A0A5K4FA05_SCHMA Loading...

Phospholipid-transporting ATPase

AlphaFold DB , UniProt , Accession A0A5K4FA05, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,366 aa.

						>A0A5K4FA05_SCHMA|A0A5K4FA05
MDHHNEKPVNSSKTTNTDQSPSSSSSSLSRTVYAHRIQNYSPLTYTSIKEYCNNEIKTSIYTIWNFLPKIIYEQLHYMSNIFFILVAIIHLFADGATSIFAIIGPFSFVLLVTMIKDIIYDLLRYYQDKQINEKKFFIMKINIETNEIYWILKKSKFIHVGDIILCKNNEEFPSDLIILSTSNLNNKCYITTVNIDGENTIKTHYCLLDTHNIYKKFLNENIIYNYNNNQYNNNNNNQFIDLLIKVNYQQPNEDFNNFEGYITILINNKKLLINNNNILYKGCKLKNTKYIIGLVIYTGNDTKLLLNSNKVKRKYTTRESKANQILFIFMIFMIIFCIIFAMVTKYWSFYHLNHIYIPFENLNSIWLQIKNVFRFLFILNYLIPISLIITTEIQQIMLSYFIRNDLNLYDFKQDLNTKSNTPQLVDELGQVNYLFSDKTGTLTLNEMNLYKIAILNIDKVYVLSDQKLQNTNDDNHYDDDHDHDHEKKDKKKREKDTNQSNRLKQILRRTNKFGHIGVVYEELNEYQNQYNQDNYGFISSSDSEFDEEDNNEQVSHLVLNKIYKSNETITSSNENLNNLSNNDNNNNQLPNELIISLTTLALCHTVEVSEDNEEKQNGTDETMCLDSFYQATSPDEKALVIGAAKLGIQFMGKLLNENNSHSRIYRLEYDQFLQNGSDQSEIMEYSIDAVLEFDSVRKRMSIMAKHPDGTYHIHSKGAESSIFEISNLSTGDLKQLASKYVTQFAINGLRTLVYASRQVDSKEYYQLLDEFYHANSLFGSERNDALKKIYSKIEYNLTLVSITGVEDKLQPGVHECLKNLRDAGIQVWVLTGDKEETAITVSRSAGHFTPNMNLVHLTNCKDFSNFAYKLFNYLENLKNFREKKRNLKKKMKQFFEKSINVIEMKTNNRIKIDFNYQNDFVDEKYLYNNNHNNNNKQLFISRSYKNVEDRPRYRHSKRPGSSGEPMALVIDGKSLRYALDPTLRKTFLNLCLHLTTVLCCRLTPLQKASVVQLVRSGFSEFGVTPITAAIGDGGNDVAMLLQANIGIGVYGKEGKEAVRASDYAIPQFKHLQRLLLVHGHQANYRICITMNLFYYKCVTFVTTQVLYTFYSGFSAVSTFETVLFSIYNLTVTSLMCMLFGIFERHLPDDILNANPYLYRRLKHQANLRSWYVCLWILDGIWHGTIIFYGATYFFTGGYYFSEGTFYDPRGNIQQLFDMSLYGCATYLFVWFSVSLRIFIASHDYTIVVFGGILTTLTVNIAILIALQSTTTLNNINFRSYTKLCRCPTFWFALPLILTIANLPSLLWRIISDAWWNLQIHLSSIPNKQIRRKYRRSPMVWFLALTTNYLTDSYDIFHRSEIRQDSS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.2	Very low	33.1	Very low	230 Å²	230	147.2 Å²	147.2	100%	1.133	77%	0.765	S	S	*	*				0	98.2	0	-65.3	-167.6	176.1	0	0	107.1
2	D	31.5	Very low	33.1	Very low	136 Å²	136	144 Å²	144	73%	0.727	76%	0.764	S	S	*	*			cis	-153.1	161.1	-2.3	-83.3	-34.4	0	0	0	108.4
3	H	35.1	Very low	32.7	Very low	162 Å²	162	147.8 Å²	147.8	75%	0.75	77%	0.77	S	S	*	*			trans	75.1	137.8	170.4	-57.2	-54.7	0	0	0	117.4
4	H	36.6	Very low	32.6	Very low	140 Å²	140	146.5 Å²	146.5	65%	0.648	77%	0.772	S	S	*	*			cis	-169.9	149.1	-15.1	-118	-47	0	0	0	105.9
5	N	35	Very low	32.4	Very low	122 Å²	122	144.5 Å²	144.5	65%	0.652	77%	0.768	S	S	*	*			trans	40.9	130.4	137.5	-60.2	5.2	0	0	0	119.4
6	E	35.7	Very low	32.3	Very low	181 Å²	181	144.4 Å²	144.4	85%	0.846	77%	0.768	S	S	*	*			cis	-165.1	143.7	45.7	-119.3	148.1	-140.7	0	0	111.9
7	K	31.8	Very low	32.1	Very low	184 Å²	184	142.7 Å²	142.7	80%	0.8	76%	0.764	S	S	*	*			trans	-72.8	-164.9	163.1	-81.8	179.8	175.3	177	0	109.9
8	P	34.5	Very low	31.9	Very low	110 Å²	110	142.9 Å²	142.9	71%	0.714	77%	0.766	S	S	*	*			cis	-133.6	156.4	-6.4	8.5	20.4	0	0	0	114
9	V	31.2	Very low	31.8	Very low	110 Å²	110	145.8 Å²	145.8	67%	0.667	77%	0.774	S	S	*	*				66.8	120.1	81	-178.3	0	0	0	0	115.5
10	N	30.1	Very low	31.6	Very low	142 Å²	142	143.3 Å²	143.3	76%	0.759	77%	0.768	S	S	*	*			trans	119.5	110.5	141	-83.8	-11.8	0	0	0	121.6
11	S	28.9	Very low	31.5	Very low	102 Å²	102	143 Å²	143	71%	0.713	77%	0.774	S	S	*	*				92.7	144	113.9	74.5	0	0	0	0	122.4
12	S	32.3	Very low	31.3	Very low	109 Å²	109	136.2 Å²	136.2	76%	0.762	75%	0.749	S	S	*	*			trans	78.9	103.6	170.7	69.9	0	0	0	0	116
13	K	28.4	Very low	31.1	Very low	194 Å²	194	135.4 Å²	135.4	84%	0.843	75%	0.754	S	S	*	*				42	105.5	73.5	-77.6	-171.9	179.5	179.5	0	112.9
14	T	31.9	Very low	30.8	Very low	129 Å²	129	132.2 Å²	132.2	79%	0.791	75%	0.751	S	S	*	*				171.1	124.5	106.9	36.9	0	0	0	0	111.5
15	T	29	Very low	30.5	Very low	116 Å²	116	131.6 Å²	131.6	71%	0.712	76%	0.762	S	S	*	*			trans	14.4	120	142.3	53.6	0	0	0	0	119
16	N	31.3	Very low	30.6	Very low	143 Å²	143	131.2 Å²	131.2	77%	0.765	77%	0.769	S	S	*	*				175.2	122.5	117.5	-85.1	-14.6	0	0	0	112.1
17	T	29	Very low	31	Very low	116 Å²	116	127.8 Å²	127.8	71%	0.712	77%	0.765	S	S	*	*			trans	45.8	122	139.5	58.2	0	0	0	0	121.2
18	D	27.5	Very low	32.3	Very low	147 Å²	147	126 Å²	126	79%	0.786	76%	0.763	S	S	*	*			trans	60.9	93.6	144.7	-57.3	-23.5	0	0	0	118.9
19	Q	30.2	Very low	34.1	Very low	198 Å²	198	124.5 Å²	124.5	93%	0.925	76%	0.756	S	S	*	*			trans	-164.9	133.2	141.6	-103.8	157.7	35.5	0	0	110.4
20	S	27.5	Very low	36.6	Very low	94 Å²	94	121 Å²	121	66%	0.657	73%	0.73	S	S	*	*			trans	-36.1	142.9	174.2	48.3	0	0	0	0	115.6	S22	S20-S22 VanDerWaalsContact C-N 3.33Å; S20-S22 PolarHBondContact O-N 3.14Å
21	P	30.7	Very low	39.2	Very low	137 Å²	137	116.7 Å²	116.7	89%	0.89	71%	0.709	S	S	*	*			trans	-73.5	92.2	168.2	30.9	-29	0	0	0	108.6	S23	P21-S23 PolarHBondContact O-N 3.19Å
22	S	28.2	Very low	42	Very low	88 Å²	88	112 Å²	112	62%	0.615	68%	0.676	S	S	*	*			trans	-64.1	123.1	171.2	51.5	0	0	0	0	110.5	S20 S24	S20-S22 VanDerWaalsContact C-N 3.33Å; S20-S22 PolarHBondContact O-N 3.14Å; S22-S24 PolarHBondContact O-N 3.06Å; S22-S24 VanDerWaalsContact O-N 3.11Å
23	S	27.9	Very low	44.5	Very low	119 Å²	119	108 Å²	108	83%	0.832	65%	0.645	S	S	*	*			trans	-51.4	95.7	159.9	49.5	0	0	0	0	112.3	P21	P21-S23 PolarHBondContact O-N 3.19Å
24	S	28.9	Very low	47.2	Very low	96 Å²	96	98.9 Å²	98.9	67%	0.671	61%	0.605	S	S	*	*			trans	-154.3	38.7	176.7	66.1	0	0	0	0	115	S22	S22-S24 PolarHBondContact O-N 3.06Å; S22-S24 VanDerWaalsContact O-N 3.11Å
25	S	31.2	Very low	49.5	Very low	126 Å²	126	93.6 Å²	93.6	88%	0.881	57%	0.571	S	S	*	*	S	Bend	trans	-127.7	16.3	174.7	67.8	0	0	0	0	114.7
26	S	36	Very low	51.8	Low	115 Å²	115	89.6 Å²	89.6	80%	0.804	54%	0.543	S	S	*	.			trans	-114.5	16.6	-168.5	59.1	0	0	0	0	116.4
27	S	45.1	Very low	54	Low	109 Å²	109	83.3 Å²	83.3	76%	0.762	51%	0.509	S	S	*	.			trans	-127.1	42.7	-163.4	67.2	0	0	0	0	117.3
28	L	58.4	Low	56	Low	146 Å²	146	81.6 Å²	81.6	76%	0.764	49%	0.493	S	S	*	.			trans	-99.8	104.9	165.6	-100.5	107.6	0	0	0	110.7	Q250	L28-Q250 WeakPolarHBondContact O-CG 3.49Å; L28-Q250 PolarHBondContact O-NE2 3.34Å
29	S	73.4	Confident	57.8	Low	79 Å²	79	78.5 Å²	78.5	55%	0.552	48%	0.477	S	S	*	.			trans	-68.7	149.5	173.8	56.5	0	0	0	0	112.7
30	R	82.6	Confident	59.3	Low	37 Å²	37	74.5 Å²	74.5	14%	0.14	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	148.9	168.9	-68.7	-171.9	178	-167.5	4	110.7	N247 Y248 Q250 P251 D301	R30-N247 WeakPolarHBondContact O-CA 3.44Å; R30-Y248 HydrophobicContact CB-CD2 4.32Å; R30-Y248 HydrophobicContact CB-CE1 4.02Å; R30-Y248 HydrophobicContact CB-CE2 3.84Å; R30-Y248 PolarHBondContact N-O 3.48Å; R30-Y248 PolarHBondContact O-N 2.93Å; R30-Q250 HydrophobicContact CG-CG 4.5Å; R30-P251 VanDerWaalsContact CZ-CD 3.47Å; R30-D301 IonicContact CZ-OD2 2.73Å; R30-D301 IonicContact NH1-OD2 3.92Å; R30-D301 PolarHBondContact NH1-OD2 3.05Å; R30-D301 IonicContact NH2-OD1 3.79Å; R30-D301 PolarHBondContact NH2-OD1 3.45Å; R30-D301 IonicContact NH2-OD2 3.42Å; R30-D301 PolarHBondContact NH2-OD2 2.71Å
