7	-81	-77.6	0	0	0	112.3	I331 L338 I339 L354 T355 N360 I361 F362 F373 L620	I331-F358 HydrophobicContact CG1-CE1 4.35Å; I331-F358 HydrophobicContact CG2-CD1 4.09Å; I331-F358 HydrophobicContact CG2-CE1 3.84Å; L338-F358 HydrophobicContact CD2-CZ 3.85Å; I339-F358 HydrophobicContact CD1-CD2 4.18Å; I339-F358 HydrophobicContact CD1-CE2 4.18Å; I339-F358 HydrophobicContact CD1-CG 4.41Å; I339-F358 HydrophobicContact CD1-CZ 4.41Å; I339-F358 HydrophobicContact CG1-CD2 4.4Å; I339-F358 HydrophobicContact CG1-CE2 3.96Å; I339-F358 HydrophobicContact CG1-CZ 4.17Å; L354-F358 HydrophobicContact CD1-CD2 4.29Å; L354-F358 HydrophobicContact CD1-CE2 3.73Å; L354-F358 HydrophobicContact CD2-CE2 4.28Å; L354-F358 HydrophobicContact CG-CD2 4.01Å; L354-F358 HydrophobicContact CG-CE2 3.77Å; L354-F358 WeakPolarHBondContact O-CD2 3.48Å; L354-F358 PolarHBondContact O-N 3.15Å; T355-F358 PolarHBondContact O-N 2.9Å; F358-N360 VanDerWaalsContact C-N 3.31Å; F358-N360 PolarHBondContact O-N 2.83Å; F358-I361 PolarHBondContact O-N 2.77Å; F358-F362 HydrophobicContact CD1-CD2 4.46Å; F358-F362 AromaticContact CD1-CE2 3.98Å; F358-F362 HydrophobicContact CD1-CE2 3.98Å; F358-F362 WeakPolarHBondContact O-CB 3.35Å; F358-F362 VanDerWaalsContact O-CD2 3.24Å; F358-F362 WeakPolarHBondContact O-CD2 3.38Å; F358-F362 PolarHBondContact O-N 3.03Å; F358-F373 HydrophobicContact CB-CE1 4.19Å; F358-F373 HydrophobicContact CB-CE2 4.31Å; F358-F373 HydrophobicContact CB-CZ 3.7Å; F358-F373 HydrophobicContact CG-CZ 4.37Å; F358-L620 HydrophobicContact CE2-CD1 4.17Å
359	V	97.3	Very high	93.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-55.4	-48.4	178.1	166.9	0	0	0	0	110.7	T355 I361 F362 E363 F373 A401 C404 Y405 L408	T355-V359 WeakPolarHBondContact O-CB 3.42Å; T355-V359 VanDerWaalsContact O-CG2 3.28Å; T355-V359 WeakPolarHBondContact O-CG2 2.91Å; T355-V359 PolarHBondContact O-N 3.2Å; V359-I361 PolarHBondContact O-N 2.81Å; V359-F362 PolarHBondContact O-N 2.89Å; V359-E363 VanDerWaalsContact O-CB 3.27Å; V359-E363 WeakPolarHBondContact O-CB 3.45Å; V359-E363 PolarHBondContact O-N 2.9Å; V359-F373 HydrophobicContact CG2-CE1 4.01Å; V359-A401 HydrophobicContact CG2-CB 3.96Å; V359-A401 WeakPolarHBondContact CG2-O 3.37Å; V359-C404 HydrophobicContact CG2-CB 4.5Å; V359-Y405 HydrophobicContact CG1-CD2 3.55Å; V359-Y405 HydrophobicContact CG1-CG 4.08Å; V359-L408 HydrophobicContact CG1-CD2 4.33Å
360	N	95.5	Very high	94.2	Very high	19 Å²	19	26 Å²	26	10%	0.102	14%	0.143	C	C	.	.	H	α-helix	trans	-67.1	-37.8	-178.2	-69	-7.3	0	0	0	112.4	S356 C357 F358 K364 I611 E616	S356-N360 WeakPolarHBondContact O-CB 3.24Å; S356-N360 PolarHBondContact O-N 2.76Å; S356-N360 VanDerWaalsContact O-N 3.09Å; S356-N360 PolarHBondContact O-ND2 2.87Å; C357-N360 PolarHBondContact O-N 2.74Å; F358-N360 VanDerWaalsContact C-N 3.31Å; F358-N360 PolarHBondContact O-N 2.83Å; N360-K364 VanDerWaalsContact O-CB 3.25Å; N360-K364 WeakPolarHBondContact O-CB 3.29Å; N360-K364 PolarHBondContact O-N 2.81Å; N360-K364 VanDerWaalsContact O-N 3.08Å; N360-I611 HydrophobicContact CB-CD1 4.35Å; N360-I611 HydrophobicContact CB-CG1 4.37Å; N360-I611 HydrophobicContact CB-CG2 3.89Å; N360-E616 HydrophobicContact CB-CG 3.72Å; N360-E616 VanDerWaalsContact ND2-CD 3.32Å; N360-E616 PolarHBondContact ND2-OE1 3.06Å
361	I	96.7	Very high	94.6	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-65.5	-47.7	175.9	-71	166.8	0	0	0	111	I331 C357 F358 V359 E363 K364 L365 L368 L613 E616 F617 L620	I331-I361 HydrophobicContact CD1-CD1 4.18Å; C357-I361 WeakPolarHBondContact O-CB 3.43Å; C357-I361 WeakPolarHBondContact O-CD1 3.36Å; C357-I361 WeakPolarHBondContact O-CG1 3.29Å; C357-I361 PolarHBondContact O-N 2.89Å; F358-I361 PolarHBondContact O-N 2.77Å; V359-I361 PolarHBondContact O-N 2.81Å; I361-E363 VanDerWaalsContact C-N 3.31Å; I361-E363 PolarHBondContact O-N 2.89Å; I361-K364 PolarHBondContact O-N 2.93Å; I361-L365 HydrophobicContact CG2-CD1 3.65Å; I361-L365 WeakPolarHBondContact O-CB 3.31Å; I361-L365 WeakPolarHBondContact O-CG 3.44Å; I361-L365 PolarHBondContact O-N 2.82Å; I361-L365 VanDerWaalsContact O-N 3.1Å; I361-L368 HydrophobicContact CG2-CD1 4.4Å; I361-L613 HydrophobicContact CB-CD1 4.45Å; I361-L613 HydrophobicContact CG1-CD1 4.09Å; I361-L613 HydrophobicContact CG2-CD1 4.49Å; I361-E616 HydrophobicContact CD1-CB 4.26Å; I361-E616 HydrophobicContact CG1-CB 3.81Å; I361-F617 HydrophobicContact CD1-CD1 4.16Å; I361-F617 HydrophobicContact CD1-CE1 4.2Å; I361-F617 HydrophobicContact CG2-CZ 4.16Å; I361-L620 HydrophobicContact CD1-CD2 3.72Å
362	F	97.2	Very high	94.7	Very high	9 Å²	9	28.7 Å²	28.7	4%	0.039	16%	0.159	C	C	.	.	H	α-helix	trans	-67.3	-31.5	179.6	-85.8	-108.7	0	0	0	112.5	I331 Y335 F358 V359 L368 V370 F373	I331-F362 HydrophobicContact CG2-CE2 3.72Å; I331-F362 HydrophobicContact CG2-CZ 4.4Å; Y335-F362 HydrophobicContact CD1-CE1 4.36Å; Y335-F362 AromaticContact CD1-CZ 3.64Å; Y335-F362 HydrophobicContact CD1-CZ 3.64Å; Y335-F362 HydrophobicContact CD2-CZ 4.4Å; Y335-F362 HydrophobicContact CE1-CE1 4.32Å; Y335-F362 HydrophobicContact CE1-CZ 4.04Å; Y335-F362 HydrophobicContact CG-CE2 4.43Å; Y335-F362 AromaticContact CG-CZ 3.82Å; Y335-F362 HydrophobicContact CG-CZ 3.82Å; F358-F362 HydrophobicContact CD1-CD2 4.46Å; F358-F362 AromaticContact CD1-CE2 3.98Å; F358-F362 HydrophobicContact CD1-CE2 3.98Å; F358-F362 WeakPolarHBondContact O-CB 3.35Å; F358-F362 VanDerWaalsContact O-CD2 3.24Å; F358-F362 WeakPolarHBondContact O-CD2 3.38Å; F358-F362 PolarHBondContact O-N 3.03Å; V359-F362 PolarHBondContact O-N 2.89Å; F362-L368 HydrophobicContact CB-CB 4.46Å; F362-L368 HydrophobicContact CD1-CB 3.83Å; F362-L368 HydrophobicContact CD1-CD1 4.11Å; F362-L368 HydrophobicContact CD1-CG 4.42Å; F362-L368 HydrophobicContact CD2-CD1 4.03Å; F362-L368 HydrophobicContact CE1-CB 4.34Å; F362-L368 HydrophobicContact CE1-CD1 4.23Å; F362-L368 HydrophobicContact CE1-CD2 4.34Å; F362-L368 HydrophobicContact CE2-CD1 4.16Å; F362-L368 HydrophobicContact CG-CB 4.23Å; F362-L368 HydrophobicContact CG-CD1 4.03Å; F362-L368 HydrophobicContact CZ-CD1 4.27Å; F362-V370 HydrophobicContact CB-CG2 3.76Å; F362-F373 HydrophobicContact CD1-CB 3.44Å; F362-F373 VanDerWaalsContact CD1-CB 3.44Å; F362-F373 HydrophobicContact CD1-CD2 4.33Å; F362-F373 AromaticContact CD1-CG 3.92Å; F362-F373 HydrophobicContact CD1-CG 3.92Å; F362-F373 HydrophobicContact CD2-CD2 4.49Å; F362-F373 HydrophobicContact CD2-CG 4.45Å; F362-F373 HydrophobicContact CE1-CB 3.67Å; F362-F373 HydrophobicContact CE1-CD2 4.05Å; F362-F373 HydrophobicContact CE1-CG 4.07Å; F362-F373 HydrophobicContact CE2-CD2 4.23Å; F362-F373 HydrophobicContact CG-CB 4.06Å; F362-F373 HydrophobicContact CG-CD1 4.46Å; F362-F373 HydrophobicContact CG-CG 4.1Å; F362-F373 HydrophobicContact CZ-CB 4.45Å; F362-F373 AromaticContact CZ-CD2 3.99Å; F362-F373 HydrophobicContact CZ-CD2 3.99Å; F362-F373 HydrophobicContact CZ-CG 4.4Å
363	E	94.8	Very high	95	Very high	28 Å²	28	28.2 Å²	28.2	13%	0.131	16%	0.156	C	C	.	.	H	α-helix	trans	-70.9	-39.2	175.8	179.8	53.4	-152	0	0	111.6	V359 I361 V370 Y405 H608 I611	V359-E363 VanDerWaalsContact O-CB 3.27Å; V359-E363 WeakPolarHBondContact O-CB 3.45Å; V359-E363 PolarHBondContact O-N 2.9Å; I361-E363 VanDerWaalsContact C-N 3.31Å; I361-E363 PolarHBondContact O-N 2.89Å; E363-V370 HydrophobicContact CB-CG2 3.69Å; E363-V370 WeakPolarHBondContact OE2-CG2 3.43Å; E363-Y405 WeakPolarHBondContact OE2-CE2 3.39Å; E363-Y405 PolarHBondContact OE2-OH 2.8Å; E363-H608 PolarHBondContact O-CE1 2.72Å; E363-H608 PolarHBondContact O-NE2 3.13Å; E363-H608 IonicContact OE1-CD2 3.86Å; E363-H608 PolarHBondContact OE1-CD2 2.55Å; E363-H608 VanDerWaalsContact OE1-CD2 3.23Å; E363-H608 IonicContact OE1-NE2 3.09Å; E363-H608 PolarHBondContact OE1-NE2 3.21Å; E363-I611 HydrophobicContact CB-CD1 4.02Å; E363-I611 HydrophobicContact CG-CD1 3.78Å
364	K	91.3	Very high	95.3	Very high	50 Å²	50	26.4 Å²	26.4	22%	0.217	15%	0.148	C	C	.	.	H	α-helix	trans	-84.7	-25.4	-171.2	-165.3	59.8	176.4	173.4	0	113.7	N360 I361 H608 I611 L613	N360-K364 VanDerWaalsContact O-CB 3.25Å; N360-K364 WeakPolarHBondContact O-CB 3.29Å; N360-K364 PolarHBondContact O-N 2.81Å; N360-K364 VanDerWaalsContact O-N 3.08Å; I361-K364 PolarHBondContact O-N 2.93Å; K364-H608 PolarHBondContact NZ-ND1 2.86Å; K364-H608 PolarHBondContact NZ-O 3.39Å; K364-I611 HydrophobicContact CB-CG2 3.97Å; K364-I611 HydrophobicContact CD-CB 4.28Å; K364-I611 HydrophobicContact CD-CG2 4.4Å; K364-I611 HydrophobicContact CG-CG2 4.11Å; K364-L613 HydrophobicContact CB-CD1 4.27Å; K364-L613 HydrophobicContact CG-CB 4.27Å; K364-L613 HydrophobicContact CG-CD1 4.46Å
365	L	93	Very high	95.3	Very high	11 Å²	11	26.5 Å²	26.5	6%	0.058	15%	0.149	C	C	.	.			trans	-88.3	123.1	-178.1	-75.8	174	0	0	0	111.4	K328 I361 D367 L368 L613 F617	K328-L365 HydrophobicContact CD-CD1 4.02Å; K328-L365 HydrophobicContact CD-CD2 4Å; K328-L365 HydrophobicContact CG-CD1 3.91Å; I361-L365 HydrophobicContact CG2-CD1 3.65Å; I361-L365 WeakPolarHBondContact O-CB 3.31Å; I361-L365 WeakPolarHBondContact O-CG 3.44Å; I361-L365 PolarHBondContact O-N 2.82Å; I361-L365 VanDerWaalsContact O-N 3.1Å; L365-D367 PolarHBondContact O-N 3.5Å; L365-L368 HydrophobicContact CB-CB 4.19Å; L365-L368 HydrophobicContact CB-CD1 3.99Å; L365-L368 HydrophobicContact CB-CG 4Å; L365-L368 HydrophobicContact CD1-CD1 3.57Å; L365-L368 HydrophobicContact CD1-CG 4.29Å; L365-L368 HydrophobicContact CG-CD1 4.43Å; L365-L368 PolarHBondContact O-N 3.41Å; L365-L368 VanDerWaalsContact O-N 3.16Å; L365-L613 HydrophobicContact CD2-CD2 3.65Å; L365-L613 HydrophobicContact CG-CD1 4.34Å; L365-L613 HydrophobicContact CG-CD2 4.16Å; L365-F617 HydrophobicContact CD1-CZ 4.38Å
366	P	90.1	Very high	95.3	Very high	127 Å²	127	27.4 Å²	27.4	83%	0.825	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-19.6	-174.1	29.5	-36.7	0	0	0	113.9	L368	P366-L368 VanDerWaalsContact C-N 3.35Å
367	D	92.5	Very high	95.2	Very high	64 Å²	64	26.6 Å²	26.6	34%	0.342	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	3.8	178.3	64.4	-57.3	0	0	0	113.4	K328 K332 L365	K328-D367 WeakPolarHBondContact CE-OD1 3.19Å; K328-D367 IonicContact NZ-OD1 2.77Å; K328-D367 PolarHBondContact NZ-OD1 2.85Å; K328-D367 IonicContact NZ-OD2 3.85Å; K332-D367 WeakPolarHBondContact CE-OD2 3.35Å; K332-D367 IonicContact NZ-OD2 3.38Å; K332-D367 PolarHBondContact NZ-OD2 3.17Å; L365-D367 PolarHBondContact O-N 3.5Å
368	L	95	Very high	95.1	Very high	26 Å²	26	26.6 Å²	26.6	14%	0.136	15%	0.149	C	C	.	.			trans	-118.6	155.2	174.3	-60.1	-175.4	0	0	0	110.1	K332 I361 F362 L365 P366	K332-L368 HydrophobicContact CB-CD2 3.95Å; K332-L368 HydrophobicContact CD-CD2 4.04Å; K332-L368 HydrophobicContact CG-CD2 3.65Å; I361-L368 HydrophobicContact CG2-CD1 4.4Å; F362-L368 HydrophobicContact CB-CB 4.46Å; F362-L368 HydrophobicContact CD1-CB 3.83Å; F362-L368 HydrophobicContact CD1-CD1 4.11Å; F362-L368 HydrophobicContact CD1-CG 4.42Å; F362-L368 HydrophobicContact CD2-CD1 4.03Å; F362-L368 HydrophobicContact CE1-CB 4.34Å; F362-L368 HydrophobicContact CE1-CD1 4.23Å; F362-L368 HydrophobicContact CE1-CD2 4.34Å; F362-L368 HydrophobicContact CE2-CD1 4.16Å; F362-L368 HydrophobicContact CG-CB 4.23Å; F362-L368 HydrophobicContact CG-CD1 4.03Å; F362-L368 HydrophobicContact CZ-CD1 4.27Å; L365-L368 HydrophobicContact CB-CB 4.19Å; L365-L368 HydrophobicContact CB-CD1 3.99Å; L365-L368 HydrophobicContact CB-CG 4Å; L365-L368 HydrophobicContact CD1-CD1 3.57Å; L365-L368 HydrophobicContact CD1-CG 4.29Å; L365-L368 HydrophobicContact CG-CD1 4.43Å; L365-L368 PolarHBondContact O-N 3.41Å; L365-L368 VanDerWaalsContact O-N 3.16Å; P366-L368 VanDerWaalsContact C-N 3.35Å
369	S	95.2	Very high	94.7	Very high	50 Å²	50	31.3 Å²	31.3	35%	0.35	17%	0.166	S	C	.	.			trans	-125.8	121.7	177.5	171.3	0	0	0	0	110.3	A371 E372 F373	S369-A371 VanDerWaalsContact C-N 3.26Å; S369-A371 PolarHBondContact O-N 3.32Å; S369-A371 PolarHBondContact OG-N 2.88Å; S369-E372 PolarHBondContact O-N 2.8Å; S369-E372 PolarHBondContact OG-N 3.37Å; S369-F373 WeakPolarHBondContact O-CB 3.24Å; S369-F373 PolarHBondContact O-N 3.47Å
370	V	96.2	Very high	94.4	Very high	6 Å²	6	32.5 Å²	32.5	4%	0.036	17%	0.172	C	C	.	.	H	α-helix	trans	-64.9	-34.5	173.4	-178.5	0	0	0	0	111.3	F362 E363 E372 F373 L374 Y405	F362-V370 HydrophobicContact CB-CG2 3.76Å; E363-V370 HydrophobicContact CB-CG2 3.69Å; E363-V370 WeakPolarHBondContact OE2-CG2 3.43Å; V370-E372 PolarHBondContact O-N 2.84Å; V370-F373 PolarHBondContact O-N 3.08Å; V370-L374 HydrophobicContact CG1-CD1 3.56Å; V370-L374 HydrophobicContact CG1-CG 3.86Å; V370-L374 WeakPolarHBondContact O-CB 3.18Å; V370-L374 WeakPolarHBondContact O-CG 3.39Å; V370-L374 PolarHBondContact O-N 2.82Å; V370-Y405 HydrophobicContact CB-CE2 4.02Å; V370-Y405 HydrophobicContact CG1-CD1 4.09Å; V370-Y405 HydrophobicContact CG1-CD2 3.68Å; V370-Y405 HydrophobicContact CG1-CE1 4Å; V370-Y405 HydrophobicContact CG1-CE2 3.54Å; V370-Y405 HydrophobicContact CG1-CG 3.89Å; V370-Y405 HydrophobicContact CG2-CE2 4.06Å
371	A	96.7	Very high	94.1	Very high	14 Å²	14	31.9 Å²	31.9	12%	0.116	17%	0.168	C	C	.	.	H	α-helix	trans	-62	-42.9	177	0	0	0	0	0	112.1	S369 S375 D490 V491 A494	S369-A371 VanDerWaalsContact C-N 3.26Å; S369-A371 PolarHBondContact O-N 3.32Å; S369-A371 PolarHBondContact OG-N 2.88Å; A371-S375 VanDerWaalsContact O-CB 3.28Å; A371-S375 WeakPolarHBondContact O-CB 3.36Å; A371-S375 PolarHBondContact O-N 3.44Å; A371-S375 VanDerWaalsContact O-N 3.09Å; A371-S375 PolarHBondContact O-OG 3.24Å; A371-S375 VanDerWaalsContact O-OG 3.11Å; A371-D490 HydrophobicContact CB-CB 4.48Å; A371-V491 HydrophobicContact CB-CG2 4.08Å; A371-A494 HydrophobicContact CB-CB 3.95Å
372	E	96	Very high	93.6	Very high	123 Å²	123	32 Å²	32	58%	0.575	17%	0.169	S	C	*	.	H	α-helix	trans	-67.8	-45.3	174.4	-175.3	177.8	178.2	0	0	111.7	S369 V370 L374 S375 V376	S369-E372 PolarHBondContact O-N 2.8Å; S369-E372 PolarHBondContact OG-N 3.37Å; V370-E372 PolarHBondContact O-N 2.84Å; E372-L374 PolarHBondContact O-N 3.14Å; E372-S375 PolarHBondContact O-N 3.28Å; E372-S375 PolarHBondContact O-OG 3.45Å; E372-S375 VanDerWaalsContact O-OG 3.11Å; E372-V376 HydrophobicContact CG-CG2 4.38Å; E372-V376 WeakPolarHBondContact O-CB 3.4Å; E372-V376 WeakPolarHBondContact O-CG2 3.45Å; E372-V376 PolarHBondContact O-N 2.92Å
373	F	97.4	Very high	93	Very high	1 Å²	1	35.3 Å²	35.3	0%	0.004	19%	0.194	C	C	.	.	H	α-helix	trans	-56.6	-51.5	177.8	167.8	-114	0	0	0	112.6	Y335 I339 F358 V359 F362 S369 V370 L377 A401	Y335-F373 AromaticContact CD2-CD2 3.61Å; Y335-F373 HydrophobicContact CD2-CD2 3.61Å; Y335-F373 AromaticContact CD2-CE2 3.61Å; Y335-F373 HydrophobicContact CD2-CE2 3.61Å; Y335-F373 AromaticContact CE2-CD2 3.43Å; Y335-F373 HydrophobicContact CE2-CD2 3.43Å; Y335-F373 VanDerWaalsContact CE2-CD2 3.43Å; Y335-F373 AromaticContact CE2-CE2 3.8Å; Y335-F373 HydrophobicContact CE2-CE2 3.8Å; Y335-F373 HydrophobicContact CG-CD2 4.41Å; I339-F373 HydrophobicContact CD1-CE2 3.91Å; I339-F373 HydrophobicContact CD1-CZ 4.21Å; F358-F373 HydrophobicContact CB-CE1 4.19Å; F358-F373 HydrophobicContact CB-CE2 4.31Å; F358-F373 HydrophobicContact CB-CZ 3.7Å; F358-F373 HydrophobicContact CG-CZ 4.37Å; V359-F373 HydrophobicContact CG2-CE1 4.01Å; F362-F373 HydrophobicContact CD1-CB 3.44Å; F362-F373 VanDerWaalsContact CD1-CB 3.44Å; F362-F373 HydrophobicContact CD1-CD2 4.33Å; F362-F373 AromaticContact CD1-CG 3.92Å; F362-F373 HydrophobicContact CD1-CG 3.92Å; F362-F373 HydrophobicContact CD2-CD2 4.49Å; F362-F373 HydrophobicContact CD2-CG 4.45Å; F362-F373 HydrophobicContact CE1-CB 3.67Å; F362-F373 HydrophobicContact CE1-CD2 4.05Å; F362-F373 HydrophobicContact CE1-CG 4.07Å; F362-F373 HydrophobicContact CE2-CD2 4.23Å; F362-F373 HydrophobicContact CG-CB 4.06Å; F362-F373 HydrophobicContact CG-CD1 4.46Å; F362-F373 HydrophobicContact CG-CG 4.1Å; F362-F373 HydrophobicContact CZ-CB 4.45Å; F362-F373 AromaticContact CZ-CD2 3.99Å; F362-F373 HydrophobicContact CZ-CD2 3.99Å; F362-F373 HydrophobicContact CZ-CG 4.4Å; S369-F373 WeakPolarHBondContact O-CB 3.24Å; S369-F373 PolarHBondContact O-N 3.47Å; V370-F373 PolarHBondContact O-N 3.08Å; F373-L377 HydrophobicContact CE1-CD2 4.4Å; F373-L377 HydrophobicContact CE2-CD2 4.04Å; F373-L377 HydrophobicContact CZ-CD2 3.74Å; F373-L377 WeakPolarHBondContact O-CB 3.22Å; F373-L377 PolarHBondContact O-N 2.84Å; F373-A401 HydrophobicContact CE1-CB 4.08Å; F373-A401 HydrophobicContact CZ-CB 4.42Å
374	L	97	Very high	92.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-69.8	-38.5	-177.5	-68.6	177.3	0	0	0	112	V370 E372 L377 L378 A401 M402 Y405 V491	V370-L374 HydrophobicContact CG1-CD1 3.56Å; V370-L374 HydrophobicContact CG1-CG 3.86Å; V370-L374 WeakPolarHBondContact O-CB 3.18Å; V370-L374 WeakPolarHBondContact O-CG 3.39Å; V370-L374 PolarHBondContact O-N 2.82Å; E372-L374 PolarHBondContact O-N 3.14Å; L374-L377 PolarHBondContact O-N 2.86Å; L374-L378 VanDerWaalsContact O-CB 3.31Å; L374-L378 WeakPolarHBondContact O-CB 3.25Å; L374-L378 WeakPolarHBondContact O-CG 3.42Å; L374-L378 PolarHBondContact O-N 2.94Å; L374-A401 HydrophobicContact CD2-CB 3.55Å; L374-M402 HydrophobicContact CD1-SD 3.86Å; L374-Y405 HydrophobicContact CD1-CD1 3.69Å; L374-Y405 HydrophobicContact CD1-CE1 4.39Å; L374-Y405 HydrophobicContact CD1-CG 3.95Å; L374-V491 HydrophobicContact CB-CG1 4.3Å; L374-V491 HydrophobicContact CD1-CG1 3.94Å; L374-V491 HydrophobicContact CD1-CG2 3.99Å
375	S	95.4	Very high	91.6	Very high	6 Å²	6	40.1 Å²	40.1	4%	0.042	22%	0.222	C	C	.	.	H	α-helix	trans	-66.5	-42.5	179.3	70.5	0	0	0	0	111.8	A371 E372 R379	A371-S375 VanDerWaalsContact O-CB 3.28Å; A371-S375 WeakPolarHBondContact O-CB 3.36Å; A371-S375 PolarHBondContact O-N 3.44Å; A371-S375 VanDerWaalsContact O-N 3.09Å; A371-S375 PolarHBondContact O-OG 3.24Å; A371-S375 VanDerWaalsContact O-OG 3.11Å; E372-S375 PolarHBondContact O-N 3.28Å; E372-S375 PolarHBondContact O-OG 3.45Å; E372-S375 VanDerWaalsContact O-OG 3.11Å; S375-R379 VanDerWaalsContact O-CB 3.32Å; S375-R379 WeakPolarHBondContact O-CB 3.27Å; S375-R379 PolarHBondContact O-N 2.92Å
376	V	94.7	Very high	90.4	Very high	21 Å²	21	42.9 Å²	42.9	13%	0.127	25%	0.254	C	S	.	.	H	α-helix	trans	-65	-45.7	176.4	172.7	0	0	0	0	110.8	L336 E372 R379 E380	L336-V376 HydrophobicContact CD1-CG1 4.13Å; L336-V376 HydrophobicContact CD2-CG1 3.87Å; E372-V376 HydrophobicContact CG-CG2 4.38Å; E372-V376 WeakPolarHBondContact O-CB 3.4Å; E372-V376 WeakPolarHBondContact O-CG2 3.45Å; E372-V376 PolarHBondContact O-N 2.92Å; V376-R379 PolarHBondContact O-N 3.43Å; V376-E380 PolarHBondContact O-N 2.88Å
377	L	94.3	Very high	89.4	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-66.6	-42.2	-177.7	-171.4	61.8	0	0	0	112.3	L336 I339 F373 L374 E380 D381 A397 A401	L336-L377 HydrophobicContact CD1-CD1 4.13Å; I339-L377 HydrophobicContact CD1-CD1 4.3Å; I339-L377 HydrophobicContact CD1-CD2 4.34Å; I339-L377 HydrophobicContact CG2-CD1 4.04Å; F373-L377 HydrophobicContact CE1-CD2 4.4Å; F373-L377 HydrophobicContact CE2-CD2 4.04Å; F373-L377 HydrophobicContact CZ-CD2 3.74Å; F373-L377 WeakPolarHBondContact O-CB 3.22Å; F373-L377 PolarHBondContact O-N 2.84Å; L374-L377 PolarHBondContact O-N 2.86Å; L377-E380 PolarHBondContact O-N 3.34Å; L377-D381 PolarHBondContact O-N 2.8Å; L377-A397 HydrophobicContact CD1-CB 4.49Å; L377-A397 HydrophobicContact CD2-CB 4.42Å; L377-A401 HydrophobicContact CD2-CB 4.03Å
378	L	92.3	Very high	88.1	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-70.6	-31.7	177.2	-74.4	169.6	0	0	0	113	L374 E380 D381 L382 I391 F392 M402 L495	L374-L378 VanDerWaalsContact O-CB 3.31Å; L374-L378 WeakPolarHBondContact O-CB 3.25Å; L374-L378 WeakPolarHBondContact O-CG 3.42Å; L374-L378 PolarHBondContact O-N 2.94Å; L378-E380 VanDerWaalsContact C-N 3.34Å; L378-D381 PolarHBondContact O-N 2.84Å; L378-L382 WeakPolarHBondContact O-CB 3.4Å; L378-L382 PolarHBondContact O-N 3.14Å; L378-I391 HydrophobicContact CD2-CG2 4.05Å; L378-F392 HydrophobicContact CD1-CE1 4.37Å; L378-F392 HydrophobicContact CD1-CZ 3.89Å; L378-F392 HydrophobicContact CD2-CE1 3.6Å; L378-F392 HydrophobicContact CD2-CZ 3.57Å; L378-F392 HydrophobicContact CG-CZ 4.38Å; L378-M402 HydrophobicContact CD1-CB 4.44Å; L378-M402 HydrophobicContact CD1-CG 4.47Å; L378-L495 HydrophobicContact CB-CD1 3.87Å; L378-L495 HydrophobicContact CD1-CD1 3.76Å; L378-L495 HydrophobicContact CD1-CD2 3.95Å; L378-L495 HydrophobicContact CG-CD1 4.49Å
379	R	91	Very high	86.6	Confident	99 Å²	99	45.7 Å²	45.7	37%	0.374	26%	0.259	S	S	.	.	H	α-helix	trans	-63.9	-41.6	170.8	176.8	-176.3	53.2	178.1	-1.5	111.2	S375 V376 L382 S383 T498 I499	S375-R379 VanDerWaalsContact O-CB 3.32Å; S375-R379 WeakPolarHBondContact O-CB 3.27Å; S375-R379 PolarHBondContact O-N 2.92Å; V376-R379 PolarHBondContact O-N 3.43Å; R379-L382 PolarHBondContact O-N 3.46Å; R379-S383 PolarHBondContact O-N 3.27Å; R379-T498 HydrophobicContact CB-CG2 3.85Å; R379-T498 HydrophobicContact CG-CG2 4.14Å; R379-I499 HydrophobicContact CB-CD1 4.29Å
380	E	89.7	Confident	85.2	Confident	25 Å²	25	46.9 Å²	46.9	12%	0.117	26%	0.26	C	S	.	.	H	α-helix	trans	-62.6	-45.6	174.8	-178.9	162.5	170.6	0	0	111.1	L336 R340 V376 L377 L378 L382 S383 N384	L336-E380 WeakPolarHBondContact CD1-OE2 3.4Å; L336-E380 WeakPolarHBondContact CD2-OE2 3.49Å; L336-E380 WeakPolarHBondContact CG-OE2 3.42Å; R340-E380 IonicContact CZ-OE1 3.44Å; R340-E380 IonicContact CZ-OE2 2.63Å; R340-E380 IonicContact NE-OE1 3.2Å; R340-E380 PolarHBondContact NE-OE1 3.37Å; R340-E380 IonicContact NE-OE2 3.71Å; R340-E380 VanDerWaalsContact NH2-CD 3.31Å; R340-E380 IonicContact NH2-OE1 3.46Å; R340-E380 PolarHBondContact NH2-OE1 2.81Å; R340-E380 VanDerWaalsContact NH2-OE1 3.13Å; R340-E380 IonicContact NH2-OE2 3.3Å; R340-E380 PolarHBondContact NH2-OE2 2.78Å; V376-E380 PolarHBondContact O-N 2.88Å; L377-E380 PolarHBondContact O-N 3.34Å; L378-E380 VanDerWaalsContact C-N 3.34Å; E380-L382 VanDerWaalsContact C-N 3.28Å; E380-L382 PolarHBondContact O-N 3.01Å; E380-S383 PolarHBondContact O-N 3.09Å; E380-S383 PolarHBondContact O-OG 3.28Å; E380-N384 PolarHBondContact O-N 2.74Å; E380-N384 PolarHBondContact O-ND2 3.02Å
381	D	89.4	Confident	83.9	Confident	5 Å²	5	46.6 Å²	46.6	3%	0.027	26%	0.258	C	S	.	.	H	α-helix	trans	-56.8	-40.5	174.8	-78.5	-8.2	0	0	0	112.6	L377 L378 N384 N385 I391 S396 G398 S399	L377-D381 PolarHBondContact O-N 2.8Å; L378-D381 PolarHBondContact O-N 2.84Å; D381-N384 PolarHBondContact O-N 3.46Å; D381-N385 WeakPolarHBondContact O-CB 3.43Å; D381-N385 PolarHBondContact O-N 3.27Å; D381-N385 PolarHBondContact O-ND2 3.35Å; D381-I391 HydrophobicContact CB-CG2 4.21Å; D381-S396 WeakPolarHBondContact OD2-CB 3.39Å; D381-S396 PolarHBondContact OD2-OG 3.2Å; D381-G398 WeakPolarHBondContact OD2-CA 3.4Å; D381-G398 PolarHBondContact OD2-N 3.08Å; D381-S399 PolarHBondContact OD2-N 3.1Å
382	L	86.3	Confident	82.5	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-66.2	-44.7	177.7	-179.6	48.1	0	0	0	111.4	L378 R379 E380 N384 N385 G386 E388 I391 I499 H503	L378-L382 WeakPolarHBondContact O-CB 3.4Å; L378-L382 PolarHBondContact O-N 3.14Å; R379-L382 PolarHBondContact O-N 3.46Å; E380-L382 VanDerWaalsContact C-N 3.28Å; E380-L382 PolarHBondContact O-N 3.01Å; L382-N384 PolarHBondContact O-N 3.49Å; L382-N385 PolarHBondContact O-N 3.12Å; L382-G386 PolarHBondContact O-N 2.88Å; L382-E388 HydrophobicContact CD1-CB 4.39Å; L382-E388 HydrophobicContact CD1-CG 3.65Å; L382-E388 HydrophobicContact CD2-CG 4.46Å; L382-I391 HydrophobicContact CB-CD1 3.42Å; L382-I391 VanDerWaalsContact CB-CD1 3.42Å; L382-I391 HydrophobicContact CB-CG1 4.35Å; L382-I391 HydrophobicContact CD1-CD1 3.48Å; L382-I391 VanDerWaalsContact CD1-CD1 3.48Å; L382-I391 HydrophobicContact CD1-CG1 4.36Å; L382-I391 HydrophobicContact CD2-CD1 4.2Å; L382-I391 HydrophobicContact CG-CD1 3.81Å; L382-I499 HydrophobicContact CD2-CD1 3.75Å; L382-I499 HydrophobicContact CD2-CG2 4.27Å; L382-H503 HydrophobicContact CD2-CB 4.42Å; L382-H503 WeakPolarHBondContact CD2-CE1 3.33Å; L382-H503 VanDerWaalsContact CD2-ND1 3.32Å; L382-H503 WeakPolarHBondContact CD2-ND1 3.35Å; L382-H503 WeakPolarHBondContact CG-NE2 3.48Å
383	S	84.7	Confident	81.3	Confident	80 Å²	80	48 Å²	48	56%	0.559	26%	0.256	S	S	*	.	H	α-helix	trans	-61.6	-32.2	177.7	72.6	0	0	0	0	112.7	R379 E380	R379-S383 PolarHBondContact O-N 3.27Å; E380-S383 PolarHBondContact O-N 3.09Å; E380-S383 PolarHBondContact O-OG 3.28Å
384	N	83	Confident	80.1	Confident	112 Å²	112	49.2 Å²	49.2	60%	0.599	27%	0.266	S	S	*	.	H	α-helix	trans	-81.8	-34.7	179.5	-69.8	-28.9	0	0	0	113.5	E380 D381 L382	E380-N384 PolarHBondContact O-N 2.74Å; E380-N384 PolarHBondContact O-ND2 3.02Å; D381-N384 PolarHBondContact O-N 3.46Å; L382-N384 PolarHBondContact O-N 3.49Å
385	N	74.7	Confident	79.5	Confident	66 Å²	66	52.8 Å²	52.8	35%	0.353	28%	0.284	S	S	.	.	H	α-helix	trans	-89.5	-16.3	-173.3	-73.1	-46.3	0	0	0	114.3	D381 L382 K387	D381-N385 WeakPolarHBondContact O-CB 3.43Å; D381-N385 PolarHBondContact O-N 3.27Å; D381-N385 PolarHBondContact O-ND2 3.35Å; L382-N385 PolarHBondContact O-N 3.12Å; N385-K387 PolarHBondContact O-N 3.28Å
386	G	67	Low	79.3	Confident	69 Å²	69	52.7 Å²	52.7	71%	0.711	28%	0.284	S	S	*	.	S	Bend	trans	65.8	-15.9	178.2	0	0	0	0	0	116.3	L382	L382-G386 PolarHBondContact O-N 2.88Å
387	K	68.1	Low	79.2	Confident	142 Å²	142	51.8 Å²	51.8	62%	0.617	28%	0.279	S	S	*	.			trans	-130	122.3	177.1	-70.7	179	-177.8	171.7	0	111	N385 S389 M390	N385-K387 PolarHBondContact O-N 3.28Å; K387-S389 PolarHBondContact O-N 3.05Å; K387-M390 HydrophobicContact CB-CB 4.45Å; K387-M390 HydrophobicContact CB-CG 4.01Å; K387-M390 WeakPolarHBondContact O-CB 3.41Å; K387-M390 PolarHBondContact O-N 2.9Å
388	E	65.2	Low	79.2	Confident	60 Å²	60	51.7 Å²	51.7	28%	0.28	28%	0.278	S	S	.	.	H	α-helix	trans	-54.1	-40.9	176	-67.8	162.5	-152.9	0	0	112.9	L382 M390 I391 S507	L382-E388 HydrophobicContact CD1-CB 4.39Å; L382-E388 HydrophobicContact CD1-CG 3.65Å; L382-E388 HydrophobicContact CD2-CG 4.46Å; E388-M390 PolarHBondContact O-N 3.45Å; E388-I391 PolarHBondContact O-N 3.33Å; E388-S507 WeakPolarHBondContact OE1-CB 3.37Å; E388-S507 PolarHBondContact OE1-OG 3.17Å; E388-S507 VanDerWaalsContact OE2-CA 3.24Å; E388-S507 WeakPolarHBondContact OE2-CA 3.44Å; E388-S507 VanDerWaalsContact OE2-CB 3.24Å; E388-S507 WeakPolarHBondContact OE2-CB 3.19Å; E388-S507 PolarHBondContact OE2-OG 2.93Å
389	S	64.6	Low	79.2	Confident	74 Å²	74	51.7 Å²	51.7	52%	0.517	28%	0.278	S	S	.	.	H	α-helix	trans	-63.1	-16.8	-179	61.8	0	0	0	0	113.9	K387	K387-S389 PolarHBondContact O-N 3.05Å
390	M	66.4	Low	79.2	Confident	76 Å²	76	47.2 Å²	47.2	37%	0.374	26%	0.262	S	S	.	.	H	α-helix	trans	-93.6	-22.6	-179.3	-65	-66.8	97.3	0	0	113.5	K387 E388 F392 R393 A394	K387-M390 HydrophobicContact CB-CB 4.45Å; K387-M390 HydrophobicContact CB-CG 4.01Å; K387-M390 WeakPolarHBondContact O-CB 3.41Å; K387-M390 PolarHBondContact O-N 2.9Å; E388-M390 PolarHBondContact O-N 3.45Å; M390-F392 PolarHBondContact O-N 2.91Å; M390-R393 CarbonylContact O-C 3.51Å; M390-R393 PolarHBondContact O-N 3.33Å; M390-A394 WeakPolarHBondContact O-CB 3.2Å; M390-A394 PolarHBondContact O-N 3.48Å
391	I	67.3	Low	79.5	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-55.6	-60.9	-173.4	-64.7	165.8	0	0	0	110.5	L378 D381 L382 E388 R393 A394 S399 L511	L378-I391 HydrophobicContact CD2-CG2 4.05Å; D381-I391 HydrophobicContact CB-CG2 4.21Å; L382-I391 HydrophobicContact CB-CD1 3.42Å; L382-I391 VanDerWaalsContact CB-CD1 3.42Å; L382-I391 HydrophobicContact CB-CG1 4.35Å; L382-I391 HydrophobicContact CD1-CD1 3.48Å; L382-I391 VanDerWaalsContact CD1-CD1 3.48Å; L382-I391 HydrophobicContact CD1-CG1 4.36Å; L382-I391 HydrophobicContact CD2-CD1 4.2Å; L382-I391 HydrophobicContact CG-CD1 3.81Å; E388-I391 PolarHBondContact O-N 3.33Å; I391-R393 PolarHBondContact O-N 3.03Å; I391-R393 VanDerWaalsContact O-N 3.17Å; I391-A394 WeakPolarHBondContact O-CB 3.18Å; I391-A394 PolarHBondContact O-N 3.41Å; I391-S399 PolarHBondContact O-OG 3.44Å; I391-L511 HydrophobicContact CD1-CD1 3.7Å
392	F	68.4	Low	79.8	Confident	5 Å²	5	45.9 Å²	45.9	2%	0.022	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	13.4	179.8	-62.8	-67.6	0	0	0	114.2	L378 M390 S399 M402 L511 S514 C515 L518 R519	L378-F392 HydrophobicContact CD1-CE1 4.37Å; L378-F392 HydrophobicContact CD1-CZ 3.89Å; L378-F392 HydrophobicContact CD2-CE1 3.6Å; L378-F392 HydrophobicContact CD2-CZ 3.57Å; L378-F392 HydrophobicContact CG-CZ 4.38Å; M390-F392 PolarHBondContact O-N 2.91Å; F392-S399 WeakPolarHBondContact CD1-OG 3.19Å; F392-M402 HydrophobicContact CE1-CB 4.23Å; F392-M402 HydrophobicContact CE1-CG 4.23Å; F392-L511 HydrophobicContact CD2-CD1 4.08Å; F392-L511 HydrophobicContact CE2-CD1 3.35Å; F392-L511 HydrophobicContact CE2-CG 3.62Å; F392-L511 WeakPolarHBondContact CE2-O 3.25Å; F392-L511 HydrophobicContact CZ-CD1 4.13Å; F392-L511 HydrophobicContact CZ-CG 4.28Å; F392-S514 VanDerWaalsContact CD2-CB 3.42Å; F392-C515 WeakPolarHBondContact CE2-SG 3.46Å; F392-C515 WeakPolarHBondContact CZ-SG 3.23Å; F392-L518 HydrophobicContact CB-CD2 4.28Å; F392-R519 HydrophobicContact CB-CG 4.23Å; F392-R519 HydrophobicContact CD1-CG 4.2Å; F392-R519 HydrophobicContact CG-CG 4.49Å; F392-R519 PolarHBondContact O-NE 3.28Å; F392-R519 PolarHBondContact O-NH2 2.92Å
393	R	70.6	Confident	80.1	Confident	162 Å²	162	46.1 Å²	46.1	61%	0.611	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	-17.4	160.3	-67.3	-175	-179.5	174.5	3.5	111.8	M390 I391 L518	M390-R393 CarbonylContact O-C 3.51Å; M390-R393 PolarHBondContact O-N 3.33Å; I391-R393 PolarHBondContact O-N 3.03Å; I391-R393 VanDerWaalsContact O-N 3.17Å; R393-L518 HydrophobicContact CG-CD2 4.33Å
394	A	72.9	Confident	80.5	Confident	26 Å²	26	42.8 Å²	42.8	22%	0.215	23%	0.233	C	C	.	.	S	Bend	trans	-73.6	152.8	174.8	0	0	0	0	0	111.2	M390 I391 S396 R519	M390-A394 WeakPolarHBondContact O-CB 3.2Å; M390-A394 PolarHBondContact O-N 3.48Å; I391-A394 WeakPolarHBondContact O-CB 3.18Å; I391-A394 PolarHBondContact O-N 3.41Å; A394-S396 PolarHBondContact O-N 3.22Å; A394-R519 PolarHBondContact O-NH2 3.15Å
395	N	84	Confident	81.1	Confident	74 Å²	74	37.8 Å²	37.8	40%	0.396	21%	0.206	S	C	.	.			trans	-87.5	52.3	165.3	-70.6	-44.7	0	0	0	109.1	A348 K351	A348-N395 HydrophobicContact CB-CB 4.14Å; K351-N395 WeakPolarHBondContact CD-O 2.94Å; K351-N395 WeakPolarHBondContact CE-O 3.49Å; K351-N395 PolarHBondContact NZ-O 3.23Å
396	S	91.1	Very high	82.1	Confident	5 Å²	5	34.6 Å²	34.6	4%	0.035	19%	0.189	C	C	.	.			trans	-81.3	159	177.9	67.4	0	0	0	0	111.5	E343 D381 A394 S399 K400	E343-S396 WeakPolarHBondContact OE1-CA 3.42Å; D381-S396 WeakPolarHBondContact OD2-CB 3.39Å; D381-S396 PolarHBondContact OD2-OG 3.2Å; A394-S396 PolarHBondContact O-N 3.22Å; S396-S399 VanDerWaalsContact OG-CB 3.31Å; S396-S399 WeakPolarHBondContact OG-CB 3.39Å; S396-S399 PolarHBondContact OG-N 3.46Å; S396-S399 PolarHBondContact OG-OG 2.98Å; S396-K400 WeakPolarHBondContact O-CB 3.2Å; S396-K400 PolarHBondContact O-N 3.08Å; S396-K400 VanDerWaalsContact O-N 3.11Å
397	A	92.5	Very high	83.3	Confident	2 Å²	2	32.3 Å²	32.3	2%	0.017	16%	0.159	C	C	.	.	H	α-helix	trans	-61.5	-44	176.1	0	0	0	0	0	111.6	I339 E343 T355 L377 S399 K400 A401	I339-A397 HydrophobicContact CG2-CB 3.54Å; E343-A397 HydrophobicContact CG-CB 4.32Å; E343-A397 PolarHBondContact OE1-N 3.34Å; E343-A397 VanDerWaalsContact OE2-CB 3.29Å; E343-A397 WeakPolarHBondContact OE2-CB 3.44Å; T355-A397 HydrophobicContact CG2-CB 4.01Å; T355-A397 WeakPolarHBondContact CG2-O 3.16Å; L377-A397 HydrophobicContact CD1-CB 4.49Å; L377-A397 HydrophobicContact CD2-CB 4.42Å; A397-S399 PolarHBondContact O-N 3.34Å; A397-K400 PolarHBondContact O-N 3.05Å; A397-A401 VanDerWaalsContact O-CB 3.31Å; A397-A401 WeakPolarHBondContact O-CB 3.35Å; A397-A401 PolarHBondContact O-N 3.48Å
398	G	93.5	Very high	84.4	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.8	-43.9	178.7	0	0	0	0	0	112.9	D381 K400 A401 M402	D381-G398 WeakPolarHBondContact OD2-CA 3.4Å; D381-G398 PolarHBondContact OD2-N 3.08Å; G398-K400 VanDerWaalsContact C-N 3.28Å; G398-K400 PolarHBondContact O-N 3.04Å; G398-A401 PolarHBondContact O-N 3.46Å; G398-M402 WeakPolarHBondContact O-CB 3.27Å; G398-M402 PolarHBondContact O-N 3.25Å
399	S	92	Very high	85.7	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.007	13%	0.129	C	C	.	.	H	α-helix	trans	-60.8	-38.8	175.7	-70.1	0	0	0	0	112.6	D381 I391 F392 S396 A397 E403	D381-S399 PolarHBondContact OD2-N 3.1Å; I391-S399 PolarHBondContact O-OG 3.44Å; F392-S399 WeakPolarHBondContact CD1-OG 3.19Å; S396-S399 VanDerWaalsContact OG-CB 3.31Å; S396-S399 WeakPolarHBondContact OG-CB 3.39Å; S396-S399 PolarHBondContact OG-N 3.46Å; S396-S399 PolarHBondContact OG-OG 2.98Å; A397-S399 PolarHBondContact O-N 3.34Å; S399-E403 WeakPolarHBondContact O-CB 3.1Å; S399-E403 PolarHBondContact O-N 2.87Å; S399-E403 VanDerWaalsContact O-N 3.09Å
400	K	92.5	Very high	87.1	Confident	5 Å²	5	21.6 Å²	21.6	2%	0.022	11%	0.105	C	C	.	.	H	α-helix	trans	-78.2	-36.5	-178.3	-152.7	59.7	168.2	162.7	0	112.5	E352 S396 A397 G398 E403 C404	E352-K400 VanDerWaalsContact CA-CG 3.49Å; E352-K400 HydrophobicContact CB-CD 4.22Å; E352-K400 HydrophobicContact CB-CG 3.74Å; E352-K400 VanDerWaalsContact CD-CE 3.5Å; E352-K400 HydrophobicContact CG-CD 4.33Å; E352-K400 VanDerWaalsContact CG-CE 3.41Å; E352-K400 HydrophobicContact CG-CG 4.1Å; E352-K400 WeakPolarHBondContact OE2-CE 3.23Å; E352-K400 IonicContact OE2-NZ 3.35Å; E352-K400 PolarHBondContact OE2-NZ 3.35Å; S396-K400 WeakPolarHBondContact O-CB 3.2Å; S396-K400 PolarHBondContact O-N 3.08Å; S396-K400 VanDerWaalsContact O-N 3.11Å; A397-K400 PolarHBondContact O-N 3.05Å; G398-K400 VanDerWaalsContact C-N 3.28Å; G398-K400 PolarHBondContact O-N 3.04Å; K400-E403 IonicContact NZ-OE1 3.99Å; K400-E403 PolarHBondContact NZ-OE1 3.16Å; K400-E403 IonicContact NZ-OE2 2.77Å; K400-E403 PolarHBondContact NZ-OE2 3.25Å; K400-E403 PolarHBondContact O-N 3.14Å; K400-C404 PolarHBondContact O-N 2.95Å; K400-C404 PolarHBondContact O-SG 3.39Å
401	A	96.2	Very high	88.3	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-59.9	-47.1	170.9	0	0	0	0	0	111.1	T355 V359 F373 L374 L377 A397 G398 E403 C404 Y405	T355-A401 HydrophobicContact CG2-CB 4.09Å; V359-A401 HydrophobicContact CG2-CB 3.96Å; V359-A401 WeakPolarHBondContact CG2-O 3.37Å; F373-A401 HydrophobicContact CE1-CB 4.08Å; F373-A401 HydrophobicContact CZ-CB 4.42Å; L374-A401 HydrophobicContact CD2-CB 3.55Å; L377-A401 HydrophobicContact CD2-CB 4.03Å; A397-A401 VanDerWaalsContact O-CB 3.31Å; A397-A401 WeakPolarHBondContact O-CB 3.35Å; A397-A401 PolarHBondContact O-N 3.48Å; G398-A401 PolarHBondContact O-N 3.46Å; A401-E403 VanDerWaalsContact C-N 3.34Å; A401-E403 PolarHBondContact O-N 3.45Å; A401-C404 PolarHBondContact O-N 3.34Å; A401-Y405 PolarHBondContact O-N 3.27Å
402	M	94.8	Very high	89.4	Confident	2 Å²	2	24.2 Å²	24.2	1%	0.01	12%	0.121	C	C	.	.	H	α-helix	trans	-61.3	-41.8	177.1	-172.2	56.4	163.9	0	0	112.1	L374 L378 F392 G398 Y405 I406 V491 F492 C515	L374-M402 HydrophobicContact CD1-SD 3.86Å; L378-M402 HydrophobicContact CD1-CB 4.44Å; L378-M402 HydrophobicContact CD1-CG 4.47Å; F392-M402 HydrophobicContact CE1-CB 4.23Å; F392-M402 HydrophobicContact CE1-CG 4.23Å; G398-M402 WeakPolarHBondContact O-CB 3.27Å; G398-M402 PolarHBondContact O-N 3.25Å; M402-Y405 PolarHBondContact O-N 3.46Å; M402-I406 WeakPolarHBondContact O-CB 3.28Å; M402-I406 VanDerWaalsContact O-CG2 3.31Å; M402-I406 WeakPolarHBondContact O-CG2 3.14Å; M402-I406 PolarHBondContact O-N 3.04Å; M402-V491 HydrophobicContact CE-CG1 3.74Å; M402-V491 HydrophobicContact SD-CG1 4.01Å; M402-F492 HydrophobicContact CE-CD1 3.92Å; M402-F492 HydrophobicContact CE-CE1 3.34Å; M402-F492 HydrophobicContact CE-CZ 4.25Å; M402-C515 HydrophobicContact CE-CB 3.65Å; M402-C515 VanDerWaalsContact CE-SG 3.57Å; M402-C515 HydrophobicContact CG-CB 4.31Å
403	E	92.8	Very high	90.7	Very high	7 Å²	7	24.5 Å²	24.5	3%	0.033	12%	0.122	C	C	.	.	H	α-helix	trans	-64.1	-39.8	176	-168.3	-172.3	145.6	0	0	112.5	S399 K400 A401 K407 R519	S399-E403 WeakPolarHBondContact O-CB 3.1Å; S399-E403 PolarHBondContact O-N 2.87Å; S399-E403 VanDerWaalsContact O-N 3.09Å; K400-E403 IonicContact NZ-OE1 3.99Å; K400-E403 PolarHBondContact NZ-OE1 3.16Å; K400-E403 IonicContact NZ-OE2 2.77Å; K400-E403 PolarHBondContact NZ-OE2 3.25Å; K400-E403 PolarHBondContact O-N 3.14Å; A401-E403 VanDerWaalsContact C-N 3.34Å; A401-E403 PolarHBondContact O-N 3.45Å; E403-K407 HydrophobicContact CG-CD 4.35Å; E403-K407 WeakPolarHBondContact O-CB 3.42Å; E403-K407 WeakPolarHBondContact O-CD 3.12Å; E403-K407 VanDerWaalsContact O-CG 3.26Å; E403-K407 WeakPolarHBondContact O-CG 3.46Å; E403-K407 PolarHBondContact O-N 3.47Å; E403-K407 IonicContact OE1-NZ 3.26Å; E403-K407 PolarHBondContact OE1-NZ 3.02Å; E403-R519 IonicContact OE2-NH1 3.91Å; E403-R519 PolarHBondContact OE2-NH1 2.74Å
404	C	92.9	Very high	91.9	Very high	10 Å²	10	16.9 Å²	16.9	7%	0.068	9%	0.093	C	C	.	.	H	α-helix	trans	-64	-48.2	175.3	-66.4	0	0	0	0	110.6	V359 K400 A401 K407 L408	V359-C404 HydrophobicContact CG2-CB 4.5Å; K400-C404 PolarHBondContact O-N 2.95Å; K400-C404 PolarHBondContact O-SG 3.39Å; A401-C404 PolarHBondContact O-N 3.34Å; C404-K407 PolarHBondContact O-N 3.08Å; C404-L408 WeakPolarHBondContact O-CB 3.29Å; C404-L408 PolarHBondContact O-N 3.42Å
405	Y	96	Very high	92.9	Very high	7 Å²	7	20.2 Å²	20.2	3%	0.027	10%	0.1	C	C	.	.	H	α-helix	trans	-67.1	-46.8	-176.9	-173.4	-114.1	0	0	0	112.8	V359 E363 V370 L374 A401 M402 K407 L408 V409 E487 L488 V491	V359-Y405 HydrophobicContact CG1-CD2 3.55Å; V359-Y405 HydrophobicContact CG1-CG 4.08Å; E363-Y405 WeakPolarHBondContact OE2-CE2 3.39Å; E363-Y405 PolarHBondContact OE2-OH 2.8Å; V370-Y405 HydrophobicContact CB-CE2 4.02Å; V370-Y405 HydrophobicContact CG1-CD1 4.09Å; V370-Y405 HydrophobicContact CG1-CD2 3.68Å; V370-Y405 HydrophobicContact CG1-CE1 4Å; V370-Y405 HydrophobicContact CG1-CE2 3.54Å; V370-Y405 HydrophobicContact CG1-CG 3.89Å; V370-Y405 HydrophobicContact CG2-CE2 4.06Å; L374-Y405 HydrophobicContact CD1-CD1 3.69Å; L374-Y405 HydrophobicContact CD1-CE1 4.39Å; L374-Y405 HydrophobicContact CD1-CG 3.95Å; A401-Y405 PolarHBondContact O-N 3.27Å; M402-Y405 PolarHBondContact O-N 3.46Å; Y405-K407 PolarHBondContact O-N 3.32Å; Y405-L408 HydrophobicContact CD2-CD2 4.37Å; Y405-L408 WeakPolarHBondContact O-CB 3.49Å; Y405-L408 PolarHBondContact O-N 3.32Å; Y405-V409 HydrophobicContact CD1-CG2 4.41Å; Y405-V409 HydrophobicContact CD2-CG1 4.37Å; Y405-V409 HydrophobicContact CE1-CG2 4.14Å; Y405-V409 HydrophobicContact CE2-CG1 3.89Å; Y405-V409 WeakPolarHBondContact O-CG2 3.46Å; Y405-V409 PolarHBondContact O-N 3.34Å; Y405-V409 VanDerWaalsContact O-N 3.08Å; Y405-E487 WeakPolarHBondContact OH-CB 3.26Å; Y405-L488 HydrophobicContact CD1-CD2 3.98Å; Y405-L488 HydrophobicContact CE1-CD2 3.95Å; Y405-V491 HydrophobicContact CD1-CG2 3.99Å; Y405-V491 HydrophobicContact CE1-CB 4.48Å; Y405-V491 HydrophobicContact CE1-CG2 3.4Å
406	I	95.1	Very high	93.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.1	-32.4	-178.7	-161.3	165.8	0	0	0	112.3	M402 G410 L488 F492 L516 F520	M402-I406 WeakPolarHBondContact O-CB 3.28Å; M402-I406 VanDerWaalsContact O-CG2 3.31Å; M402-I406 WeakPolarHBondContact O-CG2 3.14Å; M402-I406 PolarHBondContact O-N 3.04Å; I406-G410 WeakPolarHBondContact O-CA 3.23Å; I406-G410 PolarHBondContact O-N 2.76Å; I406-L488 HydrophobicContact CB-CD2 4.31Å; I406-L488 HydrophobicContact CG1-CD1 3.89Å; I406-L488 HydrophobicContact CG1-CD2 3.97Å; I406-F492 HydrophobicContact CD1-CZ 4.25Å; I406-L516 HydrophobicContact CD1-CD1 4.21Å; I406-F520 HydrophobicContact CD1-CB 3.76Å; I406-F520 HydrophobicContact CD1-CD1 3.86Å; I406-F520 HydrophobicContact CD1-CG 3.9Å; I406-F520 HydrophobicContact CG1-CB 4.22Å; I406-F520 HydrophobicContact CG1-CD1 3.83Å; I406-F520 HydrophobicContact CG1-CD2 4.29Å; I406-F520 HydrophobicContact CG1-CE1 4.2Å; I406-F520 HydrophobicContact CG1-CG 3.88Å; I406-F520 HydrophobicContact CG2-CB 4.11Å; I406-F520 HydrophobicContact CG2-CD2 3.98Å; I406-F520 HydrophobicContact CG2-CG 4.12Å
407	K	91.6	Very high	93.7	Very high	21 Å²	21	22.6 Å²	22.6	9%	0.091	10%	0.104	C	C	.	.	H	α-helix	trans	-72.8	-39.3	173.3	-70.3	175.1	179.6	172.5	0	111.9	E403 C404 Y405 T411 F520 F531 L1205	E403-K407 HydrophobicContact CG-CD 4.35Å; E403-K407 WeakPolarHBondContact O-CB 3.42Å; E403-K407 WeakPolarHBondContact O-CD 3.12Å; E403-K407 VanDerWaalsContact O-CG 3.26Å; E403-K407 WeakPolarHBondContact O-CG 3.46Å; E403-K407 PolarHBondContact O-N 3.47Å; E403-K407 IonicContact OE1-NZ 3.26Å; E403-K407 PolarHBondContact OE1-NZ 3.02Å; C404-K407 PolarHBondContact O-N 3.08Å; Y405-K407 PolarHBondContact O-N 3.32Å; K407-T411 PolarHBondContact O-OG1 3.35Å; K407-F520 HydrophobicContact CG-CD2 4.17Å; K407-F520 HydrophobicContact CG-CE2 4.11Å; K407-F531 HydrophobicContact CG-CE1 4.49Å; K407-L1205 HydrophobicContact CB-CD2 4.34Å; K407-L1205 HydrophobicContact CD-CD2 3.35Å; K407-L1205 HydrophobicContact CG-CD2 4.47Å
408	L	91.7	Very high	93.9	Very high	46 Å²	46	22.6 Å²	22.6	24%	0.241	10%	0.104	C	C	.	.	H	α-helix	trans	-59	-46.9	178.9	178	65	0	0	0	112.1	V359 C404 Y405 C607 I611	V359-L408 HydrophobicContact CG1-CD2 4.33Å; C404-L408 WeakPolarHBondContact O-CB 3.29Å; C404-L408 PolarHBondContact O-N 3.42Å; Y405-L408 HydrophobicContact CD2-CD2 4.37Å; Y405-L408 WeakPolarHBondContact O-CB 3.49Å; Y405-L408 PolarHBondContact O-N 3.32Å; L408-C607 HydrophobicContact CD1-CB 4.13Å; L408-C607 HydrophobicContact CD2-CB 4.48Å; L408-C607 HydrophobicContact CG-CB 3.92Å; L408-I611 HydrophobicContact CD2-CD1 4.15Å
409	V	93.3	Very high	94	Very high	5 Å²	5	22.9 Å²	22.9	3%	0.03	11%	0.107	C	C	.	.	H	α-helix	trans	-100.7	-23.2	-175.3	-56.3	0	0	0	0	113.9	Y405 P485 E487 L488 C607	Y405-V409 HydrophobicContact CD1-CG2 4.41Å; Y405-V409 HydrophobicContact CD2-CG1 4.37Å; Y405-V409 HydrophobicContact CE1-CG2 4.14Å; Y405-V409 HydrophobicContact CE2-CG1 3.89Å; Y405-V409 WeakPolarHBondContact O-CG2 3.46Å; Y405-V409 PolarHBondContact O-N 3.34Å; Y405-V409 VanDerWaalsContact O-N 3.08Å; V409-P485 WeakPolarHBondContact O-CG 3.19Å; V409-E487 HydrophobicContact CB-CB 4.48Å; V409-E487 HydrophobicContact CG1-CB 4.32Å; V409-E487 HydrophobicContact CG2-CB 4.45Å; V409-L488 HydrophobicContact CG2-CD1 4.06Å; V409-L488 HydrophobicContact CG2-CD2 3.35Å; V409-L488 HydrophobicContact CG2-CG 3.45Å; V409-L488 VanDerWaalsContact CG2-CG 3.45Å; V409-C607 HydrophobicContact CG1-CB 4.03Å
410	G	93.8	Very high	94.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-91	-7.8	-171.8	0	0	0	0	0	115.3	I406 D412 Y413 L414 F520	I406-G410 WeakPolarHBondContact O-CA 3.23Å; I406-G410 PolarHBondContact O-N 2.76Å; G410-D412 PolarHBondContact O-N 2.85Å; G410-Y413 WeakPolarHBondContact O-CB 3.08Å; G410-Y413 PolarHBondContact O-N 2.8Å; G410-L414 WeakPolarHBondContact O-CB 3.34Å; G410-L414 PolarHBondContact O-N 3.24Å; G410-F520 WeakPolarHBondContact O-CZ 3.34Å
411	T	91.4	Very high	94.2	Very high	23 Å²	23	25.4 Å²	25.4	14%	0.141	12%	0.124	C	C	.	.	H	α-helix	trans	-61.1	-40.8	-169.2	-68.1	0	0	0	0	113.2	K407 L414 R415 L1202	K407-T411 PolarHBondContact O-OG1 3.35Å; T411-L414 WeakPolarHBondContact O-CB 3.44Å; T411-L414 PolarHBondContact O-N 3.05Å; T411-R415 PolarHBondContact O-N 2.95Å; T411-L1202 HydrophobicContact CG2-CD2 3.87Å
412	D	90.9	Very high	94.1	Very high	108 Å²	108	25.5 Å²	25.5	58%	0.578	12%	0.124	S	C	*	.	H	α-helix	trans	-71.8	-38.3	-179.8	-67.9	-35.7	0	0	0	112.3	G410 L414 R415 Y416	G410-D412 PolarHBondContact O-N 2.85Å; D412-L414 VanDerWaalsContact C-N 3.35Å; D412-R415 PolarHBondContact O-N 2.82Å; D412-R415 IonicContact OD1-CZ 3.13Å; D412-R415 IonicContact OD1-NH1 3.78Å; D412-R415 PolarHBondContact OD1-NH1 2.91Å; D412-Y416 WeakPolarHBondContact O-CB 3.48Å; D412-Y416 PolarHBondContact O-N 2.96Å
413	Y	94.7	Very high	94.1	Very high	10 Å²	10	29.9 Å²	29.9	4%	0.039	15%	0.148	C	C	.	.	H	α-helix	trans	-58.3	-47	169.9	168.1	-102	0	0	0	111.4	G410 R415 Y416 V417 S480 K483 L484	G410-Y413 WeakPolarHBondContact O-CB 3.08Å; G410-Y413 PolarHBondContact O-N 2.8Å; Y413-R415 VanDerWaalsContact C-N 3.34Å; Y413-R415 PolarHBondContact O-N 2.87Å; Y413-Y416 WeakPolarHBondContact O-CB 3.36Å; Y413-Y416 PolarHBondContact O-N 3.15Å; Y413-Y416 VanDerWaalsContact O-N 3.17Å; Y413-V417 HydrophobicContact CD2-CG2 3.99Å; Y413-V417 HydrophobicContact CE1-CG2 4.19Å; Y413-V417 HydrophobicContact CE2-CG2 3.5Å; Y413-V417 WeakPolarHBondContact O-CG2 3.32Å; Y413-V417 PolarHBondContact O-N 2.87Å; Y413-S480 WeakPolarHBondContact CE2-OG 3.23Å; Y413-S480 PolarHBondContact OH-OG 3.27Å; Y413-K483 HydrophobicContact CD2-CB 4.23Å; Y413-K483 WeakPolarHBondContact CD2-O 3.46Å; Y413-K483 HydrophobicContact CE2-CB 4.41Å; Y413-L484 HydrophobicContact CD1-CD1 3.85Å; Y413-L484 HydrophobicContact CD2-CD1 4.49Å; Y413-L484 HydrophobicContact CE1-CD1 3.57Å; Y413-L484 HydrophobicContact CE2-CB 4.34Å; Y413-L484 HydrophobicContact CE2-CD1 4.24Å; Y413-L484 HydrophobicContact CG-CD1 4.31Å