31	T	84.2	Confident	60.9	Low	50 Å²	50	75 Å²	75	31%	0.307	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	125.5	179.8	63.8	0	0	0	0	111	Y51 V246 N247	T31-Y51 PolarHBondContact O-OH 3.45Å; T31-V246 CarbonylContact C-O 3.55Å; T31-V246 WeakPolarHBondContact CA-O 3.3Å; T31-N247 WeakPolarHBondContact CB-OD1 2.99Å; T31-N247 WeakPolarHBondContact CG2-OD1 3.45Å
32	V	87.4	Confident	62.3	Low	4 Å²	4	73 Å²	73	2%	0.024	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	143.2	-178.4	169.3	0	0	0	0	110.7	Y51 V160 V246 Y248	V32-Y51 HydrophobicContact CG2-CE2 4.47Å; V32-V160 HydrophobicContact CB-CG1 4.17Å; V32-V160 HydrophobicContact CG1-CG1 3.83Å; V32-V160 HydrophobicContact CG2-CG1 3.19Å; V32-V246 PolarHBondContact N-O 3.4Å; V32-V246 PolarHBondContact O-N 3.4Å; V32-Y248 HydrophobicContact CB-CE1 3.86Å; V32-Y248 HydrophobicContact CG2-CE1 3.49Å; V32-Y248 VanDerWaalsContact CG2-CE1 3.49Å; V32-Y248 WeakPolarHBondContact CG2-OH 3.49Å
33	Y	85.8	Confident	63.9	Low	26 Å²	26	72.2 Å²	72.2	10%	0.102	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128.7	177.3	-65.2	-96.2	0	0	0	109.3	R36 I37 Q38 T46 K245	Y33-R36 WeakPolarHBondContact O-CA 3.44Å; Y33-R36 PolarHBondContact O-N 3.4Å; Y33-I37 WeakPolarHBondContact CB-O 3.31Å; Y33-Q38 HydrophobicContact CE1-CG 4.14Å; Y33-Q38 HydrophobicContact CE2-CG 4.07Å; Y33-T46 HydrophobicContact CD2-CG2 3.56Å; Y33-T46 HydrophobicContact CE2-CG2 4.32Å; Y33-T46 HydrophobicContact CG-CG2 4.25Å; Y33-K245 HydrophobicContact CD1-CB 4.23Å; Y33-K245 HydrophobicContact CD1-CG 4.32Å; Y33-K245 HydrophobicContact CE1-CB 4.15Å; Y33-K245 HydrophobicContact CE1-CD 3.88Å; Y33-K245 HydrophobicContact CE1-CG 3.93Å
34	A	84	Confident	65.6	Low	1 Å²	1	68.7 Å²	68.7	1%	0.008	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-58.9	139.8	174.9	0	0	0	0	0	110.5	R36 I37 I163 I244 L294	A34-R36 PolarHBondContact O-N 3.25Å; A34-I37 PolarHBondContact O-N 3.25Å; A34-I163 HydrophobicContact CB-CD1 4.36Å; A34-I244 HydrophobicContact CB-CB 4.04Å; A34-I244 PolarHBondContact N-O 2.8Å; A34-L294 HydrophobicContact CB-CD1 4.11Å
35	H	81.7	Confident	67.3	Low	19 Å²	19	70.6 Å²	70.6	9%	0.088	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	59.7	8.6	-173	-52.1	94.2	0	0	0	115	I37 M139 I141 G161 I163	H35-I37 HydrophobicContact CB-CD1 4.06Å; H35-I37 HydrophobicContact CB-CG1 4.24Å; H35-I37 PolarHBondContact O-N 2.68Å; H35-M139 WeakPolarHBondContact NE2-CE 3.4Å; H35-I141 HydrophobicContact CB-CD1 4.34Å; H35-G161 PolarHBondContact N-O 2.7Å; H35-I163 WeakPolarHBondContact CE1-CD1 3.43Å
36	R	77.8	Confident	68.9	Low	32 Å²	32	65.5 Å²	65.5	12%	0.121	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	64.7	18.4	-176.2	-60.9	176.1	-92.7	171.4	-15.8	114.6	Y33 A34 Y45 T46 D162	Y33-R36 WeakPolarHBondContact O-CA 3.44Å; Y33-R36 PolarHBondContact O-N 3.4Å; A34-R36 PolarHBondContact O-N 3.25Å; R36-Y45 VanDerWaalsContact O-CA 3.22Å; R36-Y45 WeakPolarHBondContact O-CA 3.12Å; R36-Y45 WeakPolarHBondContact O-CD1 3.49Å; R36-T46 WeakPolarHBondContact CB-OG1 3.4Å; R36-T46 PolarHBondContact O-N 3.06Å; R36-D162 IonicContact CZ-OD1 3.72Å; R36-D162 VanDerWaalsContact CZ-OD1 3.27Å; R36-D162 IonicContact NE-OD1 3.74Å; R36-D162 PolarHBondContact NE-OD1 3.15Å; R36-D162 IonicContact NH2-OD1 2.9Å; R36-D162 PolarHBondContact NH2-OD1 3.14Å; R36-D162 IonicContact NH2-OD2 3.87Å; R36-D162 PolarHBondContact NH2-OD2 3.48Å
37	I	75.6	Confident	70.2	Confident	11 Å²	11	62.7 Å²	62.7	6%	0.056	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	109.8	-179.8	-59.3	169.8	0	0	0	108.9	Y33 A34 H35 L43 Y45 I143 L243	Y33-I37 WeakPolarHBondContact CB-O 3.31Å; A34-I37 PolarHBondContact O-N 3.25Å; H35-I37 HydrophobicContact CB-CD1 4.06Å; H35-I37 HydrophobicContact CB-CG1 4.24Å; H35-I37 PolarHBondContact O-N 2.68Å; I37-L43 HydrophobicContact CG2-CD1 4.09Å; I37-Y45 HydrophobicContact CG1-CD1 4.34Å; I37-Y45 HydrophobicContact CG1-CE1 3.96Å; I37-I143 HydrophobicContact CD1-CD1 4.41Å; I37-L243 HydrophobicContact CB-CD2 3.94Å; I37-L243 HydrophobicContact CD1-CD2 4.05Å; I37-L243 HydrophobicContact CG2-CD2 4.07Å
38	Q	72	Confident	71	Confident	79 Å²	79	61.6 Å²	61.6	37%	0.369	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-53.3	-178.5	-179.9	175.3	6.6	0	0	111.9	Y33 T44 T46	Y33-Q38 HydrophobicContact CE1-CG 4.14Å; Y33-Q38 HydrophobicContact CE2-CG 4.07Å; Q38-T44 WeakPolarHBondContact CB-O 3.42Å; Q38-T44 PolarHBondContact N-O 3.38Å; Q38-T46 HydrophobicContact CB-CG2 4.41Å
39	N	64.6	Low	71.1	Confident	83 Å²	83	64.5 Å²	64.5	44%	0.444	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	144.4	170.1	-62.1	-29	0	0	0	109	P42 L43 T44	N39-P42 CarbonylContact C-O 3.5Å; N39-P42 WeakPolarHBondContact CB-O 3.41Å; N39-P42 VanDerWaalsContact O-O 3.13Å; N39-L43 VanDerWaalsContact O-CA 3.29Å; N39-L43 WeakPolarHBondContact O-CA 3.48Å; N39-T44 VanDerWaalsContact CB-OG1 3.29Å; N39-T44 WeakPolarHBondContact CB-OG1 3.17Å; N39-T44 PolarHBondContact N-OG1 3.42Å; N39-T44 PolarHBondContact O-N 3.47Å
40	Y	62.8	Low	71	Confident	113 Å²	113	66.6 Å²	66.6	44%	0.443	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	-29.9	175.3	-173.7	-103.7	0	0	0	112	L43	Y40-L43 PolarHBondContact O-N 3.13Å
41	S	61.4	Low	71	Confident	104 Å²	104	66.6 Å²	66.6	73%	0.727	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.8	103.7	178.9	47.5	0	0	0	0	111.2
42	P	59.5	Low	71	Confident	96 Å²	96	66.1 Å²	66.1	62%	0.623	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	cis	-69.9	147.3	-5	30.3	-34.5	0	0	0	111.9	N39 T44	N39-P42 CarbonylContact C-O 3.5Å; N39-P42 WeakPolarHBondContact CB-O 3.41Å; N39-P42 VanDerWaalsContact O-O 3.13Å; P42-T44 PolarHBondContact O-N 3.49Å
43	L	62	Low	71.1	Confident	71 Å²	71	70.4 Å²	70.4	37%	0.372	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	110.2	177.8	-168.6	79.5	0	0	0	109.8	I37 N39 Y40 Y45 I143	I37-L43 HydrophobicContact CG2-CD1 4.09Å; N39-L43 VanDerWaalsContact O-CA 3.29Å; N39-L43 WeakPolarHBondContact O-CA 3.48Å; Y40-L43 PolarHBondContact O-N 3.13Å; L43-Y45 HydrophobicContact CD2-CE2 3.56Å; L43-Y45 HydrophobicContact CG-CE2 4.09Å; L43-I143 HydrophobicContact CD1-CD1 3.69Å; L43-I143 HydrophobicContact CD2-CD1 3.52Å; L43-I143 HydrophobicContact CG-CD1 4.22Å
44	T	62.6	Low	71.3	Confident	45 Å²	45	69.2 Å²	69.2	28%	0.276	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	130.8	179.3	44.1	0	0	0	0	109.3	Q38 N39 P42	Q38-T44 WeakPolarHBondContact CB-O 3.42Å; Q38-T44 PolarHBondContact N-O 3.38Å; N39-T44 VanDerWaalsContact CB-OG1 3.29Å; N39-T44 WeakPolarHBondContact CB-OG1 3.17Å; N39-T44 PolarHBondContact N-OG1 3.42Å; N39-T44 PolarHBondContact O-N 3.47Å; P42-T44 PolarHBondContact O-N 3.49Å
45	Y	65.1	Low	71.4	Confident	136 Å²	136	72.4 Å²	72.4	53%	0.533	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	143	176.8	-68.6	-80.9	0	0	0	110.8	R36 I37 L43 I143	R36-Y45 VanDerWaalsContact O-CA 3.22Å; R36-Y45 WeakPolarHBondContact O-CA 3.12Å; R36-Y45 WeakPolarHBondContact O-CD1 3.49Å; I37-Y45 HydrophobicContact CG1-CD1 4.34Å; I37-Y45 HydrophobicContact CG1-CE1 3.96Å; L43-Y45 HydrophobicContact CD2-CE2 3.56Å; L43-Y45 HydrophobicContact CG-CE2 4.09Å; Y45-I143 WeakPolarHBondContact OH-CD1 3.45Å
46	T	65.4	Low	71.5	Confident	20 Å²	20	72.5 Å²	72.5	12%	0.123	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-66.2	136.7	169.8	54.1	0	0	0	0	110.5	Y33 R36 Q38 I48	Y33-T46 HydrophobicContact CD2-CG2 3.56Å; Y33-T46 HydrophobicContact CE2-CG2 4.32Å; Y33-T46 HydrophobicContact CG-CG2 4.25Å; R36-T46 WeakPolarHBondContact CB-OG1 3.4Å; R36-T46 PolarHBondContact O-N 3.06Å; Q38-T46 HydrophobicContact CB-CG2 4.41Å; T46-I48 PolarHBondContact O-N 3.49Å
47	S	63.1	Low	71.4	Confident	56 Å²	56	77.4 Å²	77.4	39%	0.392	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-68.9	131.8	-178.8	86.1	0	0	0	0	110.9	K49 E50	S47-K49 PolarHBondContact O-N 3.45Å; S47-E50 PolarHBondContact O-N 2.99Å; S47-E50 WeakPolarHBondContact OG-CG 3.47Å; S47-E50 PolarHBondContact OG-OE1 3.36Å
48	I	61.1	Low	71.3	Confident	85 Å²	85	79.5 Å²	79.5	44%	0.436	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-64.4	-25.1	-179	-61.5	171.6	0	0	0	111.3	T46 E50 H159	T46-I48 PolarHBondContact O-N 3.49Å; I48-E50 VanDerWaalsContact C-N 3.27Å; I48-E50 PolarHBondContact O-N 3.37Å; I48-H159 VanDerWaalsContact CG2-CD2 3.44Å; I48-H159 WeakPolarHBondContact CG2-CD2 3.22Å
49	K	62	Low	71.5	Confident	207 Å²	207	77.2 Å²	77.2	90%	0.9	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-75	-10.1	-174	-69.6	-174.2	178.8	179.6	0	114.4	S47 Y51	S47-K49 PolarHBondContact O-N 3.45Å; K49-Y51 VanDerWaalsContact C-N 3.29Å; K49-Y51 PolarHBondContact O-N 3.2Å
50	E	70	Confident	72	Confident	123 Å²	123	75 Å²	75	58%	0.575	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-72.2	-21.9	178.7	-81	161.9	-136.1	0	0	113.4	S47 I48	S47-E50 PolarHBondContact O-N 2.99Å; S47-E50 WeakPolarHBondContact OG-CG 3.47Å; S47-E50 PolarHBondContact OG-OE1 3.36Å; I48-E50 VanDerWaalsContact C-N 3.27Å; I48-E50 PolarHBondContact O-N 3.37Å
51	Y	83.1	Confident	73	Confident	38 Å²	38	70 Å²	70	15%	0.149	37%	0.365	C	S	.	.	S	Bend	trans	-121.7	155.3	-174.2	-57.8	-69.8	0	0	0	112	T31 V32 K49 V160	T31-Y51 PolarHBondContact O-OH 3.45Å; V32-Y51 HydrophobicContact CG2-CE2 4.47Å; K49-Y51 VanDerWaalsContact C-N 3.29Å; K49-Y51 PolarHBondContact O-N 3.2Å; Y51-V160 HydrophobicContact CD1-CG1 4.47Å; Y51-V160 HydrophobicContact CD1-CG2 4.18Å; Y51-V160 HydrophobicContact CD2-CB 3.89Å; Y51-V160 HydrophobicContact CD2-CG1 4.17Å; Y51-V160 HydrophobicContact CD2-CG2 4.26Å; Y51-V160 HydrophobicContact CE2-CB 4.42Å; Y51-V160 HydrophobicContact CE2-CG1 4.24Å; Y51-V160 HydrophobicContact CG-CB 3.93Å; Y51-V160 HydrophobicContact CG-CG1 4.29Å; Y51-V160 HydrophobicContact CG-CG2 3.78Å
52	C	84.5	Confident	74	Confident	39 Å²	39	68.5 Å²	68.5	26%	0.264	35%	0.351	S	S	.	.			trans	-75.9	148.2	178.5	67	0	0	0	0	112.4	T298 D301	C52-T298 PolarHBondContact O-OG1 3.13Å; C52-T298 PolarHBondContact SG-O 3.27Å; C52-D301 PolarHBondContact SG-OD2 2.77Å
53	N	88.2	Confident	75.2	Confident	94 Å²	94	71.6 Å²	71.6	50%	0.503	36%	0.361	S	S	.	.			trans	-68	150.6	178.6	-67.2	-18.1	0	0	0	111.6	E55 G299	N53-E55 PolarHBondContact O-N 3.38Å; N53-E55 VanDerWaalsContact O-N 3.13Å; N53-G299 VanDerWaalsContact O-CA 3.31Å; N53-G299 WeakPolarHBondContact O-CA 3.08Å
54	N	90.3	Very high	76.3	Confident	1 Å²	1	79.5 Å²	79.5	1%	0.005	39%	0.386	C	S	.	.	S	Bend	trans	-78.7	13.4	178.1	-161.8	34.2	0	0	0	115.1	S155 I158 P173 K281 T298 G299	N54-S155 PolarHBondContact ND2-O 3.22Å; N54-S155 PolarHBondContact ND2-OG 3.09Å; N54-I158 WeakPolarHBondContact CB-O 3.32Å; N54-P173 PolarHBondContact ND2-O 3.42Å; N54-P173 PolarHBondContact OD1-O 3.05Å; N54-K281 PolarHBondContact OD1-NZ 3.31Å; N54-T298 HydrophobicContact CB-CG2 4.15Å; N54-G299 PolarHBondContact OD1-N 3.43Å
55	E	87.6	Confident	77.5	Confident	69 Å²	69	80.2 Å²	80.2	32%	0.322	39%	0.388	S	S	.	.			trans	-78.5	126.4	-179.2	-170.7	-177	-165.9	0	0	111	N53 K57 K156	N53-E55 PolarHBondContact O-N 3.38Å; N53-E55 VanDerWaalsContact O-N 3.13Å; E55-K57 HydrophobicContact CG-CG 4.39Å; E55-K57 WeakPolarHBondContact OE1-CE 3.42Å; E55-K57 IonicContact OE1-NZ 2.83Å; E55-K57 WeakPolarHBondContact OE2-CE 3.27Å; E55-K57 IonicContact OE2-NZ 3.94Å; E55-K57 PolarHBondContact OE2-NZ 2.82Å; E55-K156 HydrophobicContact CB-CB 4.49Å
56	I	81.8	Confident	78.6	Confident	21 Å²	21	75.5 Å²	75.5	11%	0.108	37%	0.371	C	S	.	.			trans	-88.9	130.5	174.3	-55.4	-179.4	0	0	0	109	T58 I131 N132 L305	I56-T58 HydrophobicContact CG2-CG2 4.18Å; I56-I131 HydrophobicContact CD1-CG2 3.76Å; I56-N132 PolarHBondContact N-OD1 3.28Å; I56-N132 PolarHBondContact O-ND2 2.93Å; I56-L305 HydrophobicContact CG1-CD1 4.4Å
57	K	77	Confident	79.6	Confident	135 Å²	135	79.1 Å²	79.1	59%	0.587	39%	0.389	S	S	*	.			trans	-129.7	104.9	176.2	-63.7	-178.4	-176.8	173.2	0	110	E55	E55-K57 HydrophobicContact CG-CG 4.39Å; E55-K57 WeakPolarHBondContact OE1-CE 3.42Å; E55-K57 IonicContact OE1-NZ 2.83Å; E55-K57 WeakPolarHBondContact OE2-CE 3.27Å; E55-K57 IonicContact OE2-NZ 3.94Å; E55-K57 PolarHBondContact OE2-NZ 2.82Å
58	T	73.7	Confident	80.8	Confident	55 Å²	55	80.5 Å²	80.5	34%	0.337	40%	0.396	S	S	.	.			trans	-99.3	-7.5	172.8	68.7	0	0	0	0	112.8	I56 D128	I56-T58 HydrophobicContact CG2-CG2 4.18Å; T58-D128 WeakPolarHBondContact CB-OD1 3.38Å; T58-D128 VanDerWaalsContact CG2-OD1 3.31Å; T58-D128 WeakPolarHBondContact CG2-OD1 2.96Å; T58-D128 PolarHBondContact N-OD2 3.43Å; T58-D128 PolarHBondContact OG1-OD1 2.9Å; T58-D128 PolarHBondContact OG1-OD2 2.91Å; T58-D128 VanDerWaalsContact OG1-OD2 3.07Å
59	S	74.8	Confident	82.1	Confident	30 Å²	30	80.1 Å²	80.1	21%	0.21	39%	0.391	C	S	.	.			trans	-59.5	135.5	170.7	73.8	0	0	0	0	111.1	Y61 D121 D128	S59-Y61 VanDerWaalsContact C-N 3.33Å; S59-Y61 WeakPolarHBondContact CB-O 3.49Å; S59-Y61 PolarHBondContact OG-O 2.91Å; S59-D121 WeakPolarHBondContact CA-OD1 3.38Å; S59-D121 WeakPolarHBondContact CB-OD1 3.39Å; S59-D128 PolarHBondContact N-OD2 3.4Å
60	I	76.7	Confident	83.2	Confident	36 Å²	36	70.3 Å²	70.3	19%	0.185	35%	0.348	C	S	.	.	S	Bend	trans	-75.2	-34.8	177.6	-65.8	176	0	0	0	109.1	K69 D121 R124	I60-K69 HydrophobicContact CG2-CD 4.31Å; I60-K69 PolarHBondContact O-NZ 2.88Å; I60-D121 PolarHBondContact N-OD1 2.74Å; I60-R124 VanDerWaalsContact CD1-NH1 3.31Å; I60-R124 VanDerWaalsContact CG1-NH1 3.34Å