414	L	95.3	Very high	94.1	Very high	2 Å²	2	34 Å²	34	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-59.5	-44.4	178.5	-171.6	74.6	0	0	0	111.8	G410 T411 D412 Y416 V417 L418 F520 I521 A524 F531 L533	G410-L414 WeakPolarHBondContact O-CB 3.34Å; G410-L414 PolarHBondContact O-N 3.24Å; T411-L414 WeakPolarHBondContact O-CB 3.44Å; T411-L414 PolarHBondContact O-N 3.05Å; D412-L414 VanDerWaalsContact C-N 3.35Å; L414-Y416 VanDerWaalsContact C-N 3.35Å; L414-V417 PolarHBondContact O-N 2.76Å; L414-L418 HydrophobicContact CD1-CD1 3.51Å; L414-L418 HydrophobicContact CD1-CG 4.26Å; L414-L418 HydrophobicContact CG-CD1 4.14Å; L414-L418 WeakPolarHBondContact O-CB 3.23Å; L414-L418 PolarHBondContact O-N 2.9Å; L414-F520 HydrophobicContact CB-CE1 3.92Å; L414-F520 HydrophobicContact CB-CE2 4.47Å; L414-F520 HydrophobicContact CB-CZ 3.62Å; L414-F520 HydrophobicContact CD1-CD1 4.13Å; L414-F520 HydrophobicContact CD1-CE1 3.83Å; L414-F520 HydrophobicContact CD1-CE2 4.49Å; L414-F520 HydrophobicContact CD1-CZ 4.02Å; L414-F520 HydrophobicContact CD2-CD2 4.49Å; L414-F520 HydrophobicContact CD2-CE1 4.46Å; L414-F520 HydrophobicContact CD2-CE2 3.81Å; L414-F520 HydrophobicContact CD2-CZ 3.79Å; L414-F520 HydrophobicContact CG-CE1 4.29Å; L414-F520 HydrophobicContact CG-CE2 4.5Å; L414-F520 HydrophobicContact CG-CZ 4.03Å; L414-I521 HydrophobicContact CD1-CG1 4.35Å; L414-A524 HydrophobicContact CD1-CB 3.94Å; L414-A524 HydrophobicContact CD2-CB 3.73Å; L414-A524 HydrophobicContact CG-CB 4.23Å; L414-F531 HydrophobicContact CD2-CB 3.86Å; L414-F531 HydrophobicContact CD2-CD1 3.62Å; L414-F531 HydrophobicContact CD2-CG 4.11Å; L414-L533 HydrophobicContact CD2-CD1 4.46Å; L414-L533 HydrophobicContact CG-CD1 4.44Å
415	R	94.5	Very high	94.1	Very high	96 Å²	96	33.9 Å²	33.9	36%	0.362	17%	0.166	S	C	.	.	H	α-helix	trans	-64	-40.1	176.4	-168.6	-178.2	-61.8	108.4	2.9	111.8	T411 D412 Y413 G419 L533	T411-R415 PolarHBondContact O-N 2.95Å; D412-R415 PolarHBondContact O-N 2.82Å; D412-R415 IonicContact OD1-CZ 3.13Å; D412-R415 IonicContact OD1-NH1 3.78Å; D412-R415 PolarHBondContact OD1-NH1 2.91Å; Y413-R415 VanDerWaalsContact C-N 3.34Å; Y413-R415 PolarHBondContact O-N 2.87Å; R415-G419 VanDerWaalsContact O-CA 3.25Å; R415-G419 WeakPolarHBondContact O-CA 3.25Å; R415-G419 PolarHBondContact O-N 3.32Å; R415-L533 HydrophobicContact CB-CD2 4.25Å; R415-L533 HydrophobicContact CG-CD2 4.38Å
416	Y	95	Very high	93.7	Very high	126 Å²	126	35.9 Å²	35.9	49%	0.494	18%	0.177	S	C	.	.	H	α-helix	trans	-62.8	-45.2	176.4	169.2	-99.2	0	0	0	112.4	D412 Y413 L414 R476 K483	D412-Y416 WeakPolarHBondContact O-CB 3.48Å; D412-Y416 PolarHBondContact O-N 2.96Å; Y413-Y416 WeakPolarHBondContact O-CB 3.36Å; Y413-Y416 PolarHBondContact O-N 3.15Å; Y413-Y416 VanDerWaalsContact O-N 3.17Å; L414-Y416 VanDerWaalsContact C-N 3.35Å; Y416-R476 PolarHBondContact O-NH2 2.79Å; Y416-K483 HydrophobicContact CE1-CB 4.31Å; Y416-K483 HydrophobicContact CE1-CG 4.03Å
417	V	96.7	Very high	93.4	Very high	4 Å²	4	42 Å²	42	2%	0.024	21%	0.214	C	C	.	.	H	α-helix	trans	-74.1	-52.2	-177.4	177.2	0	0	0	0	111.2	Y413 L414 R476 I477 S480	Y413-V417 HydrophobicContact CD2-CG2 3.99Å; Y413-V417 HydrophobicContact CE1-CG2 4.19Å; Y413-V417 HydrophobicContact CE2-CG2 3.5Å; Y413-V417 WeakPolarHBondContact O-CG2 3.32Å; Y413-V417 PolarHBondContact O-N 2.87Å; L414-V417 PolarHBondContact O-N 2.76Å; V417-R476 HydrophobicContact CG1-CB 4.31Å; V417-R476 PolarHBondContact O-NE 2.89Å; V417-I477 HydrophobicContact CG1-CG1 3.66Å; V417-S480 WeakPolarHBondContact CG2-OG 3.32Å
418	L	97.3	Very high	93	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-96.3	-29.6	-168.8	-60.5	-178.3	0	0	0	114.2	L414 V421 I422 I473 I521 A524 I525 L533	L414-L418 HydrophobicContact CD1-CD1 3.51Å; L414-L418 HydrophobicContact CD1-CG 4.26Å; L414-L418 HydrophobicContact CG-CD1 4.14Å; L414-L418 WeakPolarHBondContact O-CB 3.23Å; L414-L418 PolarHBondContact O-N 2.9Å; L418-V421 PolarHBondContact O-N 2.82Å; L418-I422 HydrophobicContact CB-CG1 4.25Å; L418-I422 WeakPolarHBondContact O-CG1 3.37Å; L418-I422 PolarHBondContact O-N 3.46Å; L418-I473 HydrophobicContact CD2-CG2 3.96Å; L418-I521 HydrophobicContact CD1-CG2 4.34Å; L418-A524 HydrophobicContact CD1-CB 4.03Å; L418-I525 HydrophobicContact CD1-CG1 3.85Å; L418-I525 HydrophobicContact CD2-CD1 4.17Å; L418-I525 HydrophobicContact CD2-CG1 4.09Å; L418-L533 HydrophobicContact CB-CD1 3.9Å; L418-L533 HydrophobicContact CD1-CD1 4.01Å
419	G	95.2	Very high	92.3	Very high	6 Å²	6	44.2 Å²	44.2	6%	0.062	24%	0.241	C	C	.	.	H	α-helix	trans	-50	-56.9	-172.4	0	0	0	0	0	113.7	R415 V421 I422 D423	R415-G419 VanDerWaalsContact O-CA 3.25Å; R415-G419 WeakPolarHBondContact O-CA 3.25Å; R415-G419 PolarHBondContact O-N 3.32Å; G419-V421 VanDerWaalsContact C-N 3.26Å; G419-V421 PolarHBondContact O-N 3.18Å; G419-I422 PolarHBondContact O-N 3.37Å; G419-D423 PolarHBondContact O-N 3.28Å
420	P	94.9	Very high	92.1	Very high	56 Å²	56	47.1 Å²	47.1	36%	0.364	26%	0.257	S	S	.	.	H	α-helix	trans	-59.7	-32.6	179.8	-25.8	35.1	0	0	0	114.4	Q424	P420-Q424 VanDerWaalsContact O-CG 3.26Å; P420-Q424 WeakPolarHBondContact O-CG 3.45Å; P420-Q424 PolarHBondContact O-N 3.08Å; P420-Q424 PolarHBondContact O-NE2 3.48Å
421	V	94.2	Very high	92	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.018	26%	0.262	C	S	.	.	H	α-helix	trans	-79.6	-40.5	-178.8	-174	0	0	0	0	110.7	L418 G419 Q424 L425 M472 I473 R476	L418-V421 PolarHBondContact O-N 2.82Å; G419-V421 VanDerWaalsContact C-N 3.26Å; G419-V421 PolarHBondContact O-N 3.18Å; V421-Q424 PolarHBondContact O-N 3.48Å; V421-L425 HydrophobicContact CG1-CD1 4.04Å; V421-L425 HydrophobicContact CG1-CG 4.38Å; V421-L425 WeakPolarHBondContact O-CB 3.26Å; V421-L425 VanDerWaalsContact O-CG 3.3Å; V421-L425 WeakPolarHBondContact O-CG 3.5Å; V421-L425 PolarHBondContact O-N 2.91Å; V421-M472 HydrophobicContact CG1-SD 4.41Å; V421-M472 HydrophobicContact CG2-SD 4.39Å; V421-I473 HydrophobicContact CB-CG1 4.32Å; V421-I473 HydrophobicContact CG1-CD1 3.97Å; V421-I473 HydrophobicContact CG1-CG1 3.63Å; V421-R476 VanDerWaalsContact CG2-CD 3.49Å
422	I	94.6	Very high	92.1	Very high	1 Å²	1	47 Å²	47	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-62.4	-44.8	174.2	-64.9	-63.9	0	0	0	110.1	L418 G419 Q424 L425 L426 P528 L533 L547	L418-I422 HydrophobicContact CB-CG1 4.25Å; L418-I422 WeakPolarHBondContact O-CG1 3.37Å; L418-I422 PolarHBondContact O-N 3.46Å; G419-I422 PolarHBondContact O-N 3.37Å; I422-Q424 VanDerWaalsContact C-N 3.26Å; I422-Q424 PolarHBondContact O-N 3.29Å; I422-L425 HydrophobicContact CD1-CD1 4.47Å; I422-L425 PolarHBondContact O-N 3.19Å; I422-L425 VanDerWaalsContact O-N 3.12Å; I422-L426 HydrophobicContact CG2-CD1 4.02Å; I422-L426 HydrophobicContact CG2-CG 4.2Å; I422-L426 VanDerWaalsContact O-CG 3.26Å; I422-L426 WeakPolarHBondContact O-CG 3.32Å; I422-L426 PolarHBondContact O-N 2.79Å; I422-P528 HydrophobicContact CG2-CB 3.84Å; I422-P528 HydrophobicContact CG2-CG 4.36Å; I422-L533 HydrophobicContact CG1-CD1 4.33Å; I422-L533 HydrophobicContact CG2-CB 4.39Å; I422-L547 HydrophobicContact CD1-CD2 3.77Å
423	D	93.7	Very high	92.3	Very high	95 Å²	95	42.4 Å²	42.4	51%	0.508	23%	0.23	S	C	.	.	H	α-helix	trans	-56.8	-40.8	175.9	-76.1	-25.1	0	0	0	112.1	G419 V427	G419-D423 PolarHBondContact O-N 3.28Å; D423-V427 WeakPolarHBondContact O-CG2 3.41Å
424	Q	93.5	Very high	92.2	Very high	93 Å²	93	42.5 Å²	42.5	44%	0.435	23%	0.231	S	C	.	.	H	α-helix	trans	-65.7	-48.2	174.5	-72.4	172.3	38	0	0	111.7	P420 V421 I422 L426 V427 I428	P420-Q424 VanDerWaalsContact O-CG 3.26Å; P420-Q424 WeakPolarHBondContact O-CG 3.45Å; P420-Q424 PolarHBondContact O-N 3.08Å; P420-Q424 PolarHBondContact O-NE2 3.48Å; V421-Q424 PolarHBondContact O-N 3.48Å; I422-Q424 VanDerWaalsContact C-N 3.26Å; I422-Q424 PolarHBondContact O-N 3.29Å; Q424-L426 VanDerWaalsContact C-N 3.25Å; Q424-L426 PolarHBondContact O-N 2.87Å; Q424-V427 PolarHBondContact O-N 2.83Å; Q424-I428 HydrophobicContact CB-CD1 4.06Å; Q424-I428 WeakPolarHBondContact O-CB 3.16Å; Q424-I428 WeakPolarHBondContact O-CD1 3.28Å; Q424-I428 WeakPolarHBondContact O-CG1 3.47Å; Q424-I428 PolarHBondContact O-N 3.44Å
425	L	92.5	Very high	92	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.037	24%	0.238	C	C	.	.	H	α-helix	trans	-63.1	-28.8	-179.4	-73.1	171.2	0	0	0	113.5	V421 I422 V427 F432 N469 I473 L547 I550	V421-L425 HydrophobicContact CG1-CD1 4.04Å; V421-L425 HydrophobicContact CG1-CG 4.38Å; V421-L425 WeakPolarHBondContact O-CB 3.26Å; V421-L425 VanDerWaalsContact O-CG 3.3Å; V421-L425 WeakPolarHBondContact O-CG 3.5Å; V421-L425 PolarHBondContact O-N 2.91Å; I422-L425 HydrophobicContact CD1-CD1 4.47Å; I422-L425 PolarHBondContact O-N 3.19Å; I422-L425 VanDerWaalsContact O-N 3.12Å; L425-V427 VanDerWaalsContact C-N 3.28Å; L425-F432 HydrophobicContact CD2-CE2 3.79Å; L425-F432 HydrophobicContact CD2-CZ 3.86Å; L425-N469 HydrophobicContact CD2-CB 4.4Å; L425-N469 WeakPolarHBondContact CD2-OD1 3.41Å; L425-I473 HydrophobicContact CD1-CD1 4.45Å; L425-L547 HydrophobicContact CB-CD2 4.44Å; L425-L547 HydrophobicContact CD1-CD2 3.97Å; L425-I550 HydrophobicContact CD1-CD1 3.57Å; L425-I550 HydrophobicContact CD2-CD1 4.02Å; L425-I550 HydrophobicContact CG-CD1 4.47Å
426	L	88.3	Confident	91.6	Very high	50 Å²	50	42 Å²	42	26%	0.262	24%	0.239	S	C	.	.	H	α-helix	trans	-73.1	-20.7	175.1	-68.2	177.3	0	0	0	113	I422 Q424 A534 P538 I543	I422-L426 HydrophobicContact CG2-CD1 4.02Å; I422-L426 HydrophobicContact CG2-CG 4.2Å; I422-L426 VanDerWaalsContact O-CG 3.26Å; I422-L426 WeakPolarHBondContact O-CG 3.32Å; I422-L426 PolarHBondContact O-N 2.79Å; Q424-L426 VanDerWaalsContact C-N 3.25Å; Q424-L426 PolarHBondContact O-N 2.87Å; L426-A534 HydrophobicContact CD1-CB 3.92Å; L426-P538 HydrophobicContact CD2-CB 4.39Å; L426-P538 HydrophobicContact CD2-CG 3.84Å; L426-I543 HydrophobicContact CD2-CG2 3.83Å; L426-I543 WeakPolarHBondContact O-CD1 3.44Å
427	V	88.7	Confident	91.2	Very high	128 Å²	128	40.3 Å²	40.3	78%	0.776	25%	0.246	S	C	*	.	H	α-helix	trans	-99.1	-34.2	178.8	178.5	0	0	0	0	111.4	D423 Q424 L425 G429	D423-V427 WeakPolarHBondContact O-CG2 3.41Å; Q424-V427 PolarHBondContact O-N 2.83Å; L425-V427 VanDerWaalsContact C-N 3.28Å; V427-G429 PolarHBondContact O-N 3.22Å
428	I	82.9	Confident	90.5	Very high	51 Å²	51	47.1 Å²	47.1	26%	0.262	27%	0.271	S	S	.	.			trans	-64.9	125.2	179.9	-69.8	163.1	0	0	0	109.8	Q424 D430	Q424-I428 HydrophobicContact CB-CD1 4.06Å; Q424-I428 WeakPolarHBondContact O-CB 3.16Å; Q424-I428 WeakPolarHBondContact O-CD1 3.28Å; Q424-I428 WeakPolarHBondContact O-CG1 3.47Å; Q424-I428 PolarHBondContact O-N 3.44Å; I428-D430 VanDerWaalsContact C-N 3.33Å; I428-D430 HydrophobicContact CG2-CB 3.64Å; I428-D430 WeakPolarHBondContact CG2-OD2 3.42Å
429	G	77.9	Confident	89.7	Confident	63 Å²	63	49.7 Å²	49.7	65%	0.649	28%	0.284	S	S	*	.			trans	-89.7	9.8	179	0	0	0	0	0	114.7	V427	V427-G429 PolarHBondContact O-N 3.22Å
430	D	87.6	Confident	88.1	Confident	66 Å²	66	51.6 Å²	51.6	35%	0.353	30%	0.304	S	S	.	.			trans	-65.5	158.5	-179.2	-71.4	-33.8	0	0	0	112.2	I428 F432 R461 N546	I428-D430 VanDerWaalsContact C-N 3.33Å; I428-D430 HydrophobicContact CG2-CB 3.64Å; I428-D430 WeakPolarHBondContact CG2-OD2 3.42Å; D430-F432 HydrophobicContact CB-CE1 3.86Å; D430-R461 IonicContact OD1-NH1 3.49Å; D430-N546 PolarHBondContact O-ND2 2.71Å
431	D	91.4	Very high	85.9	Confident	21 Å²	21	53.6 Å²	53.6	11%	0.112	33%	0.325	C	S	.	.			trans	-109.9	132.7	175.9	-159	-11.4	0	0	0	109	E433 N462 R542	D431-E433 WeakPolarHBondContact OD1-CB 3.41Å; D431-E433 PolarHBondContact OD1-N 2.77Å; D431-E433 VanDerWaalsContact OD1-N 3.09Å; D431-N462 WeakPolarHBondContact O-CA 3.49Å; D431-N462 WeakPolarHBondContact O-CB 3.43Å; D431-N462 PolarHBondContact O-OD1 3.46Å; D431-N462 VanDerWaalsContact O-OD1 3.08Å; D431-R542 VanDerWaalsContact CB-NH1 3.29Å; D431-R542 IonicContact OD2-CZ 3.72Å; D431-R542 IonicContact OD2-NH1 2.95Å; D431-R542 PolarHBondContact OD2-NH1 3.13Å
432	F	94.9	Very high	83.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	36%	0.36	C	S	.	.			trans	-108.7	5	176.4	-58.6	-17	0	0	0	112.1	L425 D430 I434 A465 L466 N469 N546 L549 I550	L425-F432 HydrophobicContact CD2-CE2 3.79Å; L425-F432 HydrophobicContact CD2-CZ 3.86Å; D430-F432 HydrophobicContact CB-CE1 3.86Å; F432-I434 WeakPolarHBondContact O-CG2 3.43Å; F432-I434 PolarHBondContact O-N 2.98Å; F432-A465 HydrophobicContact CD1-CB 3.86Å; F432-A465 HydrophobicContact CE1-CB 3.75Å; F432-L466 HydrophobicContact CB-CB 4.04Å; F432-L466 HydrophobicContact CB-CD1 4.15Å; F432-L466 HydrophobicContact CD2-CD1 4.07Å; F432-L466 HydrophobicContact CG-CB 4.19Å; F432-L466 HydrophobicContact CG-CD1 4.29Å; F432-N469 HydrophobicContact CE2-CB 4.4Å; F432-N469 HydrophobicContact CZ-CB 4.37Å; F432-N469 VanDerWaalsContact CZ-ND2 3.28Å; F432-N469 WeakPolarHBondContact CZ-ND2 3.44Å; F432-N546 HydrophobicContact CB-CB 4.38Å; F432-N546 WeakPolarHBondContact CB-OD1 3.2Å; F432-N546 HydrophobicContact CD2-CB 3.39Å; F432-N546 VanDerWaalsContact CD2-CG 3.48Å; F432-N546 HydrophobicContact CE2-CB 3.76Å; F432-N546 HydrophobicContact CG-CB 4.06Å; F432-N546 PolarHBondContact N-OD1 3.06Å; F432-L549 HydrophobicContact CB-CD1 4.1Å; F432-L549 WeakPolarHBondContact O-CD1 3.35Å; F432-I550 HydrophobicContact CD2-CD1 4.13Å; F432-I550 HydrophobicContact CD2-CG1 4.23Å; F432-I550 HydrophobicContact CE2-CD1 3.7Å; F432-I550 HydrophobicContact CE2-CG1 4.27Å
433	E	94.5	Very high	81	Confident	11 Å²	11	65.9 Å²	65.9	5%	0.051	40%	0.399	C	S	.	.			trans	-63.3	123.2	179.7	-171.8	59.6	-96.4	0	0	111.3	D431 D435 R438 L439 N462 R545	D431-E433 WeakPolarHBondContact OD1-CB 3.41Å; D431-E433 PolarHBondContact OD1-N 2.77Å; D431-E433 VanDerWaalsContact OD1-N 3.09Å; E433-D435 VanDerWaalsContact OE1-CB 3.31Å; E433-D435 WeakPolarHBondContact OE1-CB 3.47Å; E433-D435 PolarHBondContact OE1-N 3.11Å; E433-R438 VanDerWaalsContact CD-CD 3.5Å; E433-R438 HydrophobicContact CG-CB 3.75Å; E433-R438 WeakPolarHBondContact OE2-CD 3.49Å; E433-R438 IonicContact OE2-NH1 2.75Å; E433-L439 HydrophobicContact CB-CD2 3.99Å; E433-L439 HydrophobicContact CB-CG 4.42Å; E433-L439 HydrophobicContact CG-CD2 4.12Å; E433-L439 HydrophobicContact CG-CG 4.1Å; E433-N462 WeakPolarHBondContact O-CB 3.44Å; E433-N462 PolarHBondContact O-ND2 2.93Å; E433-R545 IonicContact OE1-CZ 3.21Å; E433-R545 IonicContact OE1-NE 3.48Å; E433-R545 IonicContact OE1-NH2 2.59Å; E433-R545 PolarHBondContact OE1-NH2 3.12Å; E433-R545 IonicContact OE2-CZ 2.92Å; E433-R545 IonicContact OE2-NE 3.41Å; E433-R545 PolarHBondContact OE2-NE 3.29Å; E433-R545 IonicContact OE2-NH2 2.79Å; E433-R545 PolarHBondContact OE2-NH2 3.17Å
434	I	93	Very high	78.8	Confident	11 Å²	11	67.3 Å²	67.3	6%	0.056	41%	0.407	C	S	.	.			trans	-119.2	1.7	178.5	68	175.4	0	0	0	112.5	F432 P436 L459 N462 R463 L466 H569 M570 L573	F432-I434 WeakPolarHBondContact O-CG2 3.43Å; F432-I434 PolarHBondContact O-N 2.98Å; I434-P436 WeakPolarHBondContact O-CD 3.39Å; I434-L459 VanDerWaalsContact C-CD2 3.48Å; I434-L459 HydrophobicContact CB-CD2 4.47Å; I434-L459 WeakPolarHBondContact O-CD2 2.94Å; I434-N462 HydrophobicContact CG2-CB 4.3Å; I434-R463 HydrophobicContact CG2-CB 3.95Å; I434-L466 HydrophobicContact CD1-CD2 4.29Å; I434-H569 WeakPolarHBondContact CD1-O 3.41Å; I434-M570 HydrophobicContact CD1-CE 3.38Å; I434-M570 HydrophobicContact CD1-SD 3.75Å; I434-M570 HydrophobicContact CG1-CE 3.24Å; I434-M570 HydrophobicContact CG1-SD 4.29Å; I434-L573 HydrophobicContact CD1-CD1 3.78Å; I434-L573 HydrophobicContact CD1-CD2 4.12Å; I434-L573 HydrophobicContact CD1-CG 4.05Å
435	D	90.8	Very high	76.7	Confident	30 Å²	30	68.2 Å²	68.2	16%	0.16	42%	0.424	C	S	.	.			trans	-81.3	114.2	168.7	-174.4	-15	0	0	0	109.8	E433 S437 R438	E433-D435 VanDerWaalsContact OE1-CB 3.31Å; E433-D435 WeakPolarHBondContact OE1-CB 3.47Å; E433-D435 PolarHBondContact OE1-N 3.11Å; D435-S437 PolarHBondContact O-N 3.45Å; D435-S437 VanDerWaalsContact O-N 3.17Å; D435-S437 WeakPolarHBondContact OD1-CB 3.16Å; D435-S437 PolarHBondContact OD1-N 3.09Å; D435-S437 PolarHBondContact OD1-OG 3.21Å; D435-S437 PolarHBondContact OD2-OG 2.76Å; D435-S437 VanDerWaalsContact OD2-OG 3.11Å; D435-R438 HydrophobicContact CB-CB 4.29Å; D435-R438 HydrophobicContact CB-CG 4.09Å; D435-R438 PolarHBondContact O-N 3.48Å; D435-R438 VanDerWaalsContact O-N 3.1Å
436	P	86.9	Confident	74.6	Confident	59 Å²	59	73.4 Å²	73.4	38%	0.383	46%	0.46	S	S	.	.	H	α-helix	trans	-57.5	-32	179.9	-20.6	30.9	0	0	0	113	I434 R438 L439 L455 L459	I434-P436 WeakPolarHBondContact O-CD 3.39Å; P436-R438 PolarHBondContact O-N 3.36Å; P436-L439 PolarHBondContact O-N 3.09Å; P436-L455 HydrophobicContact CB-CD2 4.17Å; P436-L459 HydrophobicContact CB-CD1 4.16Å; P436-L459 HydrophobicContact CG-CD1 3.83Å
437	S	85.4	Confident	72.8	Confident	90 Å²	90	74.1 Å²	74.1	63%	0.629	47%	0.467	S	S	*	.	H	α-helix	trans	-68.4	-24.2	-178	70.8	0	0	0	0	112.9	D435	D435-S437 PolarHBondContact O-N 3.45Å; D435-S437 VanDerWaalsContact O-N 3.17Å; D435-S437 WeakPolarHBondContact OD1-CB 3.16Å; D435-S437 PolarHBondContact OD1-N 3.09Å; D435-S437 PolarHBondContact OD1-OG 3.21Å; D435-S437 PolarHBondContact OD2-OG 2.76Å; D435-S437 VanDerWaalsContact OD2-OG 3.11Å
438	R	83.4	Confident	71.1	Confident	147 Å²	147	71.1 Å²	71.1	56%	0.555	46%	0.455	S	S	*	.	H	α-helix	trans	-88.9	-18	-178.2	-68.9	-175.2	165.6	-146.4	-4.6	113.8	E433 D435 P436	E433-R438 VanDerWaalsContact CD-CD 3.5Å; E433-R438 HydrophobicContact CG-CB 3.75Å; E433-R438 WeakPolarHBondContact OE2-CD 3.49Å; E433-R438 IonicContact OE2-NH1 2.75Å; D435-R438 HydrophobicContact CB-CB 4.29Å; D435-R438 HydrophobicContact CB-CG 4.09Å; D435-R438 PolarHBondContact O-N 3.48Å; D435-R438 VanDerWaalsContact O-N 3.1Å; P436-R438 PolarHBondContact O-N 3.36Å
439	L	80.6	Confident	69.8	Low	55 Å²	55	73.3 Å²	73.3	29%	0.288	48%	0.475	S	S	.	.	H	α-helix	trans	-87.3	-12.2	178.3	-68.7	174.6	0	0	0	113.2	E433 P436 L455 I458 L459	E433-L439 HydrophobicContact CB-CD2 3.99Å; E433-L439 HydrophobicContact CB-CG 4.42Å; E433-L439 HydrophobicContact CG-CD2 4.12Å; E433-L439 HydrophobicContact CG-CG 4.1Å; P436-L439 PolarHBondContact O-N 3.09Å; L439-L455 HydrophobicContact CB-CD1 3.74Å; L439-L455 HydrophobicContact CD1-CD1 3.72Å; L439-L455 HydrophobicContact CG-CD1 4.4Å; L439-I458 HydrophobicContact CD1-CG2 4.1Å; L439-L459 HydrophobicContact CD1-CD2 3.44Å; L439-L459 VanDerWaalsContact CD1-CD2 3.44Å; L439-L459 HydrophobicContact CD1-CG 3.93Å
440	G	60.3	Low	69.1	Low	47 Å²	47	75.8 Å²	75.8	49%	0.485	47%	0.473	S	S	.	.			trans	-123.4	25.4	-157.3	0	0	0	0	0	119.3	S442	G440-S442 PolarHBondContact O-N 3.37Å
441	A	49.1	Very low	68.2	Low	97 Å²	97	76.7 Å²	76.7	80%	0.802	48%	0.478	S	S	*	.			trans	-74.3	42.9	178.2	0	0	0	0	0	115.2
442	S	45.5	Very low	67.6	Low	107 Å²	107	84.8 Å²	84.8	75%	0.748	51%	0.507	S	S	*	.			trans	-117.1	107.8	165.8	-82.4	0	0	0	0	109.5	G440 D444	G440-S442 PolarHBondContact O-N 3.37Å; S442-D444 PolarHBondContact O-N 3.37Å
443	N	40.5	Very low	66.9	Low	156 Å²	156	90 Å²	90	83%	0.834	54%	0.535	S	S	*	.			trans	-77.1	34.8	-169.1	-71.6	-17.5	0	0	0	115.2	S445	N443-S445 PolarHBondContact O-N 3.24Å
444	D	48.1	Very low	66.5	Low	124 Å²	124	93.2 Å²	93.2	66%	0.663	56%	0.556	S	S	*	*			trans	-96.4	100.8	-180	-70.9	-18	0	0	0	110.9	S442 S446	S442-D444 PolarHBondContact O-N 3.37Å; D444-S446 VanDerWaalsContact C-N 3.32Å; D444-S446 PolarHBondContact O-N 2.95Å
445	S	49.4	Very low	66.2	Low	113 Å²	113	95 Å²	95	79%	0.79	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-72.8	-11	-169.3	50.6	0	0	0	0	115.6	N443	N443-S445 PolarHBondContact O-N 3.24Å
446	S	47.7	Very low	66	Low	116 Å²	116	96.5 Å²	96.5	81%	0.811	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-90.5	-6.3	-173.9	55	0	0	0	0	115.1	D444	D444-S446 VanDerWaalsContact C-N 3.32Å; D444-S446 PolarHBondContact O-N 2.95Å
447	T	50.6	Low	66.2	Low	65 Å²	65	98.6 Å²	98.6	40%	0.399	59%	0.589	S	S	.	*	G	3₁₀ helix	trans	-111.6	19.4	-178.5	-7.3	0	0	0	0	114.1	S449 N450 N451	T447-S449 PolarHBondContact O-N 3.48Å; T447-N450 PolarHBondContact O-N 2.88Å; T447-N451 WeakPolarHBondContact O-CB 3.35Å; T447-N451 VanDerWaalsContact O-CG 3.26Å; T447-N451 PolarHBondContact O-N 2.85Å
448	A	53.1	Low	66.5	Low	64 Å²	64	97.4 Å²	97.4	53%	0.529	58%	0.575	S	S	.	*	H	α-helix	trans	-58.4	-40	-165.3	0	0	0	0	0	116.2	R452	A448-R452 PolarHBondContact O-N 3.45Å
449	S	56.2	Low	66.9	Low	97 Å²	97	91.9 Å²	91.9	68%	0.678	56%	0.557	S	S	*	*	H	α-helix	trans	-70.4	-45.7	-178.8	-82.5	0	0	0	0	113.2	T447 N451 R452 N453	T447-S449 PolarHBondContact O-N 3.48Å; S449-N451 VanDerWaalsContact C-N 3.27Å; S449-N451 PolarHBondContact O-N 2.77Å; S449-R452 PolarHBondContact O-N 3.08Å; S449-N453 PolarHBondContact O-N 2.88Å
450	N	61.6	Low	67.5	Low	115 Å²	115	93.3 Å²	93.3	62%	0.615	56%	0.562	S	S	*	*	H	α-helix	trans	-65.9	-35.4	176.5	-70.4	-9.2	0	0	0	111	T447 T454	T447-N450 PolarHBondContact O-N 2.88Å; N450-T454 WeakPolarHBondContact O-CB 3.44Å; N450-T454 PolarHBondContact O-N 3.29Å; N450-T454 VanDerWaalsContact O-N 3.13Å; N450-T454 PolarHBondContact O-OG1 3.28Å
451	N	69.1	Low	69.1	Low	85 Å²	85	97 Å²	97	46%	0.455	56%	0.561	S	S	.	*	H	α-helix	trans	-66.2	-36.5	174.7	-73.8	-5.4	0	0	0	112.3	T447 S449 T454 L455	T447-N451 WeakPolarHBondContact O-CB 3.35Å; T447-N451 VanDerWaalsContact O-CG 3.26Å; T447-N451 PolarHBondContact O-N 2.85Å; S449-N451 VanDerWaalsContact C-N 3.27Å; S449-N451 PolarHBondContact O-N 2.77Å; N451-T454 PolarHBondContact O-N 3.21Å; N451-L455 WeakPolarHBondContact O-CB 3.32Å; N451-L455 PolarHBondContact O-N 3.32Å
452	R	79.1	Confident	71.3	Confident	191 Å²	191	92.3 Å²	92.3	72%	0.721	52%	0.523	S	S	*	.	H	α-helix	trans	-65.4	-47	179.9	-172.5	-179.8	176.9	91.6	0	112.5	A448 S449 T454 L455 S456	A448-R452 PolarHBondContact O-N 3.45Å; S449-R452 PolarHBondContact O-N 3.08Å; R452-T454 VanDerWaalsContact C-N 3.34Å; R452-L455 PolarHBondContact O-N 3.48Å; R452-S456 PolarHBondContact O-N 3.02Å; R452-S456 PolarHBondContact O-OG 2.92Å
453	N	80.6	Confident	73.7	Confident	110 Å²	110	90 Å²	90	59%	0.588	50%	0.498	S	S	*	.	H	α-helix	trans	-66.4	-38.6	177.3	-70.6	-7.9	0	0	0	111.3	S449 S456 V457	S449-N453 PolarHBondContact O-N 2.88Å; N453-S456 PolarHBondContact O-N 3.42Å; N453-S456 PolarHBondContact O-OG 3.19Å; N453-V457 VanDerWaalsContact O-CG2 3.31Å; N453-V457 WeakPolarHBondContact O-CG2 3.26Å; N453-V457 PolarHBondContact O-N 3.31Å; N453-V457 VanDerWaalsContact O-N 3.14Å
454	T	84.6	Confident	76.3	Confident	78 Å²	78	86.2 Å²	86.2	48%	0.479	48%	0.48	S	S	.	.	H	α-helix	trans	-64.1	-42.5	174.9	-55.1	0	0	0	0	111.1	N450 N451 R452 V457 I458	N450-T454 WeakPolarHBondContact O-CB 3.44Å; N450-T454 PolarHBondContact O-N 3.29Å; N450-T454 VanDerWaalsContact O-N 3.13Å; N450-T454 PolarHBondContact O-OG1 3.28Å; N451-T454 PolarHBondContact O-N 3.21Å; R452-T454 VanDerWaalsContact C-N 3.34Å; T454-V457 PolarHBondContact O-N 3.18Å; T454-I458 HydrophobicContact CG2-CD1 3.89Å; T454-I458 VanDerWaalsContact O-CG1 3.26Å; T454-I458 WeakPolarHBondContact O-CG1 3.42Å; T454-I458 PolarHBondContact O-N 2.85Å
455	L	87.3	Confident	78.5	Confident	50 Å²	50	81 Å²	81	26%	0.262	45%	0.454	S	S	.	.	H	α-helix	trans	-64.4	-42.4	178.1	-178.3	61.5	0	0	0	111.7	P436 L439 N451 R452 V457 I458 L459	P436-L455 HydrophobicContact CB-CD2 4.17Å; L439-L455 HydrophobicContact CB-CD1 3.74Å; L439-L455 HydrophobicContact CD1-CD1 3.72Å; L439-L455 HydrophobicContact CG-CD1 4.4Å; N451-L455 WeakPolarHBondContact O-CB 3.32Å; N451-L455 PolarHBondContact O-N 3.32Å; R452-L455 PolarHBondContact O-N 3.48Å; L455-V457 PolarHBondContact O-N 3.5Å; L455-I458 PolarHBondContact O-N 3.25Å; L455-L459 HydrophobicContact CD1-CD1 4.25Å; L455-L459 HydrophobicContact CD1-CG 4.2Å; L455-L459 HydrophobicContact CG-CD1 3.9Å; L455-L459 HydrophobicContact CG-CG 4.33Å; L455-L459 WeakPolarHBondContact O-CB 3.36Å; L455-L459 WeakPolarHBondContact O-CG 3.46Å; L455-L459 PolarHBondContact O-N 2.85Å
456	S	87.2	Confident	80.8	Confident	61 Å²	61	75.6 Å²	75.6	43%	0.427	42%	0.416	S	S	.	.	H	α-helix	trans	-63.6	-40.9	176.9	62.3	0	0	0	0	112.1	R452 N453 L459 E460	R452-S456 PolarHBondContact O-N 3.02Å; R452-S456 PolarHBondContact O-OG 2.92Å; N453-S456 PolarHBondContact O-N 3.42Å; N453-S456 PolarHBondContact O-OG 3.19Å; S456-L459 PolarHBondContact O-N 3.28Å; S456-E460 WeakPolarHBondContact O-CB 3.25Å; S456-E460 PolarHBondContact O-N 2.99Å
457	V	90.5	Very high	83.1	Confident	102 Å²	102	71.2 Å²	71.2	62%	0.618	38%	0.384	S	S	*	.	H	α-helix	trans	-64.4	-42.2	175.5	173.8	0	0	0	0	111.5	N453 T454 L455 E460 R461	N453-V457 VanDerWaalsContact O-CG2 3.31Å; N453-V457 WeakPolarHBondContact O-CG2 3.26Å; N453-V457 PolarHBondContact O-N 3.31Å; N453-V457 VanDerWaalsContact O-N 3.14Å; T454-V457 PolarHBondContact O-N 3.18Å; L455-V457 PolarHBondContact O-N 3.5Å; V457-E460 PolarHBondContact O-N 3.48Å; V457-R461 WeakPolarHBondContact O-CB 3.45Å; V457-R461 PolarHBondContact O-N 3.38Å
458	I	91	Very high	85.3	Confident	66 Å²	66	75 Å²	75	34%	0.338	40%	0.395	S	S	.	.	H	α-helix	trans	-63.8	-46.8	176.1	-68.8	166.1	0	0	0	110.8	L439 T454 L455 E460 R461 N462	L439-I458 HydrophobicContact CD1-CG2 4.1Å; T454-I458 HydrophobicContact CG2-CD1 3.89Å; T454-I458 VanDerWaalsContact O-CG1 3.26Å; T454-I458 WeakPolarHBondContact O-CG1 3.42Å; T454-I458 PolarHBondContact O-N 2.85Å; L455-I458 PolarHBondContact O-N 3.25Å; I458-E460 VanDerWaalsContact C-N 3.31Å; I458-E460 PolarHBondContact O-N 2.84Å; I458-R461 PolarHBondContact O-N 3.22Å; I458-N462 WeakPolarHBondContact O-CB 3.43Å; I458-N462 PolarHBondContact O-N 3.37Å; I458-N462 PolarHBondContact O-OD1 2.71Å
459	L	92.8	Very high	87.3	Confident	31 Å²	31	72.5 Å²	72.5	16%	0.162	37%	0.372	C	S	.	.	H	α-helix	trans	-59.4	-44	178.3	-75.6	169.7	0	0	0	111.2	I434 P436 L439 L455 S456 N462 R463	I434-L459 VanDerWaalsContact C-CD2 3.48Å; I434-L459 HydrophobicContact CB-CD2 4.47Å; I434-L459 WeakPolarHBondContact O-CD2 2.94Å; P436-L459 HydrophobicContact CB-CD1 4.16Å; P436-L459 HydrophobicContact CG-CD1 3.83Å; L439-L459 HydrophobicContact CD1-CD2 3.44Å; L439-L459 VanDerWaalsContact CD1-CD2 3.44Å; L439-L459 HydrophobicContact CD1-CG 3.93Å; L455-L459 HydrophobicContact CD1-CD1 4.25Å; L455-L459 HydrophobicContact CD1-CG 4.2Å; L455-L459 HydrophobicContact CG-CD1 3.9Å; L455-L459 HydrophobicContact CG-CG 4.33Å; L455-L459 WeakPolarHBondContact O-CB 3.36Å; L455-L459 WeakPolarHBondContact O-CG 3.46Å; L455-L459 PolarHBondContact O-N 2.85Å; S456-L459 PolarHBondContact O-N 3.28Å; L459-N462 PolarHBondContact O-N 3.18Å; L459-R463 VanDerWaalsContact O-CB 3.22Å; L459-R463 WeakPolarHBondContact O-CB 3.3Å; L459-R463 PolarHBondContact O-N 3.15Å
460	E	92.4	Very high	89.3	Confident	85 Å²	85	67.9 Å²	67.9	40%	0.397	34%	0.34	S	S	.	.	H	α-helix	trans	-64	-46	178.3	-177.7	53.6	-154.8	0	0	111.4	S456 V457 I458 N462 R463 T464	S456-E460 WeakPolarHBondContact O-CB 3.25Å; S456-E460 PolarHBondContact O-N 2.99Å; V457-E460 PolarHBondContact O-N 3.48Å; I458-E460 VanDerWaalsContact C-N 3.31Å; I458-E460 PolarHBondContact O-N 2.84Å; E460-N462 PolarHBondContact O-N 3.26Å; E460-R463 WeakPolarHBondContact O-CB 3.33Å; E460-R463 PolarHBondContact O-N 2.89Å; E460-R463 IonicContact OE1-CZ 3.06Å; E460-R463 IonicContact OE1-NE 3.9Å; E460-R463 PolarHBondContact OE1-NE 2.97Å; E460-R463 IonicContact OE1-NH2 3.5Å; E460-R463 PolarHBondContact OE1-NH2 3.41Å; E460-R463 IonicContact OE2-CZ 3.42Å; E460-R463 IonicContact OE2-NE 3.83Å; E460-R463 PolarHBondContact OE2-NE 3.46Å; E460-R463 IonicContact OE2-NH2 2.89Å; E460-R463 PolarHBondContact OE2-NH2 2.84Å; E460-T464 PolarHBondContact O-N 3.3Å; E460-T464 PolarHBondContact O-OG1 3.42Å
461	R	93.9	Very high	91	Very high	123 Å²	123	64 Å²	64	46%	0.464	32%	0.324	S	S	.	.	H	α-helix	trans	-58.4	-46.7	174.4	-172	-164.5	72	94.6	5	112.1	D430 V457 I458 R463 T464 A465	D430-R461 IonicContact OD1-NH1 3.49Å; V457-R461 WeakPolarHBondContact O-CB 3.45Å; V457-R461 PolarHBondContact O-N 3.38Å; I458-R461 PolarHBondContact O-N 3.22Å; R461-R463 VanDerWaalsContact C-N 3.33Å; R461-T464 PolarHBondContact O-N 3.05Å; R461-A465 WeakPolarHBondContact O-CB 3.48Å; R461-A465 PolarHBondContact O-N 3.49Å
462	N	95.5	Very high	92.3	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-63.9	-39.8	178.9	-69.9	4.3	0	0	0	111	D431 E433 I434 I458 L459 E460 A465 L466	D431-N462 WeakPolarHBondContact O-CA 3.49Å; D431-N462 WeakPolarHBondContact O-CB 3.43Å; D431-N462 PolarHBondContact O-OD1 3.46Å; D431-N462 VanDerWaalsContact O-OD1 3.08Å; E433-N462 WeakPolarHBondContact O-CB 3.44Å; E433-N462 PolarHBondContact O-ND2 2.93Å; I434-N462 HydrophobicContact CG2-CB 4.3Å; I458-N462 WeakPolarHBondContact O-CB 3.43Å; I458-N462 PolarHBondContact O-N 3.37Å; I458-N462 PolarHBondContact O-OD1 2.71Å; L459-N462 PolarHBondContact O-N 3.18Å; E460-N462 PolarHBondContact O-N 3.26Å; N462-A465 PolarHBondContact O-N 3.29Å; N462-L466 WeakPolarHBondContact O-CB 3.46Å; N462-L466 PolarHBondContact O-N 2.85Å
463	R	95.8	Very high	93.2	Very high	59 Å²	59	53.9 Å²	53.9	22%	0.223	28%	0.283	C	S	.	.	H	α-helix	trans	-62.5	-47.6	175.5	-172.8	-171.4	74.1	84	-1.6	111.6	I434 L459 E460 R461 A465 L466 L467 L573	I434-R463 HydrophobicContact CG2-CB 3.95Å; L459-R463 VanDerWaalsContact O-CB 3.22Å; L459-R463 WeakPolarHBondContact O-CB 3.3Å; L459-R463 PolarHBondContact O-N 3.15Å; E460-R463 WeakPolarHBondContact O-CB 3.33Å; E460-R463 PolarHBondContact O-N 2.89Å; E460-R463 IonicContact OE1-CZ 3.06Å; E460-R463 IonicContact OE1-NE 3.9Å; E460-R463 PolarHBondContact OE1-NE 2.97Å; E460-R463 IonicContact OE1-NH2 3.5Å; E460-R463 PolarHBondContact OE1-NH2 3.41Å; E460-R463 IonicContact OE2-CZ 3.42Å; E460-R463 IonicContact OE2-NE 3.83Å; E460-R463 PolarHBondContact OE2-NE 3.46Å; E460-R463 IonicContact OE2-NH2 2.89Å; E460-R463 PolarHBondContact OE2-NH2 2.84Å; R461-R463 VanDerWaalsContact C-N 3.33Å; R463-A465 VanDerWaalsContact C-N 3.32Å; R463-A465 PolarHBondContact O-N 3.14Å; R463-L466 PolarHBondContact O-N 3.2Å; R463-L467 HydrophobicContact CG-CD1 4.35Å; R463-L467 WeakPolarHBondContact O-CB 3.23Å; R463-L467 WeakPolarHBondContact O-CG 3.35Å; R463-L467 PolarHBondContact O-N 2.84Å; R463-L573 HydrophobicContact CG-CD2 3.8Å
464	T	95.6	Very high	94	Very high	75 Å²	75	48.9 Å²	48.9	46%	0.46	26%	0.256	S	S	.	.	H	α-helix	trans	-60.6	-43.6	176.1	-48.9	0	0	0	0	111.1	E460 R461 L467 K468	E460-T464 PolarHBondContact O-N 3.3Å; E460-T464 PolarHBondContact O-OG1 3.42Å; R461-T464 PolarHBondContact O-N 3.05Å; T464-L467 PolarHBondContact O-N 3.04Å; T464-K468 VanDerWaalsContact O-CB 3.27Å; T464-K468 WeakPolarHBondContact O-CB 3.26Å; T464-K468 PolarHBondContact O-N 2.97Å
465	A	95.4	Very high	94.6	Very high	14 Å²	14	51.4 Å²	51.4	12%	0.116	26%	0.262	C	S	.	.	H	α-helix	trans	-64.3	-42.7	178.2	0	0	0	0	0	112.1	F432 R461 N462 R463 N469	F432-A465 HydrophobicContact CD1-CB 3.86Å; F432-A465 HydrophobicContact CE1-CB 3.75Å; R461-A465 WeakPolarHBondContact O-CB 3.48Å; R461-A465 PolarHBondContact O-N 3.49Å; N462-A465 PolarHBondContact O-N 3.29Å; R463-A465 VanDerWaalsContact C-N 3.32Å; R463-A465 PolarHBondContact O-N 3.14Å; A465-N469 PolarHBondContact O-N 2.92Å; A465-N469 VanDerWaalsContact O-N 3.17Å; A465-N469 PolarHBondContact O-ND2 3.07Å
466	L	96.8	Very high	95.1	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.4	-54.4	174.7	176.4	58.3	0	0	0	111.1	F432 I434 N462 R463 K468 N469 V470 L549 I550 V553 L573	F432-L466 HydrophobicContact CB-CB 4.04Å; F432-L466 HydrophobicContact CB-CD1 4.15Å; F432-L466 HydrophobicContact CD2-CD1 4.07Å; F432-L466 HydrophobicContact CG-CB 4.19Å; F432-L466 HydrophobicContact CG-CD1 4.29Å; I434-L466 HydrophobicContact CD1-CD2 4.29Å; N462-L466 WeakPolarHBondContact O-CB 3.46Å; N462-L466 PolarHBondContact O-N 2.85Å; R463-L466 PolarHBondContact O-N 3.2Å; L466-K468 VanDerWaalsContact C-N 3.32Å; L466-K468 PolarHBondContact O-N 2.93Å; L466-N469 PolarHBondContact O-N 2.84Å; L466-N469 VanDerWaalsContact O-N 3.14Å; L466-V470 HydrophobicContact CD1-CG2 3.97Å; L466-V470 HydrophobicContact CG-CG2 4.39Å; L466-V470 WeakPolarHBondContact O-CG2 3.41Å; L466-V470 PolarHBondContact O-N 3.45Å; L466-L549 HydrophobicContact CD1-CB 4Å; L466-L549 HydrophobicContact CD2-CB 4.36Å; L466-I550 HydrophobicContact CD1-CG1 3.77Å; L466-V553 HydrophobicContact CD2-CG2 4.25Å; L466-L573 HydrophobicContact CD2-CD1 4.11Å; L466-L573 HydrophobicContact CD2-CD2 4.49Å
467	L	96.9	Very high	95.6	Very high	24 Å²	24	49.9 Å²	49.9	13%	0.126	24%	0.244	C	C	.	.	H	α-helix	trans	-61.3	-39.8	-178.5	-75.7	178.1	0	0	0	112.2	R463 T464 N469 V470 A471 L573 F576	R463-L467 HydrophobicContact CG-CD1 4.35Å; R463-L467 WeakPolarHBondContact O-CB 3.23Å; R463-L467 WeakPolarHBondContact O-CG 3.35Å; R463-L467 PolarHBondContact O-N 2.84Å; T464-L467 PolarHBondContact O-N 3.04Å; L467-N469 VanDerWaalsContact C-N 3.32Å; L467-N469 PolarHBondContact O-N 2.73Å; L467-V470 PolarHBondContact O-N 3.15Å; L467-A471 VanDerWaalsContact O-CB 3.24Å; L467-A471 WeakPolarHBondContact O-CB 3.26Å; L467-A471 PolarHBondContact O-N 3.15Å; L467-L573 HydrophobicContact CD1-CD2 4.08Å; L467-L573 HydrophobicContact CD2-CB 4.39Å; L467-L573 HydrophobicContact CD2-CD2 3.73Å; L467-L573 HydrophobicContact CG-CD2 3.79Å; L467-F576 HydrophobicContact CD2-CB 3.69Å; L467-F576 HydrophobicContact CD2-CD1 4.09Å; L467-F576 HydrophobicContact CD2-CG 3.95Å
468	K	95.8	Very high	95.8	Very high	145 Å²	145	48.6 Å²	48.6	63%	0.63	23%	0.231	S	C	*	.	H	α-helix	trans	-57.6	-45.2	174.7	-179.8	-177.4	177	-177	0	111.9	T464 L466 M472	T464-K468 VanDerWaalsContact O-CB 3.27Å; T464-K468 WeakPolarHBondContact O-CB 3.26Å; T464-K468 PolarHBondContact O-N 2.97Å; L466-K468 VanDerWaalsContact C-N 3.32Å; L466-K468 PolarHBondContact O-N 2.93Å; K468-M472 WeakPolarHBondContact O-CB 2.86Å; K468-M472 PolarHBondContact O-N 2.85Å
469	N	95.9	Very high	96	Very high	11 Å²	11	49.4 Å²	49.4	6%	0.059	24%	0.243	C	C	.	.	H	α-helix	trans	-72.5	-38.4	-180	-76.7	-79.8	0	0	0	112.1	L425 F432 A465 L466 L467 M472 I473 I550	L425-N469 HydrophobicContact CD2-CB 4.4Å; L425-N469 WeakPolarHBondContact CD2-OD1 3.41Å; F432-N469 HydrophobicContact CE2-CB 4.4Å; F432-N469 HydrophobicContact CZ-CB 4.37Å; F432-N469 VanDerWaalsContact CZ-ND2 3.28Å; F432-N469 WeakPolarHBondContact CZ-ND2 3.44Å; A465-N469 PolarHBondContact O-N 2.92Å; A465-N469 VanDerWaalsContact O-N 3.17Å; A465-N469 PolarHBondContact O-ND2 3.07Å; L466-N469 PolarHBondContact O-N 2.84Å; L466-N469 VanDerWaalsContact O-N 3.14Å; L467-N469 VanDerWaalsContact C-N 3.32Å; L467-N469 PolarHBondContact O-N 2.73Å; N469-M472 PolarHBondContact O-N 2.79Å; N469-I473 WeakPolarHBondContact O-CG1 3.44Å; N469-I473 PolarHBondContact O-N 3.39Å; N469-I550 HydrophobicContact CB-CD1 4.07Å
470	V	97.5	Very high	96.1	Very high	1 Å²	1	48 Å²	48	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-62.4	-48.8	174.2	173.1	0	0	0	0	110.8	L466 L467 M472 I473 W474 I550 V553 F576	L466-V470 HydrophobicContact CD1-CG2 3.97Å; L466-V470 HydrophobicContact CG-CG2 4.39Å; L466-V470 WeakPolarHBondContact O-CG2 3.41Å; L466-V470 PolarHBondContact O-N 3.45Å; L467-V470 PolarHBondContact O-N 3.15Å; V470-M472 VanDerWaalsContact C-N 3.32Å; V470-M472 PolarHBondContact O-N 3.03Å; V470-I473 PolarHBondContact O-N 3.03Å; V470-W474 WeakPolarHBondContact O-CB 3.27Å; V470-W474 PolarHBondContact O-N 2.75Å; V470-I550 HydrophobicContact CG2-CB 4.38Å; V470-I550 HydrophobicContact CG2-CG1 4.21Å; V470-I550 HydrophobicContact CG2-CG2 4.24Å; V470-V553 HydrophobicContact CG1-CB 4.36Å; V470-V553 HydrophobicContact CG1-CG1 3.89Å; V470-V553 HydrophobicContact CG2-CB 4.04Å; V470-V553 HydrophobicContact CG2-CG1 4.21Å; V470-F576 HydrophobicContact CG1-CD1 4.39Å; V470-F576 HydrophobicContact CG1-CE1 3.62Å; V470-F576 HydrophobicContact CG1-CZ 4.12Å
471	A	97.4	Very high	96.1	Very high	34 Å²	34	46.3 Å²	46.3	28%	0.281	23%	0.227	S	C	.	.	H	α-helix	trans	-60.5	-41.1	177.9	0	0	0	0	0	111.7	L467 I473 W474 Q475 F576	L467-A471 VanDerWaalsContact O-CB 3.24Å; L467-A471 WeakPolarHBondContact O-CB 3.26Å; L467-A471 PolarHBondContact O-N 3.15Å; A471-I473 PolarHBondContact O-N 3.06Å; A471-W474 PolarHBondContact O-N 3.43Å; A471-Q475 VanDerWaalsContact O-CB 3.29Å; A471-Q475 WeakPolarHBondContact O-CB 3.2Å; A471-Q475 PolarHBondContact O-N 3.05Å; A471-F576 HydrophobicContact CB-CE2 3.82Å; A471-F576 HydrophobicContact CB-CZ 4.23Å
472	M	96.3	Very high	96	Very high	59 Å²	59	41.8 Å²	41.8	29%	0.291	22%	0.215	S	C	.	.	H	α-helix	trans	-60.7	-45.1	175.3	-175.6	-172.6	-59.8	0	0	112.2	V421 K468 N469 V470 R476	V421-M472 HydrophobicContact CG1-SD 4.41Å; V421-M472 HydrophobicContact CG2-SD 4.39Å; K468-M472 WeakPolarHBondContact O-CB 2.86Å; K468-M472 PolarHBondContact O-N 2.85Å; N469-M472 PolarHBondContact O-N 2.79Å; V470-M472 VanDerWaalsContact C-N 3.32Å; V470-M472 PolarHBondContact O-N 3.03Å; M472-R476 WeakPolarHBondContact O-CG 3.44Å; M472-R476 PolarHBondContact O-N 2.75Å
473	I	97.7	Very high	95.8	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.015	23%	0.232	C	C	.	.	H	α-helix	trans	-65.4	-46.2	177.7	-69.5	167.4	0	0	0	110.2	L418 V421 L425 N469 V470 A471 R476 I477 I525 I550 L554	L418-I473 HydrophobicContact CD2-CG2 3.96Å; V421-I473 HydrophobicContact CB-CG1 4.32Å; V421-I473 HydrophobicContact CG1-CD1 3.97Å; V421-I473 HydrophobicContact CG1-CG1 3.63Å; L425-I473 HydrophobicContact CD1-CD1 4.45Å; N469-I473 WeakPolarHBondContact O-CG1 3.44Å; N469-I473 PolarHBondContact O-N 3.39Å; V470-I473 PolarHBondContact O-N 3.03Å; A471-I473 PolarHBondContact O-N 3.06Å; I473-R476 PolarHBondContact O-N 3.33Å; I473-I477 HydrophobicContact CG2-CD1 3.76Å; I473-I477 HydrophobicContact CG2-CG1 4.46Å; I473-I477 WeakPolarHBondContact O-CG1 3.46Å; I473-I477 PolarHBondContact O-N 2.82Å; I473-I525 HydrophobicContact CG2-CD1 4.08Å; I473-I550 HydrophobicContact CD1-CD1 4.39Å; I473-I550 HydrophobicContact CD1-CG2 3.47Å; I473-I550 VanDerWaalsContact CD1-CG2 3.47Å; I473-L554 HydrophobicContact CG2-CD2 4.02Å
474	W	97.8	Very high	95.8	Very high	5 Å²	5	43 Å²	43	2%	0.019	22%	0.222	C	C	.	.	H	α-helix	trans	-60.1	-48.9	180	175.4	-128.8	0	0	0	112	V470 A471 R476 I477 E478 F517 L554 L557 E580 T583 M584 F587	V470-W474 WeakPolarHBondContact O-CB 3.27Å; V470-W474 PolarHBondContact O-N 2.75Å; A471-W474 PolarHBondContact O-N 3.43Å; W474-R476 VanDerWaalsContact C-N 3.27Å; W474-R476 PolarHBondContact O-N 2.7Å; W474-I477 HydrophobicContact CE3-CB 4.15Å; W474-I477 HydrophobicContact CE3-CG2 4.25Å; W474-I477 HydrophobicContact CZ3-CB 4.3Å; W474-I477 HydrophobicContact CZ3-CG2 3.91Å; W474-I477 WeakPolarHBondContact O-CA 3.43Å; W474-I477 WeakPolarHBondContact O-CB 3.26Å; W474-I477 PolarHBondContact O-N 3.21Å; W474-E478 HydrophobicContact CH2-CB 4.49Å; W474-E478 HydrophobicContact CZ2-CB 4.41Å; W474-E478 PolarHBondContact O-N 2.93Å; W474-F517 HydrophobicContact CZ3-CE1 4.41Å; W474-F517 AromaticContact CZ3-CZ 3.96Å; W474-F517 HydrophobicContact CZ3-CZ 3.96Å; W474-L554 HydrophobicContact CB-CD1 4.38Å; W474-L554 HydrophobicContact CE3-CD1 4.32Å; W474-L557 HydrophobicContact CD2-CD2 4.01Å; W474-L557 HydrophobicContact CG-CD2 4.12Å; W474-E580 PolarHBondContact NE1-OE2 3.27Å; W474-T583 HydrophobicContact CZ2-CG2 4.17Å; W474-M584 HydrophobicContact CD2-CE 4.39Å; W474-M584 HydrophobicContact CE3-CE 3.75Å; W474-M584 HydrophobicContact CH2-CB 4.07Å; W474-M584 HydrophobicContact CH2-CE 3.45Å; W474-M584 VanDerWaalsContact CH2-CE 3.45Å; W474-M584 HydrophobicContact CH2-CG 4.41Å; W474-M584 HydrophobicContact CH2-SD 3.5Å; W474-M584 VanDerWaalsContact CH2-SD 3.5Å; W474-M584 HydrophobicContact CZ2-CB 3.99Å; W474-M584 HydrophobicContact CZ2-CE 4.08Å; W474-M584 HydrophobicContact CZ2-SD 4.34Å; W474-M584 HydrophobicContact CZ3-CE 3.25Å; W474-M584 HydrophobicContact CZ3-SD 3.76Å; W474-F587 HydrophobicContact CH2-CB 4.09Å; W474-F587 HydrophobicContact CH2-CD1 4.03Å; W474-F587 HydrophobicContact CH2-CG 4.08Å; W474-F587 HydrophobicContact CZ3-CD1 4.33Å
475	Q	96.9	Very high	95.7	Very high	132 Å²	132	39.6 Å²	39.6	62%	0.617	20%	0.201	S	C	*	.	H	α-helix	trans	-59.3	-37.4	177.2	-171.4	-175.7	8.6	0	0	112.2	A471 S479	A471-Q475 VanDerWaalsContact O-CB 3.29Å; A471-Q475 WeakPolarHBondContact O-CB 3.2Å; A471-Q475 PolarHBondContact O-N 3.05Å; Q475-S479 VanDerWaalsContact O-CB 3.3Å; Q475-S479 WeakPolarHBondContact O-CB 3.15Å; Q475-S479 PolarHBondContact O-N 3.06Å; Q475-S479 PolarHBondContact O-OG 2.78Å
476	R	97.3	Very high	95.6	Very high	79 Å²	79	41.5 Å²	41.5	30%	0.298	21%	0.206	S	C	.	.	H	α-helix	trans	-66.5	-38.9	174	-74.8	-175.4	72	79.1	3.8	112.1	Y416 V417 V421 M472 I473 W474 S479 S480	Y416-R476 PolarHBondContact O-NH2 2.79Å; V417-R476 HydrophobicContact CG1-CB 4.31Å; V417-R476 PolarHBondContact O-NE 2.89Å; V421-R476 VanDerWaalsContact CG2-CD 3.49Å; M472-R476 WeakPolarHBondContact O-CG 3.44Å; M472-R476 PolarHBondContact O-N 2.75Å; I473-R476 PolarHBondContact O-N 3.33Å; W474-R476 VanDerWaalsContact C-N 3.27Å; W474-R476 PolarHBondContact O-N 2.7Å; R476-S479 PolarHBondContact O-OG 2.53Å; R476-S480 WeakPolarHBondContact O-CB 3.48Å; R476-S480 PolarHBondContact O-N 3.21Å; R476-S480 PolarHBondContact O-OG 3.42Å
477	I	97.6	Very high	95.5	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65.2	-53.3	176.4	-67.5	163.8	0	0	0	109.6	V417 I473 W474 S479 S480 F517 I521 L554 F587	V417-I477 HydrophobicContact CG1-CG1 3.66Å; I473-I477 HydrophobicContact CG2-CD1 3.76Å; I473-I477 HydrophobicContact CG2-CG1 4.46Å; I473-I477 WeakPolarHBondContact O-CG1 3.46Å; I473-I477 PolarHBondContact O-N 2.82Å; W474-I477 HydrophobicContact CE3-CB 4.15Å; W474-I477 HydrophobicContact CE3-CG2 4.25Å; W474-I477 HydrophobicContact CZ3-CB 4.3Å; W474-I477 HydrophobicContact CZ3-CG2 3.91Å; W474-I477 WeakPolarHBondContact O-CA 3.43Å; W474-I477 WeakPolarHBondContact O-CB 3.26Å; W474-I477 PolarHBondContact O-N 3.21Å; I477-S479 PolarHBondContact O-N 3.05Å; I477-S480 PolarHBondContact O-N 3.31Å; I477-S480 PolarHBondContact O-OG 2.63Å; I477-F517 HydrophobicContact CD1-CE1 4.12Å; I477-F517 HydrophobicContact CG2-CE1 4.37Å; I477-F517 HydrophobicContact CG2-CZ 4.12Å; I477-I521 HydrophobicContact CD1-CD1 4.25Å; I477-I521 HydrophobicContact CD1-CG2 3.92Å; I477-I521 HydrophobicContact CG1-CD1 4.46Å; I477-I521 HydrophobicContact CG2-CD1 4.35Å; I477-L554 HydrophobicContact CD1-CD2 3.94Å; I477-F587 HydrophobicContact CG2-CE1 4.09Å; I477-F587 HydrophobicContact CG2-CE2 4.27Å; I477-F587 HydrophobicContact CG2-CZ 3.71Å
478	E	96.2	Very high	95.5	Very high	74 Å²	74	41.7 Å²	41.7	35%	0.346	21%	0.207	S	C	.	.	H	α-helix	trans	-56.6	-51	-178.8	-170.5	-162	174.7	0	0	111.7	W474 S480 Q481 T583	W474-E478 HydrophobicContact CH2-CB 4.49Å; W474-E478 HydrophobicContact CZ2-CB 4.41Å; W474-E478 PolarHBondContact O-N 2.93Å; E478-S480 PolarHBondContact O-N 3.33Å; E478-Q481 PolarHBondContact O-N 2.83Å; E478-T583 VanDerWaalsContact CD-CG2 3.49Å; E478-T583 HydrophobicContact CG-CG2 4.3Å; E478-T583 WeakPolarHBondContact OE1-CG2 3.39Å
479	S	94.6	Very high	95.5	Very high	84 Å²	84	34.8 Å²	34.8	59%	0.587	18%	0.177	S	C	*	.	H	α-helix	trans	-68.8	-14.4	179.6	60.6	0	0	0	0	114.2	Q475 R476 I477	Q475-S479 VanDerWaalsContact O-CB 3.3Å; Q475-S479 WeakPolarHBondContact O-CB 3.15Å; Q475-S479 PolarHBondContact O-N 3.06Å; Q475-S479 PolarHBondContact O-OG 2.78Å; R476-S479 PolarHBondContact O-OG 2.53Å; I477-S479 PolarHBondContact O-N 3.05Å
480	S	94.7	Very high	95.5	Very high	2 Å²	2	37 Å²	37	1%	0.014	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	5.8	179.8	74	0	0	0	0	114.4	Y413 V417 R476 I477 E478 C482 K483 L484	Y413-S480 WeakPolarHBondContact CE2-OG 3.23Å; Y413-S480 PolarHBondContact OH-OG 3.27Å; V417-S480 WeakPolarHBondContact CG2-OG 3.32Å; R476-S480 WeakPolarHBondContact O-CB 3.48Å; R476-S480 PolarHBondContact O-N 3.21Å; R476-S480 PolarHBondContact O-OG 3.42Å; I477-S480 PolarHBondContact O-N 3.31Å; I477-S480 PolarHBondContact O-OG 2.63Å; E478-S480 PolarHBondContact O-N 3.33Å; S480-C482 PolarHBondContact O-N 3.07Å; S480-C482 VanDerWaalsContact O-N 3.08Å; S480-K483 WeakPolarHBondContact O-CA 3.32Å; S480-K483 WeakPolarHBondContact O-CB 3.33Å; S480-K483 PolarHBondContact O-N 3.36Å; S480-L484 PolarHBondContact O-N 3.2Å