61	Y	82.3	Confident	84	Confident	10 Å²	10	68 Å²	68	4%	0.039	34%	0.339	C	S	.	.			trans	-110.3	159.7	-176.5	-45	-75.4	0	0	0	111.3	S59 N65 F66 K69 E73 D117 D121	S59-Y61 VanDerWaalsContact C-N 3.33Å; S59-Y61 WeakPolarHBondContact CB-O 3.49Å; S59-Y61 PolarHBondContact OG-O 2.91Å; Y61-N65 WeakPolarHBondContact CA-OD1 3.39Å; Y61-F66 HydrophobicContact CD1-CD2 4.15Å; Y61-F66 HydrophobicContact CD2-CD2 4.04Å; Y61-F66 HydrophobicContact CD2-CE2 4.39Å; Y61-F66 AromaticContact CG-CD2 3.79Å; Y61-F66 HydrophobicContact CG-CD2 3.79Å; Y61-K69 HydrophobicContact CD1-CB 4.12Å; Y61-K69 HydrophobicContact CD1-CD 3.85Å; Y61-K69 HydrophobicContact CD1-CG 4.18Å; Y61-K69 HydrophobicContact CE1-CB 4.13Å; Y61-K69 HydrophobicContact CE1-CD 3.93Å; Y61-K69 HydrophobicContact CE1-CG 3.92Å; Y61-E73 PolarHBondContact OH-OE1 3.26Å; Y61-E73 PolarHBondContact OH-OE2 3.22Å; Y61-D117 HydrophobicContact CE2-CB 4.38Å; Y61-D121 WeakPolarHBondContact CB-OD2 3.32Å; Y61-D121 HydrophobicContact CD2-CB 3.82Å; Y61-D121 HydrophobicContact CE2-CB 4.5Å; Y61-D121 PolarHBondContact N-OD1 3.09Å; Y61-D121 PolarHBondContact N-OD2 3.13Å
62	T	84.2	Confident	84.2	Confident	71 Å²	71	73.6 Å²	73.6	44%	0.436	36%	0.361	S	S	.	.			trans	-125.2	158.6	167.5	63.7	0	0	0	0	105.6	W64 N65 F66	T62-W64 PolarHBondContact O-N 3.02Å; T62-N65 WeakPolarHBondContact CA-OD1 3.42Å; T62-N65 PolarHBondContact N-OD1 3.11Å; T62-N65 PolarHBondContact O-N 3.1Å; T62-N65 PolarHBondContact O-OD1 3.22Å; T62-N65 VanDerWaalsContact O-OD1 3.08Å; T62-N65 PolarHBondContact OG1-N 2.94Å; T62-N65 PolarHBondContact OG1-ND2 3.15Å; T62-N65 PolarHBondContact OG1-OD1 3.03Å; T62-F66 WeakPolarHBondContact O-CB 3.35Å; T62-F66 PolarHBondContact O-N 3.3Å
63	I	82.8	Confident	84.2	Confident	161 Å²	161	72.5 Å²	72.5	83%	0.826	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-36.7	-177	-61.8	169.7	0	0	0	111.9
64	W	85.8	Confident	84	Confident	237 Å²	237	68.3 Å²	68.3	90%	0.898	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-36.9	-178.2	-60.1	108	0	0	0	114.7	T62	T62-W64 PolarHBondContact O-N 3.02Å
65	N	88.8	Confident	83.9	Confident	61 Å²	61	71.4 Å²	71.4	33%	0.326	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-4.1	-178.4	78	1.1	0	0	0	113.4	Y61 T62 P68 K69	Y61-N65 WeakPolarHBondContact CA-OD1 3.39Å; T62-N65 WeakPolarHBondContact CA-OD1 3.42Å; T62-N65 PolarHBondContact N-OD1 3.11Å; T62-N65 PolarHBondContact O-N 3.1Å; T62-N65 PolarHBondContact O-OD1 3.22Å; T62-N65 VanDerWaalsContact O-OD1 3.08Å; T62-N65 PolarHBondContact OG1-N 2.94Å; T62-N65 PolarHBondContact OG1-ND2 3.15Å; T62-N65 PolarHBondContact OG1-OD1 3.03Å; N65-P68 WeakPolarHBondContact O-CD 3.47Å; N65-K69 WeakPolarHBondContact O-CB 3.26Å; N65-K69 PolarHBondContact O-N 2.89Å; N65-K69 VanDerWaalsContact O-N 3.1Å
66	F	87.4	Confident	83.8	Confident	37 Å²	37	72.2 Å²	72.2	16%	0.162	35%	0.349	C	S	.	.	H	α-helix	trans	-55.1	-57	-179.2	172.4	-101.7	0	0	0	111.1	Y61 T62 K69 I70 M114 I118	Y61-F66 HydrophobicContact CD1-CD2 4.15Å; Y61-F66 HydrophobicContact CD2-CD2 4.04Å; Y61-F66 HydrophobicContact CD2-CE2 4.39Å; Y61-F66 AromaticContact CG-CD2 3.79Å; Y61-F66 HydrophobicContact CG-CD2 3.79Å; T62-F66 WeakPolarHBondContact O-CB 3.35Å; T62-F66 PolarHBondContact O-N 3.3Å; F66-K69 PolarHBondContact O-N 3.32Å; F66-I70 HydrophobicContact CE1-CG2 4.31Å; F66-I70 HydrophobicContact CE2-CD1 3.68Å; F66-I70 HydrophobicContact CZ-CD1 3.56Å; F66-I70 HydrophobicContact CZ-CG2 4.3Å; F66-I70 WeakPolarHBondContact O-CB 3.38Å; F66-I70 VanDerWaalsContact O-CG2 3.24Å; F66-I70 WeakPolarHBondContact O-CG2 3.36Å; F66-I70 PolarHBondContact O-N 2.95Å; F66-M114 HydrophobicContact CZ-CB 4.32Å; F66-I118 HydrophobicContact CD2-CG1 4.31Å; F66-I118 HydrophobicContact CE1-CD1 3.83Å; F66-I118 HydrophobicContact CE1-CG1 3.94Å; F66-I118 HydrophobicContact CE2-CD1 4.26Å; F66-I118 HydrophobicContact CE2-CG1 3.44Å; F66-I118 VanDerWaalsContact CE2-CG1 3.44Å; F66-I118 HydrophobicContact CZ-CD1 3.55Å; F66-I118 HydrophobicContact CZ-CG1 3.23Å
67	L	86.1	Confident	83.9	Confident	96 Å²	96	71.7 Å²	71.7	50%	0.503	35%	0.346	S	S	.	.	H	α-helix	trans	-65	-48	-174.3	-173.3	72.9	0	0	0	113.2	K69 I70 I71 M114	L67-K69 PolarHBondContact O-N 2.84Å; L67-I70 WeakPolarHBondContact O-CG2 3.41Å; L67-I71 HydrophobicContact CD1-CD1 4.01Å; L67-I71 HydrophobicContact CD1-CG1 4.46Å; L67-I71 HydrophobicContact CG-CD1 3.89Å; L67-I71 WeakPolarHBondContact O-CB 3.43Å; L67-I71 WeakPolarHBondContact O-CD1 3.23Å; L67-I71 VanDerWaalsContact O-CG1 3.23Å; L67-I71 WeakPolarHBondContact O-CG1 3.2Å; L67-I71 PolarHBondContact O-N 3.18Å; L67-I71 VanDerWaalsContact O-N 3.11Å; L67-M114 HydrophobicContact CD1-CE 4.24Å
68	P	89.6	Confident	84.4	Confident	84 Å²	84	68.8 Å²	68.8	55%	0.545	34%	0.336	S	S	.	.	H	α-helix	trans	-63.7	-40.2	178.1	-23.4	34.4	0	0	0	113	N65 Y72	N65-P68 WeakPolarHBondContact O-CD 3.47Å; P68-Y72 WeakPolarHBondContact O-CB 3.34Å; P68-Y72 PolarHBondContact O-N 3.42Å; P68-Y72 VanDerWaalsContact O-N 3.07Å
69	K	87.3	Confident	85.1	Confident	78 Å²	78	66.4 Å²	66.4	34%	0.339	32%	0.321	S	S	.	.	H	α-helix	trans	-72.7	-40.7	-177	-169.4	172.8	175	178.5	0	111.7	I60 Y61 N65 F66 L67 Y72 E73	I60-K69 HydrophobicContact CG2-CD 4.31Å; I60-K69 PolarHBondContact O-NZ 2.88Å; Y61-K69 HydrophobicContact CD1-CB 4.12Å; Y61-K69 HydrophobicContact CD1-CD 3.85Å; Y61-K69 HydrophobicContact CD1-CG 4.18Å; Y61-K69 HydrophobicContact CE1-CB 4.13Å; Y61-K69 HydrophobicContact CE1-CD 3.93Å; Y61-K69 HydrophobicContact CE1-CG 3.92Å; N65-K69 WeakPolarHBondContact O-CB 3.26Å; N65-K69 PolarHBondContact O-N 2.89Å; N65-K69 VanDerWaalsContact O-N 3.1Å; F66-K69 PolarHBondContact O-N 3.32Å; L67-K69 PolarHBondContact O-N 2.84Å; K69-Y72 WeakPolarHBondContact O-CB 3.3Å; K69-Y72 PolarHBondContact O-N 3.33Å; K69-E73 WeakPolarHBondContact O-CG 3.29Å; K69-E73 PolarHBondContact O-N 3.24Å
70	I	86.2	Confident	85.7	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-67.6	-39	177.5	-161.4	157.9	0	0	0	111.6	F66 L67 Y72 E73 Q74 M114 D117	F66-I70 HydrophobicContact CE1-CG2 4.31Å; F66-I70 HydrophobicContact CE2-CD1 3.68Å; F66-I70 HydrophobicContact CZ-CD1 3.56Å; F66-I70 HydrophobicContact CZ-CG2 4.3Å; F66-I70 WeakPolarHBondContact O-CB 3.38Å; F66-I70 VanDerWaalsContact O-CG2 3.24Å; F66-I70 WeakPolarHBondContact O-CG2 3.36Å; F66-I70 PolarHBondContact O-N 2.95Å; L67-I70 WeakPolarHBondContact O-CG2 3.41Å; I70-Y72 VanDerWaalsContact C-N 3.32Å; I70-Y72 PolarHBondContact O-N 2.94Å; I70-E73 PolarHBondContact O-N 3.43Å; I70-Q74 HydrophobicContact CG1-CG 4.41Å; I70-Q74 WeakPolarHBondContact O-CB 3.41Å; I70-Q74 VanDerWaalsContact O-CG 3.27Å; I70-Q74 WeakPolarHBondContact O-CG 3.29Å; I70-Q74 PolarHBondContact O-N 3.36Å; I70-M114 HydrophobicContact CD1-CB 4.15Å; I70-M114 HydrophobicContact CD1-CG 3.85Å; I70-M114 HydrophobicContact CG1-CG 4.39Å; I70-M114 HydrophobicContact CG2-CE 4.09Å; I70-M114 HydrophobicContact CG2-CG 4.4Å; I70-D117 HydrophobicContact CD1-CB 3.72Å