481	Q	92.8	Very high	95.4	Very high	48 Å²	48	37 Å²	37	22%	0.224	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-52	-34.3	-179.5	67.8	-174.3	-0.2	0	0	113.8	E478 K483 L484 F587 S590 V591 N598	E478-Q481 PolarHBondContact O-N 2.83Å; Q481-K483 PolarHBondContact O-N 2.83Å; Q481-L484 PolarHBondContact O-N 3.14Å; Q481-F587 HydrophobicContact CB-CD2 4.31Å; Q481-F587 HydrophobicContact CB-CE2 4.08Å; Q481-S590 PolarHBondContact OE1-OG 2.93Å; Q481-V591 HydrophobicContact CB-CG1 4.3Å; Q481-N598 PolarHBondContact NE2-ND2 2.71Å
482	C	91.1	Very high	95.4	Very high	29 Å²	29	35.3 Å²	35.3	20%	0.196	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-77.6	-4.4	177.3	67.3	0	0	0	0	113.8	S480 N598 L601 S602	S480-C482 PolarHBondContact O-N 3.07Å; S480-C482 VanDerWaalsContact O-N 3.08Å; C482-N598 HydrophobicContact CB-CB 3.99Å; C482-L601 HydrophobicContact CB-CB 3.85Å; C482-L601 HydrophobicContact CB-CD1 4.14Å; C482-L601 CarbonylContact O-C 3.51Å; C482-S602 WeakPolarHBondContact O-CA 3.36Å; C482-S602 PolarHBondContact O-N 3.26Å
483	K	92.4	Very high	95.5	Very high	85 Å²	85	33.1 Å²	33.1	37%	0.37	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-110	-4.6	176.6	-62.8	-60.7	-174.9	-173.8	0	112.6	Y413 Y416 S480 Q481 T603	Y413-K483 HydrophobicContact CD2-CB 4.23Å; Y413-K483 WeakPolarHBondContact CD2-O 3.46Å; Y413-K483 HydrophobicContact CE2-CB 4.41Å; Y416-K483 HydrophobicContact CE1-CB 4.31Å; Y416-K483 HydrophobicContact CE1-CG 4.03Å; S480-K483 WeakPolarHBondContact O-CA 3.32Å; S480-K483 WeakPolarHBondContact O-CB 3.33Å; S480-K483 PolarHBondContact O-N 3.36Å; Q481-K483 PolarHBondContact O-N 2.83Å; K483-T603 HydrophobicContact CD-CG2 4.23Å; K483-T603 PolarHBondContact O-OG1 2.86Å
484	L	94.4	Very high	95.4	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.173	C	C	.	.	S	Bend	trans	-63.7	131.4	173.4	-170.7	71.3	0	0	0	108.8	Y413 S480 Q481 L488 R489 F492 V591 S602	Y413-L484 HydrophobicContact CD1-CD1 3.85Å; Y413-L484 HydrophobicContact CD2-CD1 4.49Å; Y413-L484 HydrophobicContact CE1-CD1 3.57Å; Y413-L484 HydrophobicContact CE2-CB 4.34Å; Y413-L484 HydrophobicContact CE2-CD1 4.24Å; Y413-L484 HydrophobicContact CG-CD1 4.31Å; S480-L484 PolarHBondContact O-N 3.2Å; Q481-L484 PolarHBondContact O-N 3.14Å; L484-L488 HydrophobicContact CD1-CD1 4.13Å; L484-L488 HydrophobicContact CG-CB 4.42Å; L484-R489 HydrophobicContact CB-CG 4.49Å; L484-R489 HydrophobicContact CD2-CG 3.91Å; L484-R489 HydrophobicContact CG-CG 4.32Å; L484-F492 HydrophobicContact CD2-CD2 4.21Å; L484-F492 HydrophobicContact CD2-CE2 4.06Å; L484-V591 HydrophobicContact CD2-CB 3.69Å; L484-V591 HydrophobicContact CD2-CG1 3.83Å; L484-S602 WeakPolarHBondContact O-CB 3.41Å
485	P	94.4	Very high	95.3	Very high	3 Å²	3	33.9 Å²	33.9	2%	0.019	17%	0.172	C	C	.	.			trans	-54.5	140.1	-177.5	-26.9	32.8	0	0	0	113.4	V409 E487 L488 R489 T603	V409-P485 WeakPolarHBondContact O-CG 3.19Å; P485-E487 WeakPolarHBondContact CB-OE2 3.3Å; P485-E487 PolarHBondContact O-N 3.4Å; P485-L488 HydrophobicContact CB-CG 4.35Å; P485-L488 HydrophobicContact CG-CD1 4.26Å; P485-L488 PolarHBondContact O-N 2.96Å; P485-R489 PolarHBondContact O-N 3.19Å; P485-R489 VanDerWaalsContact O-N 3.11Å; P485-T603 CarbonylContact C-O 3.51Å; P485-T603 VanDerWaalsContact CA-O 3.26Å; P485-T603 WeakPolarHBondContact CA-O 3.22Å
486	K	93.9	Very high	95.2	Very high	54 Å²	54	27.8 Å²	27.8	24%	0.235	15%	0.145	C	C	.	.	H	α-helix	trans	-55.6	-42.1	178.2	-78.6	-172.3	-163.4	164.5	0	111.7	L488 R489 D490 S602 T603 N604	K486-L488 PolarHBondContact O-N 3.5Å; K486-R489 WeakPolarHBondContact O-CA 3.37Å; K486-R489 WeakPolarHBondContact O-CB 3.43Å; K486-R489 PolarHBondContact O-N 2.87Å; K486-D490 VanDerWaalsContact O-CG 3.24Å; K486-D490 PolarHBondContact O-N 2.87Å; K486-S602 WeakPolarHBondContact CE-O 3.41Å; K486-S602 WeakPolarHBondContact CE-OG 3.41Å; K486-S602 WeakPolarHBondContact CG-OG 3.31Å; K486-T603 PolarHBondContact N-O 2.89Å; K486-N604 VanDerWaalsContact CD-OD1 3.25Å; K486-N604 WeakPolarHBondContact CD-OD1 3.47Å
487	E	94.4	Very high	95.1	Very high	28 Å²	28	28.7 Å²	28.7	13%	0.131	16%	0.155	C	C	.	.	H	α-helix	trans	-56.5	-37	179.2	-60.1	84.9	177.1	0	0	111.7	Y405 V409 P485 V491 N604 S605	Y405-E487 WeakPolarHBondContact OH-CB 3.26Å; V409-E487 HydrophobicContact CB-CB 4.48Å; V409-E487 HydrophobicContact CG1-CB 4.32Å; V409-E487 HydrophobicContact CG2-CB 4.45Å; P485-E487 WeakPolarHBondContact CB-OE2 3.3Å; P485-E487 PolarHBondContact O-N 3.4Å; E487-V491 WeakPolarHBondContact O-CG2 3.44Å; E487-V491 PolarHBondContact O-N 3.05Å; E487-N604 WeakPolarHBondContact OE1-CA 3.18Å; E487-S605 PolarHBondContact OE1-N 3.44Å; E487-S605 PolarHBondContact OE2-N 3.2Å
488	L	95.5	Very high	94.9	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-77.2	-38.6	174.4	-68.9	-175.9	0	0	0	112.7	Y405 I406 V409 L484 P485 K486 D490 V491 F492	Y405-L488 HydrophobicContact CD1-CD2 3.98Å; Y405-L488 HydrophobicContact CE1-CD2 3.95Å; I406-L488 HydrophobicContact CB-CD2 4.31Å; I406-L488 HydrophobicContact CG1-CD1 3.89Å; I406-L488 HydrophobicContact CG1-CD2 3.97Å; V409-L488 HydrophobicContact CG2-CD1 4.06Å; V409-L488 HydrophobicContact CG2-CD2 3.35Å; V409-L488 HydrophobicContact CG2-CG 3.45Å; V409-L488 VanDerWaalsContact CG2-CG 3.45Å; L484-L488 HydrophobicContact CD1-CD1 4.13Å; L484-L488 HydrophobicContact CG-CB 4.42Å; P485-L488 HydrophobicContact CB-CG 4.35Å; P485-L488 HydrophobicContact CG-CD1 4.26Å; P485-L488 PolarHBondContact O-N 2.96Å; K486-L488 PolarHBondContact O-N 3.5Å; L488-D490 VanDerWaalsContact C-N 3.29Å; L488-D490 PolarHBondContact O-N 3.22Å; L488-V491 PolarHBondContact O-N 3.09Å; L488-F492 HydrophobicContact CB-CD2 4.46Å; L488-F492 HydrophobicContact CB-CE2 4.14Å; L488-F492 WeakPolarHBondContact O-CB 3.48Å; L488-F492 WeakPolarHBondContact O-CD2 3.31Å; L488-F492 VanDerWaalsContact O-CG 3.25Å; L488-F492 WeakPolarHBondContact O-CG 3.37Å; L488-F492 PolarHBondContact O-N 3.34Å
489	R	96.1	Very high	94.7	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.5	-42.1	176.1	-66.8	-170	68.4	160.6	-0.2	111	L484 P485 K486 F492 T493 S590 S593 D596 N598 Y599	L484-R489 HydrophobicContact CB-CG 4.49Å; L484-R489 HydrophobicContact CD2-CG 3.91Å; L484-R489 HydrophobicContact CG-CG 4.32Å; P485-R489 PolarHBondContact O-N 3.19Å; P485-R489 VanDerWaalsContact O-N 3.11Å; K486-R489 WeakPolarHBondContact O-CA 3.37Å; K486-R489 WeakPolarHBondContact O-CB 3.43Å; K486-R489 PolarHBondContact O-N 2.87Å; R489-F492 PolarHBondContact O-N 3.27Å; R489-T493 WeakPolarHBondContact O-CB 3.27Å; R489-T493 PolarHBondContact O-N 3.28Å; R489-T493 PolarHBondContact O-OG1 3.35Å; R489-T493 VanDerWaalsContact O-OG1 3.11Å; R489-S590 PolarHBondContact NH2-O 2.98Å; R489-S593 PolarHBondContact NH2-O 3.15Å; R489-D596 IonicContact CZ-OD1 2.99Å; R489-D596 IonicContact NH1-OD1 2.88Å; R489-D596 VanDerWaalsContact NH2-CB 3.33Å; R489-D596 IonicContact NH2-OD1 2.62Å; R489-D596 PolarHBondContact NH2-OD1 3.37Å; R489-N598 PolarHBondContact NH1-O 2.99Å; R489-Y599 HydrophobicContact CB-CD2 4.13Å; R489-Y599 HydrophobicContact CB-CE2 4.04Å; R489-Y599 VanDerWaalsContact NH1-CA 3.25Å; R489-Y599 VanDerWaalsContact NH1-N 3.17Å
490	D	96	Very high	94.7	Very high	56 Å²	56	24.7 Å²	24.7	30%	0.299	13%	0.128	S	C	.	.	H	α-helix	trans	-62.6	-44	177.4	-64.6	-22.1	0	0	0	111.4	A371 K486 L488 T493 A494 Y599	A371-D490 HydrophobicContact CB-CB 4.48Å; K486-D490 VanDerWaalsContact O-CG 3.24Å; K486-D490 PolarHBondContact O-N 2.87Å; L488-D490 VanDerWaalsContact C-N 3.29Å; L488-D490 PolarHBondContact O-N 3.22Å; D490-T493 PolarHBondContact O-N 2.9Å; D490-A494 WeakPolarHBondContact O-CB 3.31Å; D490-A494 PolarHBondContact O-N 3.18Å; D490-Y599 VanDerWaalsContact OD1-CE2 3.25Å; D490-Y599 WeakPolarHBondContact OD1-CE2 3.46Å; D490-Y599 PolarHBondContact OD1-OH 3.19Å; D490-Y599 PolarHBondContact OD2-OH 3.41Å
491	V	96.9	Very high	94.4	Very high	1 Å²	1	32 Å²	32	1%	0.006	16%	0.162	C	C	.	.	H	α-helix	trans	-59.9	-48.2	172.3	171.7	0	0	0	0	111.1	A371 L374 M402 Y405 E487 L488 T493 A494 L495	A371-V491 HydrophobicContact CB-CG2 4.08Å; L374-V491 HydrophobicContact CB-CG1 4.3Å; L374-V491 HydrophobicContact CD1-CG1 3.94Å; L374-V491 HydrophobicContact CD1-CG2 3.99Å; M402-V491 HydrophobicContact CE-CG1 3.74Å; M402-V491 HydrophobicContact SD-CG1 4.01Å; Y405-V491 HydrophobicContact CD1-CG2 3.99Å; Y405-V491 HydrophobicContact CE1-CB 4.48Å; Y405-V491 HydrophobicContact CE1-CG2 3.4Å; E487-V491 WeakPolarHBondContact O-CG2 3.44Å; E487-V491 PolarHBondContact O-N 3.05Å; L488-V491 PolarHBondContact O-N 3.09Å; V491-T493 VanDerWaalsContact C-N 3.32Å; V491-T493 PolarHBondContact O-N 3.42Å; V491-A494 PolarHBondContact O-N 3.4Å; V491-L495 WeakPolarHBondContact O-CB 3.42Å; V491-L495 PolarHBondContact O-N 2.69Å
492	F	97.1	Very high	94.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.3	-36	-179	-66.3	-36.4	0	0	0	112.4	M402 I406 L484 L488 R489 A496 I512 C515 L516 V591 A592	M402-F492 HydrophobicContact CE-CD1 3.92Å; M402-F492 HydrophobicContact CE-CE1 3.34Å; M402-F492 HydrophobicContact CE-CZ 4.25Å; I406-F492 HydrophobicContact CD1-CZ 4.25Å; L484-F492 HydrophobicContact CD2-CD2 4.21Å; L484-F492 HydrophobicContact CD2-CE2 4.06Å; L488-F492 HydrophobicContact CB-CD2 4.46Å; L488-F492 HydrophobicContact CB-CE2 4.14Å; L488-F492 WeakPolarHBondContact O-CB 3.48Å; L488-F492 WeakPolarHBondContact O-CD2 3.31Å; L488-F492 VanDerWaalsContact O-CG 3.25Å; L488-F492 WeakPolarHBondContact O-CG 3.37Å; L488-F492 PolarHBondContact O-N 3.34Å; R489-F492 PolarHBondContact O-N 3.27Å; F492-A496 VanDerWaalsContact O-CB 3.23Å; F492-A496 WeakPolarHBondContact O-CB 3.31Å; F492-A496 PolarHBondContact O-N 3.03Å; F492-I512 HydrophobicContact CB-CG1 4.49Å; F492-I512 HydrophobicContact CB-CG2 4.43Å; F492-I512 HydrophobicContact CD1-CG1 4.3Å; F492-I512 HydrophobicContact CD1-CG2 3.97Å; F492-I512 HydrophobicContact CD2-CG2 4.46Å; F492-I512 HydrophobicContact CE1-CG2 4.31Å; F492-I512 HydrophobicContact CG-CG2 4.06Å; F492-C515 HydrophobicContact CE1-CB 3.81Å; F492-C515 HydrophobicContact CZ-CB 4.46Å; F492-L516 HydrophobicContact CZ-CB 4.29Å; F492-L516 HydrophobicContact CZ-CD1 4.46Å; F492-V591 HydrophobicContact CD2-CG2 4.49Å; F492-A592 HydrophobicContact CB-CB 3.98Å
493	T	96.9	Very high	93.9	Very high	12 Å²	12	35.6 Å²	35.6	7%	0.074	18%	0.181	C	C	.	.	H	α-helix	trans	-66.6	-49	173.4	-64.6	0	0	0	0	111.7	R489 D490 V491 L495 A496 L497 A592 S593 N594	R489-T493 WeakPolarHBondContact O-CB 3.27Å; R489-T493 PolarHBondContact O-N 3.28Å; R489-T493 PolarHBondContact O-OG1 3.35Å; R489-T493 VanDerWaalsContact O-OG1 3.11Å; D490-T493 PolarHBondContact O-N 2.9Å; V491-T493 VanDerWaalsContact C-N 3.32Å; V491-T493 PolarHBondContact O-N 3.42Å; T493-L495 VanDerWaalsContact C-N 3.27Å; T493-L495 PolarHBondContact O-N 2.68Å; T493-A496 PolarHBondContact O-N 3.2Å; T493-L497 HydrophobicContact CG2-CD1 4.18Å; T493-L497 WeakPolarHBondContact O-CG 3.36Å; T493-L497 PolarHBondContact O-N 3.5Å; T493-A592 VanDerWaalsContact CA-O 3.23Å; T493-A592 WeakPolarHBondContact CA-O 3.1Å; T493-A592 WeakPolarHBondContact CB-O 3.35Å; T493-A592 PolarHBondContact OG1-O 3.33Å; T493-S593 WeakPolarHBondContact OG1-CA 3.28Å; T493-S593 PolarHBondContact OG1-N 3.37Å; T493-N594 HydrophobicContact CG2-CB 4.4Å; T493-N594 PolarHBondContact OG1-N 3.05Å
494	A	96.7	Very high	93.8	Very high	24 Å²	24	32.8 Å²	32.8	20%	0.198	18%	0.176	C	C	.	.	H	α-helix	trans	-60.1	-41.2	177.4	0	0	0	0	0	111.6	A371 D490 V491 T498	A371-A494 HydrophobicContact CB-CB 3.95Å; D490-A494 WeakPolarHBondContact O-CB 3.31Å; D490-A494 PolarHBondContact O-N 3.18Å; V491-A494 PolarHBondContact O-N 3.4Å; A494-T498 WeakPolarHBondContact O-CB 3.22Å; A494-T498 PolarHBondContact O-N 2.98Å; A494-T498 PolarHBondContact O-OG1 3.07Å
495	L	94.7	Very high	93.7	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-66	-44.8	177	-172.2	64.7	0	0	0	111.9	L378 V491 T493 T498 I499 L511 I512	L378-L495 HydrophobicContact CB-CD1 3.87Å; L378-L495 HydrophobicContact CD1-CD1 3.76Å; L378-L495 HydrophobicContact CD1-CD2 3.95Å; L378-L495 HydrophobicContact CG-CD1 4.49Å; V491-L495 WeakPolarHBondContact O-CB 3.42Å; V491-L495 PolarHBondContact O-N 2.69Å; T493-L495 VanDerWaalsContact C-N 3.27Å; T493-L495 PolarHBondContact O-N 2.68Å; L495-T498 PolarHBondContact O-N 3.22Å; L495-I499 HydrophobicContact CD1-CG1 3.97Å; L495-I499 HydrophobicContact CG-CG1 4.34Å; L495-I499 WeakPolarHBondContact O-CB 3.35Å; L495-I499 WeakPolarHBondContact O-CG1 3.15Å; L495-I499 PolarHBondContact O-N 3.4Å; L495-L511 HydrophobicContact CD1-CD2 3.63Å; L495-L511 HydrophobicContact CD2-CD2 3.65Å; L495-L511 HydrophobicContact CD2-CG 4.18Å; L495-L511 HydrophobicContact CG-CD2 3.62Å; L495-I512 HydrophobicContact CD2-CG1 4.41Å
496	A	95.7	Very high	93.4	Very high	4 Å²	4	40.2 Å²	40.2	3%	0.033	21%	0.214	C	C	.	.	H	α-helix	trans	-56.1	-53.4	176.5	0	0	0	0	0	110.9	F492 T493 T498 I499 E500 I512 A592	F492-A496 VanDerWaalsContact O-CB 3.23Å; F492-A496 WeakPolarHBondContact O-CB 3.31Å; F492-A496 PolarHBondContact O-N 3.03Å; T493-A496 PolarHBondContact O-N 3.2Å; A496-T498 PolarHBondContact O-N 3Å; A496-I499 PolarHBondContact O-N 3.47Å; A496-E500 WeakPolarHBondContact O-CB 3.4Å; A496-E500 WeakPolarHBondContact O-CG 3.09Å; A496-E500 PolarHBondContact O-N 3.38Å; A496-I512 HydrophobicContact CB-CD1 3.93Å; A496-A592 HydrophobicContact CB-CB 4.17Å
497	L	95.8	Very high	93.2	Very high	98 Å²	98	38.3 Å²	38.3	51%	0.513	21%	0.208	S	C	.	.	H	α-helix	trans	-58.3	-48.6	-179.9	-66.5	173.1	0	0	0	111.8	T493 I499 E500 E501	T493-L497 HydrophobicContact CG2-CD1 4.18Å; T493-L497 WeakPolarHBondContact O-CG 3.36Å; T493-L497 PolarHBondContact O-N 3.5Å; L497-I499 VanDerWaalsContact C-N 3.27Å; L497-I499 PolarHBondContact O-N 3.42Å; L497-E500 PolarHBondContact O-N 3.21Å; L497-E501 WeakPolarHBondContact O-CG 3.36Å; L497-E501 PolarHBondContact O-N 2.95Å
498	T	93.6	Very high	93.1	Very high	22 Å²	22	37 Å²	37	14%	0.135	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-35.6	-177.9	-58.4	0	0	0	0	112.7	R379 A494 L495 A496 T502	R379-T498 HydrophobicContact CB-CG2 3.85Å; R379-T498 HydrophobicContact CG-CG2 4.14Å; A494-T498 WeakPolarHBondContact O-CB 3.22Å; A494-T498 PolarHBondContact O-N 2.98Å; A494-T498 PolarHBondContact O-OG1 3.07Å; L495-T498 PolarHBondContact O-N 3.22Å; A496-T498 PolarHBondContact O-N 3Å; T498-T502 PolarHBondContact O-OG1 2.93Å; T498-T502 VanDerWaalsContact O-OG1 3.11Å
499	I	91.4	Very high	92.9	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-91.6	-32.7	-174.6	-59.3	-72.9	0	0	0	111.1	R379 L382 L495 A496 L497 E501 T502 H503 G504 A508 L511	R379-I499 HydrophobicContact CB-CD1 4.29Å; L382-I499 HydrophobicContact CD2-CD1 3.75Å; L382-I499 HydrophobicContact CD2-CG2 4.27Å; L495-I499 HydrophobicContact CD1-CG1 3.97Å; L495-I499 HydrophobicContact CG-CG1 4.34Å; L495-I499 WeakPolarHBondContact O-CB 3.35Å; L495-I499 WeakPolarHBondContact O-CG1 3.15Å; L495-I499 PolarHBondContact O-N 3.4Å; A496-I499 PolarHBondContact O-N 3.47Å; L497-I499 VanDerWaalsContact C-N 3.27Å; L497-I499 PolarHBondContact O-N 3.42Å; I499-E501 VanDerWaalsContact C-N 3.27Å; I499-E501 PolarHBondContact O-N 3.36Å; I499-T502 PolarHBondContact O-N 3.02Å; I499-T502 VanDerWaalsContact O-N 3.13Å; I499-T502 PolarHBondContact O-OG1 3.41Å; I499-H503 HydrophobicContact CG2-CB 4.16Å; I499-H503 PolarHBondContact O-N 2.9Å; I499-G504 PolarHBondContact O-N 3.39Å; I499-A508 HydrophobicContact CB-CB 4.21Å; I499-A508 HydrophobicContact CG2-CB 4.12Å; I499-L511 HydrophobicContact CB-CD2 4.41Å; I499-L511 HydrophobicContact CD1-CD2 3.92Å; I499-L511 HydrophobicContact CG1-CD2 3.59Å; I499-L511 HydrophobicContact CG2-CD2 4.35Å
500	E	93.5	Very high	92.7	Very high	50 Å²	50	40.2 Å²	40.2	23%	0.234	22%	0.217	C	C	.	.	H	α-helix	trans	-60.8	-38.6	174.6	-79.4	179	-137	0	0	112.1	A496 L497 T502 G504 V505 A508 R589	A496-E500 WeakPolarHBondContact O-CB 3.4Å; A496-E500 WeakPolarHBondContact O-CG 3.09Å; A496-E500 PolarHBondContact O-N 3.38Å; L497-E500 PolarHBondContact O-N 3.21Å; E500-T502 PolarHBondContact O-N 3.21Å; E500-G504 WeakPolarHBondContact O-CA 3.12Å; E500-G504 PolarHBondContact O-N 3.45Å; E500-V505 HydrophobicContact CG-CG2 4.23Å; E500-A508 HydrophobicContact CG-CB 3.6Å; E500-R589 VanDerWaalsContact CD-NH1 3.3Å; E500-R589 IonicContact OE1-CZ 2.74Å; E500-R589 IonicContact OE1-NH1 2.77Å; E500-R589 PolarHBondContact OE1-NH1 3.39Å; E500-R589 IonicContact OE1-NH2 2.76Å; E500-R589 IonicContact OE2-CZ 2.87Å; E500-R589 IonicContact OE2-NH1 2.85Å; E500-R589 PolarHBondContact OE2-NH1 3.43Å; E500-R589 IonicContact OE2-NH2 3.94Å; E500-R589 PolarHBondContact OE2-NH2 2.81Å
501	E	88.8	Confident	92.4	Very high	156 Å²	156	37.8 Å²	37.8	73%	0.729	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-29	176.4	-72.8	173.7	-174.8	0	0	113.4	L497 I499	L497-E501 WeakPolarHBondContact O-CG 3.36Å; L497-E501 PolarHBondContact O-N 2.95Å; I499-E501 VanDerWaalsContact C-N 3.27Å; I499-E501 PolarHBondContact O-N 3.36Å
502	T	86.3	Confident	92.3	Very high	75 Å²	75	38 Å²	38	46%	0.46	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-36.3	-169.3	50	0	0	0	0	113.9	T498 I499 E500	T498-T502 PolarHBondContact O-OG1 2.93Å; T498-T502 VanDerWaalsContact O-OG1 3.11Å; I499-T502 PolarHBondContact O-N 3.02Å; I499-T502 VanDerWaalsContact O-N 3.13Å; I499-T502 PolarHBondContact O-OG1 3.41Å; E500-T502 PolarHBondContact O-N 3.21Å
503	H	87.3	Confident	92.1	Very high	78 Å²	78	38 Å²	38	36%	0.361	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127	-13.3	-173.3	-60.1	76.7	0	0	0	112.8	L382 I499 S507	L382-H503 HydrophobicContact CD2-CB 4.42Å; L382-H503 WeakPolarHBondContact CD2-CE1 3.33Å; L382-H503 VanDerWaalsContact CD2-ND1 3.32Å; L382-H503 WeakPolarHBondContact CD2-ND1 3.35Å; L382-H503 WeakPolarHBondContact CG-NE2 3.48Å; I499-H503 HydrophobicContact CG2-CB 4.16Å; I499-H503 PolarHBondContact O-N 2.9Å; H503-S507 PolarHBondContact O-OG 2.91Å; H503-S507 VanDerWaalsContact O-OG 3.08Å
504	G	90.3	Very high	91.9	Very high	25 Å²	25	38.5 Å²	38.5	26%	0.258	21%	0.209	S	C	.	.			trans	95.2	174.5	175.8	0	0	0	0	0	114.9	I499 E500 Q506 S507 A508	I499-G504 PolarHBondContact O-N 3.39Å; E500-G504 WeakPolarHBondContact O-CA 3.12Å; E500-G504 PolarHBondContact O-N 3.45Å; G504-Q506 PolarHBondContact O-N 3.41Å; G504-S507 PolarHBondContact O-N 2.93Å; G504-A508 PolarHBondContact O-N 2.89Å; G504-A508 VanDerWaalsContact O-N 3.16Å
505	V	91.6	Very high	91.7	Very high	58 Å²	58	37.3 Å²	37.3	35%	0.352	20%	0.2	S	C	.	.	H	α-helix	trans	-61	-42.3	-171.4	163.2	0	0	0	0	114	E500 A509 Y585	E500-V505 HydrophobicContact CG-CG2 4.23Å; V505-A509 PolarHBondContact O-N 3.35Å; V505-Y585 WeakPolarHBondContact CG1-OH 3.43Å
506	Q	89.8	Confident	91.7	Very high	102 Å²	102	37.3 Å²	37.3	48%	0.477	20%	0.199	S	C	.	.	H	α-helix	trans	-68.1	-45.1	-178.7	-66.1	-60.4	-23.4	0	0	110.6	G504 A508 A509 H510 Y585	G504-Q506 PolarHBondContact O-N 3.41Å; Q506-A508 PolarHBondContact O-N 3.4Å; Q506-A509 PolarHBondContact O-N 2.99Å; Q506-A509 VanDerWaalsContact O-N 3.16Å; Q506-H510 PolarHBondContact O-N 2.87Å; Q506-H510 PolarHBondContact O-ND1 3.23Å; Q506-Y585 PolarHBondContact NE2-OH 3.37Å
507	S	88.5	Confident	91.7	Very high	13 Å²	13	37.1 Å²	37.1	9%	0.091	20%	0.198	C	C	.	.	H	α-helix	trans	-58.4	-44.8	178.4	-55.5	0	0	0	0	112.7	E388 H503 G504 A509 H510 L511	E388-S507 WeakPolarHBondContact OE1-CB 3.37Å; E388-S507 PolarHBondContact OE1-OG 3.17Å; E388-S507 VanDerWaalsContact OE2-CA 3.24Å; E388-S507 WeakPolarHBondContact OE2-CA 3.44Å; E388-S507 VanDerWaalsContact OE2-CB 3.24Å; E388-S507 WeakPolarHBondContact OE2-CB 3.19Å; E388-S507 PolarHBondContact OE2-OG 2.93Å; H503-S507 PolarHBondContact O-OG 2.91Å; H503-S507 VanDerWaalsContact O-OG 3.08Å; G504-S507 PolarHBondContact O-N 2.93Å; S507-A509 PolarHBondContact O-N 2.93Å; S507-H510 PolarHBondContact O-N 3.27Å; S507-L511 VanDerWaalsContact O-CB 3.32Å; S507-L511 WeakPolarHBondContact O-CB 3.48Å; S507-L511 PolarHBondContact O-N 3.07Å
508	A	91.9	Very high	91.5	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.008	19%	0.185	C	C	.	.	H	α-helix	trans	-59.2	-45.3	174.7	0	0	0	0	0	112.3	I499 E500 G504 Q506 H510 L511 I512	I499-A508 HydrophobicContact CB-CB 4.21Å; I499-A508 HydrophobicContact CG2-CB 4.12Å; E500-A508 HydrophobicContact CG-CB 3.6Å; G504-A508 PolarHBondContact O-N 2.89Å; G504-A508 VanDerWaalsContact O-N 3.16Å; Q506-A508 PolarHBondContact O-N 3.4Å; A508-H510 PolarHBondContact O-N 2.85Å; A508-L511 WeakPolarHBondContact O-CB 3.16Å; A508-L511 PolarHBondContact O-N 3.32Å; A508-I512 WeakPolarHBondContact O-CD1 3.25Å; A508-I512 WeakPolarHBondContact O-CG1 3.28Å; A508-I512 PolarHBondContact O-N 3.34Å
509	A	92.8	Very high	91.4	Very high	3 Å²	3	34.9 Å²	34.9	3%	0.025	18%	0.183	C	C	.	.	H	α-helix	trans	-62.4	-43.3	177.4	0	0	0	0	0	112.4	V505 Q506 S507 L511 I512 S513 Y585	V505-A509 PolarHBondContact O-N 3.35Å; Q506-A509 PolarHBondContact O-N 2.99Å; Q506-A509 VanDerWaalsContact O-N 3.16Å; S507-A509 PolarHBondContact O-N 2.93Å; A509-L511 VanDerWaalsContact C-N 3.32Å; A509-L511 PolarHBondContact O-N 3.36Å; A509-I512 PolarHBondContact O-N 3Å; A509-S513 VanDerWaalsContact O-CB 3.31Å; A509-S513 WeakPolarHBondContact O-CB 3.22Å; A509-S513 PolarHBondContact O-N 3.49Å; A509-Y585 HydrophobicContact CB-CD2 4.18Å; A509-Y585 HydrophobicContact CB-CE2 3.54Å
510	H	91.1	Very high	91.5	Very high	64 Å²	64	34.8 Å²	34.8	30%	0.296	18%	0.183	S	C	.	.	H	α-helix	trans	-63.2	-38.8	175.8	-72.9	87.2	0	0	0	112.2	Q506 S507 A508 S513 S514	Q506-H510 PolarHBondContact O-N 2.87Å; Q506-H510 PolarHBondContact O-ND1 3.23Å; S507-H510 PolarHBondContact O-N 3.27Å; A508-H510 PolarHBondContact O-N 2.85Å; H510-S513 PolarHBondContact O-N 3.38Å; H510-S514 WeakPolarHBondContact O-CB 3.44Å; H510-S514 PolarHBondContact O-N 3.46Å; H510-S514 PolarHBondContact O-OG 3.37Å
511	L	90.2	Very high	91.7	Very high	6 Å²	6	32.5 Å²	32.5	3%	0.031	17%	0.172	C	C	.	.	H	α-helix	trans	-65.2	-47.7	178.4	-167.2	81.8	0	0	0	111.2	I391 F392 L495 I499 S507 A508 A509 S514 C515	I391-L511 HydrophobicContact CD1-CD1 3.7Å; F392-L511 HydrophobicContact CD2-CD1 4.08Å; F392-L511 HydrophobicContact CE2-CD1 3.35Å; F392-L511 HydrophobicContact CE2-CG 3.62Å; F392-L511 WeakPolarHBondContact CE2-O 3.25Å; F392-L511 HydrophobicContact CZ-CD1 4.13Å; F392-L511 HydrophobicContact CZ-CG 4.28Å; L495-L511 HydrophobicContact CD1-CD2 3.63Å; L495-L511 HydrophobicContact CD2-CD2 3.65Å; L495-L511 HydrophobicContact CD2-CG 4.18Å; L495-L511 HydrophobicContact CG-CD2 3.62Å; I499-L511 HydrophobicContact CB-CD2 4.41Å; I499-L511 HydrophobicContact CD1-CD2 3.92Å; I499-L511 HydrophobicContact CG1-CD2 3.59Å; I499-L511 HydrophobicContact CG2-CD2 4.35Å; S507-L511 VanDerWaalsContact O-CB 3.32Å; S507-L511 WeakPolarHBondContact O-CB 3.48Å; S507-L511 PolarHBondContact O-N 3.07Å; A508-L511 WeakPolarHBondContact O-CB 3.16Å; A508-L511 PolarHBondContact O-N 3.32Å; A509-L511 VanDerWaalsContact C-N 3.32Å; A509-L511 PolarHBondContact O-N 3.36Å; L511-S514 PolarHBondContact O-N 3.38Å; L511-C515 PolarHBondContact O-N 2.79Å; L511-C515 PolarHBondContact O-SG 3.11Å
512	I	93.9	Very high	92.1	Very high	4 Å²	4	25.5 Å²	25.5	2%	0.021	14%	0.14	C	C	.	.	H	α-helix	trans	-62.8	-43.8	176.4	-68.5	157.4	0	0	0	110.7	F492 L495 A496 A508 A509 S514 C515 L516 L588 V591 A592	F492-I512 HydrophobicContact CB-CG1 4.49Å; F492-I512 HydrophobicContact CB-CG2 4.43Å; F492-I512 HydrophobicContact CD1-CG1 4.3Å; F492-I512 HydrophobicContact CD1-CG2 3.97Å; F492-I512 HydrophobicContact CD2-CG2 4.46Å; F492-I512 HydrophobicContact CE1-CG2 4.31Å; F492-I512 HydrophobicContact CG-CG2 4.06Å; L495-I512 HydrophobicContact CD2-CG1 4.41Å; A496-I512 HydrophobicContact CB-CD1 3.93Å; A508-I512 WeakPolarHBondContact O-CD1 3.25Å; A508-I512 WeakPolarHBondContact O-CG1 3.28Å; A508-I512 PolarHBondContact O-N 3.34Å; A509-I512 PolarHBondContact O-N 3Å; I512-S514 VanDerWaalsContact C-N 3.31Å; I512-S514 PolarHBondContact O-N 3.49Å; I512-C515 WeakPolarHBondContact O-CB 3.36Å; I512-C515 PolarHBondContact O-N 3.23Å; I512-L516 PolarHBondContact O-N 2.67Å; I512-L588 HydrophobicContact CG2-CD2 4.17Å; I512-V591 HydrophobicContact CG2-CG2 4.41Å; I512-A592 HydrophobicContact CD1-CB 3.38Å; I512-A592 HydrophobicContact CG1-CB 4.46Å
513	S	94.3	Very high	92.5	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.007	13%	0.13	C	C	.	.	H	α-helix	trans	-58.7	-43.9	175	-172.7	0	0	0	0	111.8	A509 H510 C515 L516 F517 A558	A509-S513 VanDerWaalsContact O-CB 3.31Å; A509-S513 WeakPolarHBondContact O-CB 3.22Å; A509-S513 PolarHBondContact O-N 3.49Å; H510-S513 PolarHBondContact O-N 3.38Å; S513-C515 PolarHBondContact O-N 2.66Å; S513-L516 PolarHBondContact O-N 2.84Å; S513-F517 WeakPolarHBondContact O-CB 3.39Å; S513-F517 WeakPolarHBondContact O-CD2 3.3Å; S513-F517 PolarHBondContact O-N 3Å; S513-A558 WeakPolarHBondContact CB-O 3.39Å; S513-A558 PolarHBondContact OG-O 3.23Å
514	S	92	Very high	92.9	Very high	22 Å²	22	20 Å²	20	15%	0.154	11%	0.113	C	C	.	.	I	π-helix	trans	-64.8	-38.2	177.2	-62.8	0	0	0	0	112.3	F392 H510 L511 I512 L518 R519	F392-S514 VanDerWaalsContact CD2-CB 3.42Å; H510-S514 WeakPolarHBondContact O-CB 3.44Å; H510-S514 PolarHBondContact O-N 3.46Å; H510-S514 PolarHBondContact O-OG 3.37Å; L511-S514 PolarHBondContact O-N 3.38Å; I512-S514 VanDerWaalsContact C-N 3.31Å; I512-S514 PolarHBondContact O-N 3.49Å; S514-L518 VanDerWaalsContact O-CB 3.25Å; S514-L518 WeakPolarHBondContact O-CB 3.26Å; S514-L518 PolarHBondContact O-N 3.34Å; S514-R519 PolarHBondContact O-N 3.32Å
515	C	92.1	Very high	93.2	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.101	C	C	.	.	I	π-helix	trans	-59.6	-50.2	172.7	-63.6	0	0	0	0	111.6	F392 M402 F492 L511 I512 S513 R519	F392-C515 WeakPolarHBondContact CE2-SG 3.46Å; F392-C515 WeakPolarHBondContact CZ-SG 3.23Å; M402-C515 HydrophobicContact CE-CB 3.65Å; M402-C515 VanDerWaalsContact CE-SG 3.57Å; M402-C515 HydrophobicContact CG-CB 4.31Å; F492-C515 HydrophobicContact CE1-CB 3.81Å; F492-C515 HydrophobicContact CZ-CB 4.46Å; L511-C515 PolarHBondContact O-N 2.79Å; L511-C515 PolarHBondContact O-SG 3.11Å; I512-C515 WeakPolarHBondContact O-CB 3.36Å; I512-C515 PolarHBondContact O-N 3.23Å; S513-C515 PolarHBondContact O-N 2.66Å; C515-R519 WeakPolarHBondContact O-CB 3.41Å
516	L	94.7	Very high	93.3	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.106	C	C	.	.	I	π-helix	trans	-79.7	-45.4	-169.9	-175	59.9	0	0	0	112.5	I406 F492 I512 S513 F520 I521 F587	I406-L516 HydrophobicContact CD1-CD1 4.21Å; F492-L516 HydrophobicContact CZ-CB 4.29Å; F492-L516 HydrophobicContact CZ-CD1 4.46Å; I512-L516 PolarHBondContact O-N 2.67Å; S513-L516 PolarHBondContact O-N 2.84Å; L516-F520 HydrophobicContact CD1-CD1 4.35Å; L516-F520 WeakPolarHBondContact O-CB 3.4Å; L516-I521 HydrophobicContact CD1-CD1 3.89Å; L516-I521 HydrophobicContact CD1-CG1 4.27Å; L516-I521 HydrophobicContact CD2-CD1 4.33Å; L516-I521 HydrophobicContact CG-CD1 3.74Å; L516-I521 HydrophobicContact CG-CG1 4.4Å; L516-I521 WeakPolarHBondContact O-CG1 3.43Å; L516-I521 PolarHBondContact O-N 2.9Å; L516-F587 HydrophobicContact CD2-CE1 3.84Å; L516-F587 HydrophobicContact CD2-CZ 4.11Å
517	F	95.8	Very high	93.4	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.09	C	C	.	.	I	π-helix	trans	-90.6	-53.2	-175.7	-67.4	-88.7	0	0	0	112.2	W474 I477 S513 R519 I521 C522 P523 L554 A558 M584 F587 L588	W474-F517 HydrophobicContact CZ3-CE1 4.41Å; W474-F517 AromaticContact CZ3-CZ 3.96Å; W474-F517 HydrophobicContact CZ3-CZ 3.96Å; I477-F517 HydrophobicContact CD1-CE1 4.12Å; I477-F517 HydrophobicContact CG2-CE1 4.37Å; I477-F517 HydrophobicContact CG2-CZ 4.12Å; S513-F517 WeakPolarHBondContact O-CB 3.39Å; S513-F517 WeakPolarHBondContact O-CD2 3.3Å; S513-F517 PolarHBondContact O-N 3Å; F517-R519 PolarHBondContact O-N 2.94Å; F517-I521 HydrophobicContact CD1-CB 4.34Å; F517-I521 HydrophobicContact CD1-CD1 4.3Å; F517-I521 HydrophobicContact CD1-CG2 4.32Å; F517-I521 HydrophobicContact CE1-CD1 4.11Å; F517-I521 HydrophobicContact CZ-CD1 4.44Å; F517-C522 WeakPolarHBondContact O-CB 3.33Å; F517-C522 PolarHBondContact O-N 2.69Å; F517-P523 WeakPolarHBondContact O-CD 3.14Å; F517-L554 HydrophobicContact CD1-CD2 4.43Å; F517-L554 HydrophobicContact CD1-CG 4.28Å; F517-L554 HydrophobicContact CE1-CD1 4.42Å; F517-L554 HydrophobicContact CE1-CG 4.38Å; F517-A558 HydrophobicContact CB-CB 3.52Å; F517-A558 HydrophobicContact CD1-CB 3.87Å; F517-A558 HydrophobicContact CD2-CB 3.7Å; F517-A558 HydrophobicContact CE2-CB 4.4Å; F517-A558 HydrophobicContact CG-CB 3.4Å; F517-A558 VanDerWaalsContact CG-CB 3.4Å; F517-M584 HydrophobicContact CE1-CE 3.95Å; F517-M584 HydrophobicContact CE2-CE 4.08Å; F517-M584 HydrophobicContact CE2-SD 3.72Å; F517-M584 HydrophobicContact CZ-CE 3.62Å; F517-M584 HydrophobicContact CZ-SD 3.74Å; F517-F587 HydrophobicContact CE2-CE1 4.18Å; F517-F587 HydrophobicContact CZ-CE1 4.08Å; F517-L588 HydrophobicContact CE2-CD2 4.18Å
518	L	92.6	Very high	93.6	Very high	46 Å²	46	16.1 Å²	16.1	24%	0.241	9%	0.087	C	C	.	.	I	π-helix	trans	-70.4	-32.3	-173.7	179.7	65.9	0	0	0	112.8	F392 R393 S514 P523	F392-L518 HydrophobicContact CB-CD2 4.28Å; R393-L518 HydrophobicContact CG-CD2 4.33Å; S514-L518 VanDerWaalsContact O-CB 3.25Å; S514-L518 WeakPolarHBondContact O-CB 3.26Å; S514-L518 PolarHBondContact O-N 3.34Å; L518-P523 WeakPolarHBondContact O-CD 3.47Å; L518-P523 WeakPolarHBondContact O-CG 3.33Å
519	R	89.7	Confident	93.4	Very high	27 Å²	27	17.3 Å²	17.3	10%	0.102	9%	0.094	C	C	.	.	I	π-helix	trans	-102.7	-15.3	-177.1	-68.7	-71.2	-178.1	141.1	-0.1	115	F392 A394 E403 S514 C515 F517	F392-R519 HydrophobicContact CB-CG 4.23Å; F392-R519 HydrophobicContact CD1-CG 4.2Å; F392-R519 HydrophobicContact CG-CG 4.49Å; F392-R519 PolarHBondContact O-NE 3.28Å; F392-R519 PolarHBondContact O-NH2 2.92Å; A394-R519 PolarHBondContact O-NH2 3.15Å; E403-R519 IonicContact OE2-NH1 3.91Å; E403-R519 PolarHBondContact OE2-NH1 2.74Å; S514-R519 PolarHBondContact O-N 3.32Å; C515-R519 WeakPolarHBondContact O-CB 3.41Å; F517-R519 PolarHBondContact O-N 2.94Å
520	F	94.7	Very high	93	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.114	C	C	.	.	I	π-helix	trans	-129.6	-68.4	-173.3	-169.3	-126.6	0	0	0	113.7	I406 K407 G410 L414 L516 A524 F531	I406-F520 HydrophobicContact CD1-CB 3.76Å; I406-F520 HydrophobicContact CD1-CD1 3.86Å; I406-F520 HydrophobicContact CD1-CG 3.9Å; I406-F520 HydrophobicContact CG1-CB 4.22Å; I406-F520 HydrophobicContact CG1-CD1 3.83Å; I406-F520 HydrophobicContact CG1-CD2 4.29Å; I406-F520 HydrophobicContact CG1-CE1 4.2Å; I406-F520 HydrophobicContact CG1-CG 3.88Å; I406-F520 HydrophobicContact CG2-CB 4.11Å; I406-F520 HydrophobicContact CG2-CD2 3.98Å; I406-F520 HydrophobicContact CG2-CG 4.12Å; K407-F520 HydrophobicContact CG-CD2 4.17Å; K407-F520 HydrophobicContact CG-CE2 4.11Å; G410-F520 WeakPolarHBondContact O-CZ 3.34Å; L414-F520 HydrophobicContact CB-CE1 3.92Å; L414-F520 HydrophobicContact CB-CE2 4.47Å; L414-F520 HydrophobicContact CB-CZ 3.62Å; L414-F520 HydrophobicContact CD1-CD1 4.13Å; L414-F520 HydrophobicContact CD1-CE1 3.83Å; L414-F520 HydrophobicContact CD1-CE2 4.49Å; L414-F520 HydrophobicContact CD1-CZ 4.02Å; L414-F520 HydrophobicContact CD2-CD2 4.49Å; L414-F520 HydrophobicContact CD2-CE1 4.46Å; L414-F520 HydrophobicContact CD2-CE2 3.81Å; L414-F520 HydrophobicContact CD2-CZ 3.79Å; L414-F520 HydrophobicContact CG-CE1 4.29Å; L414-F520 HydrophobicContact CG-CE2 4.5Å; L414-F520 HydrophobicContact CG-CZ 4.03Å; L516-F520 HydrophobicContact CD1-CD1 4.35Å; L516-F520 WeakPolarHBondContact O-CB 3.4Å; F520-A524 VanDerWaalsContact O-CB 3.27Å; F520-A524 WeakPolarHBondContact O-CB 3.41Å; F520-A524 PolarHBondContact O-N 3.47Å; F520-A524 VanDerWaalsContact O-N 3.12Å; F520-F531 HydrophobicContact CD2-CD1 4.39Å; F520-F531 AromaticContact CD2-CE1 3.95Å; F520-F531 HydrophobicContact CD2-CE1 3.95Å; F520-F531 HydrophobicContact CE2-CD1 4.34Å; F520-F531 HydrophobicContact CE2-CE1 4.31Å
521	I	97.2	Very high	93	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.01	11%	0.105	C	C	.	.	I	π-helix	trans	-67.7	-54.8	-173.1	-65.5	176.4	0	0	0	112.4	L414 L418 I477 L516 F517 A524 I525 L554	L414-I521 HydrophobicContact CD1-CG1 4.35Å; L418-I521 HydrophobicContact CD1-CG2 4.34Å; I477-I521 HydrophobicContact CD1-CD1 4.25Å; I477-I521 HydrophobicContact CD1-CG2 3.92Å; I477-I521 HydrophobicContact CG1-CD1 4.46Å; I477-I521 HydrophobicContact CG2-CD1 4.35Å; L516-I521 HydrophobicContact CD1-CD1 3.89Å; L516-I521 HydrophobicContact CD1-CG1 4.27Å; L516-I521 HydrophobicContact CD2-CD1 4.33Å; L516-I521 HydrophobicContact CG-CD1 3.74Å; L516-I521 HydrophobicContact CG-CG1 4.4Å; L516-I521 WeakPolarHBondContact O-CG1 3.43Å; L516-I521 PolarHBondContact O-N 2.9Å; F517-I521 HydrophobicContact CD1-CB 4.34Å; F517-I521 HydrophobicContact CD1-CD1 4.3Å; F517-I521 HydrophobicContact CD1-CG2 4.32Å; F517-I521 HydrophobicContact CE1-CD1 4.11Å; F517-I521 HydrophobicContact CZ-CD1 4.44Å; I521-A524 WeakPolarHBondContact O-CB 3.41Å; I521-A524 PolarHBondContact O-N 3.24Å; I521-A524 VanDerWaalsContact O-N 3.13Å; I521-I525 HydrophobicContact CG2-CD1 3.98Å; I521-I525 WeakPolarHBondContact O-CG1 3.17Å; I521-I525 PolarHBondContact O-N 3Å; I521-L554 HydrophobicContact CG2-CD2 4.1Å
522	C	97.3	Very high	92.9	Very high	8 Å²	8	20.6 Å²	20.6	5%	0.054	12%	0.12	C	C	.	.	H	α-helix	trans	-66.5	-41.4	-176.3	-64	0	0	0	0	112.4	F517 A524 I525 H526 A551 Q555	F517-C522 WeakPolarHBondContact O-CB 3.33Å; F517-C522 PolarHBondContact O-N 2.69Å; C522-A524 VanDerWaalsContact C-N 3.27Å; C522-A524 PolarHBondContact O-N 3.27Å; C522-I525 PolarHBondContact O-N 3.08Å; C522-H526 WeakPolarHBondContact O-CB 3.47Å; C522-H526 PolarHBondContact O-N 3.33Å; C522-A551 HydrophobicContact CB-CB 4.46Å; C522-Q555 PolarHBondContact SG-OE1 3.47Å
523	P	95.3	Very high	92.8	Very high	38 Å²	38	21 Å²	21	25%	0.247	12%	0.122	C	C	.	.	H	α-helix	trans	-56.7	-37.8	169.1	-29.9	38	0	0	0	113.7	F517 L518 H526 G527 F531	F517-P523 WeakPolarHBondContact O-CD 3.14Å; L518-P523 WeakPolarHBondContact O-CD 3.47Å; L518-P523 WeakPolarHBondContact O-CG 3.33Å; P523-H526 PolarHBondContact O-N 2.72Å; P523-G527 PolarHBondContact O-N 3.47Å; P523-F531 HydrophobicContact CB-CE2 3.79Å; P523-F531 HydrophobicContact CB-CZ 3.66Å
524	A	96	Very high	92.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-69.5	-35.5	177.5	0	0	0	0	0	113.4	L414 L418 F520 I521 C522 G527 P528 F531 L533	L414-A524 HydrophobicContact CD1-CB 3.94Å; L414-A524 HydrophobicContact CD2-CB 3.73Å; L414-A524 HydrophobicContact CG-CB 4.23Å; L418-A524 HydrophobicContact CD1-CB 4.03Å; F520-A524 VanDerWaalsContact O-CB 3.27Å; F520-A524 WeakPolarHBondContact O-CB 3.41Å; F520-A524 PolarHBondContact O-N 3.47Å; F520-A524 VanDerWaalsContact O-N 3.12Å; I521-A524 WeakPolarHBondContact O-CB 3.41Å; I521-A524 PolarHBondContact O-N 3.24Å; I521-A524 VanDerWaalsContact O-N 3.13Å; C522-A524 VanDerWaalsContact C-N 3.27Å; C522-A524 PolarHBondContact O-N 3.27Å; A524-G527 CarbonylContact O-C 3.55Å; A524-P528 WeakPolarHBondContact O-CA 3.13Å; A524-F531 HydrophobicContact CB-CB 3.86Å; A524-F531 HydrophobicContact CB-CD1 3.76Å; A524-F531 HydrophobicContact CB-CD2 3.78Å; A524-F531 HydrophobicContact CB-CE1 4.2Å; A524-F531 HydrophobicContact CB-CE2 4.23Å; A524-F531 HydrophobicContact CB-CG 3.51Å; A524-F531 HydrophobicContact CB-CZ 4.43Å; A524-L533 HydrophobicContact CB-CD1 3.97Å
525	I	96.7	Very high	91.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-68	-46.2	173.2	-64.8	168.7	0	0	0	110.2	L418 I473 I521 C522 L547 I550 A551 L554	L418-I525 HydrophobicContact CD1-CG1 3.85Å; L418-I525 HydrophobicContact CD2-CD1 4.17Å; L418-I525 HydrophobicContact CD2-CG1 4.09Å; I473-I525 HydrophobicContact CG2-CD1 4.08Å; I521-I525 HydrophobicContact CG2-CD1 3.98Å; I521-I525 WeakPolarHBondContact O-CG1 3.17Å; I521-I525 PolarHBondContact O-N 3Å; C522-I525 PolarHBondContact O-N 3.08Å; I525-L547 HydrophobicContact CG2-CD2 4.34Å; I525-I550 HydrophobicContact CG2-CB 4.28Å; I525-I550 HydrophobicContact CG2-CG2 3.86Å; I525-A551 HydrophobicContact CB-CB 4.32Å; I525-A551 HydrophobicContact CG2-CB 4.12Å; I525-L554 HydrophobicContact CD1-CD2 3.61Å
526	H	93.7	Very high	91.3	Very high	99 Å²	99	28.9 Å²	28.9	46%	0.458	18%	0.178	S	C	.	.	H	α-helix	trans	-65.7	-41.9	-179.2	178.6	-91	0	0	0	112.6	C522 P523 A551	C522-H526 WeakPolarHBondContact O-CB 3.47Å; C522-H526 PolarHBondContact O-N 3.33Å; P523-H526 PolarHBondContact O-N 2.72Å; H526-A551 HydrophobicContact CB-CB 4.25Å
527	G	91.7	Very high	90.5	Very high	15 Å²	15	34.4 Å²	34.4	16%	0.155	21%	0.206	C	C	.	.			trans	-126.6	68	-176.2	0	0	0	0	0	112.7	P523 A524 V529 L530	P523-G527 PolarHBondContact O-N 3.47Å; A524-G527 CarbonylContact O-C 3.55Å; G527-V529 PolarHBondContact O-N 3.05Å; G527-V529 VanDerWaalsContact O-N 3.11Å; G527-L530 PolarHBondContact O-N 3.21Å
528	P	92.8	Very high	89.8	Confident	3 Å²	3	35.6 Å²	35.6	2%	0.019	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-62.4	-26.8	-168.9	24.3	-35	0	0	0	114.2	I422 A524 F531 G532 L533 A534 L547	I422-P528 HydrophobicContact CG2-CB 3.84Å; I422-P528 HydrophobicContact CG2-CG 4.36Å; A524-P528 WeakPolarHBondContact O-CA 3.13Å; P528-F531 PolarHBondContact O-N 3.41Å; P528-G532 PolarHBondContact O-N 3.26Å; P528-L533 HydrophobicContact CB-CB 3.89Å; P528-L533 WeakPolarHBondContact O-CB 3.29Å; P528-L533 PolarHBondContact O-N 2.78Å; P528-A534 HydrophobicContact CB-CB 3.93Å; P528-A534 HydrophobicContact CG-CB 4.05Å; P528-A534 PolarHBondContact O-N 3.48Å; P528-L547 HydrophobicContact CG-CD1 3.99Å
529	V	86.7	Confident	89.1	Confident	26 Å²	26	41.7 Å²	41.7	16%	0.158	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-64.4	-40.5	177.2	-177.5	0	0	0	0	111.8	G527 F531 G532 A534 S536 I537	G527-V529 PolarHBondContact O-N 3.05Å; G527-V529 VanDerWaalsContact O-N 3.11Å; V529-F531 PolarHBondContact O-N 3.25Å; V529-G532 PolarHBondContact O-N 2.95Å; V529-G532 VanDerWaalsContact O-N 3.14Å; V529-A534 HydrophobicContact CG2-CB 3.97Å; V529-S536 WeakPolarHBondContact CG2-O 3.28Å; V529-I537 HydrophobicContact CG2-CG1 4.17Å
530	L	84.8	Confident	88.9	Confident	86 Å²	86	44.1 Å²	44.1	45%	0.45	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-66.6	-20.2	-177.5	-61.6	175.3	0	0	0	112.4	G527 Y1204	G527-L530 PolarHBondContact O-N 3.21Å; L530-Y1204 HydrophobicContact CD2-CD1 4.25Å
531	F	91.2	Very high	88.6	Confident	22 Å²	22	50.7 Å²	50.7	10%	0.096	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-108.9	10.7	-179.9	-68.8	-98.2	0	0	0	112.5	K407 L414 F520 P523 A524 P528 V529 L533	K407-F531 HydrophobicContact CG-CE1 4.49Å; L414-F531 HydrophobicContact CD2-CB 3.86Å; L414-F531 HydrophobicContact CD2-CD1 3.62Å; L414-F531 HydrophobicContact CD2-CG 4.11Å; F520-F531 HydrophobicContact CD2-CD1 4.39Å; F520-F531 AromaticContact CD2-CE1 3.95Å; F520-F531 HydrophobicContact CD2-CE1 3.95Å; F520-F531 HydrophobicContact CE2-CD1 4.34Å; F520-F531 HydrophobicContact CE2-CE1 4.31Å; P523-F531 HydrophobicContact CB-CE2 3.79Å; P523-F531 HydrophobicContact CB-CZ 3.66Å; A524-F531 HydrophobicContact CB-CB 3.86Å; A524-F531 HydrophobicContact CB-CD1 3.76Å; A524-F531 HydrophobicContact CB-CD2 3.78Å; A524-F531 HydrophobicContact CB-CE1 4.2Å; A524-F531 HydrophobicContact CB-CE2 4.23Å; A524-F531 HydrophobicContact CB-CG 3.51Å; A524-F531 HydrophobicContact CB-CZ 4.43Å; P528-F531 PolarHBondContact O-N 3.41Å; V529-F531 PolarHBondContact O-N 3.25Å; F531-L533 HydrophobicContact CB-CD1 4.44Å; F531-L533 HydrophobicContact CB-CG 4.3Å; F531-L533 PolarHBondContact O-N 3.39Å
532	G	88.2	Confident	88.2	Confident	34 Å²	34	56 Å²	56	35%	0.351	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	22.1	178.6	0	0	0	0	0	114.5	P528 V529	P528-G532 PolarHBondContact O-N 3.26Å; V529-G532 PolarHBondContact O-N 2.95Å; V529-G532 VanDerWaalsContact O-N 3.14Å
533	L	91.1	Very high	88	Confident	12 Å²	12	56.4 Å²	56.4	6%	0.063	31%	0.313	C	S	.	.	S	Bend	trans	-89.6	-18.3	175.6	-59.8	177.2	0	0	0	112.4	L414 R415 L418 I422 A524 P528 F531	L414-L533 HydrophobicContact CD2-CD1 4.46Å; L414-L533 HydrophobicContact CG-CD1 4.44Å; R415-L533 HydrophobicContact CB-CD2 4.25Å; R415-L533 HydrophobicContact CG-CD2 4.38Å; L418-L533 HydrophobicContact CB-CD1 3.9Å; L418-L533 HydrophobicContact CD1-CD1 4.01Å; I422-L533 HydrophobicContact CG1-CD1 4.33Å; I422-L533 HydrophobicContact CG2-CB 4.39Å; A524-L533 HydrophobicContact CB-CD1 3.97Å; P528-L533 HydrophobicContact CB-CB 3.89Å; P528-L533 WeakPolarHBondContact O-CB 3.29Å; P528-L533 PolarHBondContact O-N 2.78Å; F531-L533 HydrophobicContact CB-CD1 4.44Å; F531-L533 HydrophobicContact CB-CG 4.3Å; F531-L533 PolarHBondContact O-N 3.39Å
534	A	88.1	Confident	87.9	Confident	14 Å²	14	56.9 Å²	56.9	12%	0.116	32%	0.317	C	S	.	.			trans	-133	152	175	0	0	0	0	0	110.7	L426 P528 V529	L426-A534 HydrophobicContact CD1-CB 3.92Å; P528-A534 HydrophobicContact CB-CB 3.93Å; P528-A534 HydrophobicContact CG-CB 4.05Å; P528-A534 PolarHBondContact O-N 3.48Å; V529-A534 HydrophobicContact CG2-CB 3.97Å
535	S	79.3	Confident	87.7	Confident	106 Å²	106	59.1 Å²	59.1	74%	0.741	33%	0.326	S	S	*	.	S	Bend	trans	-82.9	-23.6	-178.9	55.8	0	0	0	0	114.1
536	S	78.9	Confident	87.7	Confident	68 Å²	68	59.4 Å²	59.4	48%	0.476	33%	0.327	S	S	.	.	S	Bend	trans	-153.1	159.5	179.3	61.3	0	0	0	0	110.8	V529	V529-S536 WeakPolarHBondContact CG2-O 3.28Å
537	I	79.3	Confident	87.8	Confident	116 Å²	116	54.8 Å²	54.8	60%	0.595	31%	0.306	S	S	*	.			trans	-60	132	175.4	-61.5	166.9	0	0	0	107.9	V529 E539	V529-I537 HydrophobicContact CG2-CG1 4.17Å; I537-E539 PolarHBondContact O-N 3.11Å; I537-E539 VanDerWaalsContact O-N 3.11Å
538	P	80.2	Confident	88	Confident	26 Å²	26	56 Å²	56	17%	0.169	31%	0.311	C	S	.	.			trans	-56.6	118.4	177.4	-24	33.3	0	0	0	110.5	L426 N540 I543	L426-P538 HydrophobicContact CD2-CB 4.39Å; L426-P538 HydrophobicContact CD2-CG 3.84Å; P538-N540 PolarHBondContact O-N 3.5Å; P538-I543 HydrophobicContact CB-CB 4.37Å; P538-I543 HydrophobicContact CB-CG2 4.21Å
539	E	79.2	Confident	88.2	Confident	174 Å²	174	55.9 Å²	55.9	81%	0.813	31%	0.31	S	S	*	.	S	Bend	trans	-69.8	-22.7	178.1	-62.9	-174.4	168.5	0	0	111.7	I537	I537-E539 PolarHBondContact O-N 3.11Å; I537-E539 VanDerWaalsContact O-N 3.11Å
540	N	85.1	Confident	88.7	Confident	77 Å²	77	54.7 Å²	54.7	41%	0.412	30%	0.302	S	S	.	.			trans	-88.2	109.8	179.3	-172.2	-12.5	0	0	0	111	P538 R542 I543 S544	P538-N540 PolarHBondContact O-N 3.5Å; N540-R542 PolarHBondContact O-N 2.78Å; N540-R542 VanDerWaalsContact O-N 3.09Å; N540-R542 WeakPolarHBondContact OD1-CB 3.35Å; N540-R542 PolarHBondContact OD1-N 3.3Å; N540-I543 HydrophobicContact CB-CB 4.44Å; N540-I543 HydrophobicContact CB-CD1 3.93Å; N540-I543 HydrophobicContact CB-CG1 4.02Å; N540-I543 PolarHBondContact O-N 2.69Å; N540-S544 PolarHBondContact O-N 3.06Å
541	N	87.2	Confident	89.3	Confident	139 Å²	139	51 Å²	51	74%	0.743	29%	0.285	S	S	*	.	H	α-helix	trans	-53.2	-30.5	176.3	-70.8	-12.6	0	0	0	113.4	S544 R545	N541-S544 PolarHBondContact O-N 3.5Å; N541-R545 WeakPolarHBondContact O-CB 3.43Å; N541-R545 PolarHBondContact O-N 3.18Å
542	R	90.6	Very high	89.5	Confident	112 Å²	112	53 Å²	53	42%	0.423	29%	0.293	S	S	.	.	H	α-helix	trans	-63	-45.1	176.2	-172.9	-176.2	-62.6	-100.7	-13.2	111.7	D431 N540 R545 N546	D431-R542 VanDerWaalsContact CB-NH1 3.29Å; D431-R542 IonicContact OD2-CZ 3.72Å; D431-R542 IonicContact OD2-NH1 2.95Å; D431-R542 PolarHBondContact OD2-NH1 3.13Å; N540-R542 PolarHBondContact O-N 2.78Å; N540-R542 VanDerWaalsContact O-N 3.09Å; N540-R542 WeakPolarHBondContact OD1-CB 3.35Å; N540-R542 PolarHBondContact OD1-N 3.3Å; R542-R545 WeakPolarHBondContact O-CB 3.37Å; R542-R545 PolarHBondContact O-N 2.93Å; R542-N546 VanDerWaalsContact O-CG 3.25Å; R542-N546 PolarHBondContact O-N 2.75Å; R542-N546 PolarHBondContact O-OD1 3.19Å
543	I	92.1	Very high	89.9	Confident	18 Å²	18	51.4 Å²	51.4	9%	0.092	28%	0.277	C	S	.	.	H	α-helix	trans	-65.8	-45.2	179.3	-61.6	177.1	0	0	0	110	L426 P538 N540 R545 N546 L547	L426-I543 HydrophobicContact CD2-CG2 3.83Å; L426-I543 WeakPolarHBondContact O-CD1 3.44Å; P538-I543 HydrophobicContact CB-CB 4.37Å; P538-I543 HydrophobicContact CB-CG2 4.21Å; N540-I543 HydrophobicContact CB-CB 4.44Å; N540-I543 HydrophobicContact CB-CD1 3.93Å; N540-I543 HydrophobicContact CB-CG1 4.02Å; N540-I543 PolarHBondContact O-N 2.69Å; I543-R545 PolarHBondContact O-N 3.36Å; I543-N546 WeakPolarHBondContact O-CB 3.18Å; I543-N546 PolarHBondContact O-N 2.91Å; I543-L547 HydrophobicContact CG2-CD1 4.37Å; I543-L547 WeakPolarHBondContact O-CG 3.46Å; I543-L547 PolarHBondContact O-N 3.42Å
544	S	92.3	Very high	90.3	Very high	47 Å²	47	50.9 Å²	50.9	33%	0.329	27%	0.274	S	S	.	.	H	α-helix	trans	-56.4	-42.5	175.1	-172.1	0	0	0	0	111.3	N540 N541 L547 T548	N540-S544 PolarHBondContact O-N 3.06Å; N541-S544 PolarHBondContact O-N 3.5Å; S544-L547 PolarHBondContact O-N 2.93Å; S544-T548 PolarHBondContact O-N 3.02Å; S544-T548 VanDerWaalsContact O-N 3.1Å; S544-T548 PolarHBondContact O-OG1 3.15Å
545	R	93.7	Very high	90.6	Very high	48 Å²	48	51.4 Å²	51.4	18%	0.181	27%	0.274	C	S	.	.	H	α-helix	trans	-66	-42.8	177.4	176.8	57.6	177.1	148	-0.1	112.6	E433 N541 R542 I543 L547 T548 L549	E433-R545 IonicContact OE1-CZ 3.21Å; E433-R545 IonicContact OE1-NE 3.48Å; E433-R545 IonicContact OE1-NH2 2.59Å; E433-R545 PolarHBondContact OE1-NH2 3.12Å; E433-R545 IonicContact OE2-CZ 2.92Å; E433-R545 IonicContact OE2-NE 3.41Å; E433-R545 PolarHBondContact OE2-NE 3.29Å; E433-R545 IonicContact OE2-NH2 2.79Å; E433-R545 PolarHBondContact OE2-NH2 3.17Å; N541-R545 WeakPolarHBondContact O-CB 3.43Å; N541-R545 PolarHBondContact O-N 3.18Å; R542-R545 WeakPolarHBondContact O-CB 3.37Å; R542-R545 PolarHBondContact O-N 2.93Å; I543-R545 PolarHBondContact O-N 3.36Å; R545-L547 VanDerWaalsContact C-N 3.32Å; R545-L547 PolarHBondContact O-N 3.5Å; R545-T548 WeakPolarHBondContact O-CB 3.31Å; R545-T548 PolarHBondContact O-N 3.25Å; R545-L549 HydrophobicContact CG-CD1 4.46Å; R545-L549 VanDerWaalsContact CZ-CD2 3.49Å; R545-L549 VanDerWaalsContact NH1-CD2 3.34Å; R545-L549 PolarHBondContact O-N 3.03Å
546	N	95.4	Very high	91.3	Very high	5 Å²	5	47.2 Å²	47.2	3%	0.027	24%	0.243	C	C	.	.	H	α-helix	trans	-57.8	-45.5	175.9	-74.5	-1	0	0	0	111.4	D430 F432 R542 I543 T548 L549 I550	D430-N546 PolarHBondContact O-ND2 2.71Å; F432-N546 HydrophobicContact CB-CB 4.38Å; F432-N546 WeakPolarHBondContact CB-OD1 3.2Å; F432-N546 HydrophobicContact CD2-CB 3.39Å; F432-N546 VanDerWaalsContact CD2-CG 3.48Å; F432-N546 HydrophobicContact CE2-CB 3.76Å; F432-N546 HydrophobicContact CG-CB 4.06Å; F432-N546 PolarHBondContact N-OD1 3.06Å; R542-N546 VanDerWaalsContact O-CG 3.25Å; R542-N546 PolarHBondContact O-N 2.75Å; R542-N546 PolarHBondContact O-OD1 3.19Å; I543-N546 WeakPolarHBondContact O-CB 3.18Å; I543-N546 PolarHBondContact O-N 2.91Å; N546-T548 PolarHBondContact O-N 3.12Å; N546-L549 PolarHBondContact O-N 3.29Å; N546-I550 WeakPolarHBondContact O-CG1 3.04Å; N546-I550 PolarHBondContact O-N 3.11Å
547	L	96.2	Very high	92.2	Very high	2 Å²	2	44 Å²	44	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-61.8	-41.5	176	-68.7	174.3	0	0	0	112	I422 L425 I525 P528 I543 S544 R545 L549 I550 A551	I422-L547 HydrophobicContact CD1-CD2 3.77Å; L425-L547 HydrophobicContact CB-CD2 4.44Å; L425-L547 HydrophobicContact CD1-CD2 3.97Å; I525-L547 HydrophobicContact CG2-CD2 4.34Å; P528-L547 HydrophobicContact CG-CD1 3.99Å; I543-L547 HydrophobicContact CG2-CD1 4.37Å; I543-L547 WeakPolarHBondContact O-CG 3.46Å; I543-L547 PolarHBondContact O-N 3.42Å; S544-L547 PolarHBondContact O-N 2.93Å; R545-L547 VanDerWaalsContact C-N 3.32Å; R545-L547 PolarHBondContact O-N 3.5Å; L547-L549 VanDerWaalsContact C-N 3.33Å; L547-L549 PolarHBondContact O-N 2.81Å; L547-I550 PolarHBondContact O-N 3.15Å; L547-A551 WeakPolarHBondContact O-CB 3.45Å; L547-A551 PolarHBondContact O-N 3.05Å
548	T	95.6	Very high	92.9	Very high	42 Å²	42	38.5 Å²	38.5	26%	0.258	19%	0.192	S	C	.	.	H	α-helix	trans	-60.1	-42.7	174	-53.2	0	0	0	0	112	S544 R545 N546 K552	S544-T548 PolarHBondContact O-N 3.02Å; S544-T548 VanDerWaalsContact O-N 3.1Å; S544-T548 PolarHBondContact O-OG1 3.15Å; R545-T548 WeakPolarHBondContact O-CB 3.31Å; R545-T548 PolarHBondContact O-N 3.25Å; N546-T548 PolarHBondContact O-N 3.12Å; T548-K552 WeakPolarHBondContact O-CB 3.14Å; T548-K552 PolarHBondContact O-N 3.33Å
549	L	96.4	Very high	93.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.2	-45	179.8	-74.3	176	0	0	0	111.8	F432 L466 R545 N546 L547 A551 K552 V553 M570	F432-L549 HydrophobicContact CB-CD1 4.1Å; F432-L549 WeakPolarHBondContact O-CD1 3.35Å; L466-L549 HydrophobicContact CD1-CB 4Å; L466-L549 HydrophobicContact CD2-CB 4.36Å; R545-L549 HydrophobicContact CG-CD1 4.46Å; R545-L549 VanDerWaalsContact CZ-CD2 3.49Å; R545-L549 VanDerWaalsContact NH1-CD2 3.34Å; R545-L549 PolarHBondContact O-N 3.03Å; N546-L549 PolarHBondContact O-N 3.29Å; L547-L549 VanDerWaalsContact C-N 3.33Å; L547-L549 PolarHBondContact O-N 2.81Å; L549-A551 PolarHBondContact O-N 3.38Å; L549-K552 PolarHBondContact O-N 3.04Å; L549-V553 WeakPolarHBondContact O-CG2 3.05Å; L549-V553 PolarHBondContact O-N 3.21Å; L549-V553 VanDerWaalsContact O-N 3.09Å; L549-M570 HydrophobicContact CD2-CE 3.55Å; L549-M570 HydrophobicContact CD2-SD 4.45Å
550	I	97.5	Very high	94.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-57	-52.1	174.8	-70.4	171.2	0	0	0	110.6	L425 F432 L466 N469 V470 I473 I525 N546 L547 K552 V553 L554	L425-I550 HydrophobicContact CD1-CD1 3.57Å; L425-I550 HydrophobicContact CD2-CD1 4.02Å; L425-I550 HydrophobicContact CG-CD1 4.47Å; F432-I550 HydrophobicContact CD2-CD1 4.13Å; F432-I550 HydrophobicContact CD2-CG1 4.23Å; F432-I550 HydrophobicContact CE2-CD1 3.7Å; F432-I550 HydrophobicContact CE2-CG1 4.27Å; L466-I550 HydrophobicContact CD1-CG1 3.77Å; N469-I550 HydrophobicContact CB-CD1 4.07Å; V470-I550 HydrophobicContact CG2-CB 4.38Å; V470-I550 HydrophobicContact CG2-CG1 4.21Å; V470-I550 HydrophobicContact CG2-CG2 4.24Å; I473-I550 HydrophobicContact CD1-CD1 4.39Å; I473-I550 HydrophobicContact CD1-CG2 3.47Å; I473-I550 VanDerWaalsContact CD1-CG2 3.47Å; I525-I550 HydrophobicContact CG2-CB 4.28Å; I525-I550 HydrophobicContact CG2-CG2 3.86Å; N546-I550 WeakPolarHBondContact O-CG1 3.04Å; N546-I550 PolarHBondContact O-N 3.11Å; L547-I550 PolarHBondContact O-N 3.15Å; I550-K552 PolarHBondContact O-N 2.78Å; I550-V553 PolarHBondContact O-N 3.28Å; I550-L554 WeakPolarHBondContact O-CB 3.35Å; I550-L554 PolarHBondContact O-N 3.27Å
551	A	97.5	Very high	94.4	Very high	10 Å²	10	31.7 Å²	31.7	8%	0.083	16%	0.162	C	C	.	.	H	α-helix	trans	-58.9	-37	-179.4	0	0	0	0	0	111.7	C522 I525 H526 L547 L549 Q555	C522-A551 HydrophobicContact CB-CB 4.46Å; I525-A551 HydrophobicContact CB-CB 4.32Å; I525-A551 HydrophobicContact CG2-CB 4.12Å; H526-A551 HydrophobicContact CB-CB 4.25Å; L547-A551 WeakPolarHBondContact O-CB 3.45Å; L547-A551 PolarHBondContact O-N 3.05Å; L549-A551 PolarHBondContact O-N 3.38Å; A551-Q555 WeakPolarHBondContact O-CB 3.39Å; A551-Q555 PolarHBondContact O-N 2.92Å
552	K	95.9	Very high	94.7	Very high	64 Å²	64	28.1 Å²	28.1	28%	0.278	14%	0.143	S	C	.	.	H	α-helix	trans	-66.7	-45.8	179	-172.7	178.1	-177.6	-176.6	0	112.9	T548 L549 I550 Q555 N556 F563 E567	T548-K552 WeakPolarHBondContact O-CB 3.14Å; T548-K552 PolarHBondContact O-N 3.33Å; L549-K552 PolarHBondContact O-N 3.04Å; I550-K552 PolarHBondContact O-N 2.78Å; K552-Q555 PolarHBondContact O-N 3.27Å; K552-N556 PolarHBondContact O-N 2.88Å; K552-F563 HydrophobicContact CG-CE1 4.46Å; K552-E567 VanDerWaalsContact CE-CD 3.46Å; K552-E567 WeakPolarHBondContact CE-OE1 3.14Å; K552-E567 WeakPolarHBondContact CE-OE2 3.4Å; K552-E567 IonicContact NZ-OE1 2.88Å; K552-E567 PolarHBondContact NZ-OE1 3.48Å; K552-E567 IonicContact NZ-OE2 2.71Å; K552-E567 PolarHBondContact NZ-OE2 2.9Å
553	V	97.5	Very high	94.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-65.3	-46.2	178.6	-177.9	0	0	0	0	110.3	L466 V470 L549 I550 Q555 N556 L557 F563 L573 I577	L466-V553 HydrophobicContact CD2-CG2 4.25Å; V470-V553 HydrophobicContact CG1-CB 4.36Å; V470-V553 HydrophobicContact CG1-CG1 3.89Å; V470-V553 HydrophobicContact CG2-CB 4.04Å; V470-V553 HydrophobicContact CG2-CG1 4.21Å; L549-V553 WeakPolarHBondContact O-CG2 3.05Å; L549-V553 PolarHBondContact O-N 3.21Å; L549-V553 VanDerWaalsContact O-N 3.09Å; I550-V553 PolarHBondContact O-N 3.28Å; V553-Q555 VanDerWaalsContact C-N 3.33Å; V553-Q555 PolarHBondContact O-N 3.34Å; V553-N556 PolarHBondContact O-N 2.93Å; V553-L557 PolarHBondContact O-N 3.49Å; V553-L557 VanDerWaalsContact O-N 3.1Å; V553-F563 HydrophobicContact CG2-CZ 4.48Å; V553-L573 HydrophobicContact CG1-CD1 4.47Å; V553-L573 HydrophobicContact CG2-CD1 3.46Å; V553-L573 VanDerWaalsContact CG2-CD1 3.46Å; V553-I577 HydrophobicContact CG1-CD1 4.25Å; V553-I577 HydrophobicContact CG1-CG1 4.42Å
554	L	97.5	Very high	94.7	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-64	-38.6	178.3	-172.1	64.5	0	0	0	111.9	I473 W474 I477 F517 I521 I525 I550 N556 L557 A558	I473-L554 HydrophobicContact CG2-CD2 4.02Å; W474-L554 HydrophobicContact CB-CD1 4.38Å; W474-L554 HydrophobicContact CE3-CD1 4.32Å; I477-L554 HydrophobicContact CD1-CD2 3.94Å; F517-L554 HydrophobicContact CD1-CD2 4.43Å; F517-L554 HydrophobicContact CD1-CG 4.28Å; F517-L554 HydrophobicContact CE1-CD1 4.42Å; F517-L554 HydrophobicContact CE1-CG 4.38Å; I521-L554 HydrophobicContact CG2-CD2 4.1Å; I525-L554 HydrophobicContact CD1-CD2 3.61Å; I550-L554 WeakPolarHBondContact O-CB 3.35Å; I550-L554 PolarHBondContact O-N 3.27Å; L554-N556 VanDerWaalsContact C-N 3.33Å; L554-N556 PolarHBondContact O-N 3.05Å; L554-L557 HydrophobicContact CD1-CD2 4.5Å; L554-L557 PolarHBondContact O-N 3.12Å; L554-A558 WeakPolarHBondContact O-CB 3.39Å; L554-A558 PolarHBondContact O-N 2.9Å
555	Q	95.6	Very high	94.3	Very high	25 Å²	25	32 Å²	32	12%	0.117	16%	0.164	C	C	.	.	H	α-helix	trans	-64.9	-37.1	175.6	-172.5	61.2	57.3	0	0	112	C522 A551 K552 V553 A558 N559	C522-Q555 PolarHBondContact SG-OE1 3.47Å; A551-Q555 WeakPolarHBondContact O-CB 3.39Å; A551-Q555 PolarHBondContact O-N 2.92Å; K552-Q555 PolarHBondContact O-N 3.27Å; V553-Q555 VanDerWaalsContact C-N 3.33Å; V553-Q555 PolarHBondContact O-N 3.34Å; Q555-A558 PolarHBondContact O-N 3.34Å; Q555-N559 PolarHBondContact NE2-OD1 3.09Å; Q555-N559 WeakPolarHBondContact O-CB 3.41Å; Q555-N559 PolarHBondContact O-N 2.69Å; Q555-N559 PolarHBondContact O-ND2 3.48Å; Q555-N559 PolarHBondContact O-OD1 3.47Å
556	N	94.2	Very high	93.7	Very high	18 Å²	18	38.6 Å²	38.6	10%	0.096	19%	0.194	C	C	.	.	H	α-helix	trans	-67.6	-40.9	177.9	-158.5	44.4	0	0	0	111.5	K552 V553 L554 N559 L560 T561 F563 I577	K552-N556 PolarHBondContact O-N 2.88Å; V553-N556 PolarHBondContact O-N 2.93Å; L554-N556 VanDerWaalsContact C-N 3.33Å; L554-N556 PolarHBondContact O-N 3.05Å; N556-N559 PolarHBondContact O-N 3.41Å; N556-L560 PolarHBondContact O-N 2.84Å; N556-T561 PolarHBondContact ND2-O 3.03Å; N556-T561 PolarHBondContact O-N 3.35Å; N556-T561 PolarHBondContact OD1-O 2.89Å; N556-T561 PolarHBondContact OD1-OG1 3Å; N556-F563 HydrophobicContact CB-CE1 4Å; N556-F563 HydrophobicContact CB-CE2 4.15Å; N556-F563 HydrophobicContact CB-CZ 3.71Å; N556-F563 WeakPolarHBondContact ND2-CD2 3.44Å; N556-F563 WeakPolarHBondContact ND2-CG 3.35Å; N556-F563 PolarHBondContact ND2-N 3.23Å; N556-I577 HydrophobicContact CB-CD1 4.21Å
557	L	96.8	Very high	93.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.2	-45.8	170.2	176.9	61.9	0	0	0	111.6	W474 V553 L554 N559 L560 F576 I577 E580 I581 M584	W474-L557 HydrophobicContact CD2-CD2 4.01Å; W474-L557 HydrophobicContact CG-CD2 4.12Å; V553-L557 PolarHBondContact O-N 3.49Å; V553-L557 VanDerWaalsContact O-N 3.1Å; L554-L557 HydrophobicContact CD1-CD2 4.5Å; L554-L557 PolarHBondContact O-N 3.12Å; L557-N559 VanDerWaalsContact C-N 3.31Å; L557-N559 PolarHBondContact O-N 2.89Å; L557-L560 PolarHBondContact O-N 2.92Å; L557-F576 HydrophobicContact CD2-CE1 4.41Å; L557-I577 HydrophobicContact CB-CG2 4.36Å; L557-I577 HydrophobicContact CD1-CG2 4.09Å; L557-E580 HydrophobicContact CD1-CB 3.73Å; L557-E580 HydrophobicContact CD2-CB 4.16Å; L557-I581 HydrophobicContact CD1-CG1 4.08Å; L557-M584 HydrophobicContact CD1-CB 4.25Å; L557-M584 HydrophobicContact CD2-CE 3.91Å; L557-M584 HydrophobicContact CG-CB 4.38Å; L557-M584 HydrophobicContact CG-CE 3.72Å
558	A	95	Very high	92.9	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.4	-31.8	178.4	0	0	0	0	0	113.3	S513 F517 L554 Q555 L560 M584	S513-A558 WeakPolarHBondContact CB-O 3.39Å; S513-A558 PolarHBondContact OG-O 3.23Å; F517-A558 HydrophobicContact CB-CB 3.52Å; F517-A558 HydrophobicContact CD1-CB 3.87Å; F517-A558 HydrophobicContact CD2-CB 3.7Å; F517-A558 HydrophobicContact CE2-CB 4.4Å; F517-A558 HydrophobicContact CG-CB 3.4Å; F517-A558 VanDerWaalsContact CG-CB 3.4Å; L554-A558 WeakPolarHBondContact O-CB 3.39Å; L554-A558 PolarHBondContact O-N 2.9Å; Q555-A558 PolarHBondContact O-N 3.34Å; A558-L560 PolarHBondContact O-N 2.87Å; A558-M584 HydrophobicContact CB-CE 4.24Å
559	N	92	Very high	92.5	Very high	43 Å²	43	47.8 Å²	47.8	23%	0.23	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-7	173	-66.7	-15	0	0	0	112.9	Q555 N556 L557 T561	Q555-N559 PolarHBondContact NE2-OD1 3.09Å; Q555-N559 WeakPolarHBondContact O-CB 3.41Å; Q555-N559 PolarHBondContact O-N 2.69Å; Q555-N559 PolarHBondContact O-ND2 3.48Å; Q555-N559 PolarHBondContact O-OD1 3.47Å; N556-N559 PolarHBondContact O-N 3.41Å; L557-N559 VanDerWaalsContact C-N 3.31Å; L557-N559 PolarHBondContact O-N 2.89Å; N559-T561 HydrophobicContact CB-CG2 4.47Å; N559-T561 WeakPolarHBondContact CB-OG1 3.47Å; N559-T561 PolarHBondContact O-N 2.94Å
560	L	91.6	Very high	92.3	Very high	28 Å²	28	47.8 Å²	47.8	15%	0.147	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	32.2	-175.1	-48.5	173.5	0	0	0	112.3	N556 L557 A558 I581 M584 Y585	N556-L560 PolarHBondContact O-N 2.84Å; L557-L560 PolarHBondContact O-N 2.92Å; A558-L560 PolarHBondContact O-N 2.87Å; L560-I581 HydrophobicContact CD2-CG2 4.22Å; L560-M584 HydrophobicContact CD2-CB 4.17Å; L560-M584 HydrophobicContact CD2-CG 3.7Å; L560-Y585 HydrophobicContact CD1-CD2 3.94Å
561	T	91.9	Very high	92	Very high	64 Å²	64	51 Å²	51	39%	0.393	25%	0.25	S	S	.	.			trans	-123.2	148.1	-177.6	52.6	0	0	0	0	111.7	N556 N559	N556-T561 PolarHBondContact ND2-O 3.03Å; N556-T561 PolarHBondContact O-N 3.35Å; N556-T561 PolarHBondContact OD1-O 2.89Å; N556-T561 PolarHBondContact OD1-OG1 3Å; N559-T561 HydrophobicContact CB-CG2 4.47Å; N559-T561 WeakPolarHBondContact CB-OG1 3.47Å; N559-T561 PolarHBondContact O-N 2.94Å
562	L	93.3	Very high	91.7	Very high	64 Å²	64	53.1 Å²	53.1	34%	0.335	27%	0.268	S	S	.	.			trans	-88.8	156.4	172.5	-59.5	-177.9	0	0	0	111	E564 N574 I577 E578 I581	L562-E564 PolarHBondContact O-N 3.2Å; L562-N574 HydrophobicContact CD2-CB 4.35Å; L562-I577 HydrophobicContact CD2-CB 4.22Å; L562-I577 HydrophobicContact CD2-CG2 3.85Å; L562-E578 HydrophobicContact CD1-CG 4.47Å; L562-E578 HydrophobicContact CD2-CB 3.89Å; L562-E578 HydrophobicContact CD2-CG 4.48Å; L562-I581 HydrophobicContact CD2-CD1 3.92Å
563	F	93.2	Very high	91.7	Very high	10 Å²	10	50.1 Å²	50.1	4%	0.044	26%	0.255	C	S	.	.			trans	-68.4	130.2	172.9	-72.6	-69.8	0	0	0	110.9	K552 V553 N556 E567 M570 K571 L573 N574 I577	K552-F563 HydrophobicContact CG-CE1 4.46Å; V553-F563 HydrophobicContact CG2-CZ 4.48Å; N556-F563 HydrophobicContact CB-CE1 4Å; N556-F563 HydrophobicContact CB-CE2 4.15Å; N556-F563 HydrophobicContact CB-CZ 3.71Å; N556-F563 WeakPolarHBondContact ND2-CD2 3.44Å; N556-F563 WeakPolarHBondContact ND2-CG 3.35Å; N556-F563 PolarHBondContact ND2-N 3.23Å; F563-E567 HydrophobicContact CD1-CB 4.38Å; F563-E567 WeakPolarHBondContact CD1-OE2 3.32Å; F563-E567 VanDerWaalsContact CE1-OE2 3.24Å; F563-E567 WeakPolarHBondContact CE1-OE2 3.46Å; F563-M570 HydrophobicContact CB-CB 4.32Å; F563-M570 HydrophobicContact CD1-CB 3.83Å; F563-M570 HydrophobicContact CD2-CB 3.91Å; F563-M570 WeakPolarHBondContact CD2-O 3.2Å; F563-M570 HydrophobicContact CE1-CB 4.06Å; F563-M570 HydrophobicContact CE1-CG 4.4Å; F563-M570 HydrophobicContact CE2-CB 4.1Å; F563-M570 HydrophobicContact CG-CB 3.76Å; F563-M570 HydrophobicContact CZ-CB 4.19Å; F563-K571 HydrophobicContact CB-CG 4.46Å; F563-L573 HydrophobicContact CD2-CB 4.41Å; F563-L573 HydrophobicContact CE2-CB 4.28Å; F563-L573 HydrophobicContact CE2-CD1 4.27Å; F563-N574 PolarHBondContact N-OD1 3.42Å; F563-N574 PolarHBondContact O-ND2 3.36Å; F563-N574 VanDerWaalsContact O-ND2 3.11Å; F563-I577 HydrophobicContact CD2-CD1 3.66Å; F563-I577 HydrophobicContact CE2-CD1 3.39Å; F563-I577 HydrophobicContact CZ-CD1 4.38Å
564	E	90.3	Very high	91.6	Very high	132 Å²	132	51.2 Å²	51.2	62%	0.617	26%	0.261	S	S	*	.			trans	-92.4	-178.8	179.8	-62.4	-178.7	173.8	0	0	113	L562 K566 E567 K571	L562-E564 PolarHBondContact O-N 3.2Å; E564-K566 PolarHBondContact O-N 3.41Å; E564-K566 VanDerWaalsContact O-N 3.14Å; E564-E567 PolarHBondContact O-N 2.79Å; E564-E567 VanDerWaalsContact O-N 3.12Å; E564-K571 VanDerWaalsContact O-CE 3.29Å; E564-K571 WeakPolarHBondContact O-CE 3.49Å
565	D	82.5	Confident	91.5	Very high	115 Å²	115	55.1 Å²	55.1	62%	0.615	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-62.6	-14.6	178.4	-73.7	-69.2	0	0	0	115.1	E567 I568 K571	D565-E567 PolarHBondContact O-N 2.66Å; D565-I568 WeakPolarHBondContact O-CG1 3.31Å; D565-K571 VanDerWaalsContact N-CE 3.26Å; D565-K571 WeakPolarHBondContact OD1-CE 3.33Å; D565-K571 IonicContact OD1-NZ 3.38Å; D565-K571 PolarHBondContact OD1-NZ 3.15Å; D565-K571 IonicContact OD2-NZ 2.97Å; D565-K571 PolarHBondContact OD2-NZ 3.11Å
566	K	82.7	Confident	91.5	Very high	187 Å²	187	55.3 Å²	55.3	81%	0.813	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-67.8	-24.9	173.4	-67	178.5	-177.9	169.5	0	112.3	E564	E564-K566 PolarHBondContact O-N 3.41Å; E564-K566 VanDerWaalsContact O-N 3.14Å
567	E	86.4	Confident	91.6	Very high	61 Å²	61	54.5 Å²	54.5	29%	0.285	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-125.7	53.7	-174.8	-52.4	-161.9	133.9	0	0	110.4	K552 F563 E564 D565 H569 M570 K571	K552-E567 VanDerWaalsContact CE-CD 3.46Å; K552-E567 WeakPolarHBondContact CE-OE1 3.14Å; K552-E567 WeakPolarHBondContact CE-OE2 3.4Å; K552-E567 IonicContact NZ-OE1 2.88Å; K552-E567 PolarHBondContact NZ-OE1 3.48Å; K552-E567 IonicContact NZ-OE2 2.71Å; K552-E567 PolarHBondContact NZ-OE2 2.9Å; F563-E567 HydrophobicContact CD1-CB 4.38Å; F563-E567 WeakPolarHBondContact CD1-OE2 3.32Å; F563-E567 VanDerWaalsContact CE1-OE2 3.24Å; F563-E567 WeakPolarHBondContact CE1-OE2 3.46Å; E564-E567 PolarHBondContact O-N 2.79Å; E564-E567 VanDerWaalsContact O-N 3.12Å; D565-E567 PolarHBondContact O-N 2.66Å; E567-H569 PolarHBondContact O-N 2.87Å; E567-H569 VanDerWaalsContact O-N 3.07Å; E567-M570 HydrophobicContact CB-CB 4.13Å; E567-M570 HydrophobicContact CB-CG 4.27Å; E567-M570 WeakPolarHBondContact O-CA 3.32Å; E567-M570 WeakPolarHBondContact O-CB 3.15Å; E567-M570 PolarHBondContact O-N 3.34Å; E567-K571 PolarHBondContact O-N 3.44Å
568	I	87	Confident	91.5	Very high	123 Å²	123	60.3 Å²	60.3	63%	0.631	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-47.3	-43.9	-173.3	-54	177	0	0	0	112.5	D565 M570 K571	D565-I568 WeakPolarHBondContact O-CG1 3.31Å; I568-M570 PolarHBondContact O-N 2.85Å; I568-K571 WeakPolarHBondContact O-CB 3.45Å; I568-K571 PolarHBondContact O-N 3.11Å
569	H	88	Confident	91.6	Very high	59 Å²	59	64.1 Å²	64.1	27%	0.273	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-66.3	-21.8	-179.7	63.9	-78.9	0	0	0	113.8	I434 E567	I434-H569 WeakPolarHBondContact CD1-O 3.41Å; E567-H569 PolarHBondContact O-N 2.87Å; E567-H569 VanDerWaalsContact O-N 3.07Å
570	M	91.5	Very high	91.9	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-90.7	-16.4	176.1	-63.5	-79.3	138.8	0	0	113	I434 L549 F563 E567 I568 A572 L573	I434-M570 HydrophobicContact CD1-CE 3.38Å; I434-M570 HydrophobicContact CD1-SD 3.75Å; I434-M570 HydrophobicContact CG1-CE 3.24Å; I434-M570 HydrophobicContact CG1-SD 4.29Å; L549-M570 HydrophobicContact CD2-CE 3.55Å; L549-M570 HydrophobicContact CD2-SD 4.45Å; F563-M570 HydrophobicContact CB-CB 4.32Å; F563-M570 HydrophobicContact CD1-CB 3.83Å; F563-M570 HydrophobicContact CD2-CB 3.91Å; F563-M570 WeakPolarHBondContact CD2-O 3.2Å; F563-M570 HydrophobicContact CE1-CB 4.06Å; F563-M570 HydrophobicContact CE1-CG 4.4Å; F563-M570 HydrophobicContact CE2-CB 4.1Å; F563-M570 HydrophobicContact CG-CB 3.76Å; F563-M570 HydrophobicContact CZ-CB 4.19Å; E567-M570 HydrophobicContact CB-CB 4.13Å; E567-M570 HydrophobicContact CB-CG 4.27Å; E567-M570 WeakPolarHBondContact O-CA 3.32Å; E567-M570 WeakPolarHBondContact O-CB 3.15Å; E567-M570 PolarHBondContact O-N 3.34Å; I568-M570 PolarHBondContact O-N 2.85Å; M570-A572 PolarHBondContact O-N 3.36Å; M570-A572 VanDerWaalsContact O-N 3.13Å; M570-L573 HydrophobicContact CB-CD1 4.4Å; M570-L573 WeakPolarHBondContact O-CB 3.33Å; M570-L573 WeakPolarHBondContact O-CG 3.36Å; M570-L573 PolarHBondContact O-N 3.09Å; M570-L573 HydrophobicContact SD-CD1 3.62Å
571	K	92.1	Very high	92.1	Very high	67 Å²	67	65 Å²	65	29%	0.291	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-55.6	-33.2	-179	-78.7	-167.6	164.2	-169.6	0	113.6	F563 E564 D565 E567 I568 L573 N574	F563-K571 HydrophobicContact CB-CG 4.46Å; E564-K571 VanDerWaalsContact O-CE 3.29Å; E564-K571 WeakPolarHBondContact O-CE 3.49Å; D565-K571 VanDerWaalsContact N-CE 3.26Å; D565-K571 WeakPolarHBondContact OD1-CE 3.33Å; D565-K571 IonicContact OD1-NZ 3.38Å; D565-K571 PolarHBondContact OD1-NZ 3.15Å; D565-K571 IonicContact OD2-NZ 2.97Å; D565-K571 PolarHBondContact OD2-NZ 3.11Å; E567-K571 PolarHBondContact O-N 3.44Å; I568-K571 WeakPolarHBondContact O-CB 3.45Å; I568-K571 PolarHBondContact O-N 3.11Å; K571-L573 PolarHBondContact O-N 3.03Å; K571-L573 VanDerWaalsContact O-N 3.09Å; K571-N574 VanDerWaalsContact O-CB 3.27Å; K571-N574 WeakPolarHBondContact O-CB 3.23Å; K571-N574 PolarHBondContact O-N 3.08Å
572	A	91.6	Very high	92.3	Very high	55 Å²	55	66 Å²	66	46%	0.455	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-58.7	-22.6	176.6	0	0	0	0	0	113.1	M570 N574 S575	M570-A572 PolarHBondContact O-N 3.36Å; M570-A572 VanDerWaalsContact O-N 3.13Å; A572-N574 VanDerWaalsContact C-N 3.31Å; A572-S575 PolarHBondContact O-OG 3.45Å
573	L	95	Very high	92.5	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-78.7	-12.6	177.7	-50.6	178.2	0	0	0	113	I434 R463 L466 L467 V553 F563 M570 K571 S575 F576 I577	I434-L573 HydrophobicContact CD1-CD1 3.78Å; I434-L573 HydrophobicContact CD1-CD2 4.12Å; I434-L573 HydrophobicContact CD1-CG 4.05Å; R463-L573 HydrophobicContact CG-CD2 3.8Å; L466-L573 HydrophobicContact CD2-CD1 4.11Å; L466-L573 HydrophobicContact CD2-CD2 4.49Å; L467-L573 HydrophobicContact CD1-CD2 4.08Å; L467-L573 HydrophobicContact CD2-CB 4.39Å; L467-L573 HydrophobicContact CD2-CD2 3.73Å; L467-L573 HydrophobicContact CG-CD2 3.79Å; V553-L573 HydrophobicContact CG1-CD1 4.47Å; V553-L573 HydrophobicContact CG2-CD1 3.46Å; V553-L573 VanDerWaalsContact CG2-CD1 3.46Å; F563-L573 HydrophobicContact CD2-CB 4.41Å; F563-L573 HydrophobicContact CE2-CB 4.28Å; F563-L573 HydrophobicContact CE2-CD1 4.27Å; M570-L573 HydrophobicContact CB-CD1 4.4Å; M570-L573 WeakPolarHBondContact O-CB 3.33Å; M570-L573 WeakPolarHBondContact O-CG 3.36Å; M570-L573 PolarHBondContact O-N 3.09Å; M570-L573 HydrophobicContact SD-CD1 3.62Å; K571-L573 PolarHBondContact O-N 3.03Å; K571-L573 VanDerWaalsContact O-N 3.09Å; L573-S575 PolarHBondContact O-N 3.18Å; L573-F576 PolarHBondContact O-N 3.05Å; L573-I577 PolarHBondContact O-N 2.69Å
574	N	95.5	Very high	92.7	Very high	24 Å²	24	64.3 Å²	64.3	13%	0.128	34%	0.339	C	S	.	.	H	α-helix	trans	-60.9	-26	175.1	-69.8	-19.1	0	0	0	112	L562 F563 K571 A572 F576 I577 E578	L562-N574 HydrophobicContact CD2-CB 4.35Å; F563-N574 PolarHBondContact N-OD1 3.42Å; F563-N574 PolarHBondContact O-ND2 3.36Å; F563-N574 VanDerWaalsContact O-ND2 3.11Å; K571-N574 VanDerWaalsContact O-CB 3.27Å; K571-N574 WeakPolarHBondContact O-CB 3.23Å; K571-N574 PolarHBondContact O-N 3.08Å; A572-N574 VanDerWaalsContact C-N 3.31Å; N574-F576 PolarHBondContact O-N 3.11Å; N574-F576 VanDerWaalsContact O-N 3.12Å; N574-I577 PolarHBondContact O-N 2.8Å; N574-I577 VanDerWaalsContact O-N 3.13Å; N574-E578 WeakPolarHBondContact O-CB 3.36Å; N574-E578 PolarHBondContact O-N 2.91Å
575	S	94.8	Very high	92.9	Very high	82 Å²	82	60.4 Å²	60.4	57%	0.573	32%	0.319	S	S	*	.	H	α-helix	trans	-55.7	-24.8	171.2	58.2	0	0	0	0	114.1	A572 L573	A572-S575 PolarHBondContact O-OG 3.45Å; L573-S575 PolarHBondContact O-N 3.18Å
576	F	96.1	Very high	93.5	Very high	30 Å²	30	62.5 Å²	62.5	13%	0.132	32%	0.323	C	S	.	.	H	α-helix	trans	-96.4	-40.1	171.9	167.7	-99.7	0	0	0	112.2	L467 V470 A471 L557 L573 N574 P579 E580	L467-F576 HydrophobicContact CD2-CB 3.69Å; L467-F576 HydrophobicContact CD2-CD1 4.09Å; L467-F576 HydrophobicContact CD2-CG 3.95Å; V470-F576 HydrophobicContact CG1-CD1 4.39Å; V470-F576 HydrophobicContact CG1-CE1 3.62Å; V470-F576 HydrophobicContact CG1-CZ 4.12Å; A471-F576 HydrophobicContact CB-CE2 3.82Å; A471-F576 HydrophobicContact CB-CZ 4.23Å; L557-F576 HydrophobicContact CD2-CE1 4.41Å; L573-F576 PolarHBondContact O-N 3.05Å; N574-F576 PolarHBondContact O-N 3.11Å; N574-F576 VanDerWaalsContact O-N 3.12Å; F576-P579 WeakPolarHBondContact O-CD 3.44Å; F576-P579 WeakPolarHBondContact O-CG 3.45Å; F576-E580 HydrophobicContact CD2-CG 4.26Å; F576-E580 HydrophobicContact CE2-CG 3.87Å; F576-E580 HydrophobicContact CZ-CG 4.06Å; F576-E580 VanDerWaalsContact O-CG 3.27Å; F576-E580 WeakPolarHBondContact O-CG 3.46Å
577	I	96.4	Very high	94.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-69.3	-48.1	-173.7	-63.1	174.7	0	0	0	112	V553 N556 L557 L562 F563 L573 N574 E580 I581	V553-I577 HydrophobicContact CG1-CD1 4.25Å; V553-I577 HydrophobicContact CG1-CG1 4.42Å; N556-I577 HydrophobicContact CB-CD1 4.21Å; L557-I577 HydrophobicContact CB-CG2 4.36Å; L557-I577 HydrophobicContact CD1-CG2 4.09Å; L562-I577 HydrophobicContact CD2-CB 4.22Å; L562-I577 HydrophobicContact CD2-CG2 3.85Å; F563-I577 HydrophobicContact CD2-CD1 3.66Å; F563-I577 HydrophobicContact CE2-CD1 3.39Å; F563-I577 HydrophobicContact CZ-CD1 4.38Å; L573-I577 PolarHBondContact O-N 2.69Å; N574-I577 PolarHBondContact O-N 2.8Å; N574-I577 VanDerWaalsContact O-N 3.13Å; I577-E580 PolarHBondContact O-N 3.22Å; I577-I581 HydrophobicContact CG2-CD1 4.09Å; I577-I581 HydrophobicContact CG2-CG1 4.15Å; I577-I581 WeakPolarHBondContact O-CG1 3.47Å; I577-I581 PolarHBondContact O-N 3.37Å; I577-I581 VanDerWaalsContact O-N 3.09Å
578	E	95.8	Very high	94.6	Very high	123 Å²	123	51 Å²	51	58%	0.575	27%	0.272	S	S	*	.	H	α-helix	trans	-54.6	-49.5	-174.7	-171.7	170.2	-161.7	0	0	113.6	L562 N574 E580	L562-E578 HydrophobicContact CD1-CG 4.47Å; L562-E578 HydrophobicContact CD2-CB 3.89Å; L562-E578 HydrophobicContact CD2-CG 4.48Å; N574-E578 WeakPolarHBondContact O-CB 3.36Å; N574-E578 PolarHBondContact O-N 2.91Å; E578-E580 VanDerWaalsContact C-N 3.3Å; E578-E580 PolarHBondContact O-N 3.03Å
579	P	96.6	Very high	95	Very high	79 Å²	79	49.1 Å²	49.1	51%	0.513	26%	0.257	S	S	.	.	H	α-helix	trans	-70.4	-21.8	176.8	27.6	-35.9	0	0	0	114.2	F576 P582	F576-P579 WeakPolarHBondContact O-CD 3.44Å; F576-P579 WeakPolarHBondContact O-CG 3.45Å; P579-P582 WeakPolarHBondContact O-CD 3.41Å
580	E	97.5	Very high	95.3	Very high	50 Å²	50	47 Å²	47	23%	0.234	25%	0.248	C	C	.	.	H	α-helix	trans	-88.9	-14.8	-177.9	-70	-62.5	151.3	0	0	113.5	W474 L557 F576 I577 E578 T583 M584	W474-E580 PolarHBondContact NE1-OE2 3.27Å; L557-E580 HydrophobicContact CD1-CB 3.73Å; L557-E580 HydrophobicContact CD2-CB 4.16Å; F576-E580 HydrophobicContact CD2-CG 4.26Å; F576-E580 HydrophobicContact CE2-CG 3.87Å; F576-E580 HydrophobicContact CZ-CG 4.06Å; F576-E580 VanDerWaalsContact O-CG 3.27Å; F576-E580 WeakPolarHBondContact O-CG 3.46Å; I577-E580 PolarHBondContact O-N 3.22Å; E578-E580 VanDerWaalsContact C-N 3.3Å; E578-E580 PolarHBondContact O-N 3.03Å; E580-T583 WeakPolarHBondContact O-CB 3.36Å; E580-T583 PolarHBondContact O-N 3.41Å; E580-T583 VanDerWaalsContact O-N 3.15Å; E580-M584 PolarHBondContact O-N 3.47Å
581	I	96.5	Very high	95.5	Very high	39 Å²	39	47 Å²	47	20%	0.2	25%	0.248	C	C	.	.	H	α-helix	trans	-55.2	-47.6	177.7	-78.2	168.4	0	0	0	112.4	L557 L560 L562 I577 T583 M584 Y585	L557-I581 HydrophobicContact CD1-CG1 4.08Å; L560-I581 HydrophobicContact CD2-CG2 4.22Å; L562-I581 HydrophobicContact CD2-CD1 3.92Å; I577-I581 HydrophobicContact CG2-CD1 4.09Å; I577-I581 HydrophobicContact CG2-CG1 4.15Å; I577-I581 WeakPolarHBondContact O-CG1 3.47Å; I577-I581 PolarHBondContact O-N 3.37Å; I577-I581 VanDerWaalsContact O-N 3.09Å; I581-T583 VanDerWaalsContact C-N 3.32Å; I581-T583 PolarHBondContact O-N 2.72Å; I581-M584 PolarHBondContact O-N 3.03Å; I581-Y585 WeakPolarHBondContact O-CB 3.19Å; I581-Y585 PolarHBondContact O-N 2.69Å
582	P	96.3	Very high	95.7	Very high	85 Å²	85	44.1 Å²	44.1	55%	0.552	24%	0.238	S	C	*	.	H	α-helix	trans	-61.9	-37.9	176.6	-24	35	0	0	0	113.1	P579 Y585 K586	P579-P582 WeakPolarHBondContact O-CD 3.41Å; P582-Y585 PolarHBondContact O-N 2.97Å; P582-K586 WeakPolarHBondContact O-CB 3.45Å; P582-K586 PolarHBondContact O-N 2.87Å
583	T	96.8	Very high	95.7	Very high	39 Å²	39	42.9 Å²	42.9	24%	0.239	23%	0.225	C	C	.	.	H	α-helix	trans	-64.3	-46.3	176.3	-51.9	0	0	0	0	110.9	W474 E478 E580 I581 Y585 K586 F587	W474-T583 HydrophobicContact CZ2-CG2 4.17Å; E478-T583 VanDerWaalsContact CD-CG2 3.49Å; E478-T583 HydrophobicContact CG-CG2 4.3Å; E478-T583 WeakPolarHBondContact OE1-CG2 3.39Å; E580-T583 WeakPolarHBondContact O-CB 3.36Å; E580-T583 PolarHBondContact O-N 3.41Å; E580-T583 VanDerWaalsContact O-N 3.15Å; I581-T583 VanDerWaalsContact C-N 3.32Å; I581-T583 PolarHBondContact O-N 2.72Å; T583-Y585 VanDerWaalsContact C-N 3.33Å; T583-Y585 PolarHBondContact O-N 3.07Å; T583-K586 PolarHBondContact O-N 3.2Å; T583-F587 WeakPolarHBondContact O-CB 3.35Å; T583-F587 PolarHBondContact O-N 3.38Å
584	M	97	Very high	95.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-57	-46.8	173.6	175.2	63.5	76.6	0	0	111.1	W474 F517 L557 A558 L560 E580 I581 K586 F587 L588	W474-M584 HydrophobicContact CD2-CE 4.39Å; W474-M584 HydrophobicContact CE3-CE 3.75Å; W474-M584 HydrophobicContact CH2-CB 4.07Å; W474-M584 HydrophobicContact CH2-CE 3.45Å; W474-M584 VanDerWaalsContact CH2-CE 3.45Å; W474-M584 HydrophobicContact CH2-CG 4.41Å; W474-M584 HydrophobicContact CH2-SD 3.5Å; W474-M584 VanDerWaalsContact CH2-SD 3.5Å; W474-M584 HydrophobicContact CZ2-CB 3.99Å; W474-M584 HydrophobicContact CZ2-CE 4.08Å; W474-M584 HydrophobicContact CZ2-SD 4.34Å; W474-M584 HydrophobicContact CZ3-CE 3.25Å; W474-M584 HydrophobicContact CZ3-SD 3.76Å; F517-M584 HydrophobicContact CE1-CE 3.95Å; F517-M584 HydrophobicContact CE2-CE 4.08Å; F517-M584 HydrophobicContact CE2-SD 3.72Å; F517-M584 HydrophobicContact CZ-CE 3.62Å; F517-M584 HydrophobicContact CZ-SD 3.74Å; L557-M584 HydrophobicContact CD1-CB 4.25Å; L557-M584 HydrophobicContact CD2-CE 3.91Å; L557-M584 HydrophobicContact CG-CB 4.38Å; L557-M584 HydrophobicContact CG-CE 3.72Å; A558-M584 HydrophobicContact CB-CE 4.24Å; L560-M584 HydrophobicContact CD2-CB 4.17Å; L560-M584 HydrophobicContact CD2-CG 3.7Å; E580-M584 PolarHBondContact O-N 3.47Å; I581-M584 PolarHBondContact O-N 3.03Å; M584-K586 PolarHBondContact O-N 3.22Å; M584-F587 WeakPolarHBondContact O-CB 3.41Å; M584-F587 PolarHBondContact O-N 3.01Å; M584-F587 HydrophobicContact SD-CD1 4.33Å; M584-L588 HydrophobicContact CG-CD1 4.11Å; M584-L588 VanDerWaalsContact O-CG 3.29Å; M584-L588 WeakPolarHBondContact O-CG 3.41Å; M584-L588 PolarHBondContact O-N 2.82Å; M584-L588 HydrophobicContact SD-CD1 4.29Å; M584-L588 HydrophobicContact SD-CG 4.22Å
585	Y	95.4	Very high	94.9	Very high	50 Å²	50	51.4 Å²	51.4	20%	0.196	28%	0.276	C	S	.	.	H	α-helix	trans	-61.2	-44.3	179	-168.3	-93.2	0	0	0	112.5	V505 Q506 A509 L560 I581 P582 T583 L588 R589	V505-Y585 WeakPolarHBondContact CG1-OH 3.43Å; Q506-Y585 PolarHBondContact NE2-OH 3.37Å; A509-Y585 HydrophobicContact CB-CD2 4.18Å; A509-Y585 HydrophobicContact CB-CE2 3.54Å; L560-Y585 HydrophobicContact CD1-CD2 3.94Å; I581-Y585 WeakPolarHBondContact O-CB 3.19Å; I581-Y585 PolarHBondContact O-N 2.69Å; P582-Y585 PolarHBondContact O-N 2.97Å; T583-Y585 VanDerWaalsContact C-N 3.33Å; T583-Y585 PolarHBondContact O-N 3.07Å; Y585-L588 PolarHBondContact O-N 3.25Å; Y585-R589 HydrophobicContact CD1-CG 4.37Å; Y585-R589 HydrophobicContact CE1-CG 3.96Å; Y585-R589 PolarHBondContact O-N 3.29Å; Y585-R589 VanDerWaalsContact O-N 3.07Å
586	K	94.9	Very high	94.6	Very high	159 Å²	159	49.4 Å²	49.4	69%	0.691	26%	0.258	S	S	*	.	H	α-helix	trans	-61.8	-43.4	175.4	-177.1	-177.6	177.1	-175.9	0	111.9	P582 T583 M584 R589 S590	P582-K586 WeakPolarHBondContact O-CB 3.45Å; P582-K586 PolarHBondContact O-N 2.87Å; T583-K586 PolarHBondContact O-N 3.2Å; M584-K586 PolarHBondContact O-N 3.22Å; K586-R589 PolarHBondContact O-N 2.9Å; K586-S590 PolarHBondContact O-N 3.27Å
587	F	96.4	Very high	94.1	Very high	5 Å²	5	51.5 Å²	51.5	2%	0.022	28%	0.282	C	S	.	.	H	α-helix	trans	-58.3	-49.2	175.2	167	-98.2	0	0	0	111.4	W474 I477 Q481 L516 F517 T583 M584 R589 S590 V591	W474-F587 HydrophobicContact CH2-CB 4.09Å; W474-F587 HydrophobicContact CH2-CD1 4.03Å; W474-F587 HydrophobicContact CH2-CG 4.08Å; W474-F587 HydrophobicContact CZ3-CD1 4.33Å; I477-F587 HydrophobicContact CG2-CE1 4.09Å; I477-F587 HydrophobicContact CG2-CE2 4.27Å; I477-F587 HydrophobicContact CG2-CZ 3.71Å; Q481-F587 HydrophobicContact CB-CD2 4.31Å; Q481-F587 HydrophobicContact CB-CE2 4.08Å; L516-F587 HydrophobicContact CD2-CE1 3.84Å; L516-F587 HydrophobicContact CD2-CZ 4.11Å; F517-F587 HydrophobicContact CE2-CE1 4.18Å; F517-F587 HydrophobicContact CZ-CE1 4.08Å; T583-F587 WeakPolarHBondContact O-CB 3.35Å; T583-F587 PolarHBondContact O-N 3.38Å; M584-F587 WeakPolarHBondContact O-CB 3.41Å; M584-F587 PolarHBondContact O-N 3.01Å; M584-F587 HydrophobicContact SD-CD1 4.33Å; F587-R589 VanDerWaalsContact C-N 3.29Å; F587-R589 PolarHBondContact O-N 3.19Å; F587-S590 PolarHBondContact O-N 3.15Å; F587-S590 VanDerWaalsContact O-N 3.1Å; F587-V591 HydrophobicContact CD2-CG1 4.11Å; F587-V591 HydrophobicContact CE1-CG1 4.29Å; F587-V591 HydrophobicContact CE2-CG1 3.65Å; F587-V591 HydrophobicContact CZ-CG1 3.74Å; F587-V591 PolarHBondContact O-N 2.96Å
588	L	96	Very high	93.6	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-58.3	-40.6	178.4	-68.5	168.9	0	0	0	112.2	I512 F517 M584 Y585 V591 A592	I512-L588 HydrophobicContact CG2-CD2 4.17Å; F517-L588 HydrophobicContact CE2-CD2 4.18Å; M584-L588 HydrophobicContact CG-CD1 4.11Å; M584-L588 VanDerWaalsContact O-CG 3.29Å; M584-L588 WeakPolarHBondContact O-CG 3.41Å; M584-L588 PolarHBondContact O-N 2.82Å; M584-L588 HydrophobicContact SD-CD1 4.29Å; M584-L588 HydrophobicContact SD-CG 4.22Å; Y585-L588 PolarHBondContact O-N 3.25Å; L588-V591 VanDerWaalsContact O-CG2 3.31Å; L588-V591 WeakPolarHBondContact O-CG2 3.34Å; L588-A592 VanDerWaalsContact O-CB 3.32Å; L588-A592 WeakPolarHBondContact O-CB 3.4Å; L588-A592 PolarHBondContact O-N 2.96Å
589	R	94.6	Very high	93.2	Very high	85 Å²	85	50.1 Å²	50.1	32%	0.321	27%	0.274	S	S	.	.	H	α-helix	trans	-66.5	-39.5	175	-78.7	-57.2	-146.3	159	0.7	113	E500 Y585 K586 F587 A592 S593	E500-R589 VanDerWaalsContact CD-NH1 3.3Å; E500-R589 IonicContact OE1-CZ 2.74Å; E500-R589 IonicContact OE1-NH1 2.77Å; E500-R589 PolarHBondContact OE1-NH1 3.39Å; E500-R589 IonicContact OE1-NH2 2.76Å; E500-R589 IonicContact OE2-CZ 2.87Å; E500-R589 IonicContact OE2-NH1 2.85Å; E500-R589 PolarHBondContact OE2-NH1 3.43Å; E500-R589 IonicContact OE2-NH2 3.94Å; E500-R589 PolarHBondContact OE2-NH2 2.81Å; Y585-R589 HydrophobicContact CD1-CG 4.37Å; Y585-R589 HydrophobicContact CE1-CG 3.96Å; Y585-R589 PolarHBondContact O-N 3.29Å; Y585-R589 VanDerWaalsContact O-N 3.07Å; K586-R589 PolarHBondContact O-N 2.9Å; F587-R589 VanDerWaalsContact C-N 3.29Å; F587-R589 PolarHBondContact O-N 3.19Å; R589-A592 PolarHBondContact O-N 2.98Å; R589-S593 PolarHBondContact O-N 3.26Å
590	S	94.7	Very high	92.6	Very high	13 Å²	13	52.8 Å²	52.8	9%	0.091	28%	0.28	C	S	.	.	H	α-helix	trans	-66.3	-47	179	177.8	0	0	0	0	111.8	Q481 R489 K586 F587 A592 S593 D596	Q481-S590 PolarHBondContact OE1-OG 2.93Å; R489-S590 PolarHBondContact NH2-O 2.98Å; K586-S590 PolarHBondContact O-N 3.27Å; F587-S590 PolarHBondContact O-N 3.15Å; F587-S590 VanDerWaalsContact O-N 3.1Å; S590-A592 PolarHBondContact O-N 2.78Å; S590-S593 PolarHBondContact O-N 3.43Å; S590-S593 VanDerWaalsContact O-N 3.15Å; S590-D596 PolarHBondContact OG-OD1 2.87Å; S590-D596 PolarHBondContact OG-OD2 3.46Å
591	V	95.3	Very high	92	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-67.7	-24.3	-179.8	-60.3	0	0	0	0	113	Q481 L484 F492 I512 F587 L588	Q481-V591 HydrophobicContact CB-CG1 4.3Å; L484-V591 HydrophobicContact CD2-CB 3.69Å; L484-V591 HydrophobicContact CD2-CG1 3.83Å; F492-V591 HydrophobicContact CD2-CG2 4.49Å; I512-V591 HydrophobicContact CG2-CG2 4.41Å; F587-V591 HydrophobicContact CD2-CG1 4.11Å; F587-V591 HydrophobicContact CE1-CG1 4.29Å; F587-V591 HydrophobicContact CE2-CG1 3.65Å; F587-V591 HydrophobicContact CZ-CG1 3.74Å; F587-V591 PolarHBondContact O-N 2.96Å; L588-V591 VanDerWaalsContact O-CG2 3.31Å; L588-V591 WeakPolarHBondContact O-CG2 3.34Å
592	A	95.6	Very high	91.4	Very high	8 Å²	8	53.1 Å²	53.1	7%	0.066	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	16	176.1	0	0	0	0	0	114	F492 T493 A496 I512 L588 R589 S590	F492-A592 HydrophobicContact CB-CB 3.98Å; T493-A592 VanDerWaalsContact CA-O 3.23Å; T493-A592 WeakPolarHBondContact CA-O 3.1Å; T493-A592 WeakPolarHBondContact CB-O 3.35Å; T493-A592 PolarHBondContact OG1-O 3.33Å; A496-A592 HydrophobicContact CB-CB 4.17Å; I512-A592 HydrophobicContact CD1-CB 3.38Å; I512-A592 HydrophobicContact CG1-CB 4.46Å; L588-A592 VanDerWaalsContact O-CB 3.32Å; L588-A592 WeakPolarHBondContact O-CB 3.4Å; L588-A592 PolarHBondContact O-N 2.96Å; R589-A592 PolarHBondContact O-N 2.98Å; S590-A592 PolarHBondContact O-N 2.78Å
593	S	93.3	Very high	90.9	Very high	28 Å²	28	51.9 Å²	51.9	20%	0.196	27%	0.274	C	S	.	.			trans	-123.1	130.4	174.5	178.9	0	0	0	0	111.4	R489 T493 R589 S590 T595 D596	R489-S593 PolarHBondContact NH2-O 3.15Å; T493-S593 WeakPolarHBondContact OG1-CA 3.28Å; T493-S593 PolarHBondContact OG1-N 3.37Å; R589-S593 PolarHBondContact O-N 3.26Å; S590-S593 PolarHBondContact O-N 3.43Å; S590-S593 VanDerWaalsContact O-N 3.15Å; S593-T595 PolarHBondContact OG-N 3Å; S593-T595 PolarHBondContact OG-OG1 3.09Å; S593-D596 PolarHBondContact OG-N 3.15Å
594	N	87.3	Confident	90.3	Very high	82 Å²	82	54.9 Å²	54.9	44%	0.439	29%	0.289	S	S	.	.	S	Bend	trans	-85.2	-10.8	170.5	62.1	1.3	0	0	0	113	T493 Y599	T493-N594 HydrophobicContact CG2-CB 4.4Å; T493-N594 PolarHBondContact OG1-N 3.05Å; N594-Y599 HydrophobicContact CB-CD2 4.05Å; N594-Y599 HydrophobicContact CB-CE2 3.98Å; N594-Y599 HydrophobicContact CB-CG 4.44Å
595	T	86.5	Confident	89.6	Confident	122 Å²	122	56 Å²	56	75%	0.748	30%	0.297	S	S	*	.	S	Bend	trans	-91.6	-8.8	173.8	60	0	0	0	0	112.7	S593	S593-T595 PolarHBondContact OG-N 3Å; S593-T595 PolarHBondContact OG-OG1 3.09Å
596	D	88.5	Confident	89	Confident	39 Å²	39	59 Å²	59	21%	0.209	32%	0.316	C	S	.	.	S	Bend	trans	-62.2	139	175.4	167.5	-86.8	0	0	0	110.9	R489 S590 S593 N598 Y599	R489-D596 IonicContact CZ-OD1 2.99Å; R489-D596 IonicContact NH1-OD1 2.88Å; R489-D596 VanDerWaalsContact NH2-CB 3.33Å; R489-D596 IonicContact NH2-OD1 2.62Å; R489-D596 PolarHBondContact NH2-OD1 3.37Å; S590-D596 PolarHBondContact OG-OD1 2.87Å; S590-D596 PolarHBondContact OG-OD2 3.46Å; S593-D596 PolarHBondContact OG-N 3.15Å; D596-N598 PolarHBondContact O-N 2.94Å; D596-N598 WeakPolarHBondContact OD1-CA 3.45Å; D596-N598 VanDerWaalsContact OD1-CB 3.26Å; D596-N598 WeakPolarHBondContact OD1-CB 3.13Å; D596-N598 PolarHBondContact OD1-N 2.84Å; D596-N598 PolarHBondContact OD1-ND2 3.21Å; D596-Y599 VanDerWaalsContact O-CB 3.3Å; D596-Y599 WeakPolarHBondContact O-CB 3.25Å; D596-Y599 PolarHBondContact O-N 3.11Å
597	A	84.1	Confident	88.3	Confident	75 Å²	75	51.5 Å²	51.5	62%	0.62	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-24.2	-173.3	0	0	0	0	0	113.1	H600	A597-H600 PolarHBondContact O-CE1 2.95Å; A597-H600 PolarHBondContact O-ND1 2.92Å
598	N	85.8	Confident	87.6	Confident	37 Å²	37	54.7 Å²	54.7	20%	0.198	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-4.8	-179.6	-54.9	-72	0	0	0	113.8	Q481 C482 R489 D596 H600 L601 S602	Q481-N598 PolarHBondContact NE2-ND2 2.71Å; C482-N598 HydrophobicContact CB-CB 3.99Å; R489-N598 PolarHBondContact NH1-O 2.99Å; D596-N598 PolarHBondContact O-N 2.94Å; D596-N598 WeakPolarHBondContact OD1-CA 3.45Å; D596-N598 VanDerWaalsContact OD1-CB 3.26Å; D596-N598 WeakPolarHBondContact OD1-CB 3.13Å; D596-N598 PolarHBondContact OD1-N 2.84Å; D596-N598 PolarHBondContact OD1-ND2 3.21Å; N598-H600 VanDerWaalsContact C-N 3.27Å; N598-H600 PolarHBondContact O-N 2.8Å; N598-L601 WeakPolarHBondContact O-CB 3.27Å; N598-L601 PolarHBondContact O-N 3.26Å; N598-S602 PolarHBondContact O-N 3.37Å
599	Y	87.9	Confident	86.6	Confident	56 Å²	56	59 Å²	59	22%	0.22	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-63.1	-30.5	-176.9	-179.6	-92.5	0	0	0	113.2	R489 D490 N594 D596 L601 S602	R489-Y599 HydrophobicContact CB-CD2 4.13Å; R489-Y599 HydrophobicContact CB-CE2 4.04Å; R489-Y599 VanDerWaalsContact NH1-CA 3.25Å; R489-Y599 VanDerWaalsContact NH1-N 3.17Å; D490-Y599 VanDerWaalsContact OD1-CE2 3.25Å; D490-Y599 WeakPolarHBondContact OD1-CE2 3.46Å; D490-Y599 PolarHBondContact OD1-OH 3.19Å; D490-Y599 PolarHBondContact OD2-OH 3.41Å; N594-Y599 HydrophobicContact CB-CD2 4.05Å; N594-Y599 HydrophobicContact CB-CE2 3.98Å; N594-Y599 HydrophobicContact CB-CG 4.44Å; D596-Y599 VanDerWaalsContact O-CB 3.3Å; D596-Y599 WeakPolarHBondContact O-CB 3.25Å; D596-Y599 PolarHBondContact O-N 3.11Å; Y599-L601 PolarHBondContact O-N 2.99Å; Y599-S602 PolarHBondContact O-OG 3.13Å
600	H	83.9	Confident	85.7	Confident	136 Å²	136	61 Å²	61	63%	0.63	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-73	-19	176	70.9	-74	0	0	0	113.2	A597 N598	A597-H600 PolarHBondContact O-CE1 2.95Å; A597-H600 PolarHBondContact O-ND1 2.92Å; N598-H600 VanDerWaalsContact C-N 3.27Å; N598-H600 PolarHBondContact O-N 2.8Å
601	L	85.9	Confident	85.3	Confident	88 Å²	88	60.5 Å²	60.5	46%	0.461	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-89.3	-15.6	-177.3	-65.3	167.2	0	0	0	113.5	C482 N598 Y599	C482-L601 HydrophobicContact CB-CB 3.85Å; C482-L601 HydrophobicContact CB-CD1 4.14Å; C482-L601 CarbonylContact O-C 3.51Å; N598-L601 WeakPolarHBondContact O-CB 3.27Å; N598-L601 PolarHBondContact O-N 3.26Å; Y599-L601 PolarHBondContact O-N 2.99Å
602	S	84.1	Confident	84.9	Confident	7 Å²	7	61.6 Å²	61.6	5%	0.049	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-59.8	148.1	178.8	39.4	0	0	0	0	111.8	C482 L484 K486 N598 Y599	C482-S602 WeakPolarHBondContact O-CA 3.36Å; C482-S602 PolarHBondContact O-N 3.26Å; L484-S602 WeakPolarHBondContact O-CB 3.41Å; K486-S602 WeakPolarHBondContact CE-O 3.41Å; K486-S602 WeakPolarHBondContact CE-OG 3.41Å; K486-S602 WeakPolarHBondContact CG-OG 3.31Å; N598-S602 PolarHBondContact O-N 3.37Å; Y599-S602 PolarHBondContact O-OG 3.13Å
603	T	84.4	Confident	84.7	Confident	59 Å²	59	62.5 Å²	62.5	36%	0.362	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-80.8	148.3	178.4	53	0	0	0	0	109.8	K483 P485 K486	K483-T603 HydrophobicContact CD-CG2 4.23Å; K483-T603 PolarHBondContact O-OG1 2.86Å; P485-T603 CarbonylContact C-O 3.51Å; P485-T603 VanDerWaalsContact CA-O 3.26Å; P485-T603 WeakPolarHBondContact CA-O 3.22Å; K486-T603 PolarHBondContact N-O 2.89Å
604	N	85	Confident	84.7	Confident	103 Å²	103	61.3 Å²	61.3	55%	0.551	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-85.4	150.3	163.7	-66.6	1.4	0	0	0	108.8	K486 E487	K486-N604 VanDerWaalsContact CD-OD1 3.25Å; K486-N604 WeakPolarHBondContact CD-OD1 3.47Å; E487-N604 WeakPolarHBondContact OE1-CA 3.18Å
605	S	82.9	Confident	84.9	Confident	22 Å²	22	59.2 Å²	59.2	15%	0.154	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-91.8	134.2	173.1	167.9	0	0	0	0	110	E487 C607	E487-S605 PolarHBondContact OE1-N 3.44Å; E487-S605 PolarHBondContact OE2-N 3.2Å; S605-C607 PolarHBondContact O-N 3.02Å; S605-C607 VanDerWaalsContact O-N 3.08Å; S605-C607 VanDerWaalsContact OG-CB 3.25Å; S605-C607 WeakPolarHBondContact OG-CB 3.34Å; S605-C607 PolarHBondContact OG-N 3.24Å; S605-C607 PolarHBondContact OG-SG 2.84Å
606	D	81.1	Confident	85.3	Confident	114 Å²	114	54 Å²	54	61%	0.61	28%	0.28	S	S	*	.			trans	-81.3	29.8	171.6	-66.7	-28.9	0	0	0	111.7	H608 E609	D606-H608 PolarHBondContact O-N 2.76Å; D606-E609 HydrophobicContact CB-CG 4.43Å; D606-E609 VanDerWaalsContact O-CB 3.29Å; D606-E609 WeakPolarHBondContact O-CB 3.39Å; D606-E609 PolarHBondContact O-N 3.04Å; D606-E609 VanDerWaalsContact O-N 3.08Å