71	I	84.9	Confident	86.4	Confident	75 Å²	75	66.5 Å²	66.5	39%	0.385	32%	0.319	S	S	.	.	H	α-helix	trans	-61.4	-44.9	174.2	-69.4	169.2	0	0	0	110	L67 E73 Q74 L75 M114	L67-I71 HydrophobicContact CD1-CD1 4.01Å; L67-I71 HydrophobicContact CD1-CG1 4.46Å; L67-I71 HydrophobicContact CG-CD1 3.89Å; L67-I71 WeakPolarHBondContact O-CB 3.43Å; L67-I71 WeakPolarHBondContact O-CD1 3.23Å; L67-I71 VanDerWaalsContact O-CG1 3.23Å; L67-I71 WeakPolarHBondContact O-CG1 3.2Å; L67-I71 PolarHBondContact O-N 3.18Å; L67-I71 VanDerWaalsContact O-N 3.11Å; I71-E73 VanDerWaalsContact C-N 3.32Å; I71-E73 PolarHBondContact O-N 3.5Å; I71-Q74 PolarHBondContact O-N 3.21Å; I71-L75 HydrophobicContact CG2-CD1 3.9Å; I71-L75 HydrophobicContact CG2-CG 4.29Å; I71-L75 WeakPolarHBondContact O-CB 3.09Å; I71-L75 VanDerWaalsContact O-CG 3.26Å; I71-L75 WeakPolarHBondContact O-CG 3.49Å; I71-L75 PolarHBondContact O-N 3.38Å; I71-M114 HydrophobicContact CG1-CE 4.41Å
72	Y	88.1	Confident	86.7	Confident	156 Å²	156	66.8 Å²	66.8	61%	0.612	32%	0.321	S	S	*	.	H	α-helix	trans	-57.7	-43.5	175.4	176.9	-98.6	0	0	0	112.3	P68 K69 I70 L75	P68-Y72 WeakPolarHBondContact O-CB 3.34Å; P68-Y72 PolarHBondContact O-N 3.42Å; P68-Y72 VanDerWaalsContact O-N 3.07Å; K69-Y72 WeakPolarHBondContact O-CB 3.3Å; K69-Y72 PolarHBondContact O-N 3.33Å; I70-Y72 VanDerWaalsContact C-N 3.32Å; I70-Y72 PolarHBondContact O-N 2.94Å; Y72-L75 PolarHBondContact O-N 3.48Å
73	E	83.8	Confident	87	Confident	15 Å²	15	63.4 Å²	63.4	7%	0.07	30%	0.3	C	S	.	.	H	α-helix	trans	-65.9	-40.4	176.4	-72.1	-174.2	-160.3	0	0	112.7	Y61 K69 I70 I71 L75 H76 R313	Y61-E73 PolarHBondContact OH-OE1 3.26Å; Y61-E73 PolarHBondContact OH-OE2 3.22Å; K69-E73 WeakPolarHBondContact O-CG 3.29Å; K69-E73 PolarHBondContact O-N 3.24Å; I70-E73 PolarHBondContact O-N 3.43Å; I71-E73 VanDerWaalsContact C-N 3.32Å; I71-E73 PolarHBondContact O-N 3.5Å; E73-L75 VanDerWaalsContact C-N 3.32Å; E73-L75 PolarHBondContact O-N 2.97Å; E73-H76 VanDerWaalsContact O-CB 3.26Å; E73-H76 WeakPolarHBondContact O-CB 3.32Å; E73-H76 PolarHBondContact O-N 3.43Å; E73-R313 WeakPolarHBondContact OE2-CD 3.45Å; E73-R313 IonicContact OE2-CZ 2.72Å; E73-R313 IonicContact OE2-NH1 3.17Å; E73-R313 PolarHBondContact OE2-NH1 3.4Å
74	Q	85.9	Confident	87.2	Confident	7 Å²	7	58.9 Å²	58.9	3%	0.033	28%	0.277	C	S	.	.	H	α-helix	trans	-69.4	-29.4	178.3	-68.4	-59.3	-27.9	0	0	112.6	I70 I71 H76 Y77 N80 L110	I70-Q74 HydrophobicContact CG1-CG 4.41Å; I70-Q74 WeakPolarHBondContact O-CB 3.41Å; I70-Q74 VanDerWaalsContact O-CG 3.27Å; I70-Q74 WeakPolarHBondContact O-CG 3.29Å; I70-Q74 PolarHBondContact O-N 3.36Å; I71-Q74 PolarHBondContact O-N 3.21Å; Q74-H76 PolarHBondContact O-N 3.04Å; Q74-Y77 PolarHBondContact O-N 2.92Å; Q74-N80 WeakPolarHBondContact O-CB 3.47Å; Q74-N80 PolarHBondContact O-ND2 3.4Å; Q74-N80 PolarHBondContact OE1-ND2 2.96Å; Q74-L110 HydrophobicContact CB-CD2 4.14Å; Q74-L110 HydrophobicContact CG-CD2 4.1Å
75	L	86.2	Confident	87.4	Confident	66 Å²	66	52 Å²	52	35%	0.346	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-13.1	174	-72.1	171.9	0	0	0	113.1	I71 Y72 E73 Y77 I81 I84	I71-L75 HydrophobicContact CG2-CD1 3.9Å; I71-L75 HydrophobicContact CG2-CG 4.29Å; I71-L75 WeakPolarHBondContact O-CB 3.09Å; I71-L75 VanDerWaalsContact O-CG 3.26Å; I71-L75 WeakPolarHBondContact O-CG 3.49Å; I71-L75 PolarHBondContact O-N 3.38Å; Y72-L75 PolarHBondContact O-N 3.48Å; E73-L75 VanDerWaalsContact C-N 3.32Å; E73-L75 PolarHBondContact O-N 2.97Å; L75-Y77 PolarHBondContact O-N 3.16Å; L75-I81 HydrophobicContact CD2-CG1 4.1Å; L75-I81 WeakPolarHBondContact O-CD1 3.25Å; L75-I81 WeakPolarHBondContact O-CG1 3.18Å; L75-I84 HydrophobicContact CD2-CD1 3.54Å
76	H	85.6	Confident	87.4	Confident	85 Å²	85	49.1 Å²	49.1	39%	0.394	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-15.5	174	-133.5	-70	0	0	0	112.6	E73 Q74 Y315 N323	E73-H76 VanDerWaalsContact O-CB 3.26Å; E73-H76 WeakPolarHBondContact O-CB 3.32Å; E73-H76 PolarHBondContact O-N 3.43Å; Q74-H76 PolarHBondContact O-N 3.04Å; H76-Y315 HydrophobicContact CB-CE1 4.31Å; H76-Y315 PolarHBondContact CD2-OH 3.43Å; H76-Y315 AromaticContact CG-CZ 3.97Å; H76-N323 PolarHBondContact O-ND2 3.23Å
77	Y	85.6	Confident	87.4	Confident	11 Å²	11	48.4 Å²	48.4	4%	0.043	24%	0.242	C	C	.	.	S	Bend	trans	-87.7	121.7	171.8	-64.7	-68.4	0	0	0	111.3	Q74 L75 S79 N80 I81 R313 E319 I388 E392	Q74-Y77 PolarHBondContact O-N 2.92Å; L75-Y77 PolarHBondContact O-N 3.16Å; Y77-S79 VanDerWaalsContact C-N 3.25Å; Y77-S79 PolarHBondContact O-N 2.92Å; Y77-N80 PolarHBondContact O-N 3.36Å; Y77-N80 VanDerWaalsContact O-N 3.07Å; Y77-I81 PolarHBondContact O-N 3.32Å; Y77-R313 PolarHBondContact OH-NH2 3.4Å; Y77-E319 HydrophobicContact CE1-CG 4.29Å; Y77-I388 HydrophobicContact CD1-CD1 3.81Å; Y77-I388 HydrophobicContact CD1-CG1 4.32Å; Y77-I388 HydrophobicContact CD2-CD1 4.04Å; Y77-I388 HydrophobicContact CD2-CG2 4.44Å; Y77-I388 HydrophobicContact CE1-CD1 4.42Å; Y77-I388 HydrophobicContact CE1-CG2 4.33Å; Y77-I388 HydrophobicContact CE2-CG2 4Å; Y77-I388 HydrophobicContact CG-CD1 3.59Å; Y77-E392 PolarHBondContact OH-OE1 3.21Å; Y77-E392 VanDerWaalsContact OH-OE1 3.09Å
78	M	87.6	Confident	87.5	Confident	73 Å²	73	47.7 Å²	47.7	36%	0.36	24%	0.238	S	C	.	.	H	α-helix	trans	-62	-32	-176.5	-68.7	-65.9	150.6	0	0	112.9	N80 I81 F82 N323 M330	M78-N80 VanDerWaalsContact C-N 3.35Å; M78-N80 PolarHBondContact O-N 3.36Å; M78-I81 HydrophobicContact SD-CD1 4.2Å; M78-F82 WeakPolarHBondContact O-CB 3.46Å; M78-F82 PolarHBondContact O-N 2.65Å; M78-F82 VanDerWaalsContact O-N 3.08Å; M78-N323 HydrophobicContact CG-CB 4.19Å; M78-N323 PolarHBondContact N-OD1 2.92Å; M78-M330 HydrophobicContact CB-CE 4.13Å
79	S	87.1	Confident	87.5	Confident	5 Å²	5	45.3 Å²	45.3	4%	0.035	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-38.6	175.5	54.5	0	0	0	0	112.6	Y77 F82 F83 I388	Y77-S79 VanDerWaalsContact C-N 3.25Å; Y77-S79 PolarHBondContact O-N 2.92Å; S79-F82 WeakPolarHBondContact O-CB 3.49Å; S79-F82 PolarHBondContact O-N 2.73Å; S79-F83 WeakPolarHBondContact O-CD2 3.34Å; S79-F83 PolarHBondContact O-N 3.37Å; S79-I388 WeakPolarHBondContact OG-CD1 3.28Å
80	N	88.6	Confident	87.4	Confident	7 Å²	7	42.7 Å²	42.7	4%	0.037	21%	0.21	C	C	.	.	H	α-helix	trans	-69.8	-41.3	-178.6	-69.2	-10.4	0	0	0	111	Q74 Y77 M78 F82 F83 I84 F106	Q74-N80 WeakPolarHBondContact O-CB 3.47Å; Q74-N80 PolarHBondContact O-ND2 3.4Å; Q74-N80 PolarHBondContact OE1-ND2 2.96Å; Y77-N80 PolarHBondContact O-N 3.36Å; Y77-N80 VanDerWaalsContact O-N 3.07Å; M78-N80 VanDerWaalsContact C-N 3.35Å; M78-N80 PolarHBondContact O-N 3.36Å; N80-F82 VanDerWaalsContact C-N 3.26Å; N80-F82 PolarHBondContact O-N 3.31Å; N80-F83 PolarHBondContact O-N 3.24Å; N80-I84 WeakPolarHBondContact O-CD1 3.07Å; N80-I84 VanDerWaalsContact O-CG1 3.29Å; N80-I84 WeakPolarHBondContact O-CG1 3.32Å; N80-I84 PolarHBondContact O-N 2.98Å; N80-I84 VanDerWaalsContact O-N 3.1Å; N80-F106 HydrophobicContact CB-CE2 4.17Å; N80-F106 HydrophobicContact CB-CZ 4.49Å