607	C	82.1	Confident	85.7	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.014	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-62.2	-30.2	-174.1	54	0	0	0	0	113.1	L408 V409 S605 E609 F610	L408-C607 HydrophobicContact CD1-CB 4.13Å; L408-C607 HydrophobicContact CD2-CB 4.48Å; L408-C607 HydrophobicContact CG-CB 3.92Å; V409-C607 HydrophobicContact CG1-CB 4.03Å; S605-C607 PolarHBondContact O-N 3.02Å; S605-C607 VanDerWaalsContact O-N 3.08Å; S605-C607 VanDerWaalsContact OG-CB 3.25Å; S605-C607 WeakPolarHBondContact OG-CB 3.34Å; S605-C607 PolarHBondContact OG-N 3.24Å; S605-C607 PolarHBondContact OG-SG 2.84Å; C607-E609 PolarHBondContact O-N 3.49Å; C607-E609 VanDerWaalsContact O-N 3.09Å; C607-F610 PolarHBondContact O-N 3Å
608	H	80.2	Confident	86.2	Confident	72 Å²	72	48.9 Å²	48.9	33%	0.333	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-57.5	-23	176	-86.7	-117.6	0	0	0	113.2	R39 E363 K364 D606 F610	R39-H608 PolarHBondContact NH2-O 3.49Å; E363-H608 PolarHBondContact O-CE1 2.72Å; E363-H608 PolarHBondContact O-NE2 3.13Å; E363-H608 IonicContact OE1-CD2 3.86Å; E363-H608 PolarHBondContact OE1-CD2 2.55Å; E363-H608 VanDerWaalsContact OE1-CD2 3.23Å; E363-H608 IonicContact OE1-NE2 3.09Å; E363-H608 PolarHBondContact OE1-NE2 3.21Å; K364-H608 PolarHBondContact NZ-ND1 2.86Å; K364-H608 PolarHBondContact NZ-O 3.39Å; D606-H608 PolarHBondContact O-N 2.76Å; H608-F610 PolarHBondContact O-N 3.28Å
609	E	74.9	Confident	86.5	Confident	91 Å²	91	48.8 Å²	48.8	43%	0.425	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-70.7	-17.7	175.1	-66.8	-157.7	156.8	0	0	112.9	I35 T36 R39 D606 C607	I35-E609 WeakPolarHBondContact CG2-O 3.29Å; T36-E609 HydrophobicContact CG2-CB 3.6Å; T36-E609 HydrophobicContact CG2-CG 4.01Å; T36-E609 WeakPolarHBondContact CG2-OE2 3.45Å; R39-E609 PolarHBondContact NH2-O 2.79Å; D606-E609 HydrophobicContact CB-CG 4.43Å; D606-E609 VanDerWaalsContact O-CB 3.29Å; D606-E609 WeakPolarHBondContact O-CB 3.39Å; D606-E609 PolarHBondContact O-N 3.04Å; D606-E609 VanDerWaalsContact O-N 3.08Å; C607-E609 PolarHBondContact O-N 3.49Å; C607-E609 VanDerWaalsContact O-N 3.09Å
610	F	76.3	Confident	86.9	Confident	128 Å²	128	46.1 Å²	46.1	56%	0.561	23%	0.23	S	C	*	.	S	Bend	trans	-105.2	-5.9	-176.5	-55.3	-76.4	0	0	0	114.5	C607 H608	C607-F610 PolarHBondContact O-N 3Å; H608-F610 PolarHBondContact O-N 3.28Å
611	I	85.5	Confident	87.4	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.01	20%	0.201	C	C	.	.			trans	-103.5	121.9	-176.5	-54.2	168.1	0	0	0	110.1	N360 E363 K364 L408 E616	N360-I611 HydrophobicContact CB-CD1 4.35Å; N360-I611 HydrophobicContact CB-CG1 4.37Å; N360-I611 HydrophobicContact CB-CG2 3.89Å; E363-I611 HydrophobicContact CB-CD1 4.02Å; E363-I611 HydrophobicContact CG-CD1 3.78Å; K364-I611 HydrophobicContact CB-CG2 3.97Å; K364-I611 HydrophobicContact CD-CB 4.28Å; K364-I611 HydrophobicContact CD-CG2 4.4Å; K364-I611 HydrophobicContact CG-CG2 4.11Å; L408-I611 HydrophobicContact CD2-CD1 4.15Å; I611-E616 HydrophobicContact CG2-CG 4.09Å
612	E	87.7	Confident	87.6	Confident	22 Å²	22	38.9 Å²	38.9	10%	0.103	20%	0.195	C	C	.	.			trans	-106.5	110.3	168.1	171.9	169.6	-162.7	0	0	109.8	I35 H50 G614 Y615 E616	I35-E612 HydrophobicContact CD1-CB 3.52Å; H50-E612 IonicContact CE1-OE1 3.78Å; H50-E612 PolarHBondContact CE1-OE1 3.21Å; H50-E612 IonicContact NE2-OE1 3.9Å; H50-E612 PolarHBondContact NE2-OE1 2.95Å; H50-E612 VanDerWaalsContact NE2-OE1 3.09Å; E612-G614 VanDerWaalsContact C-N 3.34Å; E612-G614 PolarHBondContact O-N 3.18Å; E612-Y615 WeakPolarHBondContact O-CB 3.47Å; E612-Y615 PolarHBondContact O-N 3.06Å; E612-Y615 VanDerWaalsContact O-N 3.16Å; E612-E616 WeakPolarHBondContact O-CG 3.49Å; E612-E616 PolarHBondContact O-N 3.42Å; E612-E616 VanDerWaalsContact O-N 3.09Å
613	L	91.2	Very high	87.9	Confident	28 Å²	28	39.5 Å²	39.5	15%	0.147	20%	0.197	C	C	.	.	H	α-helix	trans	-64.1	-38.9	-170	-171.4	60.9	0	0	0	112.5	I321 I361 K364 L365 Y615 E616 F617	I321-L613 HydrophobicContact CD1-CB 4.18Å; I321-L613 HydrophobicContact CD1-CD2 3.92Å; I321-L613 HydrophobicContact CD1-CG 3.82Å; I321-L613 HydrophobicContact CG1-CD2 4.42Å; I361-L613 HydrophobicContact CB-CD1 4.45Å; I361-L613 HydrophobicContact CG1-CD1 4.09Å; I361-L613 HydrophobicContact CG2-CD1 4.49Å; K364-L613 HydrophobicContact CB-CD1 4.27Å; K364-L613 HydrophobicContact CG-CB 4.27Å; K364-L613 HydrophobicContact CG-CD1 4.46Å; L365-L613 HydrophobicContact CD2-CD2 3.65Å; L365-L613 HydrophobicContact CG-CD1 4.34Å; L365-L613 HydrophobicContact CG-CD2 4.16Å; L613-Y615 VanDerWaalsContact C-N 3.33Å; L613-Y615 PolarHBondContact O-N 3.4Å; L613-E616 PolarHBondContact O-N 3Å; L613-F617 HydrophobicContact CD1-CD2 4Å; L613-F617 HydrophobicContact CD1-CE2 3.59Å; L613-F617 HydrophobicContact CD1-CZ 4.43Å; L613-F617 HydrophobicContact CD2-CE2 3.99Å; L613-F617 HydrophobicContact CG-CD2 3.79Å; L613-F617 HydrophobicContact CG-CE2 3.54Å; L613-F617 VanDerWaalsContact O-CD2 3.23Å; L613-F617 WeakPolarHBondContact O-CD2 3.31Å; L613-F617 PolarHBondContact O-N 2.84Å
614	G	92.9	Very high	88.3	Confident	2 Å²	2	36.8 Å²	36.8	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-59.9	-42.1	175.6	0	0	0	0	0	112.5	E612 F617 A618	E612-G614 VanDerWaalsContact C-N 3.34Å; E612-G614 PolarHBondContact O-N 3.18Å; G614-F617 PolarHBondContact O-N 3.46Å; G614-A618 WeakPolarHBondContact O-CB 3.32Å; G614-A618 PolarHBondContact O-N 3.2Å
615	Y	91.6	Very high	88.6	Confident	39 Å²	39	35 Å²	35	15%	0.153	17%	0.171	C	C	.	.	H	α-helix	trans	-63.7	-44.3	175.3	173.7	-101.2	0	0	0	112.1	D52 V316 I318 E612 L613 F617 A618 K619	D52-Y615 HydrophobicContact CB-CD2 4.04Å; D52-Y615 HydrophobicContact CB-CE2 4.27Å; V316-Y615 HydrophobicContact CB-CD2 4.33Å; V316-Y615 HydrophobicContact CB-CE2 4.11Å; V316-Y615 HydrophobicContact CG1-CD2 4.28Å; V316-Y615 HydrophobicContact CG1-CE2 4.37Å; V316-Y615 HydrophobicContact CG2-CE2 3.9Å; I318-Y615 HydrophobicContact CD1-CD2 4.02Å; I318-Y615 HydrophobicContact CD1-CG 4.48Å; E612-Y615 WeakPolarHBondContact O-CB 3.47Å; E612-Y615 PolarHBondContact O-N 3.06Å; E612-Y615 VanDerWaalsContact O-N 3.16Å; L613-Y615 VanDerWaalsContact C-N 3.33Å; L613-Y615 PolarHBondContact O-N 3.4Å; Y615-F617 PolarHBondContact O-N 3.17Å; Y615-A618 PolarHBondContact O-N 2.97Å; Y615-K619 HydrophobicContact CE1-CD 4.15Å; Y615-K619 VanDerWaalsContact O-CB 3.3Å; Y615-K619 WeakPolarHBondContact O-CB 3.32Å; Y615-K619 PolarHBondContact O-N 3Å
616	E	94.9	Very high	88.8	Confident	13 Å²	13	38.7 Å²	38.7	6%	0.061	19%	0.186	C	C	.	.	H	α-helix	trans	-62.7	-41.7	178.3	-61.5	-58.4	162.1	0	0	112	N360 I361 I611 E612 L613 L620	N360-E616 HydrophobicContact CB-CG 3.72Å; N360-E616 VanDerWaalsContact ND2-CD 3.32Å; N360-E616 PolarHBondContact ND2-OE1 3.06Å; I361-E616 HydrophobicContact CD1-CB 4.26Å; I361-E616 HydrophobicContact CG1-CB 3.81Å; I611-E616 HydrophobicContact CG2-CG 4.09Å; E612-E616 WeakPolarHBondContact O-CG 3.49Å; E612-E616 PolarHBondContact O-N 3.42Å; E612-E616 VanDerWaalsContact O-N 3.09Å; L613-E616 PolarHBondContact O-N 3Å; E616-L620 WeakPolarHBondContact O-CB 3.32Å; E616-L620 PolarHBondContact O-N 3.29Å
617	F	96.8	Very high	89	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.009	16%	0.159	C	C	.	.	H	α-helix	trans	-65.8	-42.3	174.3	-82.2	-65.3	0	0	0	112.7	I321 Y324 L327 K328 I331 I361 L365 L613 G614 Y615 L620 T621	I321-F617 HydrophobicContact CD1-CD2 3.79Å; I321-F617 HydrophobicContact CD1-CE2 4.05Å; Y324-F617 HydrophobicContact CD1-CB 3.71Å; Y324-F617 HydrophobicContact CD1-CG 4.35Å; Y324-F617 HydrophobicContact CD2-CB 3.85Å; Y324-F617 HydrophobicContact CD2-CG 4.39Å; Y324-F617 HydrophobicContact CE1-CB 4.04Å; Y324-F617 HydrophobicContact CE2-CB 4.17Å; Y324-F617 HydrophobicContact CG-CB 3.61Å; Y324-F617 HydrophobicContact CG-CD2 4.37Å; Y324-F617 AromaticContact CG-CG 3.97Å; Y324-F617 HydrophobicContact CG-CG 3.97Å; L327-F617 HydrophobicContact CD2-CD1 3.95Å; L327-F617 HydrophobicContact CG-CD1 4.22Å; L327-F617 HydrophobicContact CG-CE1 4.41Å; K328-F617 HydrophobicContact CB-CE1 4.13Å; K328-F617 HydrophobicContact CB-CZ 3.72Å; K328-F617 HydrophobicContact CG-CZ 4.09Å; I331-F617 HydrophobicContact CD1-CD1 4.27Å; I331-F617 HydrophobicContact CD1-CE1 3.79Å; I361-F617 HydrophobicContact CD1-CD1 4.16Å; I361-F617 HydrophobicContact CD1-CE1 4.2Å; I361-F617 HydrophobicContact CG2-CZ 4.16Å; L365-F617 HydrophobicContact CD1-CZ 4.38Å; L613-F617 HydrophobicContact CD1-CD2 4Å; L613-F617 HydrophobicContact CD1-CE2 3.59Å; L613-F617 HydrophobicContact CD1-CZ 4.43Å; L613-F617 HydrophobicContact CD2-CE2 3.99Å; L613-F617 HydrophobicContact CG-CD2 3.79Å; L613-F617 HydrophobicContact CG-CE2 3.54Å; L613-F617 VanDerWaalsContact O-CD2 3.23Å; L613-F617 WeakPolarHBondContact O-CD2 3.31Å; L613-F617 PolarHBondContact O-N 2.84Å; G614-F617 PolarHBondContact O-N 3.46Å; Y615-F617 PolarHBondContact O-N 3.17Å; F617-L620 PolarHBondContact O-N 2.99Å; F617-T621 VanDerWaalsContact O-CB 3.32Å; F617-T621 WeakPolarHBondContact O-CB 3.29Å; F617-T621 PolarHBondContact O-N 3.27Å; F617-T621 PolarHBondContact O-OG1 3.47Å
618	A	94.7	Very high	89.3	Confident	4 Å²	4	35 Å²	35	3%	0.033	17%	0.166	C	C	.	.	H	α-helix	trans	-62.4	-47.2	177.5	0	0	0	0	0	111.2	V316 I318 Y324 G614 Y615 T621 Q622	V316-A618 HydrophobicContact CG1-CB 3.55Å; I318-A618 HydrophobicContact CB-CB 4.43Å; I318-A618 HydrophobicContact CG1-CB 3.88Å; Y324-A618 WeakPolarHBondContact OH-CB 3.39Å; G614-A618 WeakPolarHBondContact O-CB 3.32Å; G614-A618 PolarHBondContact O-N 3.2Å; Y615-A618 PolarHBondContact O-N 2.97Å; A618-T621 WeakPolarHBondContact O-CB 3.47Å; A618-T621 PolarHBondContact O-N 3.24Å; A618-Q622 WeakPolarHBondContact O-CG 3.37Å; A618-Q622 PolarHBondContact O-N 3.26Å
619	K	92.9	Very high	89.5	Confident	34 Å²	34	36.5 Å²	36.5	15%	0.148	18%	0.184	C	C	.	.	H	α-helix	trans	-63.5	-44.3	177.2	-173.4	178.4	176.9	-171.5	0	111.8	Y615 T621 Q622 L623	Y615-K619 HydrophobicContact CE1-CD 4.15Å; Y615-K619 VanDerWaalsContact O-CB 3.3Å; Y615-K619 WeakPolarHBondContact O-CB 3.32Å; Y615-K619 PolarHBondContact O-N 3Å; K619-T621 VanDerWaalsContact C-N 3.31Å; K619-T621 PolarHBondContact O-N 2.87Å; K619-Q622 PolarHBondContact O-N 3.39Å; K619-L623 WeakPolarHBondContact O-CG 3.45Å; K619-L623 PolarHBondContact O-N 2.98Å
620	L	95.2	Very high	89.9	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.1	-43.4	174.3	180	60.1	0	0	0	111	I331 L354 C357 F358 I361 E616 F617 Q622 L623 L624	I331-L620 HydrophobicContact CD1-CD2 3.24Å; I331-L620 HydrophobicContact CG1-CD2 4.22Å; L354-L620 HydrophobicContact CD1-CD1 3.68Å; C357-L620 HydrophobicContact CB-CB 4.1Å; C357-L620 HydrophobicContact CB-CD1 4.34Å; F358-L620 HydrophobicContact CE2-CD1 4.17Å; I361-L620 HydrophobicContact CD1-CD2 3.72Å; E616-L620 WeakPolarHBondContact O-CB 3.32Å; E616-L620 PolarHBondContact O-N 3.29Å; F617-L620 PolarHBondContact O-N 2.99Å; L620-Q622 PolarHBondContact O-N 3.19Å; L620-L623 PolarHBondContact O-N 3.33Å; L620-L624 HydrophobicContact CD1-CD1 3.94Å; L620-L624 HydrophobicContact CD1-CD2 4.34Å; L620-L624 HydrophobicContact CD1-CG 3.9Å; L620-L624 HydrophobicContact CD2-CD1 4.42Å; L620-L624 HydrophobicContact CG-CD1 3.79Å; L620-L624 HydrophobicContact CG-CG 4.17Å; L620-L624 WeakPolarHBondContact O-CB 3.19Å; L620-L624 VanDerWaalsContact O-CG 3.24Å; L620-L624 WeakPolarHBondContact O-CG 3.42Å; L620-L624 PolarHBondContact O-N 3.33Å
621	T	94.6	Very high	90.2	Very high	4 Å²	4	31.7 Å²	31.7	3%	0.025	16%	0.162	C	C	.	.	H	α-helix	trans	-61	-42.8	177.1	-59.1	0	0	0	0	111.8	L327 F617 A618 K619 L624 N625 L644 I647	L327-T621 WeakPolarHBondContact CD2-OG1 3.5Å; F617-T621 VanDerWaalsContact O-CB 3.32Å; F617-T621 WeakPolarHBondContact O-CB 3.29Å; F617-T621 PolarHBondContact O-N 3.27Å; F617-T621 PolarHBondContact O-OG1 3.47Å; A618-T621 WeakPolarHBondContact O-CB 3.47Å; A618-T621 PolarHBondContact O-N 3.24Å; K619-T621 VanDerWaalsContact C-N 3.31Å; K619-T621 PolarHBondContact O-N 2.87Å; T621-L624 PolarHBondContact O-N 2.88Å; T621-N625 WeakPolarHBondContact CG2-ND2 3.47Å; T621-N625 WeakPolarHBondContact O-CB 3.28Å; T621-N625 PolarHBondContact O-N 3.37Å; T621-N625 PolarHBondContact O-ND2 3.1Å; T621-N625 VanDerWaalsContact O-ND2 3.14Å; T621-L644 HydrophobicContact CG2-CD2 3.88Å; T621-I647 HydrophobicContact CG2-CB 4.24Å; T621-I647 HydrophobicContact CG2-CD1 4.23Å; T621-I647 HydrophobicContact CG2-CG2 3.78Å
622	Q	90.4	Very high	90.2	Very high	69 Å²	69	37.5 Å²	37.5	32%	0.322	19%	0.193	S	C	.	.	H	α-helix	trans	-60.6	-45.9	174.4	-72.2	-176.2	-5.3	0	0	111.9	A618 K619 L620 H626	A618-Q622 WeakPolarHBondContact O-CG 3.37Å; A618-Q622 PolarHBondContact O-N 3.26Å; K619-Q622 PolarHBondContact O-N 3.39Å; L620-Q622 PolarHBondContact O-N 3.19Å; Q622-H626 PolarHBondContact O-N 3.01Å
623	L	90.2	Very high	90	Very high	19 Å²	19	40.8 Å²	40.8	10%	0.099	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-50.5	176.8	-70.3	171.4	0	0	0	110.8	E353 K619 L620 N625 H626 Y627	E353-L623 HydrophobicContact CB-CD1 4.16Å; E353-L623 HydrophobicContact CB-CD2 4.49Å; K619-L623 WeakPolarHBondContact O-CG 3.45Å; K619-L623 PolarHBondContact O-N 2.98Å; L620-L623 PolarHBondContact O-N 3.33Å; L623-N625 PolarHBondContact O-N 3.07Å; L623-H626 WeakPolarHBondContact O-CB 3.44Å; L623-H626 PolarHBondContact O-N 3.25Å; L623-H626 VanDerWaalsContact O-N 3.08Å; L623-Y627 HydrophobicContact CB-CE2 4.35Å; L623-Y627 HydrophobicContact CD2-CE2 4.27Å; L623-Y627 WeakPolarHBondContact O-CD2 3.44Å; L623-Y627 WeakPolarHBondContact O-CE2 3.43Å; L623-Y627 PolarHBondContact O-N 2.81Å
624	L	93.6	Very high	89.8	Confident	2 Å²	2	41 Å²	41	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-62.1	-42.3	-178.6	-67.1	177.3	0	0	0	111.9	L327 L338 L342 L354 L620 T621 H626 Y627 V628 L640 L644	L327-L624 HydrophobicContact CD1-CD1 4.47Å; L338-L624 HydrophobicContact CD1-CD2 4.14Å; L338-L624 HydrophobicContact CD2-CD1 4.21Å; L338-L624 HydrophobicContact CD2-CD2 3.99Å; L338-L624 HydrophobicContact CG-CD2 4.43Å; L342-L624 HydrophobicContact CD1-CD2 3.59Å; L354-L624 HydrophobicContact CD1-CD2 4.46Å; L620-L624 HydrophobicContact CD1-CD1 3.94Å; L620-L624 HydrophobicContact CD1-CD2 4.34Å; L620-L624 HydrophobicContact CD1-CG 3.9Å; L620-L624 HydrophobicContact CD2-CD1 4.42Å; L620-L624 HydrophobicContact CG-CD1 3.79Å; L620-L624 HydrophobicContact CG-CG 4.17Å; L620-L624 WeakPolarHBondContact O-CB 3.19Å; L620-L624 VanDerWaalsContact O-CG 3.24Å; L620-L624 WeakPolarHBondContact O-CG 3.42Å; L620-L624 PolarHBondContact O-N 3.33Å; T621-L624 PolarHBondContact O-N 2.88Å; L624-H626 PolarHBondContact O-N 3.49Å; L624-Y627 PolarHBondContact O-N 3.27Å; L624-Y627 VanDerWaalsContact O-N 3.07Å; L624-V628 WeakPolarHBondContact O-CB 3.42Å; L624-V628 PolarHBondContact O-N 3.36Å; L624-L640 HydrophobicContact CD1-CD1 4.07Å; L624-L644 HydrophobicContact CB-CD1 3.89Å; L624-L644 HydrophobicContact CB-CD2 3.82Å; L624-L644 HydrophobicContact CD1-CD2 4.35Å
625	N	90.8	Very high	89.6	Confident	65 Å²	65	46.4 Å²	46.4	35%	0.348	25%	0.248	S	C	.	.	H	α-helix	trans	-58.2	-35.6	173.6	-86.9	-46.9	0	0	0	112.9	T621 L623 Y627 L644	T621-N625 WeakPolarHBondContact CG2-ND2 3.47Å; T621-N625 WeakPolarHBondContact O-CB 3.28Å; T621-N625 PolarHBondContact O-N 3.37Å; T621-N625 PolarHBondContact O-ND2 3.1Å; T621-N625 VanDerWaalsContact O-ND2 3.14Å; L623-N625 PolarHBondContact O-N 3.07Å; N625-Y627 VanDerWaalsContact C-N 3.33Å; N625-Y627 PolarHBondContact O-N 2.95Å; N625-L644 WeakPolarHBondContact OD1-CB 3.35Å
626	H	87.1	Confident	89.4	Confident	101 Å²	101	49 Å²	49	47%	0.468	26%	0.261	S	S	.	.	H	α-helix	trans	-70.1	-27.8	177.3	-173.2	84	0	0	0	113.4	Q622 L623 L624 K630	Q622-H626 PolarHBondContact O-N 3.01Å; L623-H626 WeakPolarHBondContact O-CB 3.44Å; L623-H626 PolarHBondContact O-N 3.25Å; L623-H626 VanDerWaalsContact O-N 3.08Å; L624-H626 PolarHBondContact O-N 3.49Å; H626-K630 PolarHBondContact NE2-NZ 3.28Å
627	Y	86	Confident	89.2	Confident	13 Å²	13	48.4 Å²	48.4	5%	0.051	26%	0.258	C	S	.	.	H	α-helix	trans	-107.3	-16.5	-176.1	-57	-67.2	0	0	0	114.7	L342 L346 Q350 L623 L624 N625 S629 K630 I631	L342-Y627 HydrophobicContact CD2-CG 4.3Å; L346-Y627 HydrophobicContact CD2-CD1 3.47Å; L346-Y627 VanDerWaalsContact CD2-CD1 3.47Å; L346-Y627 HydrophobicContact CD2-CD2 3.78Å; L346-Y627 HydrophobicContact CD2-CE1 3.27Å; L346-Y627 HydrophobicContact CD2-CE2 3.65Å; L346-Y627 HydrophobicContact CD2-CG 3.75Å; L346-Y627 VanDerWaalsContact CD2-CZ 3.41Å; Q350-Y627 WeakPolarHBondContact CG-OH 3.14Å; Q350-Y627 PolarHBondContact NE2-OH 2.84Å; L623-Y627 HydrophobicContact CB-CE2 4.35Å; L623-Y627 HydrophobicContact CD2-CE2 4.27Å; L623-Y627 WeakPolarHBondContact O-CD2 3.44Å; L623-Y627 WeakPolarHBondContact O-CE2 3.43Å; L623-Y627 PolarHBondContact O-N 2.81Å; L624-Y627 PolarHBondContact O-N 3.27Å; L624-Y627 VanDerWaalsContact O-N 3.07Å; N625-Y627 VanDerWaalsContact C-N 3.33Å; N625-Y627 PolarHBondContact O-N 2.95Å; Y627-S629 PolarHBondContact O-N 3.27Å; Y627-K630 HydrophobicContact CD1-CD 4.36Å; Y627-K630 CarbonylContact O-C 3.6Å; Y627-K630 WeakPolarHBondContact O-CA 3.49Å; Y627-K630 WeakPolarHBondContact O-CB 3.43Å; Y627-K630 PolarHBondContact O-N 3.04Å; Y627-I631 PolarHBondContact O-N 3.41Å; Y627-I631 VanDerWaalsContact O-N 3.09Å
628	V	87.5	Confident	89	Confident	26 Å²	26	50.7 Å²	50.7	16%	0.158	28%	0.278	C	S	.	.	H	α-helix	trans	-58.4	-35.5	-176.6	72.5	0	0	0	0	111.8	L624 K630 I631 L640 P641 L644	L624-V628 WeakPolarHBondContact O-CB 3.42Å; L624-V628 PolarHBondContact O-N 3.36Å; V628-K630 PolarHBondContact O-N 3.11Å; V628-I631 WeakPolarHBondContact O-CG1 3.5Å; V628-L640 HydrophobicContact CG2-CD2 4.39Å; V628-P641 HydrophobicContact CG2-CB 4.35Å; V628-P641 HydrophobicContact CG2-CG 3.99Å; V628-L644 HydrophobicContact CB-CD1 3.97Å; V628-L644 HydrophobicContact CG1-CD1 4.22Å; V628-L644 HydrophobicContact CG2-CD1 4.09Å
629	S	84.2	Confident	88.9	Confident	103 Å²	103	55.4 Å²	55.4	72%	0.72	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-16	175.4	59.3	0	0	0	0	114.1	Y627	Y627-S629 PolarHBondContact O-N 3.27Å
630	K	83.5	Confident	88.9	Confident	106 Å²	106	53.9 Å²	53.9	46%	0.461	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-17.4	-177.7	-60.9	175.2	-175.5	167	0	112.6	K345 H626 Y627 V628	K345-K630 VanDerWaalsContact CD-O 3.27Å; K345-K630 WeakPolarHBondContact CD-O 3.37Å; K345-K630 WeakPolarHBondContact CE-O 3.38Å; K345-K630 PolarHBondContact NZ-O 3.4Å; H626-K630 PolarHBondContact NE2-NZ 3.28Å; Y627-K630 HydrophobicContact CD1-CD 4.36Å; Y627-K630 CarbonylContact O-C 3.6Å; Y627-K630 WeakPolarHBondContact O-CA 3.49Å; Y627-K630 WeakPolarHBondContact O-CB 3.43Å; Y627-K630 PolarHBondContact O-N 3.04Å; V628-K630 PolarHBondContact O-N 3.11Å
631	I	84.1	Confident	88.9	Confident	12 Å²	12	55.7 Å²	55.7	6%	0.062	31%	0.305	C	S	.	.	S	Bend	trans	-87.6	149.9	179.6	60.7	178.1	0	0	0	111.8	L342 K345 Y627 V628 I633 I637 L640	L342-I631 HydrophobicContact CD2-CD1 4.43Å; L342-I631 HydrophobicContact CD2-CG2 3.54Å; L342-I631 HydrophobicContact CG-CG2 4.27Å; K345-I631 HydrophobicContact CD-CG2 4.22Å; Y627-I631 PolarHBondContact O-N 3.41Å; Y627-I631 VanDerWaalsContact O-N 3.09Å; V628-I631 WeakPolarHBondContact O-CG1 3.5Å; I631-I633 PolarHBondContact O-N 3.46Å; I631-I637 HydrophobicContact CD1-CD1 3.85Å; I631-L640 HydrophobicContact CD1-CD2 4.21Å
632	N	84	Confident	88.8	Confident	124 Å²	124	60.7 Å²	60.7	66%	0.663	33%	0.331	S	S	*	.			trans	-81.9	111	169	-70	-1.9	0	0	0	105.7	T634	N632-T634 PolarHBondContact O-N 3.27Å
633	I	83.7	Confident	89	Confident	90 Å²	90	58.4 Å²	58.4	46%	0.462	32%	0.321	S	S	.	.			trans	-67.5	108.9	-178.9	-62.2	162.6	0	0	0	107.9	I631 I637 A638 P641	I631-I633 PolarHBondContact O-N 3.46Å; I633-I637 HydrophobicContact CG2-CG1 4.43Å; I633-A638 HydrophobicContact CG2-CB 4.39Å; I633-P641 HydrophobicContact CD1-CG 3.58Å; I633-P641 HydrophobicContact CG1-CG 4.34Å
634	T	88.2	Confident	89.3	Confident	33 Å²	33	57.5 Å²	57.5	20%	0.202	32%	0.316	C	S	.	.			trans	-84.4	158.6	174.1	68.8	0	0	0	0	110	N341 N632 Q636 I637 A638	N341-T634 VanDerWaalsContact OD1-CG2 3.31Å; N341-T634 WeakPolarHBondContact OD1-CG2 3.44Å; N632-T634 PolarHBondContact O-N 3.27Å; T634-Q636 PolarHBondContact O-N 3.08Å; T634-Q636 VanDerWaalsContact O-N 3.07Å; T634-Q636 PolarHBondContact OG1-OE1 2.97Å; T634-I637 CarbonylContact O-C 3.13Å; T634-I637 PolarHBondContact O-N 3.34Å; T634-A638 PolarHBondContact O-N 3.03Å
635	P	87.3	Confident	89.2	Confident	116 Å²	116	62 Å²	62	75%	0.753	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-55.1	-29.3	179.1	-26.8	35.3	0	0	0	113.7	I637	P635-I637 VanDerWaalsContact C-N 3.32Å; P635-I637 PolarHBondContact O-N 3.48Å
636	Q	87.9	Confident	89.4	Confident	92 Å²	92	62.1 Å²	62.1	43%	0.43	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-64.7	-35.6	177.8	-58.4	85.6	1.7	0	0	112.2	K334 D337 T634	K334-Q636 WeakPolarHBondContact CD-O 3.25Å; K334-Q636 WeakPolarHBondContact CE-O 3.37Å; K334-Q636 PolarHBondContact NZ-O 3.15Å; D337-Q636 HydrophobicContact CB-CB 4.12Å; T634-Q636 PolarHBondContact O-N 3.08Å; T634-Q636 VanDerWaalsContact O-N 3.07Å; T634-Q636 PolarHBondContact OG1-OE1 2.97Å
637	I	90.9	Very high	89.7	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-110.1	18.7	-176.1	62.8	169.8	0	0	0	113.1	F330 D337 L338 N341 I631 I633 T634 P635 E639 L640	F330-I637 HydrophobicContact CZ-CB 4.12Å; F330-I637 HydrophobicContact CZ-CG2 4.06Å; D337-I637 HydrophobicContact CB-CG2 4.18Å; L338-I637 HydrophobicContact CB-CG2 4.47Å; N341-I637 HydrophobicContact CB-CD1 4.02Å; I631-I637 HydrophobicContact CD1-CD1 3.85Å; I633-I637 HydrophobicContact CG2-CG1 4.43Å; T634-I637 CarbonylContact O-C 3.13Å; T634-I637 PolarHBondContact O-N 3.34Å; P635-I637 VanDerWaalsContact C-N 3.32Å; P635-I637 PolarHBondContact O-N 3.48Å; I637-E639 PolarHBondContact O-N 3.13Å; I637-L640 VanDerWaalsContact O-CB 3.29Å; I637-L640 WeakPolarHBondContact O-CB 3.5Å; I637-L640 PolarHBondContact O-N 3.31Å; I637-L640 VanDerWaalsContact O-N 3.09Å
638	A	91.3	Very high	90	Very high	50 Å²	50	58.8 Å²	58.8	41%	0.413	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-27.5	-174.8	0	0	0	0	0	114.3	I633 T634 L640 P641	I633-A638 HydrophobicContact CG2-CB 4.39Å; T634-A638 PolarHBondContact O-N 3.03Å; A638-L640 VanDerWaalsContact C-N 3.31Å; A638-P641 VanDerWaalsContact O-CD 3.31Å; A638-P641 WeakPolarHBondContact O-CD 3.49Å
639	E	93	Very high	90.3	Very high	103 Å²	103	62 Å²	62	48%	0.481	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-17.9	178.3	-67	153.6	-145.1	0	0	113.1	F330 K334 I637 D642 L643	F330-E639 HydrophobicContact CD2-CB 4.44Å; F330-E639 HydrophobicContact CE2-CB 4.45Å; K334-E639 IonicContact NZ-OE1 3.52Å; K334-E639 PolarHBondContact NZ-OE1 2.72Å; K334-E639 IonicContact NZ-OE2 3.01Å; K334-E639 PolarHBondContact NZ-OE2 3.41Å; I637-E639 PolarHBondContact O-N 3.13Å; E639-D642 PolarHBondContact O-N 3.24Å; E639-L643 WeakPolarHBondContact O-CG 3.24Å; E639-L643 PolarHBondContact O-N 3.09Å; E639-L643 VanDerWaalsContact O-N 3.12Å
640	L	94	Very high	90.6	Very high	3 Å²	3	59.3 Å²	59.3	2%	0.016	32%	0.318	C	S	.	.	H	α-helix	trans	-57.9	-48.2	-172.6	176.3	66.2	0	0	0	113.7	F330 L338 L624 V628 I631 I637 A638 D642 L643 L644	F330-L640 HydrophobicContact CD1-CD1 4.48Å; F330-L640 HydrophobicContact CE1-CB 4.45Å; F330-L640 HydrophobicContact CE1-CD1 4.04Å; F330-L640 HydrophobicContact CE2-CB 4.16Å; F330-L640 HydrophobicContact CZ-CB 3.85Å; F330-L640 HydrophobicContact CZ-CD1 4.29Å; L338-L640 HydrophobicContact CD1-CD2 3.69Å; L624-L640 HydrophobicContact CD1-CD1 4.07Å; V628-L640 HydrophobicContact CG2-CD2 4.39Å; I631-L640 HydrophobicContact CD1-CD2 4.21Å; I637-L640 VanDerWaalsContact O-CB 3.29Å; I637-L640 WeakPolarHBondContact O-CB 3.5Å; I637-L640 PolarHBondContact O-N 3.31Å; I637-L640 VanDerWaalsContact O-N 3.09Å; A638-L640 VanDerWaalsContact C-N 3.31Å; L640-D642 VanDerWaalsContact C-N 3.29Å; L640-D642 PolarHBondContact O-N 2.98Å; L640-L643 PolarHBondContact O-N 3.48Å; L640-L644 HydrophobicContact CD1-CD1 3.92Å; L640-L644 HydrophobicContact CD1-CD2 4.28Å; L640-L644 HydrophobicContact CD1-CG 3.9Å; L640-L644 HydrophobicContact CD2-CD1 4.48Å; L640-L644 HydrophobicContact CG-CD1 3.87Å; L640-L644 HydrophobicContact CG-CG 4.27Å; L640-L644 VanDerWaalsContact O-CG 3.29Å; L640-L644 WeakPolarHBondContact O-CG 3.45Å; L640-L644 PolarHBondContact O-N 2.97Å
641	P	93.7	Very high	90.8	Very high	38 Å²	38	57 Å²	57	25%	0.247	31%	0.31	C	S	.	.	H	α-helix	trans	-59	-40.2	-179.7	-21.1	33.1	0	0	0	112.6	V628 I633 A638 L644 Q645	V628-P641 HydrophobicContact CG2-CB 4.35Å; V628-P641 HydrophobicContact CG2-CG 3.99Å; I633-P641 HydrophobicContact CD1-CG 3.58Å; I633-P641 HydrophobicContact CG1-CG 4.34Å; A638-P641 VanDerWaalsContact O-CD 3.31Å; A638-P641 WeakPolarHBondContact O-CD 3.49Å; P641-L644 PolarHBondContact O-N 3.32Å; P641-Q645 VanDerWaalsContact O-CB 3.29Å; P641-Q645 WeakPolarHBondContact O-CB 3.41Å; P641-Q645 PolarHBondContact O-N 3.24Å
642	D	93.7	Very high	90.8	Very high	109 Å²	109	62.1 Å²	62.1	58%	0.583	34%	0.338	S	S	*	.	H	α-helix	trans	-66.7	-41.7	180	-62.2	-26.9	0	0	0	111	E639 L640 L644 Q645 N646	E639-D642 PolarHBondContact O-N 3.24Å; L640-D642 VanDerWaalsContact C-N 3.29Å; L640-D642 PolarHBondContact O-N 2.98Å; D642-L644 PolarHBondContact O-N 3.26Å; D642-Q645 PolarHBondContact O-N 3.43Å; D642-N646 PolarHBondContact O-N 3.49Å; D642-N646 PolarHBondContact O-ND2 3.32Å; D642-N646 PolarHBondContact O-OD1 3.02Å
643	L	95.1	Very high	90.5	Very high	20 Å²	20	59.9 Å²	59.9	11%	0.105	33%	0.326	C	S	.	.	H	α-helix	trans	-61.5	-44.4	175.3	-66.2	179.2	0	0	0	112.1	Q326 F330 E639 L640 Q645 N646 I647	Q326-L643 HydrophobicContact CB-CD2 3.49Å; Q326-L643 VanDerWaalsContact CB-CD2 3.49Å; Q326-L643 HydrophobicContact CG-CD2 4.38Å; F330-L643 HydrophobicContact CB-CD1 3.55Å; F330-L643 HydrophobicContact CD2-CD1 3.76Å; F330-L643 HydrophobicContact CG-CD1 3.74Å; E639-L643 WeakPolarHBondContact O-CG 3.24Å; E639-L643 PolarHBondContact O-N 3.09Å; E639-L643 VanDerWaalsContact O-N 3.12Å; L640-L643 PolarHBondContact O-N 3.48Å; L643-Q645 VanDerWaalsContact C-N 3.35Å; L643-N646 PolarHBondContact O-N 3.1Å; L643-I647 WeakPolarHBondContact O-CG1 3.43Å; L643-I647 PolarHBondContact O-N 3.33Å; L643-I647 VanDerWaalsContact O-N 3.15Å
644	L	94.9	Very high	89.2	Confident	1 Å²	1	64 Å²	64	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-67.4	-37.9	178.5	-65.4	174.9	0	0	0	111.7	T621 L624 N625 V628 L640 P641 D642 I647 S648	T621-L644 HydrophobicContact CG2-CD2 3.88Å; L624-L644 HydrophobicContact CB-CD1 3.89Å; L624-L644 HydrophobicContact CB-CD2 3.82Å; L624-L644 HydrophobicContact CD1-CD2 4.35Å; N625-L644 WeakPolarHBondContact OD1-CB 3.35Å; V628-L644 HydrophobicContact CB-CD1 3.97Å; V628-L644 HydrophobicContact CG1-CD1 4.22Å; V628-L644 HydrophobicContact CG2-CD1 4.09Å; L640-L644 HydrophobicContact CD1-CD1 3.92Å; L640-L644 HydrophobicContact CD1-CD2 4.28Å; L640-L644 HydrophobicContact CD1-CG 3.9Å; L640-L644 HydrophobicContact CD2-CD1 4.48Å; L640-L644 HydrophobicContact CG-CD1 3.87Å; L640-L644 HydrophobicContact CG-CG 4.27Å; L640-L644 VanDerWaalsContact O-CG 3.29Å; L640-L644 WeakPolarHBondContact O-CG 3.45Å; L640-L644 PolarHBondContact O-N 2.97Å; P641-L644 PolarHBondContact O-N 3.32Å; D642-L644 PolarHBondContact O-N 3.26Å; L644-I647 PolarHBondContact O-N 3.42Å; L644-S648 WeakPolarHBondContact O-CB 3.44Å; L644-S648 PolarHBondContact O-N 2.97Å
645	Q	93.1	Very high	87.3	Confident	95 Å²	95	67.6 Å²	67.6	44%	0.444	37%	0.365	S	S	.	.	H	α-helix	trans	-63.7	-45.4	175.6	-178	57.9	34.3	0	0	111.1	P641 D642 L643 I647 S648 E649	P641-Q645 VanDerWaalsContact O-CB 3.29Å; P641-Q645 WeakPolarHBondContact O-CB 3.41Å; P641-Q645 PolarHBondContact O-N 3.24Å; D642-Q645 PolarHBondContact O-N 3.43Å; L643-Q645 VanDerWaalsContact C-N 3.35Å; Q645-I647 VanDerWaalsContact C-N 3.32Å; Q645-I647 PolarHBondContact O-N 3.19Å; Q645-S648 WeakPolarHBondContact O-CB 3.27Å; Q645-S648 PolarHBondContact O-N 3.24Å; Q645-S648 VanDerWaalsContact O-N 3.15Å; Q645-E649 PolarHBondContact NE2-OE1 3.15Å; Q645-E649 WeakPolarHBondContact O-CG 3.24Å; Q645-E649 PolarHBondContact O-N 3.49Å
646	N	94.2	Very high	85.4	Confident	68 Å²	68	63.4 Å²	63.4	36%	0.364	34%	0.335	S	S	.	.	H	α-helix	trans	-57.8	-43.6	175.5	-68.9	-20	0	0	0	112	D642 L643 E649 L650	D642-N646 PolarHBondContact O-N 3.49Å; D642-N646 PolarHBondContact O-ND2 3.32Å; D642-N646 PolarHBondContact O-OD1 3.02Å; L643-N646 PolarHBondContact O-N 3.1Å; N646-E649 PolarHBondContact O-N 3.3Å; N646-L650 WeakPolarHBondContact O-CG 3.02Å; N646-L650 PolarHBondContact O-N 3.1Å
647	I	94.5	Very high	83.2	Confident	7 Å²	7	65.5 Å²	65.5	4%	0.036	35%	0.354	C	S	.	.	H	α-helix	trans	-66.4	-41.2	177.3	-65.6	165.5	0	0	0	111	L319 Y324 L327 T621 L643 L644 Q645 E649 L650 L651	L319-I647 HydrophobicContact CD1-CG2 3.93Å; Y324-I647 HydrophobicContact CD1-CD1 4Å; Y324-I647 HydrophobicContact CE1-CD1 4.35Å; Y324-I647 HydrophobicContact CE1-CG2 4.04Å; L327-I647 HydrophobicContact CB-CD1 4.14Å; L327-I647 HydrophobicContact CD2-CD1 3.88Å; T621-I647 HydrophobicContact CG2-CB 4.24Å; T621-I647 HydrophobicContact CG2-CD1 4.23Å; T621-I647 HydrophobicContact CG2-CG2 3.78Å; L643-I647 WeakPolarHBondContact O-CG1 3.43Å; L643-I647 PolarHBondContact O-N 3.33Å; L643-I647 VanDerWaalsContact O-N 3.15Å; L644-I647 PolarHBondContact O-N 3.42Å; Q645-I647 VanDerWaalsContact C-N 3.32Å; Q645-I647 PolarHBondContact O-N 3.19Å; I647-E649 VanDerWaalsContact C-N 3.32Å; I647-E649 PolarHBondContact O-N 3.35Å; I647-L650 PolarHBondContact O-N 3.46Å; I647-L651 HydrophobicContact CG2-CD1 4.2Å; I647-L651 WeakPolarHBondContact O-CG 3.24Å; I647-L651 PolarHBondContact O-N 2.8Å
648	S	91.6	Very high	80.6	Confident	38 Å²	38	70 Å²	70	27%	0.266	39%	0.385	S	S	.	.	H	α-helix	trans	-60	-41.7	175.7	-174.5	0	0	0	0	111.9	L644 Q645 L651 N652	L644-S648 WeakPolarHBondContact O-CB 3.44Å; L644-S648 PolarHBondContact O-N 2.97Å; Q645-S648 WeakPolarHBondContact O-CB 3.27Å; Q645-S648 PolarHBondContact O-N 3.24Å; Q645-S648 VanDerWaalsContact O-N 3.15Å; S648-L651 PolarHBondContact O-N 2.97Å; S648-N652 PolarHBondContact O-N 3Å; S648-N652 PolarHBondContact O-ND2 3.31Å
649	E	92.5	Very high	77.8	Confident	93 Å²	93	73 Å²	73	44%	0.435	39%	0.386	S	S	.	.	H	α-helix	trans	-64.2	-42.2	175.4	-72.7	173.3	-166.6	0	0	112.2	Q645 N646 I647 L651 N652 N653	Q645-E649 PolarHBondContact NE2-OE1 3.15Å; Q645-E649 WeakPolarHBondContact O-CG 3.24Å; Q645-E649 PolarHBondContact O-N 3.49Å; N646-E649 PolarHBondContact O-N 3.3Å; I647-E649 VanDerWaalsContact C-N 3.32Å; I647-E649 PolarHBondContact O-N 3.35Å; E649-L651 VanDerWaalsContact C-N 3.32Å; E649-L651 PolarHBondContact O-N 2.89Å; E649-N652 PolarHBondContact O-N 3.46Å; E649-N653 PolarHBondContact O-N 3Å; E649-N653 PolarHBondContact O-ND2 3.03Å
650	L	91.3	Very high	74.9	Confident	47 Å²	47	74.1 Å²	74.1	25%	0.246	40%	0.395	C	S	.	.	H	α-helix	trans	-62	-38.9	174.6	-70.5	172.9	0	0	0	112.4	L319 C323 N646 I647 N652 N653 F656	L319-L650 HydrophobicContact CD1-CB 3.7Å; L319-L650 HydrophobicContact CD1-CD1 4.27Å; L319-L650 HydrophobicContact CD2-CB 4.38Å; C323-L650 HydrophobicContact CB-CD1 4.05Å; N646-L650 WeakPolarHBondContact O-CG 3.02Å; N646-L650 PolarHBondContact O-N 3.1Å; I647-L650 PolarHBondContact O-N 3.46Å; L650-N652 VanDerWaalsContact C-N 3.35Å; L650-N653 PolarHBondContact O-N 3.21Å; L650-F656 HydrophobicContact CD2-CE2 3.95Å; L650-F656 HydrophobicContact CD2-CZ 3.94Å
651	L	87.8	Confident	72.3	Confident	57 Å²	57	80.8 Å²	80.8	30%	0.298	43%	0.426	S	S	.	.	H	α-helix	trans	-65.7	-36.1	175.5	-73.9	168.7	0	0	0	112.5	D317 L319 I647 S648 E649	D317-L651 HydrophobicContact CB-CD2 3.78Å; L319-L651 HydrophobicContact CD1-CD2 4.25Å; L319-L651 HydrophobicContact CD1-CG 4.13Å; L319-L651 HydrophobicContact CD2-CD2 3.8Å; L319-L651 HydrophobicContact CD2-CG 4.3Å; L319-L651 HydrophobicContact CG-CD2 3.73Å; L319-L651 HydrophobicContact CG-CG 4.17Å; I647-L651 HydrophobicContact CG2-CD1 4.2Å; I647-L651 WeakPolarHBondContact O-CG 3.24Å; I647-L651 PolarHBondContact O-N 2.8Å; S648-L651 PolarHBondContact O-N 2.97Å; E649-L651 VanDerWaalsContact C-N 3.32Å; E649-L651 PolarHBondContact O-N 2.89Å
652	N	84.6	Confident	69.7	Low	119 Å²	119	87.2 Å²	87.2	64%	0.636	45%	0.45	S	S	*	.	H	α-helix	trans	-78.1	-20.6	179.7	-70.8	-41.8	0	0	0	113.5	S648 E649 L650 Q654	S648-N652 PolarHBondContact O-N 3Å; S648-N652 PolarHBondContact O-ND2 3.31Å; E649-N652 PolarHBondContact O-N 3.46Å; L650-N652 VanDerWaalsContact C-N 3.35Å; N652-Q654 PolarHBondContact O-N 2.99Å
653	N	77.9	Confident	67	Low	77 Å²	77	86.3 Å²	86.3	41%	0.412	45%	0.446	S	S	.	.			trans	-71.1	96.5	177.8	-76	-28.6	0	0	0	110.7	E649 L650 T655 F656	E649-N653 PolarHBondContact O-N 3Å; E649-N653 PolarHBondContact O-ND2 3.03Å; L650-N653 PolarHBondContact O-N 3.21Å; N653-T655 PolarHBondContact O-N 3.19Å; N653-F656 HydrophobicContact CB-CD2 4.26Å; N653-F656 HydrophobicContact CB-CE2 4.3Å
654	Q	55.2	Low	64	Low	178 Å²	178	92.1 Å²	92.1	83%	0.832	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-61.1	-4.5	175.1	-66.2	-175.3	-11.5	0	0	114.2	N652 F656 T657	N652-Q654 PolarHBondContact O-N 2.99Å; Q654-F656 PolarHBondContact O-N 3.48Å; Q654-T657 PolarHBondContact O-OG1 3.2Å
655	T	48.9	Very low	61.3	Low	107 Å²	107	97.2 Å²	97.2	66%	0.656	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-70.5	-10.3	-179.5	48.9	0	0	0	0	114.3	N653 T657	N653-T655 PolarHBondContact O-N 3.19Å; T655-T657 VanDerWaalsContact C-N 3.25Å; T655-T657 PolarHBondContact O-N 2.99Å
656	F	46.8	Very low	58.6	Low	29 Å²	29	95.3 Å²	95.3	13%	0.127	50%	0.501	C	S	.	.	G	3₁₀ helix	trans	-76.8	-2.3	-179.4	-82	-86.3	0	0	0	115.2	L650 N653 Q654 S658 W659	L650-F656 HydrophobicContact CD2-CE2 3.95Å; L650-F656 HydrophobicContact CD2-CZ 3.94Å; N653-F656 HydrophobicContact CB-CD2 4.26Å; N653-F656 HydrophobicContact CB-CE2 4.3Å; Q654-F656 PolarHBondContact O-N 3.48Å; F656-S658 PolarHBondContact O-N 3.45Å; F656-S658 VanDerWaalsContact O-N 3.11Å; F656-W659 AromaticContact CD1-CD1 3.67Å; F656-W659 HydrophobicContact CD1-CD2 4.01Å; F656-W659 AromaticContact CD1-CE2 3.9Å; F656-W659 AromaticContact CD1-CG 3.92Å; F656-W659 HydrophobicContact CD1-CG 3.92Å; F656-W659 AromaticContact CD1-NE1 3.68Å; F656-W659 AromaticContact CE1-CD1 3.8Å; F656-W659 AromaticContact CE1-CD2 3.93Å; F656-W659 HydrophobicContact CE1-CD2 3.93Å; F656-W659 AromaticContact CE1-CE2 3.36Å; F656-W659 HydrophobicContact CE1-CG 4.21Å; F656-W659 HydrophobicContact CE1-CH2 4.42Å; F656-W659 AromaticContact CE1-CZ2 3.67Å; F656-W659 HydrophobicContact CE1-CZ2 3.67Å; F656-W659 AromaticContact CE1-NE1 3.28Å; F656-W659 VanDerWaalsContact CE1-NE1 3.28Å; F656-W659 HydrophobicContact CZ-CZ2 4.48Å
657	T	42.7	Very low	55.5	Low	136 Å²	136	99.6 Å²	99.6	83%	0.834	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-67.2	-7.3	175.7	51.8	0	0	0	0	114.7	Q654 T655	Q654-T657 PolarHBondContact O-OG1 3.2Å; T655-T657 VanDerWaalsContact C-N 3.25Å; T655-T657 PolarHBondContact O-N 2.99Å
658	S	36.2	Very low	52.6	Low	94 Å²	94	107.3 Å²	107.3	66%	0.657	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-137.5	44.6	175.4	87.1	0	0	0	0	114.1	F656 D660	F656-S658 PolarHBondContact O-N 3.45Å; F656-S658 VanDerWaalsContact O-N 3.11Å; S658-D660 VanDerWaalsContact C-N 3.25Å; S658-D660 PolarHBondContact O-N 2.99Å
659	W	31.7	Very low	49.9	Very low	114 Å²	114	115.3 Å²	115.3	43%	0.432	58%	0.577	S	S	.	*			trans	-62.4	87.7	176.4	-127	40.9	0	0	0	111.3	P320 F656 H661	P320-W659 HydrophobicContact CB-CE3 4.43Å; P320-W659 HydrophobicContact CB-CH2 4.32Å; P320-W659 HydrophobicContact CB-CZ3 3.73Å; P320-W659 HydrophobicContact CG-CE3 3.99Å; P320-W659 HydrophobicContact CG-CH2 4.4Å; P320-W659 HydrophobicContact CG-CZ3 3.73Å; F656-W659 AromaticContact CD1-CD1 3.67Å; F656-W659 HydrophobicContact CD1-CD2 4.01Å; F656-W659 AromaticContact CD1-CE2 3.9Å; F656-W659 AromaticContact CD1-CG 3.92Å; F656-W659 HydrophobicContact CD1-CG 3.92Å; F656-W659 AromaticContact CD1-NE1 3.68Å; F656-W659 AromaticContact CE1-CD1 3.8Å; F656-W659 AromaticContact CE1-CD2 3.93Å; F656-W659 HydrophobicContact CE1-CD2 3.93Å; F656-W659 AromaticContact CE1-CE2 3.36Å; F656-W659 HydrophobicContact CE1-CG 4.21Å; F656-W659 HydrophobicContact CE1-CH2 4.42Å; F656-W659 AromaticContact CE1-CZ2 3.67Å; F656-W659 HydrophobicContact CE1-CZ2 3.67Å; F656-W659 AromaticContact CE1-NE1 3.28Å; F656-W659 VanDerWaalsContact CE1-NE1 3.28Å; F656-W659 HydrophobicContact CZ-CZ2 4.48Å; W659-H661 PolarHBondContact O-N 3.44Å
660	D	33.6	Very low	47	Very low	126 Å²	126	117 Å²	117	67%	0.674	59%	0.589	S	S	*	*			trans	-70.5	121.1	175.9	-123.8	-17.5	0	0	0	107.7	S658 K662 N663	S658-D660 VanDerWaalsContact C-N 3.25Å; S658-D660 PolarHBondContact O-N 2.99Å; D660-K662 PolarHBondContact O-N 2.98Å; D660-N663 PolarHBondContact O-N 3.03Å
661	H	39	Very low	44	Very low	143 Å²	143	120 Å²	120	66%	0.662	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-53	-4.2	-170.7	-64.4	-75.7	0	0	0	116.7	W659 N663	W659-H661 PolarHBondContact O-N 3.44Å; H661-N663 VanDerWaalsContact C-N 3.35Å; H661-N663 PolarHBondContact O-N 3.17Å
662	K	38.8	Very low	41.2	Very low	173 Å²	173	124.5 Å²	124.5	75%	0.752	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-72.7	-22.5	179.5	-70.4	-177.3	179.6	174.8	0	114	D660 Q664 T665	D660-K662 PolarHBondContact O-N 2.98Å; K662-Q664 VanDerWaalsContact C-N 3.32Å; K662-Q664 PolarHBondContact O-N 2.8Å; K662-T665 PolarHBondContact O-OG1 2.79Å
663	N	36	Very low	38.5	Very low	91 Å²	91	123.6 Å²	123.6	49%	0.487	64%	0.636	S	S	.	*	G	3₁₀ helix	trans	-81.4	-4.8	-174.5	-71.8	-15	0	0	0	115	D660 H661 T665 S666 F667	D660-N663 PolarHBondContact O-N 3.03Å; H661-N663 VanDerWaalsContact C-N 3.35Å; H661-N663 PolarHBondContact O-N 3.17Å; N663-T665 PolarHBondContact O-N 3.48Å; N663-S666 WeakPolarHBondContact CA-OG 3.47Å; N663-S666 PolarHBondContact O-N 3.29Å; N663-S666 VanDerWaalsContact O-N 3.09Å; N663-S666 PolarHBondContact O-OG 3.02Å; N663-F667 PolarHBondContact O-N 3.27Å
664	Q	33.2	Very low	36.2	Very low	141 Å²	141	127.3 Å²	127.3	66%	0.659	66%	0.656	S	S	*	*	H	α-helix	trans	-60.6	-30	175.6	-149.7	169.1	29.1	0	0	111.5	K662	K662-Q664 VanDerWaalsContact C-N 3.32Å; K662-Q664 PolarHBondContact O-N 2.8Å
665	T	38.5	Very low	34.8	Very low	109 Å²	109	123.6 Å²	123.6	67%	0.669	65%	0.65	S	S	*	*	H	α-helix	trans	-79.1	-18.1	177.4	63.8	0	0	0	0	114.6	K662 N663	K662-T665 PolarHBondContact O-OG1 2.79Å; N663-T665 PolarHBondContact O-N 3.48Å
666	S	34.8	Very low	33.9	Very low	54 Å²	54	126.7 Å²	126.7	38%	0.378	66%	0.657	S	S	.	*	H	α-helix	trans	-90	-25.6	-179.9	37.3	0	0	0	0	113.6	N663 R669	N663-S666 WeakPolarHBondContact CA-OG 3.47Å; N663-S666 PolarHBondContact O-N 3.29Å; N663-S666 VanDerWaalsContact O-N 3.09Å; N663-S666 PolarHBondContact O-OG 3.02Å; S666-R669 PolarHBondContact O-N 3.28Å
667	F	31.1	Very low	33.1	Very low	158 Å²	158	130.1 Å²	130.1	69%	0.693	68%	0.684	S	S	*	*	H	α-helix	trans	-75.3	-37	-178.3	-132.5	-90.3	0	0	0	112.4	N663 R669 N670	N663-F667 PolarHBondContact O-N 3.27Å; F667-R669 PolarHBondContact O-N 3.17Å; F667-N670 PolarHBondContact O-N 2.86Å
668	E	32.4	Very low	32.3	Very low	170 Å²	170	129.6 Å²	129.6	79%	0.794	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	-18.9	175.2	-70.6	-173.5	165.5	0	0	113.4
669	R	35.2	Very low	31.8	Very low	205 Å²	205	136.7 Å²	136.7	77%	0.774	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-12.1	-179.8	-140.2	-178.2	-78.3	-169.9	-3.3	114.2	S666 F667	S666-R669 PolarHBondContact O-N 3.28Å; F667-R669 PolarHBondContact O-N 3.17Å
670	N	31.1	Very low	31.5	Very low	130 Å²	130	137 Å²	137	70%	0.695	72%	0.718	S	S	*	*	S	Bend	trans	-104.8	1.8	-176.2	-94	9.2	0	0	0	115.5	F667 N672	F667-N670 PolarHBondContact O-N 2.86Å; N670-N672 PolarHBondContact O-N 3.04Å
671	T	29.2	Very low	31.4	Very low	109 Å²	109	134.6 Å²	134.6	67%	0.669	72%	0.723	S	S	*	*	S	Bend	trans	-89.4	29.6	165.5	61.2	0	0	0	0	112.4
672	N	28.1	Very low	30.8	Very low	151 Å²	151	135.6 Å²	135.6	81%	0.807	73%	0.732	S	S	*	*			trans	-144	66.9	173.4	-119	2.3	0	0	0	110.2	N670	N670-N672 PolarHBondContact O-N 3.04Å
673	S	28.4	Very low	30.6	Very low	100 Å²	100	132.8 Å²	132.8	70%	0.699	73%	0.731	S	S	*	*			trans	-141.2	102.6	163.4	61	0	0	0	0	110.5
674	N	28.9	Very low	30.3	Very low	155 Å²	155	140.1 Å²	140.1	83%	0.829	75%	0.752	S	S	*	*			trans	-39.7	135.2	160.9	-101	-12.9	0	0	0	111.6	H676	N674-H676 PolarHBondContact O-N 3.46Å
675	S	26.1	Very low	29.8	Very low	100 Å²	100	141 Å²	141	70%	0.699	76%	0.756	S	S	*	*			trans	-47.8	112.4	166.9	52	0	0	0	0	112.5
676	H	30	Very low	29.2	Very low	173 Å²	173	144 Å²	144	80%	0.801	76%	0.762	S	S	*	*			trans	-152.9	106.7	148.7	-82.8	-55.7	0	0	0	111.4	N674	N674-H676 PolarHBondContact O-N 3.46Å
677	S	29.3	Very low	28.7	Very low	100 Å²	100	146 Å²	146	70%	0.699	78%	0.776	S	S	*	*			trans	45.1	104.7	145	64.8	0	0	0	0	120
678	S	26.3	Very low	28.3	Very low	125 Å²	125	146.3 Å²	146.3	87%	0.874	78%	0.784	S	S	*	*				30	103	118.2	-38.4	0	0	0	0	118
679	R	27	Very low	27.9	Very low	243 Å²	243	142.8 Å²	142.8	92%	0.917	78%	0.784	S	S	*	*			trans	-150.8	118.7	140.6	-159.3	166.1	175.8	179.2	-2.1	112.3
680	S	25.1	Very low	27.5	Very low	120 Å²	120	140 Å²	140	84%	0.839	78%	0.784	S	S	*	*			trans	-59.7	139.1	169.8	46.3	0	0	0	0	112.4
681	G	30.2	Very low	27.2	Very low	77 Å²	77	140.2 Å²	140.2	79%	0.794	79%	0.786	S	S	*	*			trans	-168.4	110.4	175.3	0	0	0	0	0	111.4
682	I	27.8	Very low	27.2	Very low	164 Å²	164	142.8 Å²	142.8	84%	0.841	80%	0.795	S	S	*	*			trans	-63.7	146.4	-169.5	-68	159	0	0	0	113.1
683	P	34.4	Very low	27	Very low	114 Å²	114	141 Å²	141	74%	0.74	79%	0.794	S	S	*	*			trans	-83.7	135.4	-169.9	33.2	-32.7	0	0	0	112.4
684	R	29.4	Very low	27	Very low	245 Å²	245	143.8 Å²	143.8	93%	0.925	80%	0.8	S	S	*	*			trans	-117.1	117.2	168.2	-80.8	-173	176.2	169	-0.2	110.7
685	H	22.4	Very low	26.9	Very low	160 Å²	160	141.1 Å²	141.1	74%	0.741	79%	0.793	S	S	*	*			trans	-54.4	134.8	160.6	-76.6	-115.1	0	0	0	111.2
686	H	26.9	Very low	26.9	Very low	171 Å²	171	142.9 Å²	142.9	79%	0.792	80%	0.799	S	S	*	*				157.8	131.2	112.4	-88.1	-70.5	0	0	0	112.3
687	S	24	Very low	26.8	Very low	97 Å²	97	140 Å²	140	68%	0.678	79%	0.794	S	S	*	*			trans	72	103	136.6	-164.9	0	0	0	0	119.8
688	L	21.6	Very low	26.7	Very low	164 Å²	164	141 Å²	141	86%	0.859	79%	0.791	S	S	*	*				33.2	111.9	117.8	-63	156.9	0	0	0	116.8
689	A	25.3	Very low	26.8	Very low	95 Å²	95	142.5 Å²	142.5	79%	0.785	79%	0.789	S	S	*	*				156.2	141.2	100.6	0	0	0	0	0	112
690	N	26.4	Very low	26.6	Very low	146 Å²	146	141.7 Å²	141.7	78%	0.781	79%	0.786	S	S	*	*			trans	85.2	99.7	146	-122.2	9.6	0	0	0	119.8
691	N	25.3	Very low	26.7	Very low	136 Å²	136	147.3 Å²	147.3	73%	0.727	79%	0.789	S	S	*	*				16	119.1	127.6	-65.4	-13.1	0	0	0	117.3
692	N	29.6	Very low	26.9	Very low	163 Å²	163	149.8 Å²	149.8	87%	0.872	79%	0.791	S	S	*	*				-154.3	121.3	129.3	-95.3	-25.4	0	0	0	110.9
693	S	23.3	Very low	26.9	Very low	113 Å²	113	147.8 Å²	147.8	79%	0.79	79%	0.792	S	S	*	*			trans	-57.6	136.2	170	-37.7	0	0	0	0	110.9
694	I	27.1	Very low	26.5	Very low	159 Å²	159	151.1 Å²	151.1	82%	0.815	80%	0.798	S	S	*	*			trans	-151.6	117.8	155.9	-103.4	148.9	0	0	0	111.1
695	S	27	Very low	26.3	Very low	98 Å²	98	144.4 Å²	144.4	69%	0.685	79%	0.794	S	S	*	*			trans	16.9	116.6	158.4	59.1	0	0	0	0	121.2
696	V	26	Very low	26.5	Very low	137 Å²	137	143.2 Å²	143.2	83%	0.83	80%	0.798	S	S	*	*			trans	-51	123.3	151.8	177.8	0	0	0	0	110.7
697	V	29	Very low	26.5	Very low	114 Å²	114	141.1 Å²	141.1	69%	0.691	80%	0.798	S	S	*	*			trans	-119.3	108.2	162	174.6	0	0	0	0	107.4	N699	V697-N699 PolarHBondContact O-N 3.22Å
698	D	26.6	Very low	26.6	Very low	120 Å²	120	144.3 Å²	144.3	64%	0.642	81%	0.806	S	S	*	*			trans	-64.1	113.3	170.6	-108.1	-43.1	0	0	0	109.7	R700	D698-R700 IonicContact OD1-NE 2.72Å
699	N	29.1	Very low	26.8	Very low	156 Å²	156	143.6 Å²	143.6	83%	0.834	80%	0.801	S	S	*	*			trans	-123	78.1	162.8	-92.2	-27.4	0	0	0	108.3	V697	V697-N699 PolarHBondContact O-N 3.22Å
700	R	23.2	Very low	26.7	Very low	226 Å²	226	147.9 Å²	147.9	85%	0.853	80%	0.802	S	S	*	*			trans	-87.1	110.9	166.2	-69.6	-175.2	-176	-164	-1.6	109.1	D698	D698-R700 IonicContact OD1-NE 2.72Å
701	R	26	Very low	26.7	Very low	239 Å²	239	147 Å²	147	90%	0.902	80%	0.804	S	S	*	*			trans	-129.4	132.8	153.5	-115.8	-179	-178.7	177.4	0.5	108.5
702	P	34.7	Very low	26.7	Very low	128 Å²	128	145.5 Å²	145.5	83%	0.831	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-91	133.4	-162.1	34.8	-30.4	0	0	0	111.3
703	S	27.9	Very low	26.5	Very low	123 Å²	123	146.2 Å²	146.2	86%	0.86	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-101.1	133.3	172	8.1	0	0	0	0	110.9
704	E	26.8	Very low	26.7	Very low	184 Å²	184	147 Å²	147	86%	0.86	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-46.2	139.9	-172	-70.5	157.5	166.8	0	0	117.3	T706	E704-T706 PolarHBondContact O-N 2.95Å
705	A	24.8	Very low	26.7	Very low	103 Å²	103	149.1 Å²	149.1	85%	0.851	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-61.9	118.2	175.6	0	0	0	0	0	111.6
706	T	26.5	Very low	26.6	Very low	135 Å²	135	152.7 Å²	152.7	83%	0.828	82%	0.821	S	S	*	*			trans	-90	113	170.1	-40.5	0	0	0	0	108.9	E704 I708	E704-T706 PolarHBondContact O-N 2.95Å; T706-I708 PolarHBondContact O-N 3.04Å
707	T	27	Very low	26.6	Very low	128 Å²	128	155.2 Å²	155.2	79%	0.785	82%	0.824	S	S	*	*			trans	-62.9	117.7	-179.2	-16.7	0	0	0	0	110.6	I709	T707-I709 PolarHBondContact O-N 3.35Å
708	I	25.3	Very low	26.5	Very low	163 Å²	163	158.7 Å²	158.7	84%	0.836	83%	0.833	S	S	*	*			trans	-71.2	106.4	175.6	-63.6	171.7	0	0	0	108.5	T706 K710	T706-I708 PolarHBondContact O-N 3.04Å; I708-K710 PolarHBondContact O-N 3.29Å
709	I	26.7	Very low	26.5	Very low	150 Å²	150	159.1 Å²	159.1	77%	0.769	84%	0.839	S	S	*	*			trans	-76	116	171.4	-63.7	173.1	0	0	0	107.7	T707	T707-I709 PolarHBondContact O-N 3.35Å
710	K	23.2	Very low	26.4	Very low	184 Å²	184	159 Å²	159	80%	0.8	84%	0.839	S	S	*	*			trans	-57.8	125.9	168.7	-80.9	178.3	174.2	177	0	109.1	I708 S712	I708-K710 PolarHBondContact O-N 3.29Å; K710-S712 PolarHBondContact O-N 3.41Å; K710-S712 VanDerWaalsContact O-N 3.15Å
711	P	26.4	Very low	26.6	Very low	127 Å²	127	159.5 Å²	159.5	83%	0.825	84%	0.841	S	S	*	*			trans	-74.7	109.1	-179.6	28.2	-29.4	0	0	0	109.5
712	S	24.8	Very low	26.5	Very low	105 Å²	105	157.9 Å²	157.9	73%	0.734	84%	0.84	S	S	*	*			trans	-63.8	130.5	169.4	-54.6	0	0	0	0	110	K710 T714	K710-S712 PolarHBondContact O-N 3.41Å; K710-S712 VanDerWaalsContact O-N 3.15Å; S712-T714 PolarHBondContact O-N 3.14Å
713	L	24.5	Very low	26.1	Very low	178 Å²	178	160 Å²	160	93%	0.932	84%	0.844	S	S	*	*			trans	-37.4	99.1	169.9	-118.8	80.8	0	0	0	111.8	K715	L713-K715 PolarHBondContact O-N 3.03Å
714	T	27.6	Very low	25.9	Very low	131 Å²	131	159.9 Å²	159.9	80%	0.804	84%	0.843	S	S	*	*			trans	-79	106.8	168.5	41.1	0	0	0	0	108.3	S712 L716	S712-T714 PolarHBondContact O-N 3.14Å; T714-L716 PolarHBondContact O-N 2.86Å
715	K	27.8	Very low	26.5	Very low	203 Å²	203	156.8 Å²	156.8	88%	0.883	84%	0.838	S	S	*	*			trans	-41.7	120.2	165.5	-76.7	176.8	173.4	-179.6	0	109.7	L713 H717	L713-K715 PolarHBondContact O-N 3.03Å; K715-H717 PolarHBondContact O-N 3.41Å
716	L	23.8	Very low	26.6	Very low	172 Å²	172	161.2 Å²	161.2	90%	0.901	84%	0.841	S	S	*	*			trans	-57.7	126.3	171.5	-78.9	157	0	0	0	109.2	T714 E718	T714-L716 PolarHBondContact O-N 2.86Å; L716-E718 PolarHBondContact O-N 2.9Å; L716-E718 VanDerWaalsContact O-N 3.08Å
717	H	26.4	Very low	26.6	Very low	191 Å²	191	159.3 Å²	159.3	88%	0.884	84%	0.839	S	S	*	*			trans	-58.7	106.5	170.8	-104.2	157.2	0	0	0	109.2	K715 V719	K715-H717 PolarHBondContact O-N 3.41Å; H717-V719 PolarHBondContact O-N 3.34Å
718	E	26.8	Very low	26.5	Very low	186 Å²	186	159.1 Å²	159.1	87%	0.869	84%	0.843	S	S	*	*			trans	-75.8	116.7	168.6	-160.6	168.1	-168.3	0	0	108	L716 D720	L716-E718 PolarHBondContact O-N 2.9Å; L716-E718 VanDerWaalsContact O-N 3.08Å; E718-D720 PolarHBondContact O-N 3.45Å
719	V	27.9	Very low	26.5	Very low	130 Å²	130	159.1 Å²	159.1	79%	0.788	84%	0.843	S	S	*	*			trans	-75.1	111	-179.4	173.2	0	0	0	0	108.8	H717 R721	H717-V719 PolarHBondContact O-N 3.34Å; V719-R721 PolarHBondContact O-N 3.43Å; V719-R721 VanDerWaalsContact O-N 3.1Å
720	D	25.9	Very low	26.4	Very low	154 Å²	154	158.9 Å²	158.9	82%	0.824	84%	0.844	S	S	*	*			trans	-41.2	105.7	173.4	-83.5	-47.1	0	0	0	113.4	E718	E718-D720 PolarHBondContact O-N 3.45Å
721	R	27.2	Very low	26.5	Very low	236 Å²	236	156.2 Å²	156.2	89%	0.891	84%	0.843	S	S	*	*			trans	-103.2	103.4	154	-73.8	-168.2	-146.6	-149.4	5.5	109.2	V719 L723	V719-R721 PolarHBondContact O-N 3.43Å; V719-R721 VanDerWaalsContact O-N 3.1Å; R721-L723 PolarHBondContact O-N 2.91Å
722	K	23.7	Very low	26.5	Very low	205 Å²	205	158.8 Å²	158.8	89%	0.891	84%	0.841	S	S	*	*			trans	-43.6	116	170.9	-65.8	174.5	176.2	179.1	0	112.4
723	L	27.4	Very low	26.5	Very low	173 Å²	173	160.2 Å²	160.2	91%	0.906	85%	0.845	S	S	*	*			trans	-131.8	128.7	153.8	-93.1	144.6	0	0	0	108	R721	R721-L723 PolarHBondContact O-N 2.91Å
724	S	24.5	Very low	26.5	Very low	120 Å²	120	159.8 Å²	159.8	84%	0.839	84%	0.842	S	S	*	*			trans	-68.3	159.9	-169.3	-142.9	0	0	0	0	112.8
725	P	38.8	Very low	26.3	Very low	118 Å²	118	163.4 Å²	163.4	77%	0.766	84%	0.841	S	S	*	*			trans	-96.4	140.6	-156.6	36.4	-30.7	0	0	0	113.7
726	E	26.8	Very low	26.1	Very low	196 Å²	196	159.3 Å²	159.3	92%	0.916	83%	0.829	S	S	*	*			trans	-114.6	116.5	164.5	-75.6	-170.7	159.5	0	0	111.4
727	A	27	Very low	26.2	Very low	95 Å²	95	160.8 Å²	160.8	79%	0.785	83%	0.831	S	S	*	*			trans	32.2	104.4	152	0	0	0	0	0	120.1
728	S	24.2	Very low	26.1	Very low	124 Å²	124	160.3 Å²	160.3	87%	0.867	83%	0.829	S	S	*	*			trans	-62.9	120.6	167.2	-7.9	0	0	0	0	113
729	I	25.8	Very low	26	Very low	163 Å²	163	160.7 Å²	160.7	84%	0.836	83%	0.831	S	S	*	*			trans	-85.7	119.8	166	-64.4	175.7	0	0	0	109
730	N	24	Very low	26.5	Very low	146 Å²	146	159.7 Å²	159.7	78%	0.781	83%	0.827	S	S	*	*			trans	-92.8	100.5	-166.9	-161.7	-5.1	0	0	0	110
731	V	26.3	Very low	26.4	Very low	128 Å²	128	159.2 Å²	159.2	78%	0.776	83%	0.825	S	S	*	*			trans	-97.3	112.2	174.7	-178.2	0	0	0	0	109.5	T733	V731-T733 PolarHBondContact O-N 3.39Å
732	K	24.6	Very low	26.5	Very low	181 Å²	181	155.6 Å²	155.6	79%	0.787	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-65.8	122.9	-176.6	-75.3	175.2	175.3	174.4	0	112.4	I734	K732-I734 PolarHBondContact O-N 3.48Å
733	T	24.6	Very low	26.6	Very low	135 Å²	135	153.1 Å²	153.1	83%	0.828	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-57.9	116.2	165.3	-50.2	0	0	0	0	111.6	V731	V731-T733 PolarHBondContact O-N 3.39Å
734	I	25.6	Very low	26.6	Very low	168 Å²	168	149 Å²	149	86%	0.862	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-93	125	167.7	-64	177.2	0	0	0	108.2	K732	K732-I734 PolarHBondContact O-N 3.48Å
735	R	22.5	Very low	26.8	Very low	208 Å²	208	149.4 Å²	149.4	79%	0.785	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-102.9	134.2	-169.1	-174.7	177.6	-169.3	169.5	4	109.7
736	N	23.8	Very low	26.1	Very low	116 Å²	116	149.4 Å²	149.4	62%	0.62	81%	0.811	S	S	*	*			trans	52.1	127.3	151.6	-61.8	-4.9	0	0	0	119.7
737	Q	26.3	Very low	26.2	Very low	204 Å²	204	144.6 Å²	144.6	95%	0.953	81%	0.805	S	S	*	*			trans	-146.5	120.5	132.9	-105.2	159	76.2	0	0	109.4
738	Q	23.7	Very low	26.2	Very low	181 Å²	181	147 Å²	147	85%	0.846	80%	0.804	S	S	*	*			trans	-79.9	138.3	175.5	-74.2	158.7	-65.6	0	0	109.4
739	E	24.7	Very low	26.3	Very low	193 Å²	193	146.1 Å²	146.1	90%	0.902	80%	0.798	S	S	*	*			trans	-145.3	155.2	159.9	-93.8	-165.4	171.1	0	0	110.6
740	P	38.9	Very low	26.4	Very low	109 Å²	109	146.1 Å²	146.1	71%	0.708	80%	0.8	S	S	*	*				-109.9	157.2	-121.8	37.1	-32.3	0	0	0	115.7
741	N	24.1	Very low	26.6	Very low	145 Å²	145	147.8 Å²	147.8	78%	0.775	80%	0.803	S	S	*	*			trans	-45.2	132.4	164.1	-75.9	-26.5	0	0	0	112.9
742	N	30.1	Very low	26.4	Very low	159 Å²	159	147.8 Å²	147.8	85%	0.85	81%	0.807	S	S	*	*			trans	-140.3	109.7	148.7	-85.5	-38.3	0	0	0	110.2
743	N	25.9	Very low	26.5	Very low	154 Å²	154	146.1 Å²	146.1	82%	0.824	81%	0.805	S	S	*	*			trans	-69.9	139.9	166.8	-65.3	-35.9	0	0	0	109.8
744	A	26.6	Very low	26.5	Very low	87 Å²	87	145 Å²	145	72%	0.719	80%	0.803	S	S	*	*			trans	-161.7	111.5	146.2	0	0	0	0	0	112.4
745	T	28.7	Very low	26.4	Very low	128 Å²	128	142.1 Å²	142.1	79%	0.785	80%	0.798	S	S	*	*			trans	65.8	97.6	136.7	52.9	0	0	0	0	120.9
746	S	23.4	Very low	26.6	Very low	117 Å²	117	138.8 Å²	138.8	82%	0.818	80%	0.801	S	S	*	*				-7	128.4	128.5	56	0	0	0	0	117.8
747	A	29	Very low	26.5	Very low	96 Å²	96	144.6 Å²	144.6	79%	0.793	81%	0.814	S	S	*	*			trans	-146	107.4	149.2	0	0	0	0	0	109.5
748	D	28.1	Very low	26.5	Very low	145 Å²	145	143.4 Å²	143.4	78%	0.775	81%	0.808	S	S	*	*			trans	41.8	107.7	148.2	-63.1	-22.5	0	0	0	121.6
749	S	25	Very low	26.5	Very low	105 Å²	105	143.9 Å²	143.9	73%	0.734	81%	0.811	S	S	*	*			trans	-12.4	120.3	133.1	47.7	0	0	0	0	116.1
750	N	29.4	Very low	26.6	Very low	163 Å²	163	143.7 Å²	143.7	87%	0.872	81%	0.807	S	S	*	*			trans	-131.1	132.3	147.1	-90.1	-41.1	0	0	0	109.6
751	E	28.3	Very low	25.9	Very low	182 Å²	182	142.8 Å²	142.8	85%	0.85	80%	0.803	S	S	*	*			trans	-59.7	126.5	-165.6	-67.2	168.5	134.4	0	0	113.1	I753	E751-I753 PolarHBondContact O-N 2.87Å
752	C	21.6	Very low	25.9	Very low	127 Å²	127	147.6 Å²	147.6	86%	0.858	81%	0.81	S	S	*	*			trans	-84.1	98.4	170.3	-153.5	0	0	0	0	107.9	S754	C752-S754 PolarHBondContact O-N 2.83Å; C752-S754 VanDerWaalsContact O-N 3.15Å
753	I	26.6	Very low	25.8	Very low	146 Å²	146	146.1 Å²	146.1	75%	0.749	80%	0.803	S	S	*	*			trans	-68	109.9	170	-64.9	174	0	0	0	107.8	E751 S755	E751-I753 PolarHBondContact O-N 2.87Å; I753-S755 PolarHBondContact O-N 2.88Å; I753-S755 VanDerWaalsContact O-N 3.08Å
754	S	23.3	Very low	25.7	Very low	112 Å²	112	144.2 Å²	144.2	78%	0.783	80%	0.797	S	S	*	*			trans	-64.5	97	175	24.2	0	0	0	0	110.1	C752	C752-S754 PolarHBondContact O-N 2.83Å; C752-S754 VanDerWaalsContact O-N 3.15Å
755	S	23.9	Very low	25.6	Very low	108 Å²	108	149.5 Å²	149.5	76%	0.755	80%	0.804	S	S	*	*			trans	-91	103.9	165.7	34	0	0	0	0	108.8	I753 R757	I753-S755 PolarHBondContact O-N 2.88Å; I753-S755 VanDerWaalsContact O-N 3.08Å; S755-R757 PolarHBondContact O-N 3.41Å; S755-R757 VanDerWaalsContact O-N 3.13Å
756	T	27.4	Very low	25.4	Very low	138 Å²	138	149.7 Å²	149.7	85%	0.847	80%	0.799	S	S	*	*			trans	-49.3	109.9	170.6	22.8	0	0	0	0	110.6	Q758	T756-Q758 PolarHBondContact O-N 3.25Å
757	R	22.5	Very low	25.4	Very low	237 Å²	237	150.9 Å²	150.9	89%	0.894	79%	0.794	S	S	*	*			trans	-71.3	93.8	174.8	-162.3	178.2	-169.3	-168.8	2.3	108.1	S755 E759	S755-R757 PolarHBondContact O-N 3.41Å; S755-R757 VanDerWaalsContact O-N 3.13Å; R757-E759 PolarHBondContact O-N 3.31Å; R757-E759 VanDerWaalsContact O-N 3.13Å
758	Q	25.9	Very low	25.2	Very low	179 Å²	179	154.6 Å²	154.6	84%	0.836	80%	0.795	S	S	*	*			trans	-59.3	110.5	163.1	-84	-179.6	-32.1	0	0	108.1	T756 K760	T756-Q758 PolarHBondContact O-N 3.25Å; Q758-K760 PolarHBondContact O-N 3.33Å; Q758-K760 VanDerWaalsContact O-N 3.08Å
759	E	23.3	Very low	25	Very low	191 Å²	191	154.7 Å²	154.7	89%	0.893	79%	0.789	S	S	*	*			trans	-58.8	109.7	168.3	-76.9	179.7	150.1	0	0	108.7	R757 S761	R757-E759 PolarHBondContact O-N 3.31Å; R757-E759 VanDerWaalsContact O-N 3.13Å; E759-S761 PolarHBondContact O-N 3.3Å; E759-S761 VanDerWaalsContact O-N 3.1Å
760	K	25.8	Very low	24.9	Very low	190 Å²	190	158.5 Å²	158.5	83%	0.826	80%	0.795	S	S	*	*			trans	-70.3	103.4	169.9	-71.7	-179.8	176.4	180	0	107.1	Q758 W762	Q758-K760 PolarHBondContact O-N 3.33Å; Q758-K760 VanDerWaalsContact O-N 3.08Å; K760-W762 PolarHBondContact O-N 3.44Å
761	S	25.8	Very low	24.7	Very low	90 Å²	90	159.8 Å²	159.8	63%	0.629	79%	0.789	S	S	*	*			trans	-38.8	120.1	160.3	177.7	0	0	0	0	108.9	E759 D763	E759-S761 PolarHBondContact O-N 3.3Å; E759-S761 VanDerWaalsContact O-N 3.1Å; S761-D763 PolarHBondContact O-N 3.03Å; S761-D763 PolarHBondContact OG-OD1 2.69Å; S761-D763 VanDerWaalsContact OG-OD1 3.07Å
762	W	24.2	Very low	24.6	Very low	245 Å²	245	158.5 Å²	158.5	93%	0.928	79%	0.787	S	S	*	*			trans	-72	76.6	169	-73.3	84.8	0	0	0	107.7	K760 T764	K760-W762 PolarHBondContact O-N 3.44Å; W762-T764 PolarHBondContact O-N 3.17Å; W762-T764 PolarHBondContact O-OG1 2.99Å
763	D	26	Very low	24.7	Very low	129 Å²	129	157.7 Å²	157.7	69%	0.69	78%	0.78	S	S	*	*			trans	-58.5	98.8	163.3	-73.8	-13.5	0	0	0	106	S761 F765	S761-D763 PolarHBondContact O-N 3.03Å; S761-D763 PolarHBondContact OG-OD1 2.69Å; S761-D763 VanDerWaalsContact OG-OD1 3.07Å; D763-F765 PolarHBondContact O-N 3.2Å
764	T	25.8	Very low	24.5	Very low	113 Å²	113	156.1 Å²	156.1	69%	0.693	78%	0.781	S	S	*	*			trans	-52.8	111.7	178.8	-65.8	0	0	0	0	106.6	W762 I766	W762-T764 PolarHBondContact O-N 3.17Å; W762-T764 PolarHBondContact O-OG1 2.99Å; T764-I766 HydrophobicContact CG2-CG1 4.12Å; T764-I766 PolarHBondContact O-N 2.61Å
765	F	23.1	Very low	24.6	Very low	199 Å²	199	160.1 Å²	160.1	87%	0.873	78%	0.784	S	S	*	*			trans	-60.1	82.4	168	-95.3	-100.3	0	0	0	107.9	D763 I767	D763-F765 PolarHBondContact O-N 3.2Å; F765-I767 VanDerWaalsContact C-N 3.3Å; F765-I767 PolarHBondContact O-N 3.49Å
766	I	24.8	Very low	24.7	Very low	132 Å²	132	163.2 Å²	163.2	68%	0.677	78%	0.784	S	S	*	*			trans	-67	99.7	163.1	-63.5	-174.7	0	0	0	104.5	T764 Q768	T764-I766 HydrophobicContact CG2-CG1 4.12Å; T764-I766 PolarHBondContact O-N 2.61Å; I766-Q768 HydrophobicContact CG2-CG 4.4Å; I766-Q768 PolarHBondContact O-N 2.9Å
767	I	23.9	Very low	24.7	Very low	141 Å²	141	163 Å²	163	72%	0.723	78%	0.778	S	S	*	*			trans	-59.4	93	164.4	-61.7	173.7	0	0	0	105.6	F765 K769	F765-I767 VanDerWaalsContact C-N 3.3Å; F765-I767 PolarHBondContact O-N 3.49Å; I767-K769 HydrophobicContact CG2-CG 4.32Å; I767-K769 PolarHBondContact O-N 3.45Å
768	Q	23.5	Very low	25	Very low	174 Å²	174	156.9 Å²	156.9	81%	0.813	77%	0.771	S	S	*	*			trans	-64.4	82.9	168.4	-76.7	-178.1	-21.9	0	0	107.3	I766 E770	I766-Q768 HydrophobicContact CG2-CG 4.4Å; I766-Q768 PolarHBondContact O-N 2.9Å; Q768-E770 PolarHBondContact O-N 2.96Å; Q768-E770 VanDerWaalsContact O-N 3.13Å
769	K	23.9	Very low	25.3	Very low	147 Å²	147	152.9 Å²	152.9	64%	0.639	76%	0.759	S	S	*	*			trans	-66.2	107	154.1	-80.6	-170	175	-177.6	0	105.4	I767 Y771	I767-K769 HydrophobicContact CG2-CG 4.32Å; I767-K769 PolarHBondContact O-N 3.45Å; K769-Y771 HydrophobicContact CB-CD2 4.06Å; K769-Y771 HydrophobicContact CB-CE2 3.71Å; K769-Y771 WeakPolarHBondContact O-CD2 3.49Å; K769-Y771 PolarHBondContact O-N 2.99Å
770	E	24.7	Very low	25.7	Very low	185 Å²	185	151.1 Å²	151.1	86%	0.864	76%	0.756	S	S	*	*			trans	-57.3	88.8	167.4	-80.8	-177.7	139.8	0	0	108.7	Q768 L772	Q768-E770 PolarHBondContact O-N 2.96Å; Q768-E770 VanDerWaalsContact O-N 3.13Å; E770-L772 PolarHBondContact O-N 3.49Å; E770-L772 VanDerWaalsContact O-N 3.13Å
771	Y	25.2	Very low	25.7	Very low	191 Å²	191	149 Å²	149	75%	0.749	75%	0.751	S	S	*	*			trans	-73.9	99.1	164.2	-75	-82.4	0	0	0	106.5	K769 P773	K769-Y771 HydrophobicContact CB-CD2 4.06Å; K769-Y771 HydrophobicContact CB-CE2 3.71Å; K769-Y771 WeakPolarHBondContact O-CD2 3.49Å; K769-Y771 PolarHBondContact O-N 2.99Å; Y771-P773 VanDerWaalsContact O-CD 3.29Å; Y771-P773 WeakPolarHBondContact O-CD 3.33Å
772	L	24.3	Very low	25.9	Very low	155 Å²	155	151 Å²	151	81%	0.812	75%	0.753	S	S	*	*			trans	-49	114.3	170.2	-87.6	147.8	0	0	0	108.7	E770 C774	E770-L772 PolarHBondContact O-N 3.49Å; E770-L772 VanDerWaalsContact O-N 3.13Å; L772-C774 PolarHBondContact O-N 3.32Å
773	P	25	Very low	26.1	Very low	110 Å²	110	147.7 Å²	147.7	71%	0.714	75%	0.746	S	S	*	*			trans	-74.3	106.6	-171.9	26.6	-30.7	0	0	0	109.2	Y771 K775	Y771-P773 VanDerWaalsContact O-CD 3.29Å; Y771-P773 WeakPolarHBondContact O-CD 3.33Å; P773-K775 PolarHBondContact O-N 3.46Å
774	C	22.2	Very low	26.5	Very low	112 Å²	112	150.2 Å²	150.2	76%	0.757	75%	0.751	S	S	*	*			trans	-62.2	100.8	168.7	-58.6	0	0	0	0	108.2	L772 F776	L772-C774 PolarHBondContact O-N 3.32Å; C774-F776 PolarHBondContact O-N 3.26Å
775	K	26.2	Very low	26.7	Very low	196 Å²	196	152.7 Å²	152.7	85%	0.852	75%	0.754	S	S	*	*			trans	-60	102.2	173.8	-74.8	-178.3	176	178.6	0	109.2	P773 N777	P773-K775 PolarHBondContact O-N 3.46Å; K775-N777 PolarHBondContact O-N 2.93Å
776	F	24.8	Very low	27.3	Very low	173 Å²	173	148.6 Å²	148.6	76%	0.759	74%	0.74	S	S	*	*			trans	-66.2	106.4	165.4	-93.4	-94.7	0	0	0	108.7	C774 S778	C774-F776 PolarHBondContact O-N 3.26Å; F776-S778 PolarHBondContact O-N 3.46Å
777	N	28.3	Very low	27.7	Very low	134 Å²	134	148.9 Å²	148.9	72%	0.717	74%	0.739	S	S	*	*			trans	-80.4	98.6	160	-89.1	-8.8	0	0	0	107.6	K775 T779	K775-N777 PolarHBondContact O-N 2.93Å; N777-T779 PolarHBondContact O-N 3.1Å
778	S	28.6	Very low	28.4	Very low	108 Å²	108	149.1 Å²	149.1	76%	0.755	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	8.8	-179.5	-47.9	0	0	0	0	114.9	F776	F776-S778 PolarHBondContact O-N 3.46Å
779	T	31.5	Very low	29.1	Very low	95 Å²	95	147.3 Å²	147.3	58%	0.583	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-17.7	-172.3	13.7	0	0	0	0	115	N777	N777-T779 PolarHBondContact O-N 3.1Å
780	D	32.3	Very low	29.8	Very low	155 Å²	155	145.1 Å²	145.1	83%	0.829	73%	0.731	S	S	*	*	S	Bend	trans	-96	1.6	-175.2	-71.7	-19.1	0	0	0	115.1
781	M	25.7	Very low	30.5	Very low	144 Å²	144	142.9 Å²	142.9	71%	0.709	72%	0.724	S	S	*	*			trans	-103.4	47.2	173.4	-77.4	-80.7	-54.1	0	0	111.4	F783	M781-F783 HydrophobicContact CE-CD2 4.34Å; M781-F783 HydrophobicContact CE-CE2 3.59Å; M781-F783 HydrophobicContact CE-CZ 4.15Å; M781-F783 PolarHBondContact O-N 3.28Å
782	I	29.8	Very low	31.3	Very low	132 Å²	132	142.7 Å²	142.7	68%	0.677	73%	0.73	S	S	*	*			trans	-73.5	97.9	167.9	-62.1	176.2	0	0	0	107.5	K784	I782-K784 VanDerWaalsContact C-N 3.27Å; I782-K784 HydrophobicContact CG2-CG 4.31Å; I782-K784 PolarHBondContact O-N 3.13Å
783	F	29.2	Very low	32.1	Very low	176 Å²	176	142.1 Å²	142.1	77%	0.772	72%	0.723	S	S	*	*			trans	-57.9	90.7	161.6	-85.2	-91.8	0	0	0	108.5	M781 Q785	M781-F783 HydrophobicContact CE-CD2 4.34Å; M781-F783 HydrophobicContact CE-CE2 3.59Å; M781-F783 HydrophobicContact CE-CZ 4.15Å; M781-F783 PolarHBondContact O-N 3.28Å; F783-Q785 PolarHBondContact O-N 2.83Å
784	K	32.9	Very low	33.3	Very low	183 Å²	183	142 Å²	142	80%	0.796	72%	0.723	S	S	*	*			trans	-65.2	109.1	167.7	-86	-173.5	175.6	-179.6	0	107.8	I782 I786	I782-K784 VanDerWaalsContact C-N 3.27Å; I782-K784 HydrophobicContact CG2-CG 4.31Å; I782-K784 PolarHBondContact O-N 3.13Å; K784-I786 PolarHBondContact O-N 3.26Å
785	Q	31.3	Very low	34.6	Very low	164 Å²	164	144.7 Å²	144.7	77%	0.766	72%	0.724	S	S	*	*			trans	-52.4	104.2	172.5	-163.2	92.4	26.2	0	0	109.2	F783 H787	F783-Q785 PolarHBondContact O-N 2.83Å; Q785-H787 PolarHBondContact O-N 3.32Å
786	I	35.2	Very low	35.9	Very low	114 Å²	114	138 Å²	138	59%	0.585	70%	0.698	S	S	*	*			trans	-71.9	112.4	178.9	-63.6	161.3	0	0	0	108	K784 L800	K784-I786 PolarHBondContact O-N 3.26Å; I786-L800 HydrophobicContact CD1-CD2 4.16Å
787	H	33.5	Very low	37.1	Very low	138 Å²	138	135.6 Å²	135.6	64%	0.639	69%	0.69	S	S	*	*			trans	-77	135.2	177.2	-116	-100.6	0	0	0	109.9	Q785 N789	Q785-H787 PolarHBondContact O-N 3.32Å; H787-N789 PolarHBondContact O-N 2.87Å; H787-N789 VanDerWaalsContact O-N 3.07Å
788	I	37.6	Very low	39.3	Very low	145 Å²	145	135.3 Å²	135.3	74%	0.744	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-67	-10.7	-170.9	-68.8	172.2	0	0	0	113.6	D790	I788-D790 VanDerWaalsContact C-N 3.3Å; I788-D790 PolarHBondContact O-N 2.9Å
789	N	38.8	Very low	41.3	Very low	137 Å²	137	136 Å²	136	73%	0.733	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-77.3	-11	-174.2	-68.3	5	0	0	0	114.5	H787 L791	H787-N789 PolarHBondContact O-N 2.87Å; H787-N789 VanDerWaalsContact O-N 3.07Å; N789-L791 VanDerWaalsContact C-N 3.26Å; N789-L791 PolarHBondContact O-N 3.29Å
790	D	38.2	Very low	42.9	Very low	100 Å²	100	134.4 Å²	134.4	54%	0.535	66%	0.663	S	S	.	*	G	3₁₀ helix	trans	-86.7	7.3	179.8	-64.3	-26.3	0	0	0	113.6	I788 E792	I788-D790 VanDerWaalsContact C-N 3.3Å; I788-D790 PolarHBondContact O-N 2.9Å; D790-E792 PolarHBondContact O-N 3.43Å
791	L	40.1	Very low	44.7	Very low	138 Å²	138	130.9 Å²	130.9	72%	0.723	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-84.8	-2.8	-175.2	-137.6	79	0	0	0	115	N789	N789-L791 VanDerWaalsContact C-N 3.26Å; N789-L791 PolarHBondContact O-N 3.29Å
792	E	42	Very low	46.9	Very low	188 Å²	188	126.8 Å²	126.8	88%	0.879	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-90.1	-4.5	178.1	-70.8	-165.6	162.5	0	0	114.2	D790	D790-E792 PolarHBondContact O-N 3.43Å
793	Q	40.5	Very low	49.1	Very low	143 Å²	143	125.5 Å²	125.5	67%	0.668	62%	0.621	S	S	*	*			trans	-109.4	115.9	174.6	-64.8	-164.4	5.8	0	0	111.6	E795 N796	Q793-E795 PolarHBondContact O-N 3.26Å; Q793-E795 VanDerWaalsContact O-N 3.11Å; Q793-N796 PolarHBondContact O-N 2.92Å
794	P	51.1	Low	50.7	Low	108 Å²	108	124.3 Å²	124.3	70%	0.701	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-19	-173.6	24.7	-33.1	0	0	0	113.7	N796 M797	P794-N796 PolarHBondContact O-N 3.35Å; P794-M797 PolarHBondContact O-N 3.45Å
795	E	50.2	Low	52.9	Low	168 Å²	168	122.9 Å²	122.9	79%	0.785	60%	0.602	S	S	*	*	H	α-helix	trans	-67.7	-23.9	178.5	-63.8	-174.1	172.8	0	0	112.7	Q793	Q793-E795 PolarHBondContact O-N 3.26Å; Q793-E795 VanDerWaalsContact O-N 3.11Å
796	N	52.5	Low	55.4	Low	56 Å²	56	118.9 Å²	118.9	30%	0.299	58%	0.583	S	S	.	*	H	α-helix	trans	-83	-14.2	-178.5	-143.9	-7.1	0	0	0	113.3	Q793 P794 L800	Q793-N796 PolarHBondContact O-N 2.92Å; P794-N796 PolarHBondContact O-N 3.35Å; N796-L800 PolarHBondContact O-N 3.46Å; N796-L800 VanDerWaalsContact O-N 3.13Å
797	M	49.8	Very low	56.8	Low	121 Å²	121	119 Å²	119	60%	0.596	58%	0.581	S	S	*	*	H	α-helix	trans	-76.2	-35.3	-174.6	-149.8	-159.1	-53.9	0	0	112.8	P794 E799 L800 L801	P794-M797 PolarHBondContact O-N 3.45Å; M797-E799 VanDerWaalsContact C-N 3.33Å; M797-L800 PolarHBondContact O-N 3.22Å; M797-L801 WeakPolarHBondContact O-CB 3.49Å; M797-L801 VanDerWaalsContact O-CG 3.31Å; M797-L801 WeakPolarHBondContact O-CG 3.08Å; M797-L801 PolarHBondContact O-N 2.78Å
798	E	74	Confident	58.4	Low	128 Å²	128	116.2 Å²	116.2	60%	0.598	57%	0.57	S	S	*	*	H	α-helix	trans	-67.9	-36.3	176.9	-164.7	84.3	-144.7	0	0	110.8	L801 S802	E798-L801 PolarHBondContact O-N 3.16Å; E798-S802 WeakPolarHBondContact O-CB 3.03Å; E798-S802 PolarHBondContact O-N 3.24Å; E798-S802 PolarHBondContact O-OG 3.16Å
799	E	71.3	Confident	60.4	Low	123 Å²	123	116.2 Å²	116.2	58%	0.575	56%	0.561	S	S	*	*	H	α-helix	trans	-67.6	-44.5	175.5	-169	169.3	-178.7	0	0	111.5	M797 L801 S802 Q803	M797-E799 VanDerWaalsContact C-N 3.33Å; E799-L801 PolarHBondContact O-N 3.39Å; E799-S802 WeakPolarHBondContact O-CB 3.48Å; E799-S802 PolarHBondContact O-N 3.43Å; E799-S802 VanDerWaalsContact O-N 3.16Å; E799-Q803 PolarHBondContact O-N 3.41Å
800	L	65.2	Low	62.2	Low	61 Å²	61	114.9 Å²	114.9	32%	0.319	55%	0.55	S	S	.	*	H	α-helix	trans	-60.6	-43	173.8	-111.3	156.6	0	0	0	112.8	I786 N796 M797 S802 Q803 Y804	I786-L800 HydrophobicContact CD1-CD2 4.16Å; N796-L800 PolarHBondContact O-N 3.46Å; N796-L800 VanDerWaalsContact O-N 3.13Å; M797-L800 PolarHBondContact O-N 3.22Å; L800-S802 VanDerWaalsContact C-N 3.32Å; L800-Q803 PolarHBondContact O-N 3.27Å; L800-Y804 PolarHBondContact O-N 3.13Å
801	L	69.9	Low	63.3	Low	82 Å²	82	114.9 Å²	114.9	43%	0.429	55%	0.55	S	S	.	.	H	α-helix	trans	-66	-36.7	175	-75.8	171.1	0	0	0	111.7	M797 E798 E799 Y804 R805	M797-L801 WeakPolarHBondContact O-CB 3.49Å; M797-L801 VanDerWaalsContact O-CG 3.31Å; M797-L801 WeakPolarHBondContact O-CG 3.08Å; M797-L801 PolarHBondContact O-N 2.78Å; E798-L801 PolarHBondContact O-N 3.16Å; E799-L801 PolarHBondContact O-N 3.39Å; L801-Y804 PolarHBondContact O-N 3.35Å; L801-R805 WeakPolarHBondContact O-CB 3.35Å; L801-R805 VanDerWaalsContact O-CG 3.28Å; L801-R805 WeakPolarHBondContact O-CG 3.41Å; L801-R805 PolarHBondContact O-N 3.2Å
802	S	72.7	Confident	64.4	Low	58 Å²	58	112.7 Å²	112.7	41%	0.406	54%	0.539	S	S	.	.	H	α-helix	trans	-66.3	-43	175.3	-63.9	0	0	0	0	111.4	E798 E799 L800 Y804 R805 E806	E798-S802 WeakPolarHBondContact O-CB 3.03Å; E798-S802 PolarHBondContact O-N 3.24Å; E798-S802 PolarHBondContact O-OG 3.16Å; E799-S802 WeakPolarHBondContact O-CB 3.48Å; E799-S802 PolarHBondContact O-N 3.43Å; E799-S802 VanDerWaalsContact O-N 3.16Å; L800-S802 VanDerWaalsContact C-N 3.32Å; S802-Y804 PolarHBondContact O-N 2.95Å; S802-R805 PolarHBondContact O-N 2.63Å; S802-E806 WeakPolarHBondContact O-CB 3.38Å; S802-E806 PolarHBondContact O-N 3.23Å
803	Q	74.3	Confident	65.9	Low	104 Å²	104	107.6 Å²	107.6	49%	0.486	52%	0.518	S	S	.	.	H	α-helix	trans	-59	-45.5	172.3	-95.3	-178.2	1.1	0	0	112.2	E799 L800 R805 E806 Q807	E799-Q803 PolarHBondContact O-N 3.41Å; L800-Q803 PolarHBondContact O-N 3.27Å; Q803-R805 PolarHBondContact O-N 2.98Å; Q803-E806 PolarHBondContact O-N 3.13Å; Q803-Q807 WeakPolarHBondContact O-CG 3.26Å; Q803-Q807 PolarHBondContact O-N 3.5Å
804	Y	63.2	Low	66.5	Low	152 Å²	152	104.4 Å²	104.4	60%	0.596	51%	0.511	S	S	*	.	H	α-helix	trans	-65.8	-39.3	-179.9	-159.1	-95.3	0	0	0	112.2	L800 L801 S802 E806 Q807 L808	L800-Y804 PolarHBondContact O-N 3.13Å; L801-Y804 PolarHBondContact O-N 3.35Å; S802-Y804 PolarHBondContact O-N 2.95Å; Y804-E806 VanDerWaalsContact C-N 3.31Å; Y804-E806 PolarHBondContact O-N 2.98Å; Y804-Q807 PolarHBondContact O-N 3.48Å; Y804-L808 HydrophobicContact CD1-CD1 3.75Å; Y804-L808 HydrophobicContact CE1-CD1 3.67Å; Y804-L808 HydrophobicContact CE1-CG 4.49Å; Y804-L808 PolarHBondContact O-N 3.01Å; Y804-L808 VanDerWaalsContact O-N 3.08Å
805	R	78.8	Confident	66.5	Low	153 Å²	153	103.7 Å²	103.7	58%	0.577	50%	0.5	S	S	*	.	H	α-helix	trans	-62.6	-39.1	173.5	-75.7	173.9	-178.9	171.7	5.1	111.7	L801 S802 Q803 L808 R809	L801-R805 WeakPolarHBondContact O-CB 3.35Å; L801-R805 VanDerWaalsContact O-CG 3.28Å; L801-R805 WeakPolarHBondContact O-CG 3.41Å; L801-R805 PolarHBondContact O-N 3.2Å; S802-R805 PolarHBondContact O-N 2.63Å; Q803-R805 PolarHBondContact O-N 2.98Å; R805-L808 PolarHBondContact O-N 3.07Å; R805-R809 PolarHBondContact O-N 3.22Å
806	E	83.7	Confident	66.8	Low	79 Å²	79	102.8 Å²	102.8	37%	0.369	50%	0.496	S	S	.	.	H	α-helix	trans	-68.9	-40.7	179.1	-165.7	56.7	-153.4	0	0	112.1	S802 Q803 Y804 L808 R809 Q810	S802-E806 WeakPolarHBondContact O-CB 3.38Å; S802-E806 PolarHBondContact O-N 3.23Å; Q803-E806 PolarHBondContact O-N 3.13Å; Y804-E806 VanDerWaalsContact C-N 3.31Å; Y804-E806 PolarHBondContact O-N 2.98Å; E806-L808 VanDerWaalsContact C-N 3.34Å; E806-L808 PolarHBondContact O-N 3.04Å; E806-R809 WeakPolarHBondContact O-CB 3.34Å; E806-R809 PolarHBondContact O-N 3.02Å; E806-R809 VanDerWaalsContact O-N 3.11Å; E806-R809 IonicContact OE1-NE 2.79Å; E806-R809 IonicContact OE2-CZ 3.91Å; E806-R809 VanDerWaalsContact OE2-CZ 3.29Å; E806-R809 IonicContact OE2-NE 3.36Å; E806-R809 PolarHBondContact OE2-NE 3.05Å; E806-R809 IonicContact OE2-NH2 3.29Å; E806-R809 PolarHBondContact OE2-NH2 2.97Å; E806-Q810 WeakPolarHBondContact O-CG 3.31Å; E806-Q810 PolarHBondContact O-N 3.29Å
807	Q	64.9	Low	67	Low	116 Å²	116	108.6 Å²	108.6	54%	0.542	52%	0.518	S	S	.	.	H	α-helix	trans	-61.5	-41.3	173.3	-73	-179.6	-14.2	0	0	112.4	Q803 Y804 R809 Q810 L811	Q803-Q807 WeakPolarHBondContact O-CG 3.26Å; Q803-Q807 PolarHBondContact O-N 3.5Å; Y804-Q807 PolarHBondContact O-N 3.48Å; Q807-R809 VanDerWaalsContact C-N 3.31Å; Q807-R809 PolarHBondContact O-N 3.01Å; Q807-Q810 PolarHBondContact O-N 3.14Å; Q807-L811 WeakPolarHBondContact O-CB 3.13Å; Q807-L811 PolarHBondContact O-N 3.22Å
808	L	68.3	Low	66.7	Low	80 Å²	80	108.2 Å²	108.2	42%	0.419	52%	0.522	S	S	.	.	H	α-helix	trans	-62.5	-38	173.2	-93.6	157.3	0	0	0	112.1	Y804 R805 E806 N812	Y804-L808 HydrophobicContact CD1-CD1 3.75Å; Y804-L808 HydrophobicContact CE1-CD1 3.67Å; Y804-L808 HydrophobicContact CE1-CG 4.49Å; Y804-L808 PolarHBondContact O-N 3.01Å; Y804-L808 VanDerWaalsContact O-N 3.08Å; R805-L808 PolarHBondContact O-N 3.07Å; E806-L808 VanDerWaalsContact C-N 3.34Å; E806-L808 PolarHBondContact O-N 3.04Å; L808-N812 PolarHBondContact O-N 3.09Å; L808-N812 VanDerWaalsContact O-N 3.1Å; L808-N812 PolarHBondContact O-ND2 3.34Å
809	R	78.6	Confident	64.7	Low	145 Å²	145	109.4 Å²	109.4	55%	0.547	53%	0.528	S	S	.	.	H	α-helix	trans	-64.2	-48.7	176.1	-134	-163.7	-53.6	-109.8	4.1	111.2	R805 E806 Q807 L811 N812 D813	R805-R809 PolarHBondContact O-N 3.22Å; E806-R809 WeakPolarHBondContact O-CB 3.34Å; E806-R809 PolarHBondContact O-N 3.02Å; E806-R809 VanDerWaalsContact O-N 3.11Å; E806-R809 IonicContact OE1-NE 2.79Å; E806-R809 IonicContact OE2-CZ 3.91Å; E806-R809 VanDerWaalsContact OE2-CZ 3.29Å; E806-R809 IonicContact OE2-NE 3.36Å; E806-R809 PolarHBondContact OE2-NE 3.05Å; E806-R809 IonicContact OE2-NH2 3.29Å; E806-R809 PolarHBondContact OE2-NH2 2.97Å; Q807-R809 VanDerWaalsContact C-N 3.31Å; Q807-R809 PolarHBondContact O-N 3.01Å; R809-L811 VanDerWaalsContact C-N 3.31Å; R809-L811 PolarHBondContact O-N 3.49Å; R809-N812 PolarHBondContact O-N 3.12Å; R809-N812 VanDerWaalsContact O-N 3.14Å; R809-D813 PolarHBondContact O-N 3.37Å
810	Q	77.2	Confident	63.3	Low	109 Å²	109	108.4 Å²	108.4	51%	0.509	53%	0.532	S	S	.	.	H	α-helix	trans	-61.6	-38.2	177.9	-69.7	174.2	9.5	0	0	112.4	E806 Q807 D813 C814	E806-Q810 WeakPolarHBondContact O-CG 3.31Å; E806-Q810 PolarHBondContact O-N 3.29Å; Q807-Q810 PolarHBondContact O-N 3.14Å; Q810-D813 PolarHBondContact O-N 2.83Å; Q810-C814 WeakPolarHBondContact O-CB 3.46Å; Q810-C814 PolarHBondContact O-N 3.46Å; Q810-C814 PolarHBondContact O-SG 2.68Å; Q810-C814 VanDerWaalsContact O-SG 3.37Å
811	L	60.4	Low	61.7	Low	100 Å²	100	113.2 Å²	113.2	52%	0.524	56%	0.558	S	S	.	*	H	α-helix	trans	-63.4	-43.2	175	-176.2	66	0	0	0	111.5	Q807 R809 C814 I815	Q807-L811 WeakPolarHBondContact O-CB 3.13Å; Q807-L811 PolarHBondContact O-N 3.22Å; R809-L811 VanDerWaalsContact C-N 3.31Å; R809-L811 PolarHBondContact O-N 3.49Å; L811-C814 WeakPolarHBondContact O-CB 3.41Å; L811-C814 PolarHBondContact O-N 2.77Å; L811-I815 HydrophobicContact CG-CD1 4.25Å; L811-I815 VanDerWaalsContact O-CG1 3.31Å; L811-I815 WeakPolarHBondContact O-CG1 3.06Å; L811-I815 PolarHBondContact O-N 3.32Å
812	N	63.5	Low	59.7	Low	92 Å²	92	114.6 Å²	114.6	49%	0.492	57%	0.573	S	S	.	*	H	α-helix	trans	-67.8	-40.4	177.9	-73.7	-20.3	0	0	0	112.4	L808 R809 C814 I815 E816	L808-N812 PolarHBondContact O-N 3.09Å; L808-N812 VanDerWaalsContact O-N 3.1Å; L808-N812 PolarHBondContact O-ND2 3.34Å; R809-N812 PolarHBondContact O-N 3.12Å; R809-N812 VanDerWaalsContact O-N 3.14Å; N812-C814 VanDerWaalsContact C-N 3.26Å; N812-C814 PolarHBondContact O-N 3.1Å; N812-I815 WeakPolarHBondContact O-CB 3.43Å; N812-I815 PolarHBondContact O-N 2.99Å; N812-I815 VanDerWaalsContact O-N 3.07Å; N812-E816 PolarHBondContact O-N 2.77Å
813	D	73.7	Confident	57.6	Low	82 Å²	82	120 Å²	120	44%	0.439	59%	0.586	S	S	.	*	H	α-helix	trans	-62	-35.5	174.3	-77.3	8	0	0	0	111.6	R809 Q810 K817	R809-D813 PolarHBondContact O-N 3.37Å; Q810-D813 PolarHBondContact O-N 2.83Å; D813-K817 WeakPolarHBondContact O-CB 3.41Å; D813-K817 VanDerWaalsContact O-CG 3.29Å; D813-K817 WeakPolarHBondContact O-CG 3.22Å; D813-K817 PolarHBondContact O-N 3.15Å; D813-K817 VanDerWaalsContact O-N 3.07Å
814	C	53.4	Low	55.5	Low	76 Å²	76	123.2 Å²	123.2	51%	0.514	60%	0.601	S	S	.	*	H	α-helix	trans	-67.3	-37.4	172.7	-77.4	0	0	0	0	112.2	Q810 L811 N812 V818	Q810-C814 WeakPolarHBondContact O-CB 3.46Å; Q810-C814 PolarHBondContact O-N 3.46Å; Q810-C814 PolarHBondContact O-SG 2.68Å; Q810-C814 VanDerWaalsContact O-SG 3.37Å; L811-C814 WeakPolarHBondContact O-CB 3.41Å; L811-C814 PolarHBondContact O-N 2.77Å; N812-C814 VanDerWaalsContact C-N 3.26Å; N812-C814 PolarHBondContact O-N 3.1Å; C814-V818 WeakPolarHBondContact O-CG2 3.44Å; C814-V818 PolarHBondContact O-N 2.91Å
815	I	50.4	Low	54	Low	93 Å²	93	123.4 Å²	123.4	48%	0.477	61%	0.612	S	S	.	*	H	α-helix	trans	-66.2	-45.5	175.8	-67.6	163.6	0	0	0	110.2	L811 N812 K817 V818 E819	L811-I815 HydrophobicContact CG-CD1 4.25Å; L811-I815 VanDerWaalsContact O-CG1 3.31Å; L811-I815 WeakPolarHBondContact O-CG1 3.06Å; L811-I815 PolarHBondContact O-N 3.32Å; N812-I815 WeakPolarHBondContact O-CB 3.43Å; N812-I815 PolarHBondContact O-N 2.99Å; N812-I815 VanDerWaalsContact O-N 3.07Å; I815-K817 VanDerWaalsContact C-N 3.32Å; I815-K817 PolarHBondContact O-N 3.09Å; I815-V818 PolarHBondContact O-N 3.24Å; I815-V818 VanDerWaalsContact O-N 3.08Å; I815-E819 PolarHBondContact O-N 3.4Å
816	E	58	Low	52.1	Low	149 Å²	149	120.9 Å²	120.9	70%	0.696	62%	0.615	S	S	*	*	H	α-helix	trans	-63.1	-35.5	177.5	-88.2	-169	167.3	0	0	112.7	N812 V818 E819	N812-E816 PolarHBondContact O-N 2.77Å; E816-V818 PolarHBondContact O-N 3.21Å; E816-E819 PolarHBondContact O-N 3.08Å
817	K	55.9	Low	49.5	Very low	177 Å²	177	123.9 Å²	123.9	77%	0.77	63%	0.634	S	S	*	*	H	α-helix	trans	-70.4	-17.4	175.7	-74.9	173.2	-176.6	172.6	0	113.8	D813 I815	D813-K817 WeakPolarHBondContact O-CB 3.41Å; D813-K817 VanDerWaalsContact O-CG 3.29Å; D813-K817 WeakPolarHBondContact O-CG 3.22Å; D813-K817 PolarHBondContact O-N 3.15Å; D813-K817 VanDerWaalsContact O-N 3.07Å; I815-K817 VanDerWaalsContact C-N 3.32Å; I815-K817 PolarHBondContact O-N 3.09Å
818	V	43.3	Very low	48	Very low	113 Å²	113	127 Å²	127	69%	0.685	65%	0.654	S	S	*	*	H	α-helix	trans	-91.9	-16.4	-179.2	173.3	0	0	0	0	111.9	C814 I815 E816 P820	C814-V818 WeakPolarHBondContact O-CG2 3.44Å; C814-V818 PolarHBondContact O-N 2.91Å; I815-V818 PolarHBondContact O-N 3.24Å; I815-V818 VanDerWaalsContact O-N 3.08Å; E816-V818 PolarHBondContact O-N 3.21Å; V818-P820 VanDerWaalsContact O-CD 3.28Å; V818-P820 WeakPolarHBondContact O-CD 3.24Å
819	E	33.3	Very low	45.9	Very low	153 Å²	153	127.4 Å²	127.4	72%	0.715	66%	0.663	S	S	*	*	S	Bend	trans	-77	111.9	170.4	-75.3	-166.6	167.1	0	0	110.5	I815 E816 N821	I815-E819 PolarHBondContact O-N 3.4Å; E816-E819 PolarHBondContact O-N 3.08Å; E819-N821 PolarHBondContact O-N 2.98Å
820	P	40	Very low	43.4	Very low	103 Å²	103	128.5 Å²	128.5	67%	0.669	67%	0.674	S	S	*	*			trans	-81.4	122.4	-164.4	30.5	-29.6	0	0	0	110.6	V818 C822	V818-P820 VanDerWaalsContact O-CD 3.28Å; V818-P820 WeakPolarHBondContact O-CD 3.24Å; P820-C822 PolarHBondContact O-N 2.86Å
821	N	32.7	Very low	41.2	Very low	161 Å²	161	129 Å²	129	86%	0.861	69%	0.685	S	S	*	*			trans	-60	75.1	157.3	-82.6	-40.4	0	0	0	109.9	E819 Y823	E819-N821 PolarHBondContact O-N 2.98Å; N821-Y823 PolarHBondContact O-N 3.34Å; N821-Y823 VanDerWaalsContact O-N 3.15Å
822	C	28.1	Very low	39.4	Very low	111 Å²	111	133 Å²	133	75%	0.75	71%	0.706	S	S	*	*			trans	-82.9	67.9	164.9	-77.3	0	0	0	0	108.7	P820	P820-C822 PolarHBondContact O-N 2.86Å
823	Y	27.7	Very low	37.6	Very low	173 Å²	173	132.8 Å²	132.8	68%	0.678	71%	0.711	S	S	*	*			trans	-118.2	114.7	164	-81.4	-80	0	0	0	109.4	N821	N821-Y823 PolarHBondContact O-N 3.34Å; N821-Y823 VanDerWaalsContact O-N 3.15Å
824	H	30.4	Very low	35.3	Very low	170 Å²	170	137.5 Å²	137.5	79%	0.787	73%	0.731	S	S	*	*			trans	41.9	104.2	157.8	-65.2	-45.4	0	0	0	118.2
825	N	31	Very low	34.1	Very low	157 Å²	157	139 Å²	139	84%	0.84	74%	0.742	S	S	*	*			trans	-130.1	94.3	149.1	-149.9	-5	0	0	0	109.9	N827	N825-N827 PolarHBondContact O-N 3.37Å
826	P	39.1	Very low	32.8	Very low	99 Å²	99	140.3 Å²	140.3	64%	0.643	75%	0.754	S	S	*	*			trans	-88.2	101.8	172.5	32.3	-22.3	0	0	0	107.3
827	N	30.7	Very low	31.2	Very low	142 Å²	142	142 Å²	142	76%	0.759	76%	0.762	S	S	*	*			trans	169.7	102.9	157.5	-88.3	-28.7	0	0	0	107.7	N825	N825-N827 PolarHBondContact O-N 3.37Å
828	L	31.8	Very low	29.8	Very low	182 Å²	182	139.4 Å²	139.4	95%	0.953	77%	0.766	S	S	*	*			trans	-166.3	63.6	152.9	-99.1	152.1	0	0	0	107.4
829	S	24.4	Very low	28.8	Very low	89 Å²	89	139.6 Å²	139.6	62%	0.622	77%	0.768	S	S	*	*			trans	-83.7	140.6	153.7	56.4	0	0	0	0	108.4
830	H	27.6	Very low	28.5	Very low	167 Å²	167	139.7 Å²	139.7	77%	0.773	77%	0.767	S	S	*	*			trans	91.6	127.9	160.1	-69.5	-74	0	0	0	120.2
831	T	29.2	Very low	27.9	Very low	120 Å²	120	142.7 Å²	142.7	74%	0.736	77%	0.77	S	S	*	*			trans	85.5	78.6	146.7	50.8	0	0	0	0	118.3
832	L	23.2	Very low	27.4	Very low	183 Å²	183	142.6 Å²	142.6	96%	0.958	77%	0.768	S	S	*	*			trans	-59.9	112.6	131.8	-78.5	150	0	0	0	109.1
833	S	26.5	Very low	27.5	Very low	88 Å²	88	149.1 Å²	149.1	62%	0.615	78%	0.777	S	S	*	*			trans	-161	108.3	154.3	58.1	0	0	0	0	111.1
834	H	25.9	Very low	27.6	Very low	182 Å²	182	148 Å²	148	84%	0.843	78%	0.782	S	S	*	*			trans	42.4	121.1	138	-60.2	-72.6	0	0	0	120.2
835	S	27	Very low	28.3	Very low	107 Å²	107	145.5 Å²	145.5	75%	0.748	78%	0.781	S	S	*	*				141.5	109.2	109.5	61.1	0	0	0	0	113.4
836	T	23.4	Very low	28.2	Very low	120 Å²	120	143.1 Å²	143.1	74%	0.736	78%	0.777	S	S	*	*			trans	17	134.1	135.3	52.5	0	0	0	0	121.2
837	Q	23.6	Very low	27.6	Very low	186 Å²	186	145.5 Å²	145.5	87%	0.869	78%	0.784	S	S	*	*			trans	73	111.2	146.4	-66.8	171.3	7.5	0	0	117.5
838	S	27.2	Very low	27.6	Very low	122 Å²	122	150.8 Å²	150.8	85%	0.853	79%	0.794	S	S	*	*				173.2	146	94.4	-161.2	0	0	0	0	111.2
839	V	23.2	Very low	27.5	Very low	117 Å²	117	148.5 Å²	148.5	71%	0.709	79%	0.787	S	S	*	*			trans	-80.6	127.9	-178.6	168.1	0	0	0	0	109.3
840	H	26.9	Very low	28.5	Very low	154 Å²	154	149.9 Å²	149.9	71%	0.713	80%	0.795	S	S	*	*			trans	170.5	132.7	133.7	-93.2	-16.1	0	0	0	116.2
841	K	26.6	Very low	28.7	Very low	167 Å²	167	149.8 Å²	149.8	73%	0.726	80%	0.8	S	S	*	*			trans	72.3	101.4	137.6	-68.3	176.4	-179.9	176.6	0	120.9
842	I	23.2	Very low	28.6	Very low	159 Å²	159	150.2 Å²	150.2	82%	0.815	80%	0.798	S	S	*	*				33.5	114.2	117.1	-53.1	168.3	0	0	0	116.8
843	R	29.3	Very low	28.7	Very low	248 Å²	248	148 Å²	148	94%	0.936	79%	0.787	S	S	*	*				-164.7	139	127.6	-146.1	165.5	179.9	167.3	-1.8	113.4
844	D	30	Very low	29	Very low	148 Å²	148	150.3 Å²	150.3	79%	0.791	80%	0.797	S	S	*	*			trans	-62.4	165.5	-175.9	-83.9	-52.4	0	0	0	118
845	P	45.7	Very low	28.9	Very low	118 Å²	118	148.7 Å²	148.7	77%	0.766	80%	0.795	S	S	*	*			trans	-93.1	154.5	-170.7	37.4	-33.1	0	0	0	113.5
846	S	28.7	Very low	29	Very low	108 Å²	108	149.9 Å²	149.9	76%	0.755	79%	0.791	S	S	*	*			trans	-155.8	124.6	155.8	56.6	0	0	0	0	112.9
847	N	25.6	Very low	29.2	Very low	148 Å²	148	151.6 Å²	151.6	79%	0.791	80%	0.796	S	S	*	*			trans	44.9	117.1	138.5	-66.1	-16.4	0	0	0	119.9
848	R	30.5	Very low	29.2	Very low	253 Å²	253	146 Å²	146	96%	0.955	79%	0.788	S	S	*	*				-157.7	121.9	120.7	-107.2	163.4	-162	-154.9	4.3	112.3
849	T	29.1	Very low	29.5	Very low	134 Å²	134	148.2 Å²	148.2	82%	0.822	79%	0.79	S	S	*	*			trans	-79.6	169.7	178.5	21.8	0	0	0	0	112.5
850	P	46.5	Very low	29.7	Very low	119 Å²	119	149.1 Å²	149.1	77%	0.773	79%	0.791	S	S	*	*			trans	-96.1	165	-153.1	38.2	-34.5	0	0	0	113.4
851	N	30.6	Very low	29.7	Very low	165 Å²	165	148.8 Å²	148.8	88%	0.882	80%	0.795	S	S	*	*			trans	-123.2	146	174.4	-140.2	0.7	0	0	0	112.4
852	N	28	Very low	29.9	Very low	129 Å²	129	150 Å²	150	69%	0.69	80%	0.803	S	S	*	*			trans	-95.8	159.1	-157.7	-95	-26	0	0	0	114.3
853	N	25.7	Very low	30.2	Very low	136 Å²	136	149.3 Å²	149.3	73%	0.727	80%	0.799	S	S	*	*			trans	64.8	127.2	140.2	-64	-15	0	0	0	121.1
854	T	31.7	Very low	30.3	Very low	136 Å²	136	145 Å²	145	83%	0.834	80%	0.795	S	S	*	*				163.8	114.9	111.9	42.1	0	0	0	0	107.6
855	N	24.5	Very low	30.1	Very low	149 Å²	149	145.8 Å²	145.8	80%	0.797	80%	0.799	S	S	*	*				81.2	129.3	59.5	-143.4	20.6	0	0	0	114.3
856	I	28.2	Very low	29.2	Very low	131 Å²	131	143.7 Å²	143.7	67%	0.672	80%	0.798	S	S	*	*			trans	114	121	147.1	-59.8	166.2	0	0	0	120
857	N	28.5	Very low	29	Very low	157 Å²	157	147.6 Å²	147.6	84%	0.84	80%	0.802	S	S	*	*			trans	44.1	139.1	147.6	-69.2	-14.9	0	0	0	121.2
858	G	24.5	Very low	28.9	Very low	68 Å²	68	148.3 Å²	148.3	70%	0.701	80%	0.798	S	S	*	*			cis	105.4	104	22.8	0	0	0	0	0	110.7
859	N	32.3	Very low	28.6	Very low	168 Å²	168	142 Å²	142	90%	0.898	78%	0.783	S	S	*	*			trans	-167	151.4	150	-128.9	-9	0	0	0	115
860	N	27.2	Very low	28.4	Very low	137 Å²	137	145.5 Å²	145.5	73%	0.733	78%	0.782	S	S	*	*			trans	-95.8	167.8	-166.4	-75.8	-44	0	0	0	115.4
861	N	27.6	Very low	27.3	Very low	146 Å²	146	146.8 Å²	146.8	78%	0.781	78%	0.782	S	S	*	*			trans	76	115.1	148.9	-65.3	-18.7	0	0	0	120.2
862	H	31.6	Very low	27	Very low	193 Å²	193	146.8 Å²	146.8	89%	0.894	78%	0.781	S	S	*	*				-161	131.3	127.1	-114.4	-76.6	0	0	0	112.2
863	I	28.8	Very low	26.9	Very low	145 Å²	145	144.9 Å²	144.9	74%	0.744	78%	0.778	S	S	*	*			trans	-92.3	136.6	171.7	-69.2	165.2	0	0	0	108.2
864	N	30.9	Very low	26.9	Very low	158 Å²	158	150.5 Å²	150.5	85%	0.845	79%	0.789	S	S	*	*			trans	-169.5	140.6	142.5	-101.9	-22.6	0	0	0	113.6
865	N	26.4	Very low	26.7	Very low	163 Å²	163	152.9 Å²	152.9	87%	0.872	79%	0.791	S	S	*	*			trans	-75.2	152.3	-178.4	-72.1	-38.4	0	0	0	113.6
866	G	25.9	Very low	26.9	Very low	74 Å²	74	151 Å²	151	76%	0.763	79%	0.789	S	S	*	*			trans	159.5	92.2	157.7	0	0	0	0	0	117.4
867	K	24.8	Very low	27	Very low	190 Å²	190	150.8 Å²	150.8	83%	0.826	79%	0.794	S	S	*	*			trans	54	126.5	134.1	-85.1	-174.8	173.1	179.3	0	122.6
868	F	24.6	Very low	27.2	Very low	164 Å²	164	149.2 Å²	149.2	72%	0.719	79%	0.785	S	S	*	*			trans	81.6	116.9	136.7	-86.1	-78.6	0	0	0	121.4
869	D	23.3	Very low	27.9	Very low	120 Å²	120	152.5 Å²	152.5	64%	0.642	78%	0.783	S	S	*	*			trans	69.4	120.3	134	-88.5	-17.4	0	0	0	122.4
870	R	25.2	Very low	28.3	Very low	207 Å²	207	149.6 Å²	149.6	78%	0.781	77%	0.766	S	S	*	*			trans	72.5	130.8	142.1	-65.8	-175.1	-170.7	-156.2	1.9	118.4
871	N	23.6	Very low	29	Very low	146 Å²	146	146.7 Å²	146.7	78%	0.781	76%	0.757	S	S	*	*			trans	73	104.6	158.8	-56.5	-26.1	0	0	0	114.8
872	L	24.8	Very low	29.4	Very low	166 Å²	166	149 Å²	149	87%	0.869	76%	0.755	S	S	*	*			trans	-164.7	96.4	134	-91	146.4	0	0	0	105.1
873	S	25.4	Very low	29.6	Very low	88 Å²	88	148 Å²	148	62%	0.615	74%	0.744	S	S	*	*				52.6	89.7	100	68.9	0	0	0	0	112.8	Q875	S873-Q875 PolarHBondContact O-N 3.46Å
874	R	25.2	Very low	30.4	Very low	254 Å²	254	146.5 Å²	146.5	96%	0.958	73%	0.734	S	S	*	*			trans	6.5	94.7	143.3	-66	177.7	174.4	-176.8	-2	114.6
875	Q	27.6	Very low	31.1	Very low	187 Å²	187	141.9 Å²	141.9	87%	0.874	72%	0.717	S	S	*	*			trans	-124.7	116.8	147.9	-84.4	-175.2	-2.2	0	0	109	S873 T877	S873-Q875 PolarHBondContact O-N 3.46Å; Q875-T877 PolarHBondContact O-N 3.09Å
876	S	28.9	Very low	31.3	Very low	109 Å²	109	143 Å²	143	76%	0.762	71%	0.71	S	S	*	*			trans	-43.5	122.7	166.9	48.2	0	0	0	0	112.4
877	T	29.9	Very low	31.9	Very low	127 Å²	127	148.4 Å²	148.4	78%	0.779	71%	0.707	S	S	*	*			trans	179.8	113	134	34.5	0	0	0	0	107.3	Q875	Q875-T877 PolarHBondContact O-N 3.09Å
878	D	33.8	Very low	32.6	Very low	123 Å²	123	147.4 Å²	147.4	66%	0.658	70%	0.702	S	S	*	*			trans	-158.7	50.7	156.7	-101.3	-22.5	0	0	0	111.7	I880	D878-I880 PolarHBondContact O-N 3.22Å
879	E	37.5	Very low	33.3	Very low	138 Å²	138	146.2 Å²	146.2	65%	0.645	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-4.9	161.7	-142.9	-174.6	177.8	0	0	111.8
880	I	41.6	Very low	33.8	Very low	107 Å²	107	146.5 Å²	146.5	55%	0.549	70%	0.702	S	S	.	*	H	α-helix	trans	-78.6	-29.8	179.3	-62.1	175.7	0	0	0	111.4	D878 Y882 R883 Q884	D878-I880 PolarHBondContact O-N 3.22Å; I880-Y882 VanDerWaalsContact C-N 3.33Å; I880-Y882 PolarHBondContact O-N 3.06Å; I880-R883 PolarHBondContact O-N 3.45Å; I880-Q884 HydrophobicContact CG2-CG 4.18Å; I880-Q884 PolarHBondContact O-N 3.07Å
881	S	42.7	Very low	34	Very low	76 Å²	76	143.4 Å²	143.4	53%	0.531	70%	0.701	S	S	.	*	H	α-helix	trans	-65.5	-34.3	179.4	-73.8	0	0	0	0	112.7	A885	S881-A885 PolarHBondContact O-N 3.04Å
882	Y	34.6	Very low	34.3	Very low	193 Å²	193	141.8 Å²	141.8	76%	0.757	70%	0.701	S	S	*	*	H	α-helix	trans	-76.5	-34	178.5	-154.4	-96.2	0	0	0	112.7	I880 R886	I880-Y882 VanDerWaalsContact C-N 3.33Å; I880-Y882 PolarHBondContact O-N 3.06Å; Y882-R886 PolarHBondContact O-N 2.82Å
883	R	37.2	Very low	34.4	Very low	173 Å²	173	142.6 Å²	142.6	65%	0.653	70%	0.698	S	S	*	*	H	α-helix	trans	-75.6	-30.8	174.7	-73.6	-168.2	177.9	-169.9	0.5	113.2	I880 R886 R887	I880-R883 PolarHBondContact O-N 3.45Å; R883-R886 PolarHBondContact O-N 2.93Å; R883-R887 PolarHBondContact O-N 3.49Å
884	Q	44.7	Very low	34.5	Very low	114 Å²	114	143.3 Å²	143.3	53%	0.533	70%	0.703	S	S	.	*	H	α-helix	trans	-70.3	-33.6	174	-78.5	-171.1	1.3	0	0	112.6	I880 R886 K888	I880-Q884 HydrophobicContact CG2-CG 4.18Å; I880-Q884 PolarHBondContact O-N 3.07Å; Q884-R886 PolarHBondContact O-N 3.38Å; Q884-K888 WeakPolarHBondContact O-CB 3.2Å; Q884-K888 WeakPolarHBondContact O-CG 3.32Å; Q884-K888 PolarHBondContact O-N 3.33Å
885	A	44.7	Very low	34.7	Very low	60 Å²	60	138.6 Å²	138.6	50%	0.496	70%	0.697	S	S	.	*	H	α-helix	trans	-64	-38.7	173.8	0	0	0	0	0	112.3	S881	S881-A885 PolarHBondContact O-N 3.04Å
886	R	30.7	Very low	34.7	Very low	188 Å²	188	138 Å²	138	71%	0.709	70%	0.699	S	S	*	*	H	α-helix	trans	-78.2	-32.3	178.5	-120.4	-177.2	-175.6	-127.8	3.4	114	Y882 R883 Q884 I889	Y882-R886 PolarHBondContact O-N 2.82Å; R883-R886 PolarHBondContact O-N 2.93Å; Q884-R886 PolarHBondContact O-N 3.38Å; R886-I889 PolarHBondContact O-N 3.1Å
887	R	38.4	Very low	34.6	Very low	187 Å²	187	138 Å²	138	71%	0.706	70%	0.699	S	S	*	*	H	α-helix	trans	-76.4	-25.7	175.1	-81.7	-175.9	176.2	157	-0.9	113.6	R883 I889 I890 N891	R883-R887 PolarHBondContact O-N 3.49Å; R887-I889 PolarHBondContact O-N 2.93Å; R887-I890 PolarHBondContact O-N 2.82Å; R887-N891 PolarHBondContact O-N 3.27Å