81	I	89.9	Confident	87.3	Confident	61 Å²	61	49 Å²	49	31%	0.313	24%	0.243	S	C	.	.	H	α-helix	trans	-56.1	-46.7	171.2	-65.2	170.4	0	0	0	109.8	L75 Y77 M78 I84 L85	L75-I81 HydrophobicContact CD2-CG1 4.1Å; L75-I81 WeakPolarHBondContact O-CD1 3.25Å; L75-I81 WeakPolarHBondContact O-CG1 3.18Å; Y77-I81 PolarHBondContact O-N 3.32Å; M78-I81 HydrophobicContact SD-CD1 4.2Å; I81-I84 PolarHBondContact O-N 3.37Å; I81-L85 HydrophobicContact CG2-CD1 3.99Å; I81-L85 HydrophobicContact CG2-CG 4.43Å; I81-L85 WeakPolarHBondContact O-CG 3.4Å; I81-L85 PolarHBondContact O-N 2.96Å
82	F	90.3	Very high	87.2	Confident	16 Å²	16	51.8 Å²	51.8	7%	0.07	25%	0.252	C	S	.	.	H	α-helix	trans	-61.1	-47.2	-179.5	172	-103.3	0	0	0	113.2	M78 S79 N80 I84 L85 V86 M330 M333 N380 I383	M78-F82 WeakPolarHBondContact O-CB 3.46Å; M78-F82 PolarHBondContact O-N 2.65Å; M78-F82 VanDerWaalsContact O-N 3.08Å; S79-F82 WeakPolarHBondContact O-CB 3.49Å; S79-F82 PolarHBondContact O-N 2.73Å; N80-F82 VanDerWaalsContact C-N 3.26Å; N80-F82 PolarHBondContact O-N 3.31Å; F82-I84 VanDerWaalsContact C-N 3.3Å; F82-I84 PolarHBondContact O-N 3.04Å; F82-L85 WeakPolarHBondContact O-CB 3.47Å; F82-L85 PolarHBondContact O-N 3.27Å; F82-L85 VanDerWaalsContact O-N 3.14Å; F82-V86 HydrophobicContact CD1-CG2 4.34Å; F82-V86 HydrophobicContact CD2-CG2 4.14Å; F82-V86 HydrophobicContact CE1-CG2 3.93Å; F82-V86 HydrophobicContact CE2-CG2 3.59Å; F82-V86 HydrophobicContact CG-CG2 4.47Å; F82-V86 HydrophobicContact CZ-CG2 3.49Å; F82-V86 VanDerWaalsContact CZ-CG2 3.49Å; F82-V86 WeakPolarHBondContact O-CG2 3.03Å; F82-V86 PolarHBondContact O-N 3.26Å; F82-M330 HydrophobicContact CB-SD 3.67Å; F82-M330 HydrophobicContact CD2-CG 4.2Å; F82-M330 HydrophobicContact CD2-SD 3.85Å; F82-M330 HydrophobicContact CG-CG 4.42Å; F82-M330 HydrophobicContact CG-SD 3.89Å; F82-M333 HydrophobicContact CD2-CE 4.39Å; F82-M333 HydrophobicContact CE1-CE 4.37Å; F82-M333 HydrophobicContact CE2-CE 3.25Å; F82-M333 HydrophobicContact CE2-SD 4.36Å; F82-M333 HydrophobicContact CZ-CE 3.22Å; F82-M333 HydrophobicContact CZ-SD 3.73Å; F82-N380 WeakPolarHBondContact CE1-OD1 3.38Å; F82-I383 HydrophobicContact CD1-CB 4.41Å; F82-I383 HydrophobicContact CD1-CD1 3.44Å; F82-I383 VanDerWaalsContact CD1-CD1 3.44Å; F82-I383 HydrophobicContact CD1-CG1 4.29Å; F82-I383 HydrophobicContact CD1-CG2 4.49Å; F82-I383 HydrophobicContact CD2-CD1 4.37Å; F82-I383 HydrophobicContact CE1-CB 4.22Å; F82-I383 HydrophobicContact CE1-CD1 3.39Å; F82-I383 HydrophobicContact CE1-CG1 3.94Å; F82-I383 HydrophobicContact CE2-CD1 4.43Å; F82-I383 HydrophobicContact CG-CD1 3.9Å; F82-I383 HydrophobicContact CZ-CD1 3.97Å
83	F	89	Confident	86.7	Confident	1 Å²	1	44.7 Å²	44.7	0%	0.004	23%	0.225	C	C	.	.	H	α-helix	trans	-65	-33.7	178.3	-69.6	-60.8	0	0	0	112.9	S79 N80 V86 A87 I102 F106 N380 I383 I385	S79-F83 WeakPolarHBondContact O-CD2 3.34Å; S79-F83 PolarHBondContact O-N 3.37Å; N80-F83 PolarHBondContact O-N 3.24Å; F83-V86 PolarHBondContact O-N 3.44Å; F83-A87 VanDerWaalsContact O-CB 3.3Å; F83-A87 WeakPolarHBondContact O-CB 3.06Å; F83-A87 PolarHBondContact O-N 2.89Å; F83-I102 HydrophobicContact CD1-CG2 4.34Å; F83-F106 HydrophobicContact CB-CD1 4.45Å; F83-F106 HydrophobicContact CB-CD2 3.72Å; F83-F106 HydrophobicContact CB-CE2 3.86Å; F83-F106 HydrophobicContact CB-CG 4.03Å; F83-F106 HydrophobicContact CB-CZ 4.27Å; F83-F106 HydrophobicContact CD2-CD2 4.09Å; F83-F106 HydrophobicContact CD2-CE2 4.39Å; F83-F106 HydrophobicContact CG-CD2 4.14Å; F83-N380 WeakPolarHBondContact CE1-OD1 3.36Å; F83-I383 HydrophobicContact CE2-CG2 3.84Å; F83-I383 HydrophobicContact CZ-CB 3.84Å; F83-I383 HydrophobicContact CZ-CG2 3.65Å; F83-I385 HydrophobicContact CD1-CD1 4.41Å; F83-I385 HydrophobicContact CD1-CG1 4.13Å; F83-I385 HydrophobicContact CD2-CG1 4.21Å; F83-I385 HydrophobicContact CE1-CD1 3.86Å; F83-I385 HydrophobicContact CE1-CG1 3.41Å; F83-I385 VanDerWaalsContact CE1-CG1 3.41Å; F83-I385 HydrophobicContact CE2-CB 4.21Å; F83-I385 HydrophobicContact CE2-CG1 3.53Å; F83-I385 HydrophobicContact CZ-CB 4.18Å; F83-I385 HydrophobicContact CZ-CD1 4.07Å; F83-I385 HydrophobicContact CZ-CG1 3.1Å
84	I	88.4	Confident	86.4	Confident	65 Å²	65	50.6 Å²	50.6	33%	0.333	26%	0.257	S	S	.	.	H	α-helix	trans	-63.5	-45.3	172.1	-68	165.6	0	0	0	110.4	L75 N80 I81 F82 A87 I88 F106	L75-I84 HydrophobicContact CD2-CD1 3.54Å; N80-I84 WeakPolarHBondContact O-CD1 3.07Å; N80-I84 VanDerWaalsContact O-CG1 3.29Å; N80-I84 WeakPolarHBondContact O-CG1 3.32Å; N80-I84 PolarHBondContact O-N 2.98Å; N80-I84 VanDerWaalsContact O-N 3.1Å; I81-I84 PolarHBondContact O-N 3.37Å; F82-I84 VanDerWaalsContact C-N 3.3Å; F82-I84 PolarHBondContact O-N 3.04Å; I84-A87 PolarHBondContact O-N 3.34Å; I84-I88 HydrophobicContact CG2-CD1 4.05Å; I84-I88 WeakPolarHBondContact O-CG1 3.44Å; I84-I88 PolarHBondContact O-N 2.96Å; I84-F106 HydrophobicContact CD1-CZ 4.23Å; I84-F106 HydrophobicContact CG1-CE1 3.87Å; I84-F106 HydrophobicContact CG1-CZ 3.75Å
85	L	89.4	Confident	85.7	Confident	93 Å²	93	51.8 Å²	51.8	49%	0.487	27%	0.272	S	S	.	.	H	α-helix	trans	-62.4	-44.8	176.9	-70.1	171.7	0	0	0	111.9	I81 F82 A87 I88 I89	I81-L85 HydrophobicContact CG2-CD1 3.99Å; I81-L85 HydrophobicContact CG2-CG 4.43Å; I81-L85 WeakPolarHBondContact O-CG 3.4Å; I81-L85 PolarHBondContact O-N 2.96Å; F82-L85 WeakPolarHBondContact O-CB 3.47Å; F82-L85 PolarHBondContact O-N 3.27Å; F82-L85 VanDerWaalsContact O-N 3.14Å; L85-A87 VanDerWaalsContact C-N 3.31Å; L85-A87 PolarHBondContact O-N 3.03Å; L85-I88 PolarHBondContact O-N 3.09Å; L85-I89 VanDerWaalsContact O-CG1 3.31Å; L85-I89 WeakPolarHBondContact O-CG1 3.43Å; L85-I89 PolarHBondContact O-N 2.84Å
86	V	88.6	Confident	85.1	Confident	1 Å²	1	50 Å²	50	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-62.5	-38.7	176.3	174.1	0	0	0	0	111.2	F82 F83 I89 H90 I102 L376 F377	F82-V86 HydrophobicContact CD1-CG2 4.34Å; F82-V86 HydrophobicContact CD2-CG2 4.14Å; F82-V86 HydrophobicContact CE1-CG2 3.93Å; F82-V86 HydrophobicContact CE2-CG2 3.59Å; F82-V86 HydrophobicContact CG-CG2 4.47Å; F82-V86 HydrophobicContact CZ-CG2 3.49Å; F82-V86 VanDerWaalsContact CZ-CG2 3.49Å; F82-V86 WeakPolarHBondContact O-CG2 3.03Å; F82-V86 PolarHBondContact O-N 3.26Å; F83-V86 PolarHBondContact O-N 3.44Å; V86-I89 PolarHBondContact O-N 2.92Å; V86-H90 PolarHBondContact O-N 2.91Å; V86-H90 PolarHBondContact O-ND1 3.36Å; V86-I102 HydrophobicContact CG1-CD1 4.17Å; V86-I102 HydrophobicContact CG1-CG2 4.49Å; V86-L376 HydrophobicContact CG2-CD2 4.33Å; V86-F377 HydrophobicContact CG1-CD1 4.05Å; V86-F377 HydrophobicContact CG1-CE1 4.19Å