888	K	39.6	Very low	34.5	Very low	169 Å²	169	138 Å²	138	74%	0.735	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-12.3	171.1	-80.2	-175.5	178.8	178.7	0	113.9	Q884	Q884-K888 WeakPolarHBondContact O-CB 3.2Å; Q884-K888 WeakPolarHBondContact O-CG 3.32Å; Q884-K888 PolarHBondContact O-N 3.33Å
889	I	39	Very low	34	Very low	138 Å²	138	138 Å²	138	71%	0.708	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-16.1	175.7	-63.4	175.2	0	0	0	112.5	R886 R887	R886-I889 PolarHBondContact O-N 3.1Å; R887-I889 PolarHBondContact O-N 2.93Å
890	I	34.4	Very low	33.6	Very low	127 Å²	127	137.9 Å²	137.9	65%	0.651	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	-12.7	-173.5	-61.8	-179.5	0	0	0	114.4	R887	R887-I890 PolarHBondContact O-N 2.82Å
891	N	30.8	Very low	32.9	Very low	141 Å²	141	138.2 Å²	138.2	75%	0.754	72%	0.724	S	S	*	*			trans	-116.1	30.2	-177.2	-101.2	11.2	0	0	0	117.2	R887 K893	R887-N891 PolarHBondContact O-N 3.27Å; N891-K893 VanDerWaalsContact C-N 3.3Å; N891-K893 PolarHBondContact O-N 3.35Å
892	S	29.7	Very low	32	Very low	112 Å²	112	143.6 Å²	143.6	78%	0.783	75%	0.746	S	S	*	*			trans	-92.6	64.1	156.8	51.1	0	0	0	0	110.6
893	K	26.8	Very low	31.6	Very low	184 Å²	184	137.6 Å²	137.6	80%	0.8	74%	0.743	S	S	*	*			trans	-83.7	143.5	156.7	-90.4	-177.7	176.6	175.9	0	108.8	N891	N891-K893 VanDerWaalsContact C-N 3.3Å; N891-K893 PolarHBondContact O-N 3.35Å
894	S	27.7	Very low	31.1	Very low	103 Å²	103	141 Å²	141	72%	0.72	76%	0.755	S	S	*	*			trans	76.3	99.3	176.6	75.8	0	0	0	0	115.9
895	N	28.4	Very low	30.4	Very low	155 Å²	155	142 Å²	142	83%	0.829	77%	0.769	S	S	*	*				-149.3	123.9	105.7	-86.4	-24.8	0	0	0	108.9	S897	N895-S897 PolarHBondContact O-N 3.3Å; N895-S897 VanDerWaalsContact O-N 3.1Å
896	N	28.2	Very low	29.5	Very low	173 Å²	173	147.4 Å²	147.4	93%	0.925	79%	0.789	S	S	*	*			trans	-49.6	111.8	177.5	-72.1	-30.6	0	0	0	110.6
897	S	26.9	Very low	29.4	Very low	109 Å²	109	147.7 Å²	147.7	76%	0.762	80%	0.795	S	S	*	*			trans	-135.8	117.5	153.9	56.2	0	0	0	0	108.7	N895	N895-S897 PolarHBondContact O-N 3.3Å; N895-S897 VanDerWaalsContact O-N 3.1Å
898	T	27.1	Very low	28.9	Very low	128 Å²	128	148.2 Å²	148.2	79%	0.785	80%	0.802	S	S	*	*			trans	-51.6	132.1	-178.3	-25.3	0	0	0	0	110.2	V900	T898-V900 PolarHBondContact O-N 3.21Å; T898-V900 VanDerWaalsContact O-N 3.08Å
899	P	23.5	Very low	28.3	Very low	123 Å²	123	147 Å²	147	80%	0.799	81%	0.809	S	S	*	*			trans	-72.1	108.3	-175.5	27.4	-31.8	0	0	0	110.1
900	V	28.3	Very low	27.6	Very low	136 Å²	136	149 Å²	149	82%	0.824	82%	0.816	S	S	*	*			trans	-75.2	122	173.5	-178.7	0	0	0	0	108.7	T898	T898-V900 PolarHBondContact O-N 3.21Å; T898-V900 VanDerWaalsContact O-N 3.08Å
901	P	27.8	Very low	26.9	Very low	114 Å²	114	149 Å²	149	74%	0.74	83%	0.826	S	S	*	*			trans	-77.6	135.2	-170.7	28.4	-31.9	0	0	0	112.7	G903	P901-G903 PolarHBondContact O-N 3.3Å
902	L	24.3	Very low	26.7	Very low	189 Å²	189	147.6 Å²	147.6	99%	0.99	83%	0.827	S	S	*	*			trans	-54.7	94.2	172.1	-82.1	147.3	0	0	0	111.8
903	G	26	Very low	26.4	Very low	67 Å²	67	151 Å²	151	69%	0.691	83%	0.83	S	S	*	*			trans	-91.8	119.4	169.6	0	0	0	0	0	111.7	P901	P901-G903 PolarHBondContact O-N 3.3Å
904	R	25.8	Very low	26.5	Very low	244 Å²	244	151.3 Å²	151.3	92%	0.921	83%	0.834	S	S	*	*			trans	2.2	121.8	157.8	-67.8	176.6	-174.6	161.2	1.3	117.9
905	V	30.4	Very low	26.3	Very low	134 Å²	134	153.9 Å²	153.9	81%	0.812	84%	0.84	S	S	*	*			trans	-137.2	86.2	137.3	-174	0	0	0	0	108.8
906	L	25.5	Very low	26	Very low	175 Å²	175	151 Å²	151	92%	0.916	83%	0.832	S	S	*	*			trans	-107.5	93.5	157.2	-89.4	166.4	0	0	0	106
907	K	29.2	Very low	26	Very low	193 Å²	193	151.1 Å²	151.1	84%	0.839	83%	0.827	S	S	*	*			trans	-97.8	108.1	163.5	-89.4	-175.3	175.5	179.4	0	107.7	T909	K907-T909 PolarHBondContact O-N 3.34Å
908	K	26.7	Very low	25.9	Very low	199 Å²	199	153.4 Å²	153.4	87%	0.865	83%	0.83	S	S	*	*			trans	-55.1	119.6	167.9	-76.5	173.5	170.9	178.3	0	109.3	Q910	K908-Q910 PolarHBondContact O-N 2.88Å
909	T	27.7	Very low	26	Very low	143 Å²	143	156.9 Å²	156.9	88%	0.877	83%	0.834	S	S	*	*			trans	-75.1	104.6	161.5	35.6	0	0	0	0	107.9	K907	K907-T909 PolarHBondContact O-N 3.34Å
910	Q	24.9	Very low	26	Very low	180 Å²	180	157 Å²	157	84%	0.841	83%	0.833	S	S	*	*			trans	-78.9	120.8	167.1	-95.4	174.6	-49.7	0	0	108.4	K908 S912	K908-Q910 PolarHBondContact O-N 2.88Å; Q910-S912 PolarHBondContact O-N 3.41Å
911	C	19.7	Very low	25.9	Very low	128 Å²	128	157.4 Å²	157.4	87%	0.865	83%	0.831	S	S	*	*			trans	-63	108.4	164.5	-82.8	0	0	0	0	109.7
912	S	26	Very low	25.8	Very low	111 Å²	111	159 Å²	159	78%	0.776	83%	0.833	S	S	*	*			trans	-86.4	115	166.6	26.5	0	0	0	0	109.8	Q910	Q910-S912 PolarHBondContact O-N 3.41Å
913	H	23.7	Very low	26.1	Very low	182 Å²	182	157 Å²	157	84%	0.843	82%	0.824	S	S	*	*			trans	-61.1	129.3	159.4	-76.4	22.4	0	0	0	109.8
914	Q	28.5	Very low	26.2	Very low	191 Å²	191	158.4 Å²	158.4	89%	0.893	82%	0.823	S	S	*	*			trans	-137.8	115.5	153.3	-74.8	-167.6	-14.5	0	0	109.8
915	N	23	Very low	26.2	Very low	157 Å²	157	154.6 Å²	154.6	84%	0.84	82%	0.819	S	S	*	*			trans	-77.9	152.5	167.2	-95.4	-18.8	0	0	0	110.4
916	S	22.8	Very low	26.3	Very low	96 Å²	96	153.4 Å²	153.4	67%	0.671	82%	0.816	S	S	*	*			trans	67.8	138.9	158.8	81.8	0	0	0	0	115.4
917	H	28.7	Very low	26.4	Very low	175 Å²	175	153.8 Å²	153.8	81%	0.81	81%	0.811	S	S	*	*			cis	-155.5	148.2	31	-103.4	-65.2	0	0	0	110.8	K919	H917-K919 PolarHBondContact O-N 3.26Å
918	N	23.9	Very low	26.8	Very low	156 Å²	156	151.9 Å²	151.9	83%	0.834	81%	0.809	S	S	*	*			trans	-43.3	125.6	157	-78.9	-20.1	0	0	0	112
919	K	28.8	Very low	27.2	Very low	201 Å²	201	148.5 Å²	148.5	87%	0.874	80%	0.801	S	S	*	*			trans	-143.4	92	149.7	-101.3	179.4	-178.6	178.1	0	109.1	H917 N921	H917-K919 PolarHBondContact O-N 3.26Å; K919-N921 PolarHBondContact O-N 3.11Å
920	T	24.3	Very low	27.6	Very low	127 Å²	127	148.1 Å²	148.1	78%	0.779	79%	0.794	S	S	*	*			trans	-48.3	122.8	149.5	39.8	0	0	0	0	109.2
921	N	26.9	Very low	28.2	Very low	143 Å²	143	145.8 Å²	145.8	77%	0.765	79%	0.787	S	S	*	*			trans	-135.5	90.8	159.7	-142.9	23.8	0	0	0	108	K919 N923	K919-N921 PolarHBondContact O-N 3.11Å; N921-N923 PolarHBondContact O-N 3Å
922	N	25.4	Very low	29	Very low	149 Å²	149	145.2 Å²	145.2	80%	0.797	78%	0.775	S	S	*	*			trans	-65.4	119.4	160.5	-72	-20.6	0	0	0	106.8
923	N	31.1	Very low	29.4	Very low	147 Å²	147	146.8 Å²	146.8	79%	0.786	78%	0.775	S	S	*	*			trans	-132.6	109.7	153.5	-95.7	-10.6	0	0	0	108.5	N921	N921-N923 PolarHBondContact O-N 3Å
924	S	26.6	Very low	30.1	Very low	96 Å²	96	146 Å²	146	67%	0.671	78%	0.777	S	S	*	*			trans	-64.1	163.5	170.8	41.8	0	0	0	0	113.8
925	I	26.2	Very low	30.6	Very low	164 Å²	164	144.3 Å²	144.3	84%	0.841	77%	0.774	S	S	*	*			trans	87.5	105.8	149.8	-79.7	153	0	0	0	117
926	S	32	Very low	31	Very low	109 Å²	109	140.5 Å²	140.5	76%	0.762	77%	0.772	S	S	*	*				-161.1	108.5	111.1	54.5	0	0	0	0	109
927	K	29.1	Very low	31.7	Very low	183 Å²	183	143.7 Å²	143.7	80%	0.796	78%	0.782	S	S	*	*			trans	-82	137	159.2	-79.5	175.8	167.2	-177.6	0	107
928	D	36.9	Very low	32	Very low	152 Å²	152	143.3 Å²	143.3	81%	0.813	79%	0.785	S	S	*	*			trans	-154.6	96.2	152.1	-70.2	-49	0	0	0	102.6
929	D	35.7	Very low	32.5	Very low	129 Å²	129	139.4 Å²	139.4	69%	0.69	78%	0.782	S	S	*	*				71	128.2	78	-71.5	-15.6	0	0	0	113.7
930	D	35.7	Very low	32.8	Very low	135 Å²	135	136.9 Å²	136.9	72%	0.722	78%	0.778	S	S	*	*			trans	91.7	96.7	150.1	-59.1	-13.2	0	0	0	120.8
931	D	37.6	Very low	33.1	Very low	130 Å²	130	136.9 Å²	136.9	70%	0.695	77%	0.773	S	S	*	*				87.9	118.1	106.7	-82.2	-2.1	0	0	0	122.7
932	N	36	Very low	33.4	Very low	117 Å²	117	137.4 Å²	137.4	63%	0.626	78%	0.776	S	S	*	*				81.5	110.3	129.9	-65.3	-39.7	0	0	0	120.8
933	N	34.2	Very low	33.7	Very low	144 Å²	144	136.8 Å²	136.8	77%	0.77	77%	0.773	S	S	*	*				43.7	115.6	126.4	-54.8	-29.1	0	0	0	118.4
934	D	39.6	Very low	33.6	Very low	166 Å²	166	140.4 Å²	140.4	89%	0.888	78%	0.777	S	S	*	*				-154.4	140.5	122.2	-140.8	-10.8	0	0	0	111.4
935	D	37.2	Very low	33.7	Very low	154 Å²	154	141.1 Å²	141.1	82%	0.824	78%	0.778	S	S	*	*			trans	-82.1	152.5	-171.5	-74.3	-58.2	0	0	0	113
936	G	31.5	Very low	33.8	Very low	78 Å²	78	138.3 Å²	138.3	80%	0.804	77%	0.773	S	S	*	*			trans	86.7	111.5	143.7	0	0	0	0	0	118.1
937	D	38.2	Very low	33.6	Very low	162 Å²	162	141.8 Å²	141.8	87%	0.866	78%	0.777	S	S	*	*				-162.7	117.6	117.3	-153.9	7.6	0	0	0	109.9	G939	D937-G939 PolarHBondContact O-N 3.31Å
938	D	34.3	Very low	33.5	Very low	167 Å²	167	138.5 Å²	138.5	89%	0.893	78%	0.776	S	S	*	*			trans	-74.6	106.3	171.6	-80.4	-47.4	0	0	0	108.6
939	G	35	Very low	33.1	Very low	74 Å²	74	139.1 Å²	139.1	76%	0.763	78%	0.779	S	S	*	*			trans	-119.2	101.4	175.5	0	0	0	0	0	111.2	D937	D937-G939 PolarHBondContact O-N 3.31Å
940	D	35.4	Very low	32.9	Very low	148 Å²	148	140.7 Å²	140.7	79%	0.791	79%	0.786	S	S	*	*			trans	-48.9	139.3	179.1	-93.6	-53.4	0	0	0	116.1
941	N	30.1	Very low	32.5	Very low	127 Å²	127	137.3 Å²	137.3	68%	0.679	78%	0.783	S	S	*	*			trans	37.9	107.5	137.7	-76.4	-49	0	0	0	119.9
942	D	34	Very low	32.1	Very low	155 Å²	155	140.7 Å²	140.7	83%	0.829	79%	0.791	S	S	*	*			trans	-147.6	79.4	138.6	-90.5	-33.1	0	0	0	109.5	Y944	D942-Y944 PolarHBondContact O-N 3.33Å; D942-Y944 VanDerWaalsContact O-N 3.1Å
943	N	31.2	Very low	31.6	Very low	136 Å²	136	141.4 Å²	141.4	73%	0.727	80%	0.8	S	S	*	*			trans	-81.4	84.8	177.8	-156.7	11.4	0	0	0	109.8	T945	N943-T945 VanDerWaalsContact C-N 3.33Å; N943-T945 PolarHBondContact O-N 3.19Å
944	Y	28.4	Very low	31.4	Very low	222 Å²	222	142.2 Å²	142.2	87%	0.871	80%	0.804	S	S	*	*			trans	-71.5	83.1	169.3	-103.7	-90.7	0	0	0	110.2	D942 S946	D942-Y944 PolarHBondContact O-N 3.33Å; D942-Y944 VanDerWaalsContact O-N 3.1Å; Y944-S946 PolarHBondContact O-N 2.75Å
945	T	29.3	Very low	30.8	Very low	111 Å²	111	141.5 Å²	141.5	68%	0.681	80%	0.798	S	S	*	*			trans	-85.2	102.2	164.5	41.2	0	0	0	0	109.6	N943 E947	N943-T945 VanDerWaalsContact C-N 3.33Å; N943-T945 PolarHBondContact O-N 3.19Å; T945-E947 PolarHBondContact O-N 3.08Å; T945-E947 VanDerWaalsContact O-N 3.15Å
946	S	28.6	Very low	30.3	Very low	106 Å²	106	139 Å²	139	74%	0.741	79%	0.791	S	S	*	*			trans	-70.7	100	171.9	65.7	0	0	0	0	110.5	Y944 C948	Y944-S946 PolarHBondContact O-N 2.75Å; S946-C948 PolarHBondContact O-N 2.55Å
947	E	28.3	Very low	30.1	Very low	182 Å²	182	141.5 Å²	141.5	85%	0.85	79%	0.79	S	S	*	*			trans	-68.1	113	163.3	-77.8	-176.7	142.9	0	0	109.1	T945 D949	T945-E947 PolarHBondContact O-N 3.08Å; T945-E947 VanDerWaalsContact O-N 3.15Å; E947-D949 PolarHBondContact O-N 3.42Å
948	C	27.3	Very low	29.6	Very low	113 Å²	113	142 Å²	142	76%	0.764	79%	0.787	S	S	*	*			trans	-79	111.4	167.5	-80	0	0	0	0	109	S946 I950	S946-C948 PolarHBondContact O-N 2.55Å; C948-I950 PolarHBondContact O-N 3.28Å; C948-I950 VanDerWaalsContact O-N 3.11Å
949	D	28.4	Very low	29.2	Very low	165 Å²	165	139.2 Å²	139.2	88%	0.882	78%	0.78	S	S	*	*			trans	-51.4	107.2	172.2	-79	-49	0	0	0	112.5	E947 G951	E947-D949 PolarHBondContact O-N 3.42Å; D949-G951 PolarHBondContact O-N 3.39Å
950	I	29.8	Very low	28.8	Very low	162 Å²	162	142.1 Å²	142.1	83%	0.831	78%	0.784	S	S	*	*			trans	-79.8	103	167.9	-64.4	171.3	0	0	0	107.7	C948 K952	C948-I950 PolarHBondContact O-N 3.28Å; C948-I950 VanDerWaalsContact O-N 3.11Å; I950-K952 PolarHBondContact O-N 3.41Å; I950-K952 VanDerWaalsContact O-N 3.13Å
951	G	27.8	Very low	28.5	Very low	65 Å²	65	140 Å²	140	67%	0.67	78%	0.781	S	S	*	*			trans	-53.3	111.8	178.1	0	0	0	0	0	113.2	D949 T953	D949-G951 PolarHBondContact O-N 3.39Å; G951-T953 PolarHBondContact O-N 3.22Å
952	K	28.5	Very low	28.4	Very low	200 Å²	200	141.7 Å²	141.7	87%	0.87	79%	0.788	S	S	*	*			trans	-63.2	110.5	170.4	-68.2	177.2	180	173.7	0	109.6	I950 L954	I950-K952 PolarHBondContact O-N 3.41Å; I950-K952 VanDerWaalsContact O-N 3.13Å; K952-L954 PolarHBondContact O-N 3.15Å
953	T	26.9	Very low	28.1	Very low	132 Å²	132	140.1 Å²	140.1	81%	0.81	78%	0.784	S	S	*	*			trans	-80	101.3	171.7	-37.1	0	0	0	0	108.3	G951 I955	G951-T953 PolarHBondContact O-N 3.22Å; T953-I955 PolarHBondContact O-N 3.27Å
954	L	29.2	Very low	28	Very low	161 Å²	161	139.6 Å²	139.6	84%	0.843	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-67.2	117	174.1	-80.9	150	0	0	0	110.1	K952	K952-L954 PolarHBondContact O-N 3.15Å
955	I	26.7	Very low	27.9	Very low	151 Å²	151	136.9 Å²	136.9	77%	0.774	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-87.4	116.6	169.8	-60.5	172.5	0	0	0	107.2	T953 T957	T953-I955 PolarHBondContact O-N 3.27Å; I955-T957 PolarHBondContact O-N 3.17Å
956	P	27.3	Very low	28	Very low	102 Å²	102	143 Å²	143	66%	0.662	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-80.2	120.3	-177.9	-5.5	22.8	0	0	0	111.1
957	T	26.8	Very low	28.1	Very low	130 Å²	130	143 Å²	143	80%	0.798	80%	0.797	S	S	*	*			trans	-83.5	108.8	170.9	42.4	0	0	0	0	109.7	I955 S959	I955-T957 PolarHBondContact O-N 3.17Å; T957-S959 PolarHBondContact O-N 2.83Å
958	H	27.7	Very low	28.1	Very low	174 Å²	174	139.7 Å²	139.7	81%	0.806	79%	0.794	S	S	*	*			trans	-92.3	93.2	170.8	-76.4	-73.3	0	0	0	110
959	S	25.7	Very low	28.3	Very low	107 Å²	107	141 Å²	141	75%	0.748	80%	0.799	S	S	*	*			trans	-96.1	100.9	167.3	44.1	0	0	0	0	109.4	T957 S961	T957-S959 PolarHBondContact O-N 2.83Å; S959-S961 PolarHBondContact O-N 2.89Å
960	T	27.7	Very low	28.5	Very low	135 Å²	135	138.5 Å²	138.5	83%	0.828	79%	0.794	S	S	*	*			trans	-87.3	99	168.2	42.7	0	0	0	0	109.3
961	S	27.8	Very low	28.4	Very low	105 Å²	105	137.7 Å²	137.7	73%	0.734	79%	0.791	S	S	*	*			trans	-73.2	122.6	171	47.5	0	0	0	0	110.7	S959	S959-S961 PolarHBondContact O-N 2.89Å
962	I	29.2	Very low	28.6	Very low	161 Å²	161	139.6 Å²	139.6	83%	0.826	80%	0.795	S	S	*	*			trans	-79.9	113.8	170.4	-67.2	169.8	0	0	0	107.6
963	T	27.8	Very low	28.8	Very low	123 Å²	123	136 Å²	136	76%	0.755	79%	0.785	S	S	*	*			trans	-81.2	111.6	173.9	42.8	0	0	0	0	109.8
964	T	29.6	Very low	29	Very low	124 Å²	124	140 Å²	140	76%	0.761	79%	0.787	S	S	*	*			trans	-89	114.1	165.1	45.2	0	0	0	0	109.3	R966	T964-R966 PolarHBondContact O-N 3.36Å
965	D	25.9	Very low	29.2	Very low	165 Å²	165	139.4 Å²	139.4	88%	0.882	79%	0.785	S	S	*	*			trans	-61.8	114.7	170.9	-77.7	-36.8	0	0	0	110.5
966	R	30.9	Very low	29.4	Very low	240 Å²	240	143.3 Å²	143.3	91%	0.906	79%	0.791	S	S	*	*			trans	-118	111.3	160.5	-99	-176.6	176.4	175.6	-0.3	108.2	T964 S968	T964-R966 PolarHBondContact O-N 3.36Å; R966-S968 PolarHBondContact O-N 2.92Å
967	S	30.7	Very low	29.7	Very low	107 Å²	107	145.3 Å²	145.3	75%	0.748	80%	0.796	S	S	*	*			trans	-58.6	111.2	171.6	48.6	0	0	0	0	111.6
968	S	27.5	Very low	29.9	Very low	111 Å²	111	146 Å²	146	78%	0.776	80%	0.795	S	S	*	*			trans	30.6	101.2	133	57.5	0	0	0	0	118	R966	R966-S968 PolarHBondContact O-N 2.92Å
969	T	32.3	Very low	30.1	Very low	142 Å²	142	148.3 Å²	148.3	87%	0.871	80%	0.798	S	S	*	*			trans	-128.9	123.3	144.6	41.9	0	0	0	0	109.1
970	S	32	Very low	30.5	Very low	112 Å²	112	149.9 Å²	149.9	78%	0.783	80%	0.798	S	S	*	*			trans	-37.9	133	-177.1	48.6	0	0	0	0	119.5
971	N	28	Very low	30.7	Very low	144 Å²	144	150.9 Å²	150.9	77%	0.77	80%	0.799	S	S	*	*			trans	9	127.6	140.3	-64.3	8.4	0	0	0	120
972	S	32.7	Very low	30.9	Very low	105 Å²	105	156.6 Å²	156.6	73%	0.734	80%	0.804	S	S	*	*			trans	-142	109.7	134.9	59.7	0	0	0	0	108.6
973	D	31.2	Very low	30.8	Very low	126 Å²	126	156.8 Å²	156.8	67%	0.674	81%	0.805	S	S	*	*			trans	-64.5	134.7	176.9	-65	-48.2	0	0	0	111.8
974	Y	31.9	Very low	30.9	Very low	216 Å²	216	157 Å²	157	85%	0.847	81%	0.806	S	S	*	*			trans	-141.6	100.8	156	-77.3	-71	0	0	0	108.5
975	D	32.8	Very low	30.6	Very low	148 Å²	148	159.7 Å²	159.7	79%	0.791	81%	0.81	S	S	*	*			trans	-63.4	132.6	172.9	-76.3	-43.1	0	0	0	111.1
976	Y	30.9	Very low	30.6	Very low	232 Å²	232	157.7 Å²	157.7	91%	0.91	81%	0.808	S	S	*	*			trans	-123.1	106.9	167	-115.6	-90.4	0	0	0	107.5
977	D	33.7	Very low	30.3	Very low	145 Å²	145	152.5 Å²	152.5	78%	0.775	80%	0.803	S	S	*	*			trans	-76	135	179.2	-78.7	-43.6	0	0	0	112.2
978	D	31.1	Very low	30.3	Very low	145 Å²	145	154 Å²	154	78%	0.775	81%	0.808	S	S	*	*			trans	-70.3	128.9	177.9	-162.8	10	0	0	0	111.3
979	Y	33.2	Very low	30.2	Very low	221 Å²	221	157.3 Å²	157.3	87%	0.867	81%	0.811	S	S	*	*			trans	-122.4	105.4	168.9	-94.5	-84.5	0	0	0	109.4
980	D	33.1	Very low	30.1	Very low	141 Å²	141	156.8 Å²	156.8	75%	0.754	80%	0.803	S	S	*	*			trans	-81.6	118.1	-176	-153.8	2.5	0	0	0	110.5	R982	D980-R982 PolarHBondContact O-N 3.48Å
981	D	33	Very low	29.8	Very low	156 Å²	156	156.9 Å²	156.9	83%	0.834	80%	0.799	S	S	*	*			trans	-80.4	105.1	-177.6	-98.9	-28.8	0	0	0	111.4	I983	D981-I983 PolarHBondContact O-N 3Å
982	R	32	Very low	29.7	Very low	225 Å²	225	155.1 Å²	155.1	85%	0.849	80%	0.798	S	S	*	*			trans	-84.9	101.1	168.7	-72.9	-173	-173.1	-172.5	2.9	111.2	D980 T984	D980-R982 PolarHBondContact O-N 3.48Å; R982-T984 PolarHBondContact O-N 3.35Å
983	I	27.3	Very low	29.4	Very low	165 Å²	165	158.3 Å²	158.3	85%	0.846	80%	0.801	S	S	*	*			trans	-70	112.3	165.4	-62.3	173.9	0	0	0	108.4	D981	D981-I983 PolarHBondContact O-N 3Å
984	T	28.2	Very low	29	Very low	127 Å²	127	162.1 Å²	162.1	78%	0.779	81%	0.808	S	S	*	*			trans	-116.2	117.7	169.2	-32.2	0	0	0	0	108.6	R982	R982-T984 PolarHBondContact O-N 3.35Å
985	E	24.3	Very low	28.8	Very low	181 Å²	181	158.4 Å²	158.4	85%	0.846	81%	0.807	S	S	*	*			trans	-73.3	125.2	178.2	-161.7	169.8	-149.9	0	0	109.4
986	C	25.6	Very low	28.4	Very low	122 Å²	122	160.6 Å²	160.6	82%	0.824	81%	0.81	S	S	*	*			trans	-139.2	119.5	168.9	-98.6	0	0	0	0	110.1
987	T	24.9	Very low	28.3	Very low	132 Å²	132	158.6 Å²	158.6	81%	0.81	81%	0.806	S	S	*	*			trans	-61.6	139	175.8	48.5	0	0	0	0	113
988	T	31.3	Very low	27.8	Very low	139 Å²	139	162 Å²	162	85%	0.853	81%	0.808	S	S	*	*			trans	-135.6	106.9	160.5	53.3	0	0	0	0	109.8
989	E	25	Very low	27.5	Very low	179 Å²	179	160.2 Å²	160.2	84%	0.836	80%	0.803	S	S	*	*			trans	-83.5	166.4	161.5	-70.9	180	147.7	0	0	110.2
990	D	30	Very low	27.1	Very low	132 Å²	132	155.3 Å²	155.3	71%	0.706	80%	0.796	S	S	*	*			trans	99.6	93	155	-67.1	-15.5	0	0	0	122
991	T	25.5	Very low	26.8	Very low	113 Å²	113	157.4 Å²	157.4	69%	0.693	80%	0.798	S	S	*	*				68.9	138.6	117.3	61.8	0	0	0	0	123.7
992	S	26.8	Very low	26.6	Very low	108 Å²	108	156.7 Å²	156.7	76%	0.755	80%	0.795	S	S	*	*			trans	76.8	147.8	147.7	80.4	0	0	0	0	116.5
993	E	25.4	Very low	26.7	Very low	171 Å²	171	154.3 Å²	154.3	80%	0.799	80%	0.799	S	S	*	*			cis	-167.8	146.4	-9.6	-121.3	-179.7	156.1	0	0	105.7
994	Y	22.3	Very low	26.8	Very low	207 Å²	207	156 Å²	156	81%	0.812	80%	0.8	S	S	*	*			trans	21.6	124	143.5	-86.4	-100.7	0	0	0	120.5
995	T	28.9	Very low	27.2	Very low	137 Å²	137	156 Å²	156	84%	0.84	80%	0.802	S	S	*	*				173.4	139.5	98.9	35.7	0	0	0	0	114.5
996	K	24	Very low	27.5	Very low	194 Å²	194	158.7 Å²	158.7	84%	0.843	80%	0.804	S	S	*	*			trans	-42.9	145.3	164.4	-68	160.7	170.2	166.9	0	114.3
997	K	27.8	Very low	27.5	Very low	190 Å²	190	164.8 Å²	164.8	83%	0.826	81%	0.81	S	S	*	*				169.9	125.3	112	-98.2	169.7	-177.7	173	0	114.6
998	R	24.2	Very low	27.9	Very low	216 Å²	216	164.7 Å²	164.7	82%	0.815	80%	0.803	S	S	*	*				59.2	111.9	124.5	-95	-174	178.3	-170.4	-0.9	121.1
999	T	23.8	Very low	27.8	Very low	109 Å²	109	164.1 Å²	164.1	67%	0.669	81%	0.805	S	S	*	*				69.7	126.8	119.4	55.2	0	0	0	0	121.6
1000	T	25.6	Very low	28.2	Very low	118 Å²	118	161.1 Å²	161.1	72%	0.724	80%	0.799	S	S	*	*			trans	77.8	110.6	135.3	60.7	0	0	0	0	119.1
1001	K	27.3	Very low	28	Very low	185 Å²	185	166.3 Å²	166.3	80%	0.804	81%	0.809	S	S	*	*				165	131.6	101.1	-99.2	172.1	-176.9	175.1	0	111.6
1002	N	29.1	Very low	28.4	Very low	141 Å²	141	169.9 Å²	169.9	75%	0.754	82%	0.818	S	S	*	*			trans	38.9	111.4	138	-62.7	-10.6	0	0	0	118.9
1003	N	33.3	Very low	28.8	Very low	175 Å²	175	171.5 Å²	171.5	94%	0.936	82%	0.818	S	S	*	*			trans	-145.9	131.1	136	-94.9	-30.6	0	0	0	111.5
1004	K	30	Very low	29.3	Very low	199 Å²	199	172.7 Å²	172.7	87%	0.865	82%	0.823	S	S	*	*			trans	-67.9	156.8	-177.2	-86.7	176.6	175.5	177.1	0	112.2
1005	P	35.8	Very low	30.1	Very low	128 Å²	128	169.7 Å²	169.7	83%	0.831	82%	0.82	S	S	*	*			trans	-84.4	131	-162.6	33.3	-32.6	0	0	0	111.9
1006	R	30	Very low	30.8	Very low	237 Å²	237	168.5 Å²	168.5	89%	0.894	82%	0.817	S	S	*	*			trans	-98.1	112	171.7	-146	176	-172.3	-178	1.5	108.7	I1008	R1006-I1008 PolarHBondContact O-N 3.19Å
1007	R	26.6	Very low	32.2	Very low	250 Å²	250	168 Å²	168	94%	0.943	82%	0.818	S	S	*	*			trans	-55.5	109.9	173.2	-129.9	177.2	-177.8	175.6	-0.4	109.6
1008	I	32.9	Very low	33.3	Very low	130 Å²	130	164.2 Å²	164.2	67%	0.667	82%	0.816	S	S	*	*			trans	-130.4	106.5	162.3	-63.1	179.7	0	0	0	107.2	R1006 T1010	R1006-I1008 PolarHBondContact O-N 3.19Å; I1008-T1010 HydrophobicContact CG2-CG2 4.32Å; I1008-T1010 PolarHBondContact O-N 2.92Å
1009	S	29.3	Very low	35.5	Very low	127 Å²	127	157.5 Å²	157.5	89%	0.888	80%	0.8	S	S	*	*			trans	-61.5	107.4	171.1	-177.8	0	0	0	0	108.6
1010	T	32.7	Very low	38.4	Very low	117 Å²	117	154.9 Å²	154.9	72%	0.718	79%	0.786	S	S	*	*			trans	-131.5	129.9	169.5	29	0	0	0	0	108.8	I1008 Q1012	I1008-T1010 HydrophobicContact CG2-CG2 4.32Å; I1008-T1010 PolarHBondContact O-N 2.92Å; T1010-Q1012 PolarHBondContact O-N 3.07Å
1011	R	26.3	Very low	41.1	Very low	240 Å²	240	156.4 Å²	156.4	91%	0.906	79%	0.789	S	S	*	*			trans	-43.9	121.2	-176.3	-74.6	169.8	161.7	178.3	-7.1	111.8	N1013	R1011-N1013 PolarHBondContact O-N 3.04Å; R1011-N1013 VanDerWaalsContact O-N 3.1Å
1012	Q	34.2	Very low	44.1	Very low	188 Å²	188	153.6 Å²	153.6	88%	0.879	78%	0.783	S	S	*	*			trans	-69.8	101.6	168.6	-79.6	176.6	-40.9	0	0	109	T1010 H1014	T1010-Q1012 PolarHBondContact O-N 3.07Å; Q1012-H1014 PolarHBondContact O-N 3.46Å
1013	N	35.5	Very low	46.9	Very low	142 Å²	142	152.1 Å²	152.1	76%	0.759	77%	0.771	S	S	*	*			trans	-61.6	119.9	155.7	-74.9	-23.3	0	0	0	107.1	R1011 L1015	R1011-N1013 PolarHBondContact O-N 3.04Å; R1011-N1013 VanDerWaalsContact O-N 3.1Å; N1013-L1015 PolarHBondContact O-N 2.94Å
1014	H	34.8	Very low	49.2	Very low	196 Å²	196	148.5 Å²	148.5	91%	0.907	75%	0.751	S	S	*	*			trans	-65.6	73.7	168.7	-87.9	-82.8	0	0	0	109.4	Q1012 S1016	Q1012-H1014 PolarHBondContact O-N 3.46Å; H1014-S1016 PolarHBondContact O-N 3.1Å
1015	L	39.7	Very low	52.1	Low	145 Å²	145	141.6 Å²	141.6	76%	0.759	73%	0.732	S	S	*	*			trans	-73.8	108.6	155.8	-79.4	160.7	0	0	0	105.2	N1013 E1017	N1013-L1015 PolarHBondContact O-N 2.94Å; L1015-E1017 PolarHBondContact O-N 3.33Å
1016	S	44.8	Very low	54.8	Low	111 Å²	111	142 Å²	142	78%	0.776	72%	0.723	S	S	*	*			trans	-38.4	100.4	173.3	48.1	0	0	0	0	110.6	H1014 S1018	H1014-S1016 PolarHBondContact O-N 3.1Å; S1016-S1018 PolarHBondContact O-N 3.08Å
1017	E	52.1	Low	57.4	Low	184 Å²	184	137.3 Å²	137.3	86%	0.86	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-57.3	123.7	173.9	-78.8	-179	161.7	0	0	107.3	L1015	L1015-E1017 PolarHBondContact O-N 3.33Å
1018	S	52.3	Low	60.5	Low	111 Å²	111	130 Å²	130	78%	0.776	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-53.9	133.8	172	-59	0	0	0	0	107.9	S1016 S1020	S1016-S1018 PolarHBondContact O-N 3.08Å; S1018-S1020 PolarHBondContact O-N 3.34Å
1019	P	70.3	Confident	63.3	Low	74 Å²	74	130.7 Å²	130.7	48%	0.481	69%	0.688	S	S	.	*	P	Polyproline II helix	trans	-54.5	132.7	-173.2	18.8	-30	0	0	0	109.8	Q1023 L1024	P1019-Q1023 HydrophobicContact CB-CB 4.16Å; P1019-L1024 HydrophobicContact CB-CD1 4.41Å; P1019-L1024 HydrophobicContact CG-CD1 4Å; P1019-L1024 HydrophobicContact CG-CG 4.49Å
1020	S	83.8	Confident	66.3	Low	55 Å²	55	130.6 Å²	130.6	39%	0.385	67%	0.674	S	S	.	*	P	Polyproline II helix	trans	-59.7	155.1	179.5	74.8	0	0	0	0	109.7	S1018 D1022 Q1023 L1024	S1018-S1020 PolarHBondContact O-N 3.34Å; S1020-D1022 PolarHBondContact O-N 3.02Å; S1020-D1022 VanDerWaalsContact O-N 3.1Å; S1020-Q1023 WeakPolarHBondContact O-CB 3.21Å; S1020-Q1023 PolarHBondContact O-N 3.26Å; S1020-Q1023 WeakPolarHBondContact OG-CG 3.47Å; S1020-Q1023 PolarHBondContact OG-N 3.09Å; S1020-L1024 PolarHBondContact O-N 3.41Å
1021	L	83.5	Confident	68.8	Low	149 Å²	149	129.7 Å²	129.7	78%	0.78	66%	0.664	S	S	*	*	H	α-helix	trans	-53.2	-34.5	177.4	-175.2	65.4	0	0	0	111.7	L1024 A1025	L1021-L1024 PolarHBondContact O-N 3.43Å; L1021-A1025 WeakPolarHBondContact O-CB 3.4Å; L1021-A1025 PolarHBondContact O-N 3.33Å
1022	D	89.6	Confident	72.1	Confident	127 Å²	127	124.9 Å²	124.9	68%	0.679	65%	0.649	S	S	*	*	H	α-helix	trans	-68.3	-42.1	176.6	-60.7	-35.1	0	0	0	112.3	S1020 L1024 A1025 E1026	S1020-D1022 PolarHBondContact O-N 3.02Å; S1020-D1022 VanDerWaalsContact O-N 3.1Å; D1022-L1024 VanDerWaalsContact C-N 3.31Å; D1022-L1024 PolarHBondContact O-N 3.06Å; D1022-A1025 PolarHBondContact O-N 3.2Å; D1022-E1026 WeakPolarHBondContact O-CB 3.4Å; D1022-E1026 PolarHBondContact O-N 3.31Å
1023	Q	87.2	Confident	74.9	Confident	109 Å²	109	123 Å²	123	51%	0.509	64%	0.638	S	S	.	*	H	α-helix	trans	-63.3	-38.4	174.6	-72.9	174.7	-12	0	0	111.9	P1019 S1020 E1026 K1027	P1019-Q1023 HydrophobicContact CB-CB 4.16Å; S1020-Q1023 WeakPolarHBondContact O-CB 3.21Å; S1020-Q1023 PolarHBondContact O-N 3.26Å; S1020-Q1023 WeakPolarHBondContact OG-CG 3.47Å; S1020-Q1023 PolarHBondContact OG-N 3.09Å; Q1023-E1026 PolarHBondContact O-N 3.46Å; Q1023-K1027 WeakPolarHBondContact O-CB 3.33Å; Q1023-K1027 PolarHBondContact O-N 3.42Å
1024	L	82.9	Confident	77.4	Confident	99 Å²	99	120.9 Å²	120.9	52%	0.518	63%	0.625	S	S	.	*	H	α-helix	trans	-66.5	-39.5	175	-107.7	146	0	0	0	111.7	P1019 S1020 L1021 D1022 L1028	P1019-L1024 HydrophobicContact CB-CD1 4.41Å; P1019-L1024 HydrophobicContact CG-CD1 4Å; P1019-L1024 HydrophobicContact CG-CG 4.49Å; S1020-L1024 PolarHBondContact O-N 3.41Å; L1021-L1024 PolarHBondContact O-N 3.43Å; D1022-L1024 VanDerWaalsContact C-N 3.31Å; D1022-L1024 PolarHBondContact O-N 3.06Å; L1024-L1028 WeakPolarHBondContact O-CB 3.44Å; L1024-L1028 PolarHBondContact O-N 3.46Å
1025	A	89	Confident	80	Confident	54 Å²	54	116.4 Å²	116.4	45%	0.446	61%	0.607	S	S	.	*	H	α-helix	trans	-65.4	-41.2	175.1	0	0	0	0	0	112	L1021 D1022 L1028 Q1029	L1021-A1025 WeakPolarHBondContact O-CB 3.4Å; L1021-A1025 PolarHBondContact O-N 3.33Å; D1022-A1025 PolarHBondContact O-N 3.2Å; A1025-L1028 WeakPolarHBondContact O-CB 3.42Å; A1025-L1028 PolarHBondContact O-N 3.04Å; A1025-Q1029 PolarHBondContact O-N 3.41Å
1026	E	93.1	Very high	82.5	Confident	138 Å²	138	115.6 Å²	115.6	65%	0.645	60%	0.6	S	S	*	*	H	α-helix	trans	-66.1	-44.4	177.1	-165.5	170.1	-157.6	0	0	111.4	D1022 Q1023 L1028 Q1029 E1030	D1022-E1026 WeakPolarHBondContact O-CB 3.4Å; D1022-E1026 PolarHBondContact O-N 3.31Å; Q1023-E1026 PolarHBondContact O-N 3.46Å; E1026-L1028 VanDerWaalsContact C-N 3.32Å; E1026-L1028 PolarHBondContact O-N 2.86Å; E1026-Q1029 WeakPolarHBondContact O-CB 3.47Å; E1026-Q1029 PolarHBondContact O-N 3.32Å; E1026-Q1029 VanDerWaalsContact O-N 3.07Å; E1026-E1030 PolarHBondContact O-N 2.88Å
1027	K	85.9	Confident	84.8	Confident	137 Å²	137	114.8 Å²	114.8	60%	0.596	59%	0.586	S	S	*	*	H	α-helix	trans	-63.4	-36.5	175.2	-166.1	169.5	-174.3	174.1	0	112.6	Q1023 Q1029 E1030 L1031	Q1023-K1027 WeakPolarHBondContact O-CB 3.33Å; Q1023-K1027 PolarHBondContact O-N 3.42Å; K1027-Q1029 VanDerWaalsContact C-N 3.33Å; K1027-E1030 PolarHBondContact O-N 3.45Å; K1027-L1031 WeakPolarHBondContact O-CB 3.4Å; K1027-L1031 WeakPolarHBondContact O-CG 3.29Å; K1027-L1031 PolarHBondContact O-N 3.33Å
1028	L	90.6	Very high	86.5	Confident	98 Å²	98	111.4 Å²	111.4	51%	0.513	57%	0.57	S	S	.	*	H	α-helix	trans	-64.2	-39.4	172.8	-174.7	76.4	0	0	0	111.3	L1024 A1025 E1026 K1032	L1024-L1028 WeakPolarHBondContact O-CB 3.44Å; L1024-L1028 PolarHBondContact O-N 3.46Å; A1025-L1028 WeakPolarHBondContact O-CB 3.42Å; A1025-L1028 PolarHBondContact O-N 3.04Å; E1026-L1028 VanDerWaalsContact C-N 3.32Å; E1026-L1028 PolarHBondContact O-N 2.86Å; L1028-K1032 WeakPolarHBondContact O-CG 3.45Å; L1028-K1032 PolarHBondContact O-N 2.97Å
1029	Q	92.1	Very high	88.4	Confident	144 Å²	144	113.7 Å²	113.7	67%	0.673	56%	0.562	S	S	*	*	H	α-helix	trans	-68.7	-38.3	178.1	-169.5	171.5	-14.2	0	0	111.8	A1025 E1026 K1027 K1032 K1033	A1025-Q1029 PolarHBondContact O-N 3.41Å; E1026-Q1029 WeakPolarHBondContact O-CB 3.47Å; E1026-Q1029 PolarHBondContact O-N 3.32Å; E1026-Q1029 VanDerWaalsContact O-N 3.07Å; K1027-Q1029 VanDerWaalsContact C-N 3.33Å; Q1029-K1032 PolarHBondContact O-N 2.83Å; Q1029-K1033 PolarHBondContact O-N 2.99Å; Q1029-K1033 VanDerWaalsContact O-N 3.1Å
1030	E	92.6	Very high	89.4	Confident	125 Å²	125	115.5 Å²	115.5	58%	0.584	56%	0.564	S	S	*	*	H	α-helix	trans	-63.5	-46.9	173.8	-168.8	176.3	-163.5	0	0	111.8	E1026 K1027 K1032 K1033 M1034	E1026-E1030 PolarHBondContact O-N 2.88Å; K1027-E1030 PolarHBondContact O-N 3.45Å; E1030-K1032 VanDerWaalsContact C-N 3.32Å; E1030-K1032 PolarHBondContact O-N 3.07Å; E1030-K1033 WeakPolarHBondContact O-CB 3.38Å; E1030-K1033 PolarHBondContact O-N 2.62Å; E1030-K1033 VanDerWaalsContact O-N 3.11Å; E1030-M1034 PolarHBondContact O-N 2.99Å
1031	L	85.7	Confident	89.7	Confident	98 Å²	98	118.8 Å²	118.8	51%	0.513	57%	0.573	S	S	.	*	H	α-helix	trans	-60.3	-39.8	175.6	-77.8	167.7	0	0	0	112.5	K1027 K1033 M1034 L1035	K1027-L1031 WeakPolarHBondContact O-CB 3.4Å; K1027-L1031 WeakPolarHBondContact O-CG 3.29Å; K1027-L1031 PolarHBondContact O-N 3.33Å; L1031-K1033 VanDerWaalsContact C-N 3.33Å; L1031-K1033 PolarHBondContact O-N 3.2Å; L1031-M1034 PolarHBondContact O-N 3.47Å; L1031-L1035 WeakPolarHBondContact O-CB 3.31Å; L1031-L1035 PolarHBondContact O-N 2.83Å
1032	K	94.3	Very high	89.9	Confident	138 Å²	138	117 Å²	117	60%	0.6	56%	0.563	S	S	*	*	H	α-helix	trans	-62.1	-40.1	174.5	-78.3	178.4	177.9	-179.2	0	112.1	L1028 Q1029 E1030 Q1036	L1028-K1032 WeakPolarHBondContact O-CG 3.45Å; L1028-K1032 PolarHBondContact O-N 2.97Å; Q1029-K1032 PolarHBondContact O-N 2.83Å; E1030-K1032 VanDerWaalsContact C-N 3.32Å; E1030-K1032 PolarHBondContact O-N 3.07Å; K1032-Q1036 WeakPolarHBondContact O-CB 3.17Å; K1032-Q1036 PolarHBondContact O-N 3.43Å; K1032-Q1036 VanDerWaalsContact O-N 3.12Å
1033	K	94.1	Very high	90.1	Very high	149 Å²	149	116.7 Å²	116.7	65%	0.648	56%	0.558	S	S	*	*	H	α-helix	trans	-68	-40.5	178	-166.6	-178.9	-179.5	-173.9	0	111.6	Q1029 E1030 L1031 Q1036 L1037	Q1029-K1033 PolarHBondContact O-N 2.99Å; Q1029-K1033 VanDerWaalsContact O-N 3.1Å; E1030-K1033 WeakPolarHBondContact O-CB 3.38Å; E1030-K1033 PolarHBondContact O-N 2.62Å; E1030-K1033 VanDerWaalsContact O-N 3.11Å; L1031-K1033 VanDerWaalsContact C-N 3.33Å; L1031-K1033 PolarHBondContact O-N 3.2Å; K1033-Q1036 PolarHBondContact O-N 3.38Å; K1033-L1037 PolarHBondContact O-N 2.89Å; K1033-L1037 VanDerWaalsContact O-N 3.08Å
1034	M	86.4	Confident	90.4	Very high	98 Å²	98	118.4 Å²	118.4	48%	0.483	57%	0.566	S	S	.	*	H	α-helix	trans	-64	-44.4	177.3	-154.7	-174.7	-54.7	0	0	111.5	E1030 L1031 Q1036 L1037 E1038	E1030-M1034 PolarHBondContact O-N 2.99Å; L1031-M1034 PolarHBondContact O-N 3.47Å; M1034-Q1036 VanDerWaalsContact C-N 3.26Å; M1034-Q1036 PolarHBondContact O-N 3.23Å; M1034-L1037 WeakPolarHBondContact O-CB 3.37Å; M1034-L1037 PolarHBondContact O-N 2.96Å; M1034-E1038 PolarHBondContact O-N 2.91Å
1035	L	90.1	Very high	90.7	Very high	101 Å²	101	117.7 Å²	117.7	53%	0.529	57%	0.565	S	S	.	*	H	α-helix	trans	-65.2	-30	176.4	-168.8	142.3	0	0	0	112.6	L1031 R1039	L1031-L1035 WeakPolarHBondContact O-CB 3.31Å; L1031-L1035 PolarHBondContact O-N 2.83Å; L1035-R1039 WeakPolarHBondContact O-CB 3.33Å; L1035-R1039 PolarHBondContact O-N 3.3Å; L1035-R1039 VanDerWaalsContact O-N 3.14Å
1036	Q	92.4	Very high	90.8	Very high	129 Å²	129	119.1 Å²	119.1	60%	0.603	57%	0.568	S	S	*	*	H	α-helix	trans	-72.5	-36.6	175	-168.2	162.4	3.3	0	0	112.4	K1032 K1033 M1034 R1039 Q1040	K1032-Q1036 WeakPolarHBondContact O-CB 3.17Å; K1032-Q1036 PolarHBondContact O-N 3.43Å; K1032-Q1036 VanDerWaalsContact O-N 3.12Å; K1033-Q1036 PolarHBondContact O-N 3.38Å; M1034-Q1036 VanDerWaalsContact C-N 3.26Å; M1034-Q1036 PolarHBondContact O-N 3.23Å; Q1036-R1039 PolarHBondContact O-N 3.49Å; Q1036-Q1040 PolarHBondContact O-N 3.09Å; Q1036-Q1040 VanDerWaalsContact O-N 3.17Å
1037	L	93.5	Very high	90.8	Very high	93 Å²	93	115.4 Å²	115.4	49%	0.487	56%	0.561	S	S	.	*	H	α-helix	trans	-64.2	-48.4	171.9	-92.7	159.4	0	0	0	111.8	K1033 M1034 R1039 Q1040 E1041	K1033-L1037 PolarHBondContact O-N 2.89Å; K1033-L1037 VanDerWaalsContact O-N 3.08Å; M1034-L1037 WeakPolarHBondContact O-CB 3.37Å; M1034-L1037 PolarHBondContact O-N 2.96Å; L1037-R1039 PolarHBondContact O-N 2.79Å; L1037-Q1040 WeakPolarHBondContact O-CB 3.35Å; L1037-Q1040 PolarHBondContact O-N 2.9Å; L1037-Q1040 VanDerWaalsContact O-N 3.07Å; L1037-E1041 PolarHBondContact O-N 2.87Å
1038	E	87.8	Confident	91.2	Very high	114 Å²	114	112.6 Å²	112.6	53%	0.533	56%	0.559	S	S	.	*	H	α-helix	trans	-58.4	-38.1	176.3	-75.6	-173	157.7	0	0	111.9	M1034 Q1040 E1041 I1042	M1034-E1038 PolarHBondContact O-N 2.91Å; E1038-Q1040 VanDerWaalsContact C-N 3.35Å; E1038-Q1040 PolarHBondContact O-N 2.63Å; E1038-E1041 PolarHBondContact O-N 2.97Å; E1038-I1042 VanDerWaalsContact O-CG1 3.29Å; E1038-I1042 WeakPolarHBondContact O-CG1 3.35Å; E1038-I1042 PolarHBondContact O-N 3.2Å; E1038-I1042 VanDerWaalsContact O-N 3.07Å
1039	R	91.7	Very high	91	Very high	158 Å²	158	114.6 Å²	114.6	60%	0.596	56%	0.563	S	S	*	*	H	α-helix	trans	-65.4	-37.7	177.1	-167.7	177.8	-75.4	-97.2	1.9	112	L1035 Q1036 L1037 E1043	L1035-R1039 WeakPolarHBondContact O-CB 3.33Å; L1035-R1039 PolarHBondContact O-N 3.3Å; L1035-R1039 VanDerWaalsContact O-N 3.14Å; Q1036-R1039 PolarHBondContact O-N 3.49Å; L1037-R1039 PolarHBondContact O-N 2.79Å; R1039-E1043 WeakPolarHBondContact O-CG 3.32Å; R1039-E1043 PolarHBondContact O-N 3.31Å; R1039-E1043 VanDerWaalsContact O-N 3.11Å
1040	Q	91.5	Very high	91.1	Very high	113 Å²	113	110.8 Å²	110.8	53%	0.528	55%	0.55	S	S	.	*	H	α-helix	trans	-67.5	-42.4	175.2	-76.9	-179	-23.5	0	0	112.4	Q1036 L1037 E1038 I1042 E1043 E1044	Q1036-Q1040 PolarHBondContact O-N 3.09Å; Q1036-Q1040 VanDerWaalsContact O-N 3.17Å; L1037-Q1040 WeakPolarHBondContact O-CB 3.35Å; L1037-Q1040 PolarHBondContact O-N 2.9Å; L1037-Q1040 VanDerWaalsContact O-N 3.07Å; E1038-Q1040 VanDerWaalsContact C-N 3.35Å; E1038-Q1040 PolarHBondContact O-N 2.63Å; Q1040-I1042 VanDerWaalsContact C-N 3.31Å; Q1040-I1042 PolarHBondContact O-N 2.98Å; Q1040-E1043 PolarHBondContact O-N 2.95Å; Q1040-E1044 PolarHBondContact O-N 2.94Å
1041	E	90.2	Very high	91.2	Very high	124 Å²	124	109.5 Å²	109.5	58%	0.579	54%	0.544	S	S	*	.	H	α-helix	trans	-61	-41.2	176.1	-72.2	-177.7	175.1	0	0	111.7	L1037 E1038 E1044 V1045	L1037-E1041 PolarHBondContact O-N 2.87Å; E1038-E1041 PolarHBondContact O-N 2.97Å; E1041-E1044 PolarHBondContact O-N 3.2Å; E1041-V1045 WeakPolarHBondContact O-CG2 3.42Å; E1041-V1045 PolarHBondContact O-N 3.24Å; E1041-V1045 VanDerWaalsContact O-N 3.1Å
1042	I	87.8	Confident	91.5	Very high	110 Å²	110	108.1 Å²	108.1	56%	0.564	54%	0.539	S	S	*	.	H	α-helix	trans	-63.6	-42.7	175.9	-67.9	166.9	0	0	0	111	E1038 Q1040 E1044 V1045 V1046	E1038-I1042 VanDerWaalsContact O-CG1 3.29Å; E1038-I1042 WeakPolarHBondContact O-CG1 3.35Å; E1038-I1042 PolarHBondContact O-N 3.2Å; E1038-I1042 VanDerWaalsContact O-N 3.07Å; Q1040-I1042 VanDerWaalsContact C-N 3.31Å; Q1040-I1042 PolarHBondContact O-N 2.98Å; I1042-E1044 VanDerWaalsContact C-N 3.34Å; I1042-E1044 PolarHBondContact O-N 3.13Å; I1042-V1045 PolarHBondContact O-N 3.3Å; I1042-V1046 HydrophobicContact CG2-CG2 4.38Å; I1042-V1046 VanDerWaalsContact O-CG2 3.29Å; I1042-V1046 WeakPolarHBondContact O-CG2 3.29Å; I1042-V1046 PolarHBondContact O-N 3.12Å
1043	E	92.7	Very high	91.3	Very high	121 Å²	121	105.6 Å²	105.6	57%	0.565	53%	0.532	S	S	*	.	H	α-helix	trans	-61.7	-40.3	177.4	-78.5	174.8	-170.6	0	0	112.1	R1039 Q1040 V1046 A1047	R1039-E1043 WeakPolarHBondContact O-CG 3.32Å; R1039-E1043 PolarHBondContact O-N 3.31Å; R1039-E1043 VanDerWaalsContact O-N 3.11Å; Q1040-E1043 PolarHBondContact O-N 2.95Å; E1043-V1046 PolarHBondContact O-N 2.93Å; E1043-A1047 WeakPolarHBondContact O-CB 3.27Å; E1043-A1047 PolarHBondContact O-N 3.15Å
1044	E	93.1	Very high	91.3	Very high	146 Å²	146	104.1 Å²	104.1	68%	0.682	53%	0.525	S	S	*	.	H	α-helix	trans	-64.8	-43.6	176.9	-169.9	176.4	-177.8	0	0	112.1	Q1040 E1041 I1042 V1046 A1047 S1048	Q1040-E1044 PolarHBondContact O-N 2.94Å; E1041-E1044 PolarHBondContact O-N 3.2Å; I1042-E1044 VanDerWaalsContact C-N 3.34Å; I1042-E1044 PolarHBondContact O-N 3.13Å; E1044-V1046 PolarHBondContact O-N 3.13Å; E1044-A1047 PolarHBondContact O-N 2.65Å; E1044-S1048 WeakPolarHBondContact O-CB 3.38Å; E1044-S1048 PolarHBondContact O-N 3.15Å
1045	V	89.1	Confident	91.6	Very high	83 Å²	83	104.7 Å²	104.7	50%	0.503	53%	0.527	S	S	.	.	H	α-helix	trans	-64.2	-41	176.8	173.1	0	0	0	0	111.4	E1041 I1042 K1049	E1041-V1045 WeakPolarHBondContact O-CG2 3.42Å; E1041-V1045 PolarHBondContact O-N 3.24Å; E1041-V1045 VanDerWaalsContact O-N 3.1Å; I1042-V1045 PolarHBondContact O-N 3.3Å; V1045-K1049 PolarHBondContact O-N 2.71Å; V1045-K1049 VanDerWaalsContact O-N 3.08Å
1046	V	92.7	Very high	91.7	Very high	84 Å²	84	105.5 Å²	105.5	51%	0.509	53%	0.528	S	S	.	.	H	α-helix	trans	-66.3	-42	177.1	171.3	0	0	0	0	110.9	I1042 E1043 E1044 K1049 T1050	I1042-V1046 HydrophobicContact CG2-CG2 4.38Å; I1042-V1046 VanDerWaalsContact O-CG2 3.29Å; I1042-V1046 WeakPolarHBondContact O-CG2 3.29Å; I1042-V1046 PolarHBondContact O-N 3.12Å; E1043-V1046 PolarHBondContact O-N 2.93Å; E1044-V1046 PolarHBondContact O-N 3.13Å; V1046-K1049 PolarHBondContact O-N 3.09Å; V1046-T1050 WeakPolarHBondContact O-CB 3.39Å; V1046-T1050 PolarHBondContact O-N 3.06Å; V1046-T1050 PolarHBondContact O-OG1 3.46Å
1047	A	93.1	Very high	91.8	Very high	60 Å²	60	104.7 Å²	104.7	50%	0.496	52%	0.524	S	S	.	.	H	α-helix	trans	-61.5	-46.8	176.5	0	0	0	0	0	111.8	E1043 E1044 K1049 T1050 E1051	E1043-A1047 WeakPolarHBondContact O-CB 3.27Å; E1043-A1047 PolarHBondContact O-N 3.15Å; E1044-A1047 PolarHBondContact O-N 2.65Å; A1047-K1049 PolarHBondContact O-N 2.97Å; A1047-T1050 PolarHBondContact O-N 3.22Å; A1047-E1051 PolarHBondContact O-N 3.08Å; A1047-E1051 VanDerWaalsContact O-N 3.07Å
1048	S	92.9	Very high	91.9	Very high	78 Å²	78	107.6 Å²	107.6	55%	0.545	53%	0.533	S	S	.	.	H	α-helix	trans	-59.5	-45.7	177.7	-179	0	0	0	0	112.3	E1044 T1050 E1051 V1052	E1044-S1048 WeakPolarHBondContact O-CB 3.38Å; E1044-S1048 PolarHBondContact O-N 3.15Å; S1048-T1050 PolarHBondContact O-N 2.99Å; S1048-E1051 PolarHBondContact O-N 2.87Å; S1048-V1052 PolarHBondContact O-N 2.99Å
1049	K	87.9	Confident	92.2	Very high	140 Å²	140	105.3 Å²	105.3	61%	0.609	53%	0.529	S	S	*	.	H	α-helix	trans	-65.6	-37	176.4	-75.3	-173	177.2	-171.4	0	113	V1045 V1046 A1047 E1051 V1052 I1053	V1045-K1049 PolarHBondContact O-N 2.71Å; V1045-K1049 VanDerWaalsContact O-N 3.08Å; V1046-K1049 PolarHBondContact O-N 3.09Å; A1047-K1049 PolarHBondContact O-N 2.97Å; K1049-E1051 VanDerWaalsContact C-N 3.28Å; K1049-E1051 PolarHBondContact O-N 3.45Å; K1049-V1052 PolarHBondContact O-N 3.07Å; K1049-I1053 WeakPolarHBondContact O-CG1 3.15Å; K1049-I1053 PolarHBondContact O-N 3.41Å
1050	T	94	Very high	92.3	Very high	65 Å²	65	102.3 Å²	102.3	40%	0.399	52%	0.524	S	S	.	.	H	α-helix	trans	-63.8	-37	177.7	-56.2	0	0	0	0	111.1	V1046 A1047 S1048 I1053 K1054	V1046-T1050 WeakPolarHBondContact O-CB 3.39Å; V1046-T1050 PolarHBondContact O-N 3.06Å; V1046-T1050 PolarHBondContact O-OG1 3.46Å; A1047-T1050 PolarHBondContact O-N 3.22Å; S1048-T1050 PolarHBondContact O-N 2.99Å; T1050-I1053 PolarHBondContact O-N 3.48Å; T1050-K1054 WeakPolarHBondContact O-CG 3.44Å; T1050-K1054 PolarHBondContact O-N 3.35Å; T1050-K1054 VanDerWaalsContact O-N 3.09Å
1051	E	94.4	Very high	92.4	Very high	98 Å²	98	103.2 Å²	103.2	46%	0.458	53%	0.528	S	S	.	.	H	α-helix	trans	-67.3	-42.1	175.8	-171.1	57.9	-152.8	0	0	112.3	A1047 S1048 K1049 I1053 K1054 Q1055	A1047-E1051 PolarHBondContact O-N 3.08Å; A1047-E1051 VanDerWaalsContact O-N 3.07Å; S1048-E1051 PolarHBondContact O-N 2.87Å; K1049-E1051 VanDerWaalsContact C-N 3.28Å; K1049-E1051 PolarHBondContact O-N 3.45Å; E1051-I1053 VanDerWaalsContact C-N 3.31Å; E1051-I1053 PolarHBondContact O-N 2.96Å; E1051-K1054 PolarHBondContact O-N 2.92Å; E1051-Q1055 WeakPolarHBondContact O-CG 3.39Å; E1051-Q1055 PolarHBondContact O-N 3.1Å
1052	V	92.9	Very high	92.5	Very high	68 Å²	68	103.9 Å²	103.9	41%	0.412	53%	0.532	S	S	.	.	H	α-helix	trans	-60.9	-40.7	175.2	174.9	0	0	0	0	111.4	S1048 K1049 Q1055 Q1056	S1048-V1052 PolarHBondContact O-N 2.99Å; K1049-V1052 PolarHBondContact O-N 3.07Å; V1052-Q1055 PolarHBondContact O-N 3.38Å; V1052-Q1056 WeakPolarHBondContact O-CG 3.48Å; V1052-Q1056 PolarHBondContact O-N 3.1Å; V1052-Q1056 VanDerWaalsContact O-N 3.08Å
1053	I	89.9	Confident	92.7	Very high	85 Å²	85	104.1 Å²	104.1	44%	0.436	53%	0.533	S	S	.	.	H	α-helix	trans	-63.5	-45.6	177.1	-69	167.5	0	0	0	110.6	K1049 T1050 E1051 Q1055 Q1056 E1057	K1049-I1053 WeakPolarHBondContact O-CG1 3.15Å; K1049-I1053 PolarHBondContact O-N 3.41Å; T1050-I1053 PolarHBondContact O-N 3.48Å; E1051-I1053 VanDerWaalsContact C-N 3.31Å; E1051-I1053 PolarHBondContact O-N 2.96Å; I1053-Q1055 VanDerWaalsContact C-N 3.29Å; I1053-Q1055 PolarHBondContact O-N 3.33Å; I1053-Q1056 WeakPolarHBondContact O-CB 3.29Å; I1053-Q1056 PolarHBondContact O-N 2.68Å; I1053-Q1056 VanDerWaalsContact O-N 3.1Å; I1053-E1057 HydrophobicContact CG2-CG 4.47Å; I1053-E1057 WeakPolarHBondContact O-CG 3.07Å; I1053-E1057 PolarHBondContact O-N 3.17Å
1054	K	94.3	Very high	92.7	Very high	119 Å²	119	104.1 Å²	104.1	52%	0.517	53%	0.533	S	S	.	.	H	α-helix	trans	-59.4	-38.4	176.1	-74.9	179	-179.9	177.4	0	112.8	T1050 E1051 Q1056 E1057 K1058	T1050-K1054 WeakPolarHBondContact O-CG 3.44Å; T1050-K1054 PolarHBondContact O-N 3.35Å; T1050-K1054 VanDerWaalsContact O-N 3.09Å; E1051-K1054 PolarHBondContact O-N 2.92Å; K1054-Q1056 VanDerWaalsContact C-N 3.34Å; K1054-E1057 PolarHBondContact O-N 3.38Å; K1054-K1058 WeakPolarHBondContact O-CB 3.46Å; K1054-K1058 PolarHBondContact O-N 3.14Å
1055	Q	91.4	Very high	92.6	Very high	109 Å²	109	100.2 Å²	100.2	51%	0.509	52%	0.522	S	S	.	.	H	α-helix	trans	-66	-37.3	176.2	-71.1	176.9	8.4	0	0	112.2	E1051 V1052 I1053 S1059	E1051-Q1055 WeakPolarHBondContact O-CG 3.39Å; E1051-Q1055 PolarHBondContact O-N 3.1Å; V1052-Q1055 PolarHBondContact O-N 3.38Å; I1053-Q1055 VanDerWaalsContact C-N 3.29Å; I1053-Q1055 PolarHBondContact O-N 3.33Å; Q1055-S1059 PolarHBondContact O-N 3.46Å; Q1055-S1059 VanDerWaalsContact O-N 3.07Å; Q1055-S1059 PolarHBondContact O-OG 2.94Å
1056	Q	92.4	Very high	92.6	Very high	119 Å²	119	101.5 Å²	101.5	56%	0.556	52%	0.523	S	S	*	.	H	α-helix	trans	-67.2	-44.3	175	-71.4	177.6	-12.7	0	0	111.8	V1052 I1053 K1054 K1058 S1059 I1060	V1052-Q1056 WeakPolarHBondContact O-CG 3.48Å; V1052-Q1056 PolarHBondContact O-N 3.1Å; V1052-Q1056 VanDerWaalsContact O-N 3.08Å; I1053-Q1056 WeakPolarHBondContact O-CB 3.29Å; I1053-Q1056 PolarHBondContact O-N 2.68Å; I1053-Q1056 VanDerWaalsContact O-N 3.1Å; K1054-Q1056 VanDerWaalsContact C-N 3.34Å; Q1056-K1058 VanDerWaalsContact C-N 3.35Å; Q1056-K1058 PolarHBondContact O-N 3.11Å; Q1056-S1059 WeakPolarHBondContact O-CB 3.46Å; Q1056-S1059 PolarHBondContact O-N 2.96Å; Q1056-S1059 VanDerWaalsContact O-N 3.15Å; Q1056-I1060 WeakPolarHBondContact O-CG1 3.49Å; Q1056-I1060 PolarHBondContact O-N 3.5Å
1057	E	95.6	Very high	92.3	Very high	112 Å²	112	101.7 Å²	101.7	52%	0.523	52%	0.52	S	S	.	.	H	α-helix	trans	-58.7	-45.8	176	-71.2	175.2	159	0	0	111.4	I1053 K1054 S1059 I1060 E1061	I1053-E1057 HydrophobicContact CG2-CG 4.47Å; I1053-E1057 WeakPolarHBondContact O-CG 3.07Å; I1053-E1057 PolarHBondContact O-N 3.17Å; K1054-E1057 PolarHBondContact O-N 3.38Å; E1057-S1059 VanDerWaalsContact C-N 3.3Å; E1057-S1059 PolarHBondContact O-N 2.88Å; E1057-I1060 WeakPolarHBondContact O-CB 3.44Å; E1057-I1060 PolarHBondContact O-N 3.33Å; E1057-I1060 VanDerWaalsContact O-N 3.12Å; E1057-E1061 PolarHBondContact O-N 3.39Å
1058	K	94.2	Very high	92.1	Very high	153 Å²	153	102.7 Å²	102.7	67%	0.665	52%	0.517	S	S	*	.	H	α-helix	trans	-61.6	-36.9	175.5	-169.1	178.2	-177.6	-179.4	0	113	K1054 Q1056 I1060 E1061 Q1062	K1054-K1058 WeakPolarHBondContact O-CB 3.46Å; K1054-K1058 PolarHBondContact O-N 3.14Å; Q1056-K1058 VanDerWaalsContact C-N 3.35Å; Q1056-K1058 PolarHBondContact O-N 3.11Å; K1058-I1060 VanDerWaalsContact C-N 3.33Å; K1058-E1061 PolarHBondContact O-N 3.2Å; K1058-Q1062 PolarHBondContact O-N 3.32Å; K1058-Q1062 VanDerWaalsContact O-N 3.09Å