87	A	86.5	Confident	84.7	Confident	21 Å²	21	46.2 Å²	46.2	17%	0.174	25%	0.25	C	C	.	.	H	α-helix	trans	-64.5	-38.4	175.4	0	0	0	0	0	112.3	F83 I84 L85 H90 I103	F83-A87 VanDerWaalsContact O-CB 3.3Å; F83-A87 WeakPolarHBondContact O-CB 3.06Å; F83-A87 PolarHBondContact O-N 2.89Å; I84-A87 PolarHBondContact O-N 3.34Å; L85-A87 VanDerWaalsContact C-N 3.31Å; L85-A87 PolarHBondContact O-N 3.03Å; A87-H90 PolarHBondContact O-N 3.07Å; A87-I103 HydrophobicContact CB-CD1 4.18Å; A87-I103 HydrophobicContact CB-CG1 4.17Å
88	I	89.1	Confident	84.5	Confident	81 Å²	81	48.3 Å²	48.3	42%	0.415	27%	0.266	S	S	.	.	H	α-helix	trans	-65	-40.4	173.8	-67	164.3	0	0	0	110.8	I84 L85 H90 L91 F92	I84-I88 HydrophobicContact CG2-CD1 4.05Å; I84-I88 WeakPolarHBondContact O-CG1 3.44Å; I84-I88 PolarHBondContact O-N 2.96Å; L85-I88 PolarHBondContact O-N 3.09Å; I88-H90 VanDerWaalsContact C-N 3.29Å; I88-H90 PolarHBondContact O-N 3.43Å; I88-L91 VanDerWaalsContact O-CB 3.29Å; I88-L91 WeakPolarHBondContact O-CB 3.49Å; I88-L91 PolarHBondContact O-N 3.05Å; I88-F92 HydrophobicContact CG2-CE2 4.04Å; I88-F92 WeakPolarHBondContact O-CD2 3.48Å
89	I	89.3	Confident	84.3	Confident	35 Å²	35	48.5 Å²	48.5	18%	0.179	27%	0.267	C	S	.	.	H	α-helix	trans	-63.8	-33.2	179.3	-65.8	165.9	0	0	0	111.7	L85 V86 L91 F92 A93 F373 L376 F377	L85-I89 VanDerWaalsContact O-CG1 3.31Å; L85-I89 WeakPolarHBondContact O-CG1 3.43Å; L85-I89 PolarHBondContact O-N 2.84Å; V86-I89 PolarHBondContact O-N 2.92Å; I89-L91 PolarHBondContact O-N 2.84Å; I89-L91 VanDerWaalsContact O-N 3.14Å; I89-F92 PolarHBondContact O-N 2.89Å; I89-A93 PolarHBondContact O-N 2.88Å; I89-F373 HydrophobicContact CD1-CD1 4.47Å; I89-F373 HydrophobicContact CD1-CE1 4.32Å; I89-F373 HydrophobicContact CG2-CB 3.92Å; I89-F373 HydrophobicContact CG2-CD1 3.65Å; I89-F373 HydrophobicContact CG2-CD2 3.93Å; I89-F373 HydrophobicContact CG2-CE1 4.08Å; I89-F373 HydrophobicContact CG2-CE2 4.32Å; I89-F373 HydrophobicContact CG2-CG 3.57Å; I89-F373 HydrophobicContact CG2-CZ 4.4Å; I89-L376 HydrophobicContact CD1-CD2 3.72Å; I89-F377 HydrophobicContact CB-CE1 4.27Å; I89-F377 HydrophobicContact CB-CZ 4.46Å; I89-F377 HydrophobicContact CG2-CE1 3.88Å; I89-F377 HydrophobicContact CG2-CZ 3.77Å
90	H	85.4	Confident	84.1	Confident	23 Å²	23	55.3 Å²	55.3	11%	0.106	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-19.7	174	-79.9	80.3	0	0	0	113.7	V86 A87 I88 F92 I99 I102 F377	V86-H90 PolarHBondContact O-N 2.91Å; V86-H90 PolarHBondContact O-ND1 3.36Å; A87-H90 PolarHBondContact O-N 3.07Å; I88-H90 VanDerWaalsContact C-N 3.29Å; I88-H90 PolarHBondContact O-N 3.43Å; H90-F92 VanDerWaalsContact C-N 3.26Å; H90-F92 PolarHBondContact O-N 2.88Å; H90-I99 HydrophobicContact CB-CD1 3.96Å; H90-I99 HydrophobicContact CB-CG1 4.09Å; H90-I102 WeakPolarHBondContact CE1-CD1 3.23Å; H90-F377 HydrophobicContact CB-CZ 4.42Å; H90-F377 AromaticContact CD2-CZ 3.92Å; H90-F377 AromaticContact CE1-CD1 3.03Å; H90-F377 WeakPolarHBondContact CE1-CD1 3.39Å; H90-F377 AromaticContact CE1-CE1 3.04Å; H90-F377 WeakPolarHBondContact CE1-CE1 3.4Å; H90-F377 AromaticContact CE1-CG 3.72Å; H90-F377 AromaticContact CE1-CZ 3.71Å; H90-F377 AromaticContact CG-CE1 3.77Å; H90-F377 AromaticContact CG-CZ 3.77Å; H90-F377 AromaticContact ND1-CD1 3.67Å; H90-F377 AromaticContact ND1-CE1 3.14Å; H90-F377 WeakPolarHBondContact ND1-CE1 3.09Å; H90-F377 AromaticContact ND1-CZ 3.65Å; H90-F377 AromaticContact NE2-CD1 3.54Å; H90-F377 AromaticContact NE2-CE1 3.65Å; H90-F377 AromaticContact NE2-CG 3.75Å; H90-F377 AromaticContact NE2-CZ 3.91Å
91	L	84	Confident	83.8	Confident	132 Å²	132	55 Å²	55	69%	0.691	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-19.7	175.3	-60.3	172.2	0	0	0	112.7	I88 I89	I88-L91 VanDerWaalsContact O-CB 3.29Å; I88-L91 WeakPolarHBondContact O-CB 3.49Å; I88-L91 PolarHBondContact O-N 3.05Å; I89-L91 PolarHBondContact O-N 2.84Å; I89-L91 VanDerWaalsContact O-N 3.14Å
92	F	82.7	Confident	83.4	Confident	134 Å²	134	52.2 Å²	52.2	59%	0.588	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	-16.9	-173.8	-61.3	-77.3	0	0	0	114.1	I88 I89 H90	I88-F92 HydrophobicContact CG2-CE2 4.04Å; I88-F92 WeakPolarHBondContact O-CD2 3.48Å; I89-F92 PolarHBondContact O-N 2.89Å; H90-F92 VanDerWaalsContact C-N 3.26Å; H90-F92 PolarHBondContact O-N 2.88Å
93	A	78.7	Confident	83.2	Confident	6 Å²	6	54.7 Å²	54.7	5%	0.05	29%	0.294	C	S	.	.	S	Bend	trans	-136.4	135.7	-176	0	0	0	0	0	111.5	I89 G95 F373 F377	I89-A93 PolarHBondContact O-N 2.88Å; A93-G95 PolarHBondContact O-N 2.8Å; A93-F373 HydrophobicContact CB-CB 4.01Å; A93-F373 HydrophobicContact CB-CD2 4Å; A93-F373 HydrophobicContact CB-CG 4.47Å; A93-F377 HydrophobicContact CB-CE2 4.23Å; A93-F377 HydrophobicContact CB-CZ 4.4Å
94	D	75.5	Confident	83	Confident	139 Å²	139	55.6 Å²	55.6	74%	0.743	30%	0.304	S	S	*	.			trans	-66.7	117.7	174.1	-60.3	-46.8	0	0	0	109.6
95	G	72	Confident	82.8	Confident	33 Å²	33	53 Å²	53	34%	0.34	29%	0.291	S	S	.	.			trans	-76.9	146.7	-177.8	0	0	0	0	0	113.1	A93 T97 F377	A93-G95 PolarHBondContact O-N 2.8Å; G95-T97 PolarHBondContact O-N 3.03Å; G95-F377 VanDerWaalsContact CA-CD2 3.42Å
96	A	72.6	Confident	82.7	Confident	29 Å²	29	49.4 Å²	49.4	24%	0.24	27%	0.271	C	S	.	.	S	Bend	trans	-67	-27	167.2	0	0	0	0	0	111.6	I378	A96-I378 HydrophobicContact CB-CD1 4.08Å; A96-I378 HydrophobicContact CB-CG1 3.95Å
97	T	77.7	Confident	82.6	Confident	5 Å²	5	52.6 Å²	52.6	3%	0.031	29%	0.294	C	S	.	.	S	Bend	trans	-112	151.6	174.4	54	0	0	0	0	110	G95 Y381 F1124	G95-T97 PolarHBondContact O-N 3.03Å; T97-Y381 HydrophobicContact CG2-CE2 4.42Å; T97-F1124 HydrophobicContact CG2-CD2 4.1Å; T97-F1124 HydrophobicContact CG2-CE2 4.08Å
98	S	81.6	Confident	82.6	Confident	54 Å²	54	56.8 Å²	56.8	38%	0.378	31%	0.308	S	S	.	.			trans	-64.5	148.2	173.4	79.1	0	0	0	0	111.3	F100 A101 T1121	S98-F100 PolarHBondContact O-N 2.64Å; S98-A101 WeakPolarHBondContact O-CB 3.45Å; S98-A101 PolarHBondContact O-N 2.96Å; S98-T1121 VanDerWaalsContact N-CG2 3.26Å; S98-T1121 WeakPolarHBondContact OG-CG2 3.5Å
99	I	84.1	Confident	82.4	Confident	77 Å²	77	53.3 Å²	53.3	40%	0.395	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-31.9	176.4	-164	172.6	0	0	0	112.3	H90 A101 I102 I103	H90-I99 HydrophobicContact CB-CD1 3.96Å; H90-I99 HydrophobicContact CB-CG1 4.09Å; I99-A101 PolarHBondContact O-N 2.95Å; I99-I102 PolarHBondContact O-N 3.1Å; I99-I103 HydrophobicContact CD1-CD1 3.57Å; I99-I103 HydrophobicContact CG1-CD1 3.48Å; I99-I103 VanDerWaalsContact CG1-CD1 3.48Å; I99-I103 HydrophobicContact CG1-CG1 3.92Å; I99-I103 PolarHBondContact O-N 3.46Å
100	F	83.5	Confident	82.3	Confident	149 Å²	149	53.3 Å²	53.3	65%	0.654	29%	0.291	S	S	*	.	H	α-helix	trans	-60.4	-31.4	177.4	-176.1	-98.8	0	0	0	112.2	S98 I102 G104	S98-F100 PolarHBondContact O-N 2.64Å; F100-I102 PolarHBondContact O-N 3.31Å; F100-G104 VanDerWaalsContact O-CA 3.31Å; F100-G104 WeakPolarHBondContact O-CA 3.26Å; F100-G104 PolarHBondContact O-N 3.15Å