1059	S	93.8	Very high	91.7	Very high	66 Å²	66	104.9 Å²	104.9	46%	0.462	52%	0.519	S	S	.	.	H	α-helix	trans	-67.3	-35.9	176.2	-58	0	0	0	0	111.6	Q1055 Q1056 E1057 L1063	Q1055-S1059 PolarHBondContact O-N 3.46Å; Q1055-S1059 VanDerWaalsContact O-N 3.07Å; Q1055-S1059 PolarHBondContact O-OG 2.94Å; Q1056-S1059 WeakPolarHBondContact O-CB 3.46Å; Q1056-S1059 PolarHBondContact O-N 2.96Å; Q1056-S1059 VanDerWaalsContact O-N 3.15Å; E1057-S1059 VanDerWaalsContact C-N 3.3Å; E1057-S1059 PolarHBondContact O-N 2.88Å; S1059-L1063 WeakPolarHBondContact O-CG 3.43Å; S1059-L1063 PolarHBondContact O-N 2.8Å
1060	I	93.7	Very high	91.2	Very high	95 Å²	95	102.5 Å²	102.5	49%	0.487	51%	0.512	S	S	.	.	H	α-helix	trans	-66.4	-47.5	175	-67.3	165.6	0	0	0	110.4	Q1056 E1057 K1058 Q1062 L1063 E1064	Q1056-I1060 WeakPolarHBondContact O-CG1 3.49Å; Q1056-I1060 PolarHBondContact O-N 3.5Å; E1057-I1060 WeakPolarHBondContact O-CB 3.44Å; E1057-I1060 PolarHBondContact O-N 3.33Å; E1057-I1060 VanDerWaalsContact O-N 3.12Å; K1058-I1060 VanDerWaalsContact C-N 3.33Å; I1060-Q1062 VanDerWaalsContact C-N 3.27Å; I1060-Q1062 PolarHBondContact O-N 3.28Å; I1060-L1063 PolarHBondContact O-N 3.07Å; I1060-L1063 VanDerWaalsContact O-N 3.14Å; I1060-E1064 WeakPolarHBondContact O-CG 3.46Å; I1060-E1064 PolarHBondContact O-N 3.12Å
1061	E	94.8	Very high	90.6	Very high	132 Å²	132	107 Å²	107	62%	0.617	52%	0.522	S	S	*	.	H	α-helix	trans	-58.8	-38.2	177.5	-71.4	179.4	171.5	0	0	112.5	E1057 K1058 E1064 S1065	E1057-E1061 PolarHBondContact O-N 3.39Å; K1058-E1061 PolarHBondContact O-N 3.2Å; E1061-E1064 PolarHBondContact O-N 3.37Å; E1061-S1065 PolarHBondContact O-N 2.78Å
1062	Q	93	Very high	89.9	Confident	139 Å²	139	110.3 Å²	110.3	65%	0.65	54%	0.535	S	S	*	.	H	α-helix	trans	-63.3	-44.6	176.1	-173.7	175	-3	0	0	111.8	K1058 I1060 E1064 S1065 E1066	K1058-Q1062 PolarHBondContact O-N 3.32Å; K1058-Q1062 VanDerWaalsContact O-N 3.09Å; I1060-Q1062 VanDerWaalsContact C-N 3.27Å; I1060-Q1062 PolarHBondContact O-N 3.28Å; Q1062-E1064 VanDerWaalsContact C-N 3.33Å; Q1062-E1064 PolarHBondContact O-N 3.14Å; Q1062-S1065 PolarHBondContact O-N 3.11Å; Q1062-E1066 PolarHBondContact O-N 3.47Å
1063	L	91.5	Very high	88.9	Confident	114 Å²	114	114.6 Å²	114.6	60%	0.597	55%	0.55	S	S	*	*	H	α-helix	trans	-64.9	-36.8	177	-71.9	169.9	0	0	0	112.1	S1059 I1060 E1066 L1067	S1059-L1063 WeakPolarHBondContact O-CG 3.43Å; S1059-L1063 PolarHBondContact O-N 2.8Å; I1060-L1063 PolarHBondContact O-N 3.07Å; I1060-L1063 VanDerWaalsContact O-N 3.14Å; L1063-E1066 PolarHBondContact O-N 3.02Å; L1063-L1067 WeakPolarHBondContact O-CB 3.4Å; L1063-L1067 PolarHBondContact O-N 3.41Å
1064	E	92.2	Very high	87.4	Confident	121 Å²	121	117.5 Å²	117.5	57%	0.565	56%	0.562	S	S	*	*	H	α-helix	trans	-65.6	-42.5	175.2	-71.4	-172.5	157.4	0	0	112	I1060 E1061 Q1062 E1066 L1067 D1068	I1060-E1064 WeakPolarHBondContact O-CG 3.46Å; I1060-E1064 PolarHBondContact O-N 3.12Å; E1061-E1064 PolarHBondContact O-N 3.37Å; Q1062-E1064 VanDerWaalsContact C-N 3.33Å; Q1062-E1064 PolarHBondContact O-N 3.14Å; E1064-E1066 PolarHBondContact O-N 3.44Å; E1064-L1067 WeakPolarHBondContact O-CB 3.49Å; E1064-L1067 PolarHBondContact O-N 3.37Å; E1064-D1068 PolarHBondContact O-N 3.45Å
1065	S	90.5	Very high	85.2	Confident	64 Å²	64	122.2 Å²	122.2	45%	0.448	58%	0.576	S	S	.	*	H	α-helix	trans	-61.9	-42.2	175.4	-177.8	0	0	0	0	112.3	E1061 Q1062 D1068 Q1069	E1061-S1065 PolarHBondContact O-N 2.78Å; Q1062-S1065 PolarHBondContact O-N 3.11Å; S1065-D1068 PolarHBondContact O-N 3.06Å; S1065-Q1069 PolarHBondContact O-N 3.43Å
1066	E	90	Very high	83.4	Confident	111 Å²	111	122.7 Å²	122.7	52%	0.519	59%	0.589	S	S	.	*	H	α-helix	trans	-64.7	-40.8	177.2	-163.4	174.9	-166.6	0	0	111.5	Q1062 L1063 E1064 D1068 Q1069 L1070	Q1062-E1066 PolarHBondContact O-N 3.47Å; L1063-E1066 PolarHBondContact O-N 3.02Å; E1064-E1066 PolarHBondContact O-N 3.44Å; E1066-D1068 VanDerWaalsContact C-N 3.32Å; E1066-D1068 PolarHBondContact O-N 3.01Å; E1066-Q1069 PolarHBondContact O-N 3.47Å; E1066-L1070 WeakPolarHBondContact O-CG 3.33Å; E1066-L1070 PolarHBondContact O-N 2.75Å; E1066-L1070 VanDerWaalsContact O-N 3.1Å
1067	L	85.4	Confident	81.3	Confident	87 Å²	87	125.1 Å²	125.1	46%	0.455	61%	0.605	S	S	.	*	H	α-helix	trans	-61.4	-39.7	174.7	-162.4	87.4	0	0	0	112.1	L1063 E1064 L1070 R1071	L1063-L1067 WeakPolarHBondContact O-CB 3.4Å; L1063-L1067 PolarHBondContact O-N 3.41Å; E1064-L1067 WeakPolarHBondContact O-CB 3.49Å; E1064-L1067 PolarHBondContact O-N 3.37Å; L1067-L1070 PolarHBondContact O-N 3.13Å; L1067-R1071 WeakPolarHBondContact O-CG 3.38Å; L1067-R1071 PolarHBondContact O-N 3.43Å; L1067-R1071 VanDerWaalsContact O-N 3.15Å
1068	D	88.7	Confident	78.9	Confident	81 Å²	81	129.5 Å²	129.5	43%	0.433	62%	0.622	S	S	.	*	H	α-helix	trans	-74.4	-30.1	179.4	-89.5	-4.1	0	0	0	113.3	E1064 S1065 E1066 R1071 K1072	E1064-D1068 PolarHBondContact O-N 3.45Å; S1065-D1068 PolarHBondContact O-N 3.06Å; E1066-D1068 VanDerWaalsContact C-N 3.32Å; E1066-D1068 PolarHBondContact O-N 3.01Å; D1068-R1071 PolarHBondContact O-N 3.3Å; D1068-R1071 IonicContact OD1-CZ 3.23Å; D1068-R1071 IonicContact OD1-NH1 2.63Å; D1068-R1071 PolarHBondContact OD1-NH1 3.22Å; D1068-K1072 PolarHBondContact O-N 2.8Å
1069	Q	85	Confident	76.3	Confident	124 Å²	124	130.9 Å²	130.9	58%	0.579	63%	0.633	S	S	*	*	H	α-helix	trans	-64.3	-46.9	169.6	-74	-176.1	34.7	0	0	111.2	S1065 E1066 R1071 K1072 E1073	S1065-Q1069 PolarHBondContact O-N 3.43Å; E1066-Q1069 PolarHBondContact O-N 3.47Å; Q1069-R1071 PolarHBondContact O-N 2.96Å; Q1069-K1072 PolarHBondContact O-N 3.44Å; Q1069-E1073 PolarHBondContact O-N 3.21Å
1070	L	77.9	Confident	73.7	Confident	90 Å²	90	137.3 Å²	137.3	47%	0.471	65%	0.653	S	S	.	*	H	α-helix	trans	-58.6	-35.6	176.7	-72.7	169.4	0	0	0	112.1	E1066 L1067 K1072 H1074	E1066-L1070 WeakPolarHBondContact O-CG 3.33Å; E1066-L1070 PolarHBondContact O-N 2.75Å; E1066-L1070 VanDerWaalsContact O-N 3.1Å; L1067-L1070 PolarHBondContact O-N 3.13Å; L1070-K1072 VanDerWaalsContact C-N 3.34Å; L1070-K1072 PolarHBondContact O-N 3.11Å; L1070-H1074 PolarHBondContact O-ND1 3.07Å
1071	R	81.8	Confident	71.2	Confident	161 Å²	161	138.3 Å²	138.3	61%	0.608	67%	0.666	S	S	*	*	H	α-helix	trans	-68.6	-28.6	175.5	-73.8	169.3	175.1	171.7	-1.4	113.7	L1067 D1068 Q1069	L1067-R1071 WeakPolarHBondContact O-CG 3.38Å; L1067-R1071 PolarHBondContact O-N 3.43Å; L1067-R1071 VanDerWaalsContact O-N 3.15Å; D1068-R1071 PolarHBondContact O-N 3.3Å; D1068-R1071 IonicContact OD1-CZ 3.23Å; D1068-R1071 IonicContact OD1-NH1 2.63Å; D1068-R1071 PolarHBondContact OD1-NH1 3.22Å; Q1069-R1071 PolarHBondContact O-N 2.96Å
1072	K	79.4	Confident	68.7	Low	166 Å²	166	138 Å²	138	72%	0.722	68%	0.675	S	S	*	*	H	α-helix	trans	-79	-36.5	-179.6	-75.4	176.3	-176.3	171.3	0	112.5	D1068 Q1069 L1070 H1074	D1068-K1072 PolarHBondContact O-N 2.8Å; Q1069-K1072 PolarHBondContact O-N 3.44Å; L1070-K1072 VanDerWaalsContact C-N 3.34Å; L1070-K1072 PolarHBondContact O-N 3.11Å; K1072-H1074 PolarHBondContact O-N 3.48Å
1073	E	70.9	Confident	66	Low	158 Å²	158	139.8 Å²	139.8	74%	0.738	69%	0.689	S	S	*	*	H	α-helix	trans	-65	-27.4	179.4	-72.7	-171	152.6	0	0	113.1	Q1069 R1075	Q1069-E1073 PolarHBondContact O-N 3.21Å; E1073-R1075 VanDerWaalsContact C-N 3.35Å; E1073-R1075 PolarHBondContact O-N 3.42Å
1074	H	58.5	Low	63.4	Low	147 Å²	147	138.1 Å²	138.1	68%	0.681	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	20.3	-174.6	-68.7	83.8	0	0	0	115.1	L1070 K1072 P1076	L1070-H1074 PolarHBondContact O-ND1 3.07Å; K1072-H1074 PolarHBondContact O-N 3.48Å; H1074-P1076 WeakPolarHBondContact O-CD 3.37Å
1075	R	49.6	Very low	60.6	Low	217 Å²	217	143.6 Å²	143.6	82%	0.819	72%	0.715	S	S	*	*			trans	-87.5	114.1	171.9	-84.3	-168	-171.5	-166	3.9	111.7	E1073	E1073-R1075 VanDerWaalsContact C-N 3.35Å; E1073-R1075 PolarHBondContact O-N 3.42Å
1076	P	53.1	Low	57.9	Low	120 Å²	120	148.9 Å²	148.9	78%	0.779	73%	0.732	S	S	*	*			trans	-68.7	136.6	-177.1	-9.7	23.8	0	0	0	111.9	H1074 K1078	H1074-P1076 WeakPolarHBondContact O-CD 3.37Å; P1076-K1078 PolarHBondContact O-N 3.01Å; P1076-K1078 VanDerWaalsContact O-N 3.13Å
1077	L	46.9	Very low	55.4	Low	169 Å²	169	150 Å²	150	89%	0.885	75%	0.746	S	S	*	*			trans	-54.1	113	174.3	-73.1	160.6	0	0	0	110.6	M1079	L1077-M1079 PolarHBondContact O-N 3.02Å
1078	K	46.4	Very low	52.8	Low	205 Å²	205	150.8 Å²	150.8	89%	0.891	76%	0.759	S	S	*	*			trans	-58.2	106.9	174.9	-81.2	-179.4	173.9	178.6	0	110.2	P1076 K1080	P1076-K1078 PolarHBondContact O-N 3.01Å; P1076-K1078 VanDerWaalsContact O-N 3.13Å; K1078-K1080 PolarHBondContact O-N 3.42Å
1079	M	38.6	Very low	50	Low	182 Å²	182	157 Å²	157	90%	0.897	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-64.5	130	168.3	-69.8	-167.2	76.7	0	0	110.2	L1077	L1077-M1079 PolarHBondContact O-N 3.02Å
1080	K	38.9	Very low	47.5	Very low	201 Å²	201	156.2 Å²	156.2	87%	0.874	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-60.7	135.8	177.8	-81.9	177.7	173.8	175.1	0	110.8	K1078	K1078-K1080 PolarHBondContact O-N 3.42Å
1081	P	43.3	Very low	45.2	Very low	116 Å²	116	158.1 Å²	158.1	75%	0.753	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-76.9	145.2	-178.7	31.5	-32.3	0	0	0	111
1082	P	41.5	Very low	42.7	Very low	126 Å²	126	155.7 Å²	155.7	82%	0.818	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-80.2	144.2	-179.7	19.2	-7.9	0	0	0	111.9
1083	N	37	Very low	40.2	Very low	176 Å²	176	159 Å²	159	94%	0.941	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-50.5	127.7	177.5	-70.5	-36.7	0	0	0	113.2
1084	G	35.9	Very low	38.3	Very low	78 Å²	78	158.5 Å²	158.5	80%	0.804	83%	0.83	S	S	*	*			trans	-150	86.4	178.5	0	0	0	0	0	112.2
1085	R	32.8	Very low	37	Very low	236 Å²	236	158 Å²	158	89%	0.891	84%	0.837	S	S	*	*			trans	-25.9	127.7	172.7	-118.1	167.1	177.8	171.2	-1.6	118.4
1086	H	34.8	Very low	35.9	Very low	176 Å²	176	152.5 Å²	152.5	82%	0.815	83%	0.831	S	S	*	*			trans	10.5	121.2	139.4	-61.3	-78.8	0	0	0	120.4
1087	T	36.1	Very low	35	Very low	134 Å²	134	153.2 Å²	153.2	82%	0.822	84%	0.836	S	S	*	*			trans	-160.7	95	133.4	42.3	0	0	0	0	107.8
1088	S	30.8	Very low	34	Very low	103 Å²	103	149.8 Å²	149.8	72%	0.72	83%	0.832	S	S	*	*				61.5	93.1	96.5	66.2	0	0	0	0	116.9
1089	K	31.4	Very low	33.4	Very low	211 Å²	211	145 Å²	145	92%	0.917	83%	0.825	S	S	*	*				48.2	114.2	129.5	-66.4	179.7	177.2	178.1	0	119.9
1090	S	31.3	Very low	32.9	Very low	109 Å²	109	141.8 Å²	141.8	76%	0.762	82%	0.82	S	S	*	*			trans	-159.4	102.4	131.9	50.4	0	0	0	0	108.9
1091	T	30.2	Very low	32.5	Very low	130 Å²	130	140.6 Å²	140.6	80%	0.798	82%	0.823	S	S	*	*				46.6	99.9	99.1	49.7	0	0	0	0	115.8
1092	S	28.4	Very low	31.9	Very low	110 Å²	110	140.5 Å²	140.5	77%	0.769	82%	0.824	S	S	*	*				149.7	135.9	91.7	57.2	0	0	0	0	113.3
1093	R	27.4	Very low	31.3	Very low	235 Å²	235	139.7 Å²	139.7	89%	0.887	82%	0.822	S	S	*	*			trans	53.6	114.9	152.9	-75.8	179.2	171.3	-167.8	-3	119.1
1094	T	31.2	Very low	30.9	Very low	147 Å²	147	139.3 Å²	139.3	90%	0.902	81%	0.814	S	S	*	*				-158.2	147.3	103.9	30.7	0	0	0	0	111
1095	V	31.6	Very low	30.5	Very low	138 Å²	138	141.1 Å²	141.1	84%	0.836	81%	0.813	S	S	*	*			trans	-72.9	139.5	-159.4	172.3	0	0	0	0	114.2
1096	S	25.4	Very low	30.2	Very low	100 Å²	100	140.1 Å²	140.1	70%	0.699	81%	0.811	S	S	*	*			trans	-75	146.6	165.9	-43.9	0	0	0	0	112.3
1097	P	34.1	Very low	29.7	Very low	135 Å²	135	137 Å²	137	88%	0.877	81%	0.809	S	S	*	*			trans	-98	113.4	146.2	29.3	-15.9	0	0	0	108.7
1098	A	26.7	Very low	29.5	Very low	97 Å²	97	135.7 Å²	135.7	80%	0.802	81%	0.806	S	S	*	*			trans	-109.7	129.6	168.4	0	0	0	0	0	108.4
1099	S	33	Very low	29.3	Very low	106 Å²	106	138 Å²	138	74%	0.741	81%	0.81	S	S	*	*			trans	-164.8	89.7	154.6	55.3	0	0	0	0	107
1100	S	28.9	Very low	29.2	Very low	114 Å²	114	136 Å²	136	80%	0.797	81%	0.808	S	S	*	*				57.9	85.8	86.2	70.6	0	0	0	0	113.3
1101	L	30	Very low	28.9	Very low	176 Å²	176	135.1 Å²	135.1	92%	0.921	80%	0.802	S	S	*	*			trans	-118.7	101.2	152.9	-82.2	165.9	0	0	0	106.8	S1103	L1101-S1103 PolarHBondContact O-N 3.36Å
1102	S	30.2	Very low	28.7	Very low	113 Å²	113	135.8 Å²	135.8	79%	0.79	80%	0.801	S	S	*	*			trans	-70.2	116	172.3	47.6	0	0	0	0	109.4
1103	S	29.3	Very low	28.9	Very low	109 Å²	109	138.4 Å²	138.4	76%	0.762	80%	0.804	S	S	*	*			trans	-84	103.6	166.6	55.4	0	0	0	0	109.3	L1101	L1101-S1103 PolarHBondContact O-N 3.36Å
1104	E	29.2	Very low	28.7	Very low	168 Å²	168	133.4 Å²	133.4	79%	0.785	80%	0.8	S	S	*	*			trans	-99	88.8	160	-74.4	-176.9	170.9	0	0	107.8
1105	C	26.7	Very low	28.5	Very low	116 Å²	116	134.6 Å²	134.6	78%	0.784	80%	0.796	S	S	*	*			trans	-98.4	97.1	165.8	-71.3	0	0	0	0	107.4	S1107	C1105-S1107 PolarHBondContact O-N 3.46Å
1106	Y	28.2	Very low	28.3	Very low	215 Å²	215	134 Å²	134	84%	0.843	79%	0.787	S	S	*	*			trans	-71.8	113.4	165.2	-93.9	-88.5	0	0	0	109
1107	S	23.9	Very low	28.3	Very low	111 Å²	111	136 Å²	136	78%	0.776	80%	0.8	S	S	*	*			trans	-67.1	125	165.8	-53.9	0	0	0	0	110	C1105	C1105-S1107 PolarHBondContact O-N 3.46Å
1108	S	30.6	Very low	28	Very low	107 Å²	107	136.4 Å²	136.4	75%	0.748	79%	0.79	S	S	*	*			trans	-129.7	104.5	159.7	54.7	0	0	0	0	108.7
1109	N	27.5	Very low	27.8	Very low	151 Å²	151	137.2 Å²	137.2	81%	0.807	79%	0.789	S	S	*	*			trans	-55.4	127.5	169.4	-66.8	-33	0	0	0	109.9
1110	L	29	Very low	27.6	Very low	169 Å²	169	143.1 Å²	143.1	89%	0.885	80%	0.797	S	S	*	*			trans	-124.5	88.4	162.6	-124.8	83.9	0	0	0	107.7
1111	S	25	Very low	27.5	Very low	91 Å²	91	144.7 Å²	144.7	64%	0.636	80%	0.797	S	S	*	*			trans	-92	147.9	155.3	52.4	0	0	0	0	108.6
1112	D	27.2	Very low	27.5	Very low	143 Å²	143	144.2 Å²	144.2	77%	0.765	80%	0.795	S	S	*	*			trans	75.7	81.5	161	-50.3	-28.8	0	0	0	118.9
1113	I	30.9	Very low	27.7	Very low	165 Å²	165	143 Å²	143	85%	0.846	79%	0.785	S	S	*	*			trans	-139	83.9	139.5	-54.7	-178.4	0	0	0	109.1
1114	T	24.1	Very low	27.6	Very low	130 Å²	130	146.7 Å²	146.7	80%	0.798	79%	0.787	S	S	*	*			trans	-91	105.8	152.1	45.5	0	0	0	0	107.9
1115	Q	26.5	Very low	27.6	Very low	173 Å²	173	149.4 Å²	149.4	81%	0.808	79%	0.792	S	S	*	*			trans	176.1	145	145.5	-101	171	5.5	0	0	110.8
1116	N	28.2	Very low	27.6	Very low	124 Å²	124	150.9 Å²	150.9	66%	0.663	79%	0.787	S	S	*	*			trans	81.9	68.4	169.2	-61.7	-5.1	0	0	0	117.9	H1118	N1116-H1118 VanDerWaalsContact C-N 3.27Å; N1116-H1118 PolarHBondContact O-N 3.14Å; N1116-H1118 VanDerWaalsContact O-N 3.13Å
1117	C	24.6	Very low	27.7	Very low	142 Å²	142	147.6 Å²	147.6	96%	0.959	78%	0.784	S	S	*	*			trans	-74.8	82.6	148.3	-67.6	0	0	0	0	109
1118	H	27.7	Very low	27.9	Very low	145 Å²	145	148.4 Å²	148.4	67%	0.671	78%	0.78	S	S	*	*			trans	-88.3	131.5	164.8	-86.5	-51.9	0	0	0	110.2	N1116 Y1120	N1116-H1118 VanDerWaalsContact C-N 3.27Å; N1116-H1118 PolarHBondContact O-N 3.14Å; N1116-H1118 VanDerWaalsContact O-N 3.13Å; H1118-Y1120 PolarHBondContact O-N 3.46Å
1119	S	23.6	Very low	27.8	Very low	113 Å²	113	151.1 Å²	151.1	79%	0.79	78%	0.784	S	S	*	*			trans	-40.6	111.1	176.7	-57.4	0	0	0	0	113.6	N1121	S1119-N1121 PolarHBondContact O-N 3.28Å
1120	Y	27.5	Very low	28	Very low	230 Å²	230	152.5 Å²	152.5	90%	0.902	79%	0.785	S	S	*	*			trans	-85.5	98	161	-89.6	-87.7	0	0	0	109	H1118 N1122	H1118-Y1120 PolarHBondContact O-N 3.46Å; Y1120-N1122 PolarHBondContact O-N 3.5Å
1121	N	27.8	Very low	27.9	Very low	148 Å²	148	150.7 Å²	150.7	79%	0.791	78%	0.776	S	S	*	*			trans	-56.8	118.5	158.6	-79.2	-28.7	0	0	0	108.6	S1119 P1123	S1119-N1121 PolarHBondContact O-N 3.28Å; N1121-P1123 WeakPolarHBondContact O-CD 3.49Å
1122	N	29.1	Very low	28	Very low	165 Å²	165	153.6 Å²	153.6	88%	0.882	79%	0.785	S	S	*	*			trans	-100	109.1	170.7	-141.5	7.7	0	0	0	108.2	Y1120	Y1120-N1122 PolarHBondContact O-N 3.5Å
1123	P	34.6	Very low	28.1	Very low	89 Å²	89	155 Å²	155	58%	0.578	78%	0.784	S	S	*	*			trans	-87.1	165	179.1	34.8	-30.3	0	0	0	111.3	N1121	N1121-P1123 WeakPolarHBondContact O-CD 3.49Å
1124	F	28	Very low	28.1	Very low	185 Å²	185	154.7 Å²	154.7	81%	0.811	78%	0.784	S	S	*	*			trans	77.4	97.2	172.4	-65.7	-85.8	0	0	0	116.9
1125	Y	30	Very low	28.2	Very low	225 Å²	225	152.9 Å²	152.9	88%	0.882	78%	0.777	S	S	*	*				-155.2	95.1	107.3	-103.9	-79	0	0	0	108.4
1126	H	25.9	Very low	28.4	Very low	148 Å²	148	152.7 Å²	152.7	69%	0.685	78%	0.782	S	S	*	*			trans	-73.5	123.6	160.5	-123.8	-82.2	0	0	0	106.5	D1128	H1126-D1128 IonicContact CE1-OD2 2.89Å; H1126-D1128 PolarHBondContact CE1-OD2 3.17Å; H1126-D1128 IonicContact ND1-OD1 2.92Å; H1126-D1128 IonicContact ND1-OD2 3.98Å; H1126-D1128 PolarHBondContact ND1-OD2 3.07Å
1127	N	30.7	Very low	28.4	Very low	146 Å²	146	152.9 Å²	152.9	78%	0.781	78%	0.782	S	S	*	*			trans	-150	95.4	152.4	-96.6	-21.2	0	0	0	107	I1129	N1127-I1129 PolarHBondContact O-N 3.02Å
1128	D	27.4	Very low	28.7	Very low	128 Å²	128	153.7 Å²	153.7	68%	0.684	78%	0.777	S	S	*	*			trans	-60.2	113.9	170.2	-64.5	-72.1	0	0	0	109.6	H1126	H1126-D1128 IonicContact CE1-OD2 2.89Å; H1126-D1128 PolarHBondContact CE1-OD2 3.17Å; H1126-D1128 IonicContact ND1-OD1 2.92Å; H1126-D1128 IonicContact ND1-OD2 3.98Å; H1126-D1128 PolarHBondContact ND1-OD2 3.07Å
1129	I	29.7	Very low	28.7	Very low	163 Å²	163	151.8 Å²	151.8	84%	0.836	78%	0.776	S	S	*	*			trans	-118.1	117.1	158.4	-64.1	-179.8	0	0	0	107	N1127	N1127-I1129 PolarHBondContact O-N 3.02Å
1130	H	31.1	Very low	28.9	Very low	180 Å²	180	153 Å²	153	83%	0.833	77%	0.773	S	S	*	*			trans	-49.2	134.3	-171.9	-97	-94	0	0	0	114.5	N1132	H1130-N1132 PolarHBondContact O-N 2.59Å
1131	N	26	Very low	28.9	Very low	131 Å²	131	148.3 Å²	148.3	70%	0.701	76%	0.764	S	S	*	*			trans	-40.3	124.4	158.2	-81.1	-51.7	0	0	0	112.1
1132	N	28.5	Very low	29	Very low	153 Å²	153	148.5 Å²	148.5	82%	0.818	77%	0.765	S	S	*	*			trans	-128.4	83.5	144.9	-145.9	3	0	0	0	108.4	H1130 N1134	H1130-N1132 PolarHBondContact O-N 2.59Å; N1132-N1134 PolarHBondContact O-N 3.34Å
1133	K	28.3	Very low	28.8	Very low	172 Å²	172	146.9 Å²	146.9	75%	0.748	76%	0.757	S	S	*	*			trans	-80.3	96.9	170.3	-76.3	-178.9	178.1	178.7	0	108
1134	N	29.9	Very low	28.4	Very low	159 Å²	159	151.2 Å²	151.2	85%	0.85	77%	0.769	S	S	*	*			trans	-104.7	88.9	152.4	-95.5	-4.2	0	0	0	107.7	N1132	N1132-N1134 PolarHBondContact O-N 3.34Å
1135	S	28.2	Very low	28.4	Very low	91 Å²	91	151.9 Å²	151.9	64%	0.636	77%	0.772	S	S	*	*			trans	-92.8	89	173.9	-177.3	0	0	0	0	108	N1137	S1135-N1137 PolarHBondContact O-N 3.1Å
1136	N	29.5	Very low	28.2	Very low	170 Å²	170	150.9 Å²	150.9	91%	0.909	77%	0.772	S	S	*	*			trans	-93	77.8	161.2	-96.3	0.9	0	0	0	108.4	N1138	N1136-N1138 PolarHBondContact O-N 2.88Å
1137	N	29.4	Very low	28.1	Very low	127 Å²	127	149.9 Å²	149.9	68%	0.679	77%	0.772	S	S	*	*			trans	-90.3	89.1	164.2	-83.2	-10.4	0	0	0	107.8	S1135 T1139	S1135-N1137 PolarHBondContact O-N 3.1Å; N1137-T1139 PolarHBondContact O-N 3.1Å
1138	N	29	Very low	28	Very low	159 Å²	159	148.4 Å²	148.4	85%	0.85	77%	0.773	S	S	*	*			trans	-84.7	74.2	158.4	-104.3	0.9	0	0	0	108	N1136 N1140	N1136-N1138 PolarHBondContact O-N 2.88Å; N1138-N1140 PolarHBondContact O-N 3.4Å
1139	T	28.4	Very low	28	Very low	106 Å²	106	145.8 Å²	145.8	65%	0.65	77%	0.765	S	S	*	*			trans	-81.7	90	160.8	42.8	0	0	0	0	107.4	N1137 N1141	N1137-T1139 PolarHBondContact O-N 3.1Å; T1139-N1141 PolarHBondContact O-N 3.41Å
1140	N	28.4	Very low	27.9	Very low	137 Å²	137	146.2 Å²	146.2	73%	0.733	77%	0.767	S	S	*	*			trans	-65.9	99	165.6	-96	-9.8	0	0	0	108.3	N1138 N1142	N1138-N1140 PolarHBondContact O-N 3.4Å; N1140-N1142 VanDerWaalsContact C-N 3.3Å; N1140-N1142 PolarHBondContact O-N 3.48Å
1141	N	27.3	Very low	27.6	Very low	133 Å²	133	142.4 Å²	142.4	71%	0.711	76%	0.76	S	S	*	*			trans	-64.2	89	162.8	-84.7	-20.8	0	0	0	108.9	T1139 N1143	T1139-N1141 PolarHBondContact O-N 3.41Å; N1141-N1143 PolarHBondContact O-N 3.34Å; N1141-N1143 VanDerWaalsContact O-N 3.1Å
1142	N	28.8	Very low	27.5	Very low	152 Å²	152	142.2 Å²	142.2	81%	0.813	76%	0.76	S	S	*	*			trans	-82.4	68.2	160.1	-79.2	-4.5	0	0	0	109.1	N1140	N1140-N1142 VanDerWaalsContact C-N 3.3Å; N1140-N1142 PolarHBondContact O-N 3.48Å
1143	N	25.8	Very low	27.4	Very low	131 Å²	131	145.7 Å²	145.7	70%	0.701	76%	0.763	S	S	*	*			trans	-87.4	112.2	149.9	-85	-23.5	0	0	0	105.5	N1141	N1141-N1143 PolarHBondContact O-N 3.34Å; N1141-N1143 VanDerWaalsContact O-N 3.1Å
1144	H	25.9	Very low	27.4	Very low	179 Å²	179	145 Å²	145	83%	0.829	76%	0.762	S	S	*	*			trans	163.9	105.6	146.6	-87.8	-59.2	0	0	0	108.8
1145	F	28	Very low	27.1	Very low	200 Å²	200	142.5 Å²	142.5	88%	0.877	76%	0.757	S	S	*	*				-170.7	79.1	120.8	-115.8	-87.4	0	0	0	107.4
1146	F	25.6	Very low	27.1	Very low	204 Å²	204	145.4 Å²	145.4	90%	0.895	77%	0.766	S	S	*	*			trans	-84.4	110.1	155.2	-102	-85.1	0	0	0	105.8	S1148	F1146-S1148 PolarHBondContact O-N 3.44Å
1147	D	25.1	Very low	27	Very low	126 Å²	126	144.9 Å²	144.9	67%	0.674	76%	0.762	S	S	*	*			trans	-67.1	96.7	170.3	-168.8	-7.3	0	0	0	108.7	S1149	D1147-S1149 VanDerWaalsContact C-N 3.26Å; D1147-S1149 VanDerWaalsContact CG-OG 3.3Å; D1147-S1149 PolarHBondContact O-N 3.33Å; D1147-S1149 VanDerWaalsContact O-N 3.15Å; D1147-S1149 WeakPolarHBondContact OD1-CB 3.41Å; D1147-S1149 PolarHBondContact OD1-OG 3.08Å
1148	S	28.6	Very low	26.8	Very low	116 Å²	116	147.8 Å²	147.8	81%	0.811	77%	0.772	S	S	*	*			trans	-81.2	74.7	170.1	54.9	0	0	0	0	109.1	F1146	F1146-S1148 PolarHBondContact O-N 3.44Å
1149	S	25.9	Very low	26.7	Very low	73 Å²	73	143.7 Å²	143.7	51%	0.51	77%	0.767	S	S	.	*			trans	-142	63.6	170.8	62.2	0	0	0	0	112	D1147	D1147-S1149 VanDerWaalsContact C-N 3.26Å; D1147-S1149 VanDerWaalsContact CG-OG 3.3Å; D1147-S1149 PolarHBondContact O-N 3.33Å; D1147-S1149 VanDerWaalsContact O-N 3.15Å; D1147-S1149 WeakPolarHBondContact OD1-CB 3.41Å; D1147-S1149 PolarHBondContact OD1-OG 3.08Å
1150	I	27.7	Very low	26.6	Very low	172 Å²	172	146.4 Å²	146.4	88%	0.882	78%	0.777	S	S	*	*			trans	-154.7	80.9	142.7	-79.5	127.3	0	0	0	105.8
1151	S	24.4	Very low	26.6	Very low	99 Å²	99	147.1 Å²	147.1	69%	0.692	78%	0.781	S	S	*	*			trans	-133	100.6	156.1	64.8	0	0	0	0	106
1152	N	25.9	Very low	26.7	Very low	128 Å²	128	147.8 Å²	147.8	68%	0.684	78%	0.784	S	S	*	*			trans	165.1	69.4	152.6	-84.2	-16.5	0	0	0	109.2
1153	Y	25	Very low	26.6	Very low	225 Å²	225	147.5 Å²	147.5	88%	0.882	78%	0.782	S	S	*	*			trans	-101.7	90.1	143.6	-90.4	-81.2	0	0	0	106.8	S1155	Y1153-S1155 PolarHBondContact O-N 3.2Å
1154	H	28	Very low	26.6	Very low	157 Å²	157	146.8 Å²	146.8	73%	0.727	79%	0.787	S	S	*	*			trans	-52.1	117.3	167.1	-97.2	-68.2	0	0	0	108.8	N1156	H1154-N1156 PolarHBondContact O-N 3.12Å
1155	S	24.9	Very low	26.6	Very low	107 Å²	107	148.3 Å²	148.3	75%	0.748	79%	0.786	S	S	*	*			trans	-58.8	85.9	165.4	-47.8	0	0	0	0	109.7	Y1153 N1157	Y1153-S1155 PolarHBondContact O-N 3.2Å; S1155-N1157 PolarHBondContact O-N 2.99Å
1156	N	27.5	Very low	26.6	Very low	153 Å²	153	142.5 Å²	142.5	82%	0.818	78%	0.782	S	S	*	*			trans	-75.1	78.1	161.5	-99.8	-6.5	0	0	0	108.2	H1154 Q1158	H1154-N1156 PolarHBondContact O-N 3.12Å; N1156-Q1158 VanDerWaalsContact C-N 3.27Å; N1156-Q1158 PolarHBondContact O-N 3.28Å
1157	N	26.7	Very low	26.6	Very low	158 Å²	158	141.2 Å²	141.2	85%	0.845	78%	0.779	S	S	*	*			trans	-73.4	83.5	162	-97.8	-13.5	0	0	0	108.4	S1155	S1155-N1157 PolarHBondContact O-N 2.99Å
1158	Q	26.4	Very low	26.7	Very low	189 Å²	189	140.2 Å²	140.2	88%	0.883	78%	0.782	S	S	*	*			trans	-138.1	113.4	157.9	-74.6	-158.5	-1.3	0	0	110.6	N1156	N1156-Q1158 VanDerWaalsContact C-N 3.27Å; N1156-Q1158 PolarHBondContact O-N 3.28Å
1159	G	26.6	Very low	26.6	Very low	72 Å²	72	140.6 Å²	140.6	74%	0.742	78%	0.779	S	S	*	*			trans	75.4	72.3	140.2	0	0	0	0	0	118.2
1160	L	26.4	Very low	26.7	Very low	163 Å²	163	143.8 Å²	143.8	85%	0.853	79%	0.789	S	S	*	*			trans	-131.1	61.2	146.8	-80.7	171	0	0	0	109.6
1161	N	28.5	Very low	26.5	Very low	153 Å²	153	140.9 Å²	140.9	82%	0.818	78%	0.779	S	S	*	*			trans	-81.2	138.8	149.9	-81	-24.4	0	0	0	107.3
1162	N	29.1	Very low	26.5	Very low	147 Å²	147	142.9 Å²	142.9	79%	0.786	78%	0.778	S	S	*	*			trans	86.6	70.6	175	-51.8	-23.5	0	0	0	116.5
1163	L	26.2	Very low	26.5	Very low	145 Å²	145	143.9 Å²	143.9	76%	0.759	78%	0.783	S	S	*	*			trans	-127.2	72.3	140.2	-95.3	153.6	0	0	0	108.2	R1165	L1163-R1165 PolarHBondContact O-N 3.38Å
1164	S	27.1	Very low	26.5	Very low	117 Å²	117	142.6 Å²	142.6	82%	0.818	78%	0.778	S	S	*	*			trans	-64.8	81.1	158.7	52.2	0	0	0	0	108.3
1165	R	25.4	Very low	26.3	Very low	211 Å²	211	144.9 Å²	144.9	80%	0.796	78%	0.78	S	S	*	*			trans	-100.4	95.1	170.9	-148.4	169.8	175.9	151	-2	106.9	L1163 E1167	L1163-R1165 PolarHBondContact O-N 3.38Å; R1165-E1167 PolarHBondContact O-N 2.94Å; R1165-E1167 VanDerWaalsContact O-N 3.08Å
1166	G	27.5	Very low	26.2	Very low	78 Å²	78	146.5 Å²	146.5	80%	0.804	79%	0.786	S	S	*	*			trans	-60.6	107.6	172.3	0	0	0	0	0	108.9
1167	E	26.4	Very low	26.1	Very low	177 Å²	177	145.4 Å²	145.4	83%	0.827	78%	0.776	S	S	*	*			trans	-85	121.9	163.4	-74.5	-174.3	160.1	0	0	107.9	R1165 V1169	R1165-E1167 PolarHBondContact O-N 2.94Å; R1165-E1167 VanDerWaalsContact O-N 3.08Å; E1167-V1169 PolarHBondContact O-N 3.47Å; E1167-V1169 VanDerWaalsContact O-N 3.17Å
1168	S	27.4	Very low	26	Very low	104 Å²	104	143.5 Å²	143.5	73%	0.727	78%	0.775	S	S	*	*			trans	-55.6	113.6	178.7	47.6	0	0	0	0	110.3	I1170	S1168-I1170 VanDerWaalsContact C-N 3.35Å; S1168-I1170 PolarHBondContact O-N 3.1Å
1169	V	26.2	Very low	25.9	Very low	125 Å²	125	142.4 Å²	142.4	76%	0.758	77%	0.768	S	S	*	*			trans	-62.7	97.3	165	178.4	0	0	0	0	107.4	E1167 T1171	E1167-V1169 PolarHBondContact O-N 3.47Å; E1167-V1169 VanDerWaalsContact O-N 3.17Å; V1169-T1171 VanDerWaalsContact C-N 3.35Å; V1169-T1171 HydrophobicContact CG1-CG2 4.32Å; V1169-T1171 PolarHBondContact O-N 3.11Å
1170	I	26.8	Very low	25.8	Very low	140 Å²	140	148.2 Å²	148.2	72%	0.718	78%	0.775	S	S	*	*			trans	-68.9	101.8	163.9	-60.6	176.8	0	0	0	105.5	S1168 E1172	S1168-I1170 VanDerWaalsContact C-N 3.35Å; S1168-I1170 PolarHBondContact O-N 3.1Å; I1170-E1172 VanDerWaalsContact C-N 3.34Å; I1170-E1172 HydrophobicContact CG2-CG 4.38Å; I1170-E1172 PolarHBondContact O-N 3.39Å
1171	T	24.6	Very low	25.6	Very low	111 Å²	111	147.5 Å²	147.5	68%	0.681	77%	0.768	S	S	*	*			trans	-73.9	89.2	173.7	11.9	0	0	0	0	107.3	V1169 N1173	V1169-T1171 VanDerWaalsContact C-N 3.35Å; V1169-T1171 HydrophobicContact CG1-CG2 4.32Å; V1169-T1171 PolarHBondContact O-N 3.11Å; T1171-N1173 VanDerWaalsContact C-N 3.3Å; T1171-N1173 PolarHBondContact O-N 3.41Å
1172	E	24.2	Very low	25.6	Very low	141 Å²	141	150.1 Å²	150.1	66%	0.659	77%	0.772	S	S	*	*			trans	-69.4	93.9	164.5	-77.4	-172.5	164.8	0	0	108.4	I1170 Y1174	I1170-E1172 VanDerWaalsContact C-N 3.34Å; I1170-E1172 HydrophobicContact CG2-CG 4.38Å; I1170-E1172 PolarHBondContact O-N 3.39Å; E1172-Y1174 VanDerWaalsContact C-N 3.32Å; E1172-Y1174 HydrophobicContact CB-CD2 4.49Å; E1172-Y1174 HydrophobicContact CB-CE2 4.21Å; E1172-Y1174 WeakPolarHBondContact O-CD2 3.46Å; E1172-Y1174 PolarHBondContact O-N 3.05Å
1173	N	25.8	Very low	25.4	Very low	149 Å²	149	149.4 Å²	149.4	80%	0.797	77%	0.767	S	S	*	*			trans	-62.6	94.7	165.6	-79.7	-35.9	0	0	0	108.4	T1171 R1175	T1171-N1173 VanDerWaalsContact C-N 3.3Å; T1171-N1173 PolarHBondContact O-N 3.41Å; N1173-R1175 PolarHBondContact O-N 3Å
1174	Y	24.4	Very low	25.4	Very low	197 Å²	197	149.5 Å²	149.5	77%	0.773	77%	0.768	S	S	*	*			trans	-63.3	91	163.7	-81.1	-89.9	0	0	0	108.5	E1172 T1176	E1172-Y1174 VanDerWaalsContact C-N 3.32Å; E1172-Y1174 HydrophobicContact CB-CD2 4.49Å; E1172-Y1174 HydrophobicContact CB-CE2 4.21Å; E1172-Y1174 WeakPolarHBondContact O-CD2 3.46Å; E1172-Y1174 PolarHBondContact O-N 3.05Å; Y1174-T1176 PolarHBondContact O-N 3.29Å
1175	R	24.1	Very low	25.2	Very low	205 Å²	205	155.2 Å²	155.2	77%	0.774	77%	0.772	S	S	*	*			trans	-70.6	107.1	167.6	-152.6	-179.8	-163.8	-178.6	2	106.5	N1173 E1177	N1173-R1175 PolarHBondContact O-N 3Å; R1175-E1177 PolarHBondContact O-N 2.99Å
1176	T	24.1	Very low	25.3	Very low	142 Å²	142	154.3 Å²	154.3	87%	0.871	77%	0.774	S	S	*	*			trans	-65.1	80.8	172.1	38.1	0	0	0	0	109.8	Y1174	Y1174-T1176 PolarHBondContact O-N 3.29Å
1177	E	24.8	Very low	25.2	Very low	130 Å²	130	153.6 Å²	153.6	61%	0.607	77%	0.766	S	S	*	*			trans	-87.7	111.5	163.7	-75.3	-172.7	-175.7	0	0	108.6	R1175 F1179	R1175-E1177 PolarHBondContact O-N 2.99Å; E1177-F1179 PolarHBondContact O-N 3.17Å
1178	S	23.3	Very low	25.3	Very low	118 Å²	118	154.3 Å²	154.3	83%	0.825	77%	0.769	S	S	*	*			trans	-61.4	88.4	177.2	57.1	0	0	0	0	111	Q1180	S1178-Q1180 PolarHBondContact O-N 2.87Å
1179	F	24.3	Very low	25.2	Very low	165 Å²	165	158.1 Å²	158.1	72%	0.724	78%	0.778	S	S	*	*			trans	-86.8	89.7	167.4	-107.3	-93.5	0	0	0	109.6	E1177 E1181	E1177-F1179 PolarHBondContact O-N 3.17Å; F1179-E1181 PolarHBondContact O-N 3.32Å
1180	Q	24.5	Very low	25.3	Very low	194 Å²	194	157.5 Å²	157.5	91%	0.907	78%	0.779	S	S	*	*			trans	-72.6	92.2	156.8	-86.4	-173.6	-36.6	0	0	108.1	S1178	S1178-Q1180 PolarHBondContact O-N 2.87Å
1181	E	23.8	Very low	25.2	Very low	148 Å²	148	159.9 Å²	159.9	69%	0.692	78%	0.779	S	S	*	*			trans	-131.6	117.3	160.4	-92.3	-167.9	154.2	0	0	112.3	F1179 L1183	F1179-E1181 PolarHBondContact O-N 3.32Å; E1181-L1183 PolarHBondContact O-N 2.78Å
1182	K	27.3	Very low	25.1	Very low	209 Å²	209	160.4 Å²	160.4	91%	0.909	79%	0.785	S	S	*	*			trans	-52.8	90	165.9	-72.5	168	170.8	172	0	110
1183	L	25.1	Very low	25.2	Very low	132 Å²	132	159.9 Å²	159.9	69%	0.691	78%	0.783	S	S	*	*			trans	-95.3	104.2	164.9	-131.1	79.4	0	0	0	109.6	E1181 W1185	E1181-L1183 PolarHBondContact O-N 2.78Å; L1183-W1185 PolarHBondContact O-N 3.36Å
1184	L	25.7	Very low	25.1	Very low	147 Å²	147	157.6 Å²	157.6	77%	0.77	78%	0.776	S	S	*	*			trans	-67.9	94.6	175.8	-138.9	99.3	0	0	0	108.9	K1186	L1184-K1186 HydrophobicContact CD2-CG 4.49Å; L1184-K1186 PolarHBondContact O-N 3.1Å
1185	W	24	Very low	25.1	Very low	236 Å²	236	157.4 Å²	157.4	89%	0.894	78%	0.782	S	S	*	*			trans	-69.8	91.5	174.8	-83.3	70	0	0	0	110.6	L1183 G1187	L1183-W1185 PolarHBondContact O-N 3.36Å; W1185-G1187 PolarHBondContact O-N 3.3Å
1186	K	26.3	Very low	25.2	Very low	193 Å²	193	152.3 Å²	152.3	84%	0.839	77%	0.774	S	S	*	*			trans	-89.2	77.7	161.7	-81.5	-177.4	174.4	179	0	109.1	L1184	L1184-K1186 HydrophobicContact CD2-CG 4.49Å; L1184-K1186 PolarHBondContact O-N 3.1Å
1187	G	27.2	Very low	25.2	Very low	62 Å²	62	154.3 Å²	154.3	64%	0.639	77%	0.771	S	S	*	*			trans	-107	105.3	168	0	0	0	0	0	110.1	W1185 M1189	W1185-G1187 PolarHBondContact O-N 3.3Å; G1187-M1189 PolarHBondContact O-N 3.36Å
1188	Q	28.1	Very low	25.2	Very low	192 Å²	192	153.4 Å²	153.4	90%	0.897	78%	0.778	S	S	*	*			trans	-75	105.6	171.9	-79.5	-178.9	-45.9	0	0	109.4	S1190	Q1188-S1190 PolarHBondContact O-N 3.45Å
1189	M	25.5	Very low	25.4	Very low	185 Å²	185	153.1 Å²	153.1	91%	0.911	77%	0.767	S	S	*	*			trans	-72.1	120.2	163.6	-102.6	145.5	73.1	0	0	109	G1187 R1191	G1187-M1189 PolarHBondContact O-N 3.36Å; M1189-R1191 PolarHBondContact O-N 2.9Å
1190	S	26.6	Very low	25.5	Very low	112 Å²	112	150 Å²	150	78%	0.783	77%	0.766	S	S	*	*			trans	-61.2	123	175.3	57.9	0	0	0	0	110.1	Q1188 C1192	Q1188-S1190 PolarHBondContact O-N 3.45Å; S1190-C1192 PolarHBondContact O-N 3.07Å; S1190-C1192 VanDerWaalsContact O-N 3.11Å
1191	R	25.3	Very low	25.8	Very low	190 Å²	190	143.8 Å²	143.8	72%	0.717	74%	0.739	S	S	*	*			trans	-79.6	87.1	-174.5	-161.1	180	-167	-169.1	-0.8	110.2	M1189 E1193	M1189-R1191 PolarHBondContact O-N 2.9Å; R1191-E1193 HydrophobicContact CG-CG 4.07Å; R1191-E1193 IonicContact CZ-OE1 3.95Å; R1191-E1193 IonicContact NE-OE1 2.72Å; R1191-E1193 PolarHBondContact NE-OE1 3.02Å; R1191-E1193 IonicContact NE-OE2 2.84Å; R1191-E1193 IonicContact NH2-OE1 2.64Å; R1191-E1193 PolarHBondContact NH2-OE1 3.45Å; R1191-E1193 VanDerWaalsContact NH2-OE1 3.07Å; R1191-E1193 IonicContact NH2-OE2 3.51Å
1192	C	23.6	Very low	26	Very low	121 Å²	121	141.6 Å²	141.6	82%	0.818	73%	0.731	S	S	*	*			trans	-97.7	81.2	154.4	-72.4	0	0	0	0	106.7	S1190 P1194	S1190-C1192 PolarHBondContact O-N 3.07Å; S1190-C1192 VanDerWaalsContact O-N 3.11Å; C1192-P1194 WeakPolarHBondContact O-CD 3.45Å
1193	E	24.7	Very low	26	Very low	130 Å²	130	136.1 Å²	136.1	61%	0.607	71%	0.711	S	S	*	*			trans	-79.7	102.3	166.3	-83.5	172.2	-157.4	0	0	107.1	R1191 Q1195	R1191-E1193 HydrophobicContact CG-CG 4.07Å; R1191-E1193 IonicContact CZ-OE1 3.95Å; R1191-E1193 IonicContact NE-OE1 2.72Å; R1191-E1193 PolarHBondContact NE-OE1 3.02Å; R1191-E1193 IonicContact NE-OE2 2.84Å; R1191-E1193 IonicContact NH2-OE1 2.64Å; R1191-E1193 PolarHBondContact NH2-OE1 3.45Å; R1191-E1193 VanDerWaalsContact NH2-OE1 3.07Å; R1191-E1193 IonicContact NH2-OE2 3.51Å; E1193-Q1195 PolarHBondContact O-N 2.97Å
1194	P	25.2	Very low	26.1	Very low	101 Å²	101	132 Å²	132	66%	0.656	69%	0.687	S	S	*	*			trans	-59.2	132.1	154.3	25.9	-29.1	0	0	0	105.9	C1192 V1196	C1192-P1194 WeakPolarHBondContact O-CD 3.45Å; P1194-V1196 HydrophobicContact CB-CG2 4.33Å; P1194-V1196 HydrophobicContact CG-CG2 4.13Å; P1194-V1196 PolarHBondContact O-N 3.4Å
1195	Q	23.7	Very low	26.3	Very low	193 Å²	193	126.7 Å²	126.7	90%	0.902	66%	0.659	S	S	*	*			trans	-64.5	71	172.1	-72.6	-165.1	-12	0	0	109.9	E1193 K1197	E1193-Q1195 PolarHBondContact O-N 2.97Å; Q1195-K1197 VanDerWaalsContact C-N 3.3Å; Q1195-K1197 PolarHBondContact O-N 3.38Å
1196	V	25.4	Very low	26.5	Very low	99 Å²	99	117 Å²	117	60%	0.6	63%	0.628	S	S	*	*			trans	-72.8	97.5	162.9	-176.7	0	0	0	0	103.8	P1194 C1198	P1194-V1196 HydrophobicContact CB-CG2 4.33Å; P1194-V1196 HydrophobicContact CG-CG2 4.13Å; P1194-V1196 PolarHBondContact O-N 3.4Å; V1196-C1198 PolarHBondContact O-N 2.94Å
1197	K	25.2	Very low	26.5	Very low	184 Å²	184	115.2 Å²	115.2	80%	0.8	62%	0.615	S	S	*	*			trans	-57.8	92.8	155.7	-78.5	179.4	178	174.2	0	105.5	Q1195 N1199	Q1195-K1197 VanDerWaalsContact C-N 3.3Å; Q1195-K1197 PolarHBondContact O-N 3.38Å; K1197-N1199 PolarHBondContact O-N 2.9Å
1198	C	24.2	Very low	26.5	Very low	111 Å²	111	114.5 Å²	114.5	75%	0.75	60%	0.603	S	S	*	*			trans	-58.6	96.9	168.4	-66.4	0	0	0	0	106.3	V1196 S1200	V1196-C1198 PolarHBondContact O-N 2.94Å; C1198-S1200 PolarHBondContact O-N 3.47Å; C1198-S1200 VanDerWaalsContact O-N 3.14Å
1199	N	27.4	Very low	26.4	Very low	111 Å²	111	106.7 Å²	106.7	59%	0.594	57%	0.57	S	S	*	*			trans	-60.5	115.7	161.7	-89	-18.7	0	0	0	105.3	K1197 N1201	K1197-N1199 PolarHBondContact O-N 2.9Å; N1199-N1201 PolarHBondContact O-N 3.44Å
1200	S	27.1	Very low	26.5	Very low	101 Å²	101	105.6 Å²	105.6	71%	0.706	56%	0.562	S	S	*	*	S	Bend	trans	-67.5	34.2	176	50.8	0	0	0	0	113.1	C1198	C1198-S1200 PolarHBondContact O-N 3.47Å; C1198-S1200 VanDerWaalsContact O-N 3.14Å
1201	N	29.6	Very low	26.5	Very low	63 Å²	63	103.7 Å²	103.7	34%	0.337	56%	0.56	S	S	.	*			trans	-111.1	14.1	-176.2	-68.4	-3.9	0	0	0	112.6	N1199 L1203 Y1204	N1199-N1201 PolarHBondContact O-N 3.44Å; N1201-L1203 PolarHBondContact O-N 3.01Å; N1201-L1203 VanDerWaalsContact O-N 3.12Å; N1201-Y1204 HydrophobicContact CB-CD2 4.36Å; N1201-Y1204 HydrophobicContact CB-CE2 4.14Å
1202	L	28.9	Very low	26.6	Very low	102 Å²	102	101 Å²	101	53%	0.534	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.2	94.8	168.9	-97.6	158.4	0	0	0	108.1	T411	T411-L1202 HydrophobicContact CG2-CD2 3.87Å
1203	L	27.4	Very low	26.8	Very low	93 Å²	93	98.8 Å²	98.8	49%	0.487	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	153.8	40	154.2	-78.1	164	0	0	0	112	N1201 L1205	N1201-L1203 PolarHBondContact O-N 3.01Å; N1201-L1203 VanDerWaalsContact O-N 3.12Å; L1203-L1205 HydrophobicContact CD2-CD1 3.4Å; L1203-L1205 VanDerWaalsContact CD2-CD1 3.4Å; L1203-L1205 HydrophobicContact CD2-CG 4.08Å; L1203-L1205 PolarHBondContact O-N 3.43Å
1204	Y	27.8	Very low	26.9	Very low	46 Å²	46	99.2 Å²	99.2	18%	0.18	57%	0.568	C	S	.	*			trans	-70.9	65.1	165	-92	-89.1	0	0	0	111.1	Q99 L530 N1201	Q99-Y1204 HydrophobicContact CB-CE1 3.69Å; Q99-Y1204 WeakPolarHBondContact CB-OH 3.44Å; Q99-Y1204 HydrophobicContact CG-CE1 4.3Å; Q99-Y1204 PolarHBondContact N-OH 3.01Å; Q99-Y1204 PolarHBondContact O-OH 3.34Å; L530-Y1204 HydrophobicContact CD2-CD1 4.25Å; N1201-Y1204 HydrophobicContact CB-CD2 4.36Å; N1201-Y1204 HydrophobicContact CB-CE2 4.14Å
1205	L	30.2	Very low	26.9	Very low	35 Å²	35	99.8 Å²	99.8	18%	0.183	57%	0.571	C	S	.	*			trans	-93.6	-28.6	-169.2	-75.1	-179.6	0	0	0	116.3	E352 K407 L1203 R1207	E352-L1205 WeakPolarHBondContact OE1-CB 3.35Å; E352-L1205 VanDerWaalsContact OE1-O 3.08Å; K407-L1205 HydrophobicContact CB-CD2 4.34Å; K407-L1205 HydrophobicContact CD-CD2 3.35Å; K407-L1205 HydrophobicContact CG-CD2 4.47Å; L1203-L1205 HydrophobicContact CD2-CD1 3.4Å; L1203-L1205 VanDerWaalsContact CD2-CD1 3.4Å; L1203-L1205 HydrophobicContact CD2-CG 4.08Å; L1203-L1205 PolarHBondContact O-N 3.43Å; L1205-R1207 PolarHBondContact O-N 3.26Å
1206	S	26.7	Very low	27	Very low	34 Å²	34	97.6 Å²	97.6	24%	0.238	57%	0.565	C	S	.	*	T	Hydrogen-bonded Turn	trans	-91.6	8.4	-157	-45.2	0	0	0	0	118.5	E352	E352-S1206 WeakPolarHBondContact OE1-CA 3.45Å
1207	R	26	Very low	27.2	Very low	155 Å²	155	95.8 Å²	95.8	59%	0.585	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.8	5.1	-178.3	-106.9	-174.7	177.7	139.1	3	117.5	L1205 S1209	L1205-R1207 PolarHBondContact O-N 3.26Å; R1207-S1209 PolarHBondContact O-N 3.27Å; R1207-S1209 VanDerWaalsContact O-N 3.15Å
1208	A	28.4	Very low	27.4	Very low	46 Å²	46	96.1 Å²	96.1	38%	0.38	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70	-6.1	178.4	0	0	0	0	0	114.5
1209	S	26.8	Very low	27.6	Very low	28 Å²	28	98.1 Å²	98.1	20%	0.196	57%	0.573	C	S	.	*	T	Hydrogen-bonded Turn	trans	-95.4	6.8	-176.5	56.1	0	0	0	0	116.5	R1207	R1207-S1209 PolarHBondContact O-N 3.27Å; R1207-S1209 VanDerWaalsContact O-N 3.15Å
1210	E	25.6	Very low	27.5	Very low	162 Å²	162	100 Å²	100	76%	0.757	58%	0.582	S	S	*	*			trans	-114.1	75.5	175.3	-70.3	-178.7	179	0	0	111
1211	G	27.1	Very low	27.6	Very low	72 Å²	72	104.3 Å²	104.3	74%	0.742	59%	0.591	S	S	*	*			trans	-104.7	71.7	-177.2	0	0	0	0	0	114.3
1212	T	28.1	Very low	27.8	Very low	134 Å²	134	105.2 Å²	105.2	82%	0.822	61%	0.607	S	S	*	*			trans	-134.4	57.4	151.1	52.4	0	0	0	0	109.6	I1214	T1212-I1214 PolarHBondContact O-N 3.19Å
1213	G	27.1	Very low	27.9	Very low	74 Å²	74	107.8 Å²	107.8	76%	0.763	62%	0.621	S	S	*	*			trans	-73.5	75.6	172	0	0	0	0	0	111.3	P1215	G1213-P1215 VanDerWaalsContact O-CD 3.28Å; G1213-P1215 WeakPolarHBondContact O-CD 3.44Å
1214	I	26.6	Very low	28	Very low	140 Å²	140	114.6 Å²	114.6	72%	0.718	64%	0.64	S	S	*	*			trans	-67.5	116.7	162.4	-61	174.2	0	0	0	106.3	T1212 L1216	T1212-I1214 PolarHBondContact O-N 3.19Å; I1214-L1216 PolarHBondContact O-N 3.13Å; I1214-L1216 VanDerWaalsContact O-N 3.1Å
1215	P	27	Very low	27.9	Very low	112 Å²	112	118.7 Å²	118.7	73%	0.727	68%	0.676	S	S	*	*			trans	-67.8	113.4	175.1	-9.7	25	0	0	0	107.8	G1213 G1217	G1213-P1215 VanDerWaalsContact O-CD 3.28Å; G1213-P1215 WeakPolarHBondContact O-CD 3.44Å; P1215-G1217 PolarHBondContact O-N 3.35Å
1216	L	25.5	Very low	27.8	Very low	147 Å²	147	122.7 Å²	122.7	77%	0.77	70%	0.701	S	S	*	*			trans	-69.8	49.6	172.5	-79.7	163.5	0	0	0	111.7	I1214	I1214-L1216 PolarHBondContact O-N 3.13Å; I1214-L1216 VanDerWaalsContact O-N 3.1Å
1217	G	28.9	Very low	27.8	Very low	62 Å²	62	130 Å²	130	64%	0.639	73%	0.731	S	S	*	*			trans	-89.5	1.2	-179	0	0	0	0	0	115.1	P1215	P1215-G1217 PolarHBondContact O-N 3.35Å
1218	H	29.2	Very low	27.9	Very low	191 Å²	191	129.7 Å²	129.7	88%	0.884	74%	0.74	S	S	*	*	S	Bend	trans	-122.4	14.6	-174.4	-95.5	87.5	0	0	0	115.6
1219	L	28.3	Very low	27.9	Very low	152 Å²	152	130.6 Å²	130.6	80%	0.796	75%	0.753	S	S	*	*			trans	-113.6	23.7	177.3	-103.7	144.8	0	0	0	114
1220	I	25.8	Very low	28	Very low	151 Å²	151	139.9 Å²	139.9	77%	0.774	78%	0.784	S	S	*	*			trans	-116.7	70.7	168.2	-49.7	178.7	0	0	0	108	A1222	I1220-A1222 PolarHBondContact O-N 3.22Å
1221	E	29.9	Very low	28.1	Very low	192 Å²	192	143.9 Å²	143.9	90%	0.897	79%	0.792	S	S	*	*			trans	-71.7	101.7	151.7	-85.8	-174.4	159.7	0	0	107	N1223	E1221-N1223 VanDerWaalsContact C-N 3.33Å; E1221-N1223 PolarHBondContact O-N 2.95Å
1222	A	31.9	Very low	28.3	Very low	81 Å²	81	147.9 Å²	147.9	67%	0.669	79%	0.791	S	S	*	*			trans	-63.9	93.4	169.8	0	0	0	0	0	108.8	I1220	I1220-A1222 PolarHBondContact O-N 3.22Å
1223	N	31.4	Very low	28.4	Very low	156 Å²	156	146.5 Å²	146.5	83%	0.834	79%	0.787	S	S	*	*			trans	177.2	86.4	150.8	-89.4	-27.6	0	0	0	111.1	E1221	E1221-N1223 VanDerWaalsContact C-N 3.33Å; E1221-N1223 PolarHBondContact O-N 2.95Å
1224	R	29.3	Very low	28.6	Very low	237 Å²	237	149.8 Å²	149.8	89%	0.894	78%	0.783	S	S	*	*			trans	175.1	109	137.3	-97.7	169	-167.5	-141.3	4.9	108.6	V1226	R1224-V1226 VanDerWaalsContact C-N 3.35Å; R1224-V1226 PolarHBondContact O-N 3.48Å
1225	S	27.2	Very low	28.9	Very low	131 Å²	131	149.4 Å²	149.4	92%	0.916	79%	0.787	S	S	*	*			trans	-62.2	90.8	172.9	-45.9	0	0	0	0	109.9	H1227	S1225-H1227 PolarHBondContact O-N 3.46Å
1226	V	28.1	Very low	29.2	Very low	119 Å²	119	151.3 Å²	151.3	72%	0.721	78%	0.784	S	S	*	*			trans	-78.4	111.6	167.5	-179.8	0	0	0	0	107.3	R1224 I1228	R1224-V1226 VanDerWaalsContact C-N 3.35Å; R1224-V1226 PolarHBondContact O-N 3.48Å; V1226-I1228 VanDerWaalsContact C-N 3.34Å; V1226-I1228 HydrophobicContact CG1-CG1 4.49Å; V1226-I1228 PolarHBondContact O-N 2.98Å
1227	H	26.3	Very low	29.4	Very low	188 Å²	188	152.2 Å²	152.2	87%	0.87	79%	0.789	S	S	*	*			trans	-70.9	86.7	-179.2	-145.4	-36.9	0	0	0	109.3	S1225 G1229	S1225-H1227 PolarHBondContact O-N 3.46Å; H1227-G1229 PolarHBondContact O-N 3.26Å; H1227-G1229 VanDerWaalsContact O-N 3.13Å
1228	I	28.2	Very low	29.5	Very low	149 Å²	149	156.6 Å²	156.6	76%	0.764	80%	0.796	S	S	*	*			trans	-72.7	106.4	172.5	-62.6	172.8	0	0	0	107.5	V1226 R1230	V1226-I1228 VanDerWaalsContact C-N 3.34Å; V1226-I1228 HydrophobicContact CG1-CG1 4.49Å; V1226-I1228 PolarHBondContact O-N 2.98Å; I1228-R1230 PolarHBondContact O-N 3.1Å
1229	G	28.8	Very low	29.8	Very low	64 Å²	64	152.7 Å²	152.7	66%	0.66	79%	0.788	S	S	*	*			trans	-57.6	117.4	176.9	0	0	0	0	0	111.3	H1227 R1231	H1227-G1229 PolarHBondContact O-N 3.26Å; H1227-G1229 VanDerWaalsContact O-N 3.13Å; G1229-R1231 PolarHBondContact O-N 3.24Å
1230	R	28	Very low	30	Very low	223 Å²	223	158.1 Å²	158.1	84%	0.842	81%	0.809	S	S	*	*			trans	-68	109.7	174.5	-153	-179.5	-164.8	-178.1	4	107.9	I1228 E1232	I1228-R1230 PolarHBondContact O-N 3.1Å; R1230-E1232 VanDerWaalsContact C-N 3.34Å; R1230-E1232 PolarHBondContact O-N 3.2Å
1231	R	26.8	Very low	30.3	Very low	247 Å²	247	158.5 Å²	158.5	93%	0.932	81%	0.811	S	S	*	*			trans	-66.6	95.8	165.2	-92.1	-177.2	173.9	171.9	-1	107.8	G1229 S1233	G1229-R1231 PolarHBondContact O-N 3.24Å; R1231-S1233 VanDerWaalsContact C-N 3.32Å; R1231-S1233 PolarHBondContact O-N 3.34Å; R1231-S1233 VanDerWaalsContact O-N 3.09Å
1232	E	31.2	Very low	30.3	Very low	155 Å²	155	156.7 Å²	156.7	72%	0.724	81%	0.806	S	S	*	*			trans	-72.3	91.8	163	-69.6	-176.6	169	0	0	107.4	R1230 E1234	R1230-E1232 VanDerWaalsContact C-N 3.34Å; R1230-E1232 PolarHBondContact O-N 3.2Å; E1232-E1234 VanDerWaalsContact C-N 3.27Å; E1232-E1234 PolarHBondContact O-N 3.37Å
1233	S	32	Very low	30.2	Very low	105 Å²	105	160.9 Å²	160.9	73%	0.734	81%	0.814	S	S	*	*			trans	-70.6	91	166.1	52	0	0	0	0	107.9	R1231 T1235	R1231-S1233 VanDerWaalsContact C-N 3.32Å; R1231-S1233 PolarHBondContact O-N 3.34Å; R1231-S1233 VanDerWaalsContact O-N 3.09Å; S1233-T1235 PolarHBondContact O-N 3.36Å
1234	E	30.5	Very low	30.1	Very low	144 Å²	144	161.2 Å²	161.2	67%	0.673	81%	0.812	S	S	*	*			trans	-53.3	101.8	165.4	-72.6	-171.8	157.8	0	0	109.2	E1232 K1236	E1232-E1234 VanDerWaalsContact C-N 3.27Å; E1232-E1234 PolarHBondContact O-N 3.37Å; E1234-K1236 PolarHBondContact O-N 3.38Å; E1234-K1236 IonicContact OE2-NZ 2.96Å; E1234-K1236 PolarHBondContact OE2-NZ 3.38Å
1235	T	32.9	Very low	30.2	Very low	131 Å²	131	156.4 Å²	156.4	80%	0.804	81%	0.807	S	S	*	*			trans	-74.4	78.9	162.9	15.8	0	0	0	0	107.5	S1233 L1237	S1233-T1235 PolarHBondContact O-N 3.36Å; T1235-L1237 PolarHBondContact O-N 3.31Å
1236	K	32.6	Very low	30.3	Very low	152 Å²	152	158.1 Å²	158.1	66%	0.661	80%	0.8	S	S	*	*			trans	-71.6	87.1	162.5	-84.6	176.3	174.1	129.5	0	108.2	E1234 L1238	E1234-K1236 PolarHBondContact O-N 3.38Å; E1234-K1236 IonicContact OE2-NZ 2.96Å; E1234-K1236 PolarHBondContact OE2-NZ 3.38Å; K1236-L1238 PolarHBondContact O-N 2.89Å
1237	L	31.2	Very low	30.5	Very low	167 Å²	167	160.9 Å²	160.9	87%	0.874	81%	0.806	S	S	*	*			trans	-63.5	109	154.7	-83	155.5	0	0	0	107.3	T1235	T1235-L1237 PolarHBondContact O-N 3.31Å
1238	L	30.7	Very low	30.8	Very low	153 Å²	153	158.8 Å²	158.8	80%	0.801	80%	0.801	S	S	*	*			trans	-108.1	126	163.7	-89.9	162.6	0	0	0	107.5	K1236	K1236-L1238 PolarHBondContact O-N 2.89Å
1239	P	34.8	Very low	31.1	Very low	110 Å²	110	159.7 Å²	159.7	71%	0.714	80%	0.804	S	S	*	*			trans	-88.3	119.2	-178.5	33.3	-29.1	0	0	0	110.7
1240	H	33.3	Very low	31.3	Very low	265 Å²	265	168.4 Å²	168.4	100%	1.227	82%	0.817	S	S	*	*			trans	-174.6	0	143.9	-98.9	-59.6	0	0	0	106.4

Retrieved 1,240 of 1,240 residues in 1871.8 ms (Link to these results)

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