101	A	80.6	Confident	82.5	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-70	-14.5	-178.7	0	0	0	0	0	114.6	S98 I99 P105 Y381 T1121 S1125	S98-A101 WeakPolarHBondContact O-CB 3.45Å; S98-A101 PolarHBondContact O-N 2.96Å; I99-A101 PolarHBondContact O-N 2.95Å; A101-P105 WeakPolarHBondContact O-CD 3.5Å; A101-Y381 WeakPolarHBondContact CB-OH 3.49Å; A101-Y381 PolarHBondContact O-OH 3.36Å; A101-T1121 HydrophobicContact CB-CG2 3.79Å; A101-S1125 WeakPolarHBondContact CA-OG 3.4Å; A101-S1125 VanDerWaalsContact CB-OG 3.28Å; A101-S1125 WeakPolarHBondContact CB-OG 3.46Å
102	I	82.6	Confident	82.6	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-110	-51.9	178.3	-65.4	164.1	0	0	0	109.7	F83 V86 H90 I99 F100 G104 F106 N380	F83-I102 HydrophobicContact CD1-CG2 4.34Å; V86-I102 HydrophobicContact CG1-CD1 4.17Å; V86-I102 HydrophobicContact CG1-CG2 4.49Å; H90-I102 WeakPolarHBondContact CE1-CD1 3.23Å; I99-I102 PolarHBondContact O-N 3.1Å; F100-I102 PolarHBondContact O-N 3.31Å; I102-G104 VanDerWaalsContact C-N 3.35Å; I102-G104 PolarHBondContact O-N 3.01Å; I102-F106 VanDerWaalsContact O-CB 3.25Å; I102-F106 WeakPolarHBondContact O-CB 3.46Å; I102-F106 PolarHBondContact O-N 2.89Å; I102-N380 VanDerWaalsContact CD1-ND2 3.34Å; I102-N380 WeakPolarHBondContact CD1-ND2 3.49Å; I102-N380 WeakPolarHBondContact CG1-ND2 3.37Å
103	I	85.7	Confident	82.7	Confident	69 Å²	69	46 Å²	46	35%	0.354	26%	0.261	S	S	.	.	H	α-helix	trans	-66.8	-36.7	-178.9	-64.4	-171.7	0	0	0	111.3	A87 I99 F106 S107	A87-I103 HydrophobicContact CB-CD1 4.18Å; A87-I103 HydrophobicContact CB-CG1 4.17Å; I99-I103 HydrophobicContact CD1-CD1 3.57Å; I99-I103 HydrophobicContact CG1-CD1 3.48Å; I99-I103 VanDerWaalsContact CG1-CD1 3.48Å; I99-I103 HydrophobicContact CG1-CG1 3.92Å; I99-I103 PolarHBondContact O-N 3.46Å; I103-F106 PolarHBondContact O-N 3.27Å; I103-S107 WeakPolarHBondContact O-CB 3.43Å; I103-S107 PolarHBondContact O-N 3.2Å
104	G	84.9	Confident	83.2	Confident	20 Å²	20	47.6 Å²	47.6	21%	0.206	27%	0.267	C	S	.	.	H	α-helix	trans	-57.8	-61.9	179.7	0	0	0	0	0	112.3	F100 I102 F106 S107 F108	F100-G104 VanDerWaalsContact O-CA 3.31Å; F100-G104 WeakPolarHBondContact O-CA 3.26Å; F100-G104 PolarHBondContact O-N 3.15Å; I102-G104 VanDerWaalsContact C-N 3.35Å; I102-G104 PolarHBondContact O-N 3.01Å; G104-F106 VanDerWaalsContact C-N 3.34Å; G104-F106 PolarHBondContact O-N 2.81Å; G104-S107 PolarHBondContact O-N 2.51Å; G104-F108 WeakPolarHBondContact O-CB 3.36Å; G104-F108 PolarHBondContact O-N 3.5Å
105	P	84.2	Confident	83.8	Confident	9 Å²	9	45 Å²	45	6%	0.058	25%	0.253	C	S	.	.	H	α-helix	trans	-59.8	-40.2	176.9	-25.7	35.2	0	0	0	113.3	A101 F108 V109 I385	A101-P105 WeakPolarHBondContact O-CD 3.5Å; P105-F108 PolarHBondContact O-N 3.48Å; P105-V109 VanDerWaalsContact O-CG2 3.32Å; P105-V109 WeakPolarHBondContact O-CG2 3.3Å; P105-V109 PolarHBondContact O-N 2.91Å; P105-I385 HydrophobicContact CB-CD1 4.2Å; P105-I385 HydrophobicContact CB-CG2 4.37Å
106	F	87.5	Confident	84.4	Confident	19 Å²	19	44.5 Å²	44.5	8%	0.083	24%	0.241	C	C	.	.	H	α-helix	trans	-64.4	-46.9	179.3	177.9	-115.6	0	0	0	112.5	N80 F83 I84 I102 I103 G104 F108 V109 L110	N80-F106 HydrophobicContact CB-CE2 4.17Å; N80-F106 HydrophobicContact CB-CZ 4.49Å; F83-F106 HydrophobicContact CB-CD1 4.45Å; F83-F106 HydrophobicContact CB-CD2 3.72Å; F83-F106 HydrophobicContact CB-CE2 3.86Å; F83-F106 HydrophobicContact CB-CG 4.03Å; F83-F106 HydrophobicContact CB-CZ 4.27Å; F83-F106 HydrophobicContact CD2-CD2 4.09Å; F83-F106 HydrophobicContact CD2-CE2 4.39Å; F83-F106 HydrophobicContact CG-CD2 4.14Å; I84-F106 HydrophobicContact CD1-CZ 4.23Å; I84-F106 HydrophobicContact CG1-CE1 3.87Å; I84-F106 HydrophobicContact CG1-CZ 3.75Å; I102-F106 VanDerWaalsContact O-CB 3.25Å; I102-F106 WeakPolarHBondContact O-CB 3.46Å; I102-F106 PolarHBondContact O-N 2.89Å; I103-F106 PolarHBondContact O-N 3.27Å; G104-F106 VanDerWaalsContact C-N 3.34Å; G104-F106 PolarHBondContact O-N 2.81Å; F106-F108 VanDerWaalsContact C-N 3.32Å; F106-F108 PolarHBondContact O-N 3.04Å; F106-V109 PolarHBondContact O-N 3.41Å; F106-L110 HydrophobicContact CD1-CD1 4.08Å; F106-L110 HydrophobicContact CD2-CG 4.49Å; F106-L110 HydrophobicContact CE1-CD1 3.48Å; F106-L110 VanDerWaalsContact CE1-CD1 3.48Å; F106-L110 HydrophobicContact CE1-CG 4.41Å; F106-L110 HydrophobicContact CE2-CD1 3.95Å; F106-L110 HydrophobicContact CE2-CD2 4.49Å; F106-L110 HydrophobicContact CE2-CG 4.07Å; F106-L110 HydrophobicContact CZ-CD1 3.41Å; F106-L110 VanDerWaalsContact CZ-CD1 3.41Å; F106-L110 HydrophobicContact CZ-CG 4.05Å; F106-L110 PolarHBondContact O-N 2.9Å
107	S	87	Confident	84.9	Confident	68 Å²	68	43.6 Å²	43.6	48%	0.476	23%	0.232	S	C	.	.	H	α-helix	trans	-63.5	-38.6	176.9	-174.7	0	0	0	0	111.7	I103 G104 L111	I103-S107 WeakPolarHBondContact O-CB 3.43Å; I103-S107 PolarHBondContact O-N 3.2Å; G104-S107 PolarHBondContact O-N 2.51Å; S107-L111 VanDerWaalsContact O-CB 3.31Å; S107-L111 WeakPolarHBondContact O-CB 3.25Å; S107-L111 PolarHBondContact O-N 3.11Å
108	F	86.6	Confident	85.4	Confident	109 Å²	109	46.5 Å²	46.5	48%	0.478	25%	0.247	S	C	.	.	H	α-helix	trans	-63.4	-47.9	175.2	177.3	-95	0	0	0	111.3	G104 P105 F106 L110 L111 V112 L1129	G104-F108 WeakPolarHBondContact O-CB 3.36Å; G104-F108 PolarHBondContact O-N 3.5Å; P105-F108 PolarHBondContact O-N 3.48Å; F106-F108 VanDerWaalsContact C-N 3.32Å; F106-F108 PolarHBondContact O-N 3.04Å; F108-L110 PolarHBondContact O-N 3.06Å; F108-L111 PolarHBondContact O-N 3.4Å; F108-V112 HydrophobicContact CD1-CG2 4.21Å; F108-V112 HydrophobicContact CE1-CG2 3.8Å; F108-V112 HydrophobicContact CE2-CG2 4.12Å; F108-V112 HydrophobicContact CZ-CG2 3.76Å; F108-V112 WeakPolarHBondContact O-CG2 3.47Å; F108-V112 PolarHBondContact O-N 2.8Å; F108-L1129 HydrophobicContact CD1-CD1 3.46Å; F108-L1129 VanDerWaalsContact CD1-CD1 3.46Å; F108-L1129 HydrophobicContact CE1-CD1 3.8Å; F108-L1129 HydrophobicContact CG-CD1 4.22Å
109	V	85.1	Confident	85.6	Confident	7 Å²	7	48.4 Å²	48.4	4%	0.042	25%	0.252	C	S	.	.	H	α-helix	trans	-60.7	-45.9	178.7	169	0	0	0	0	111.1	P105 F106 L111 V112 T113 I385 I389	P105-V109 VanDerWaalsContact O-CG2 3.32Å; P105-V109 WeakPolarHBondContact O-CG2 3.3Å; P105-V109 PolarHBondContact O-N 2.91Å; F106-V109 PolarHBondContact O-N 3.41Å; V109-L111 PolarHBondContact O-N 3.39Å; V109-V112 PolarHBondContact O-N 3.36Å; V109-T113 WeakPolarHBondContact O-CG2 3.43Å; V109-T113 PolarHBondContact O-N 3.48Å; V109-T113 PolarHBondContact O-OG1 3.45Å; V109-I385 HydrophobicContact CG2-CG2 4.08Å; V109-I389 HydrophobicContact CG1-CB 4.1Å; V109-I389 HydrophobicContact CG1-CG2 4.04Å; V109-I389 HydrophobicContact CG2-CG2 4.07Å
110	L	86.4	Confident	85.3	Confident	35 Å²	35	48.3 Å²	48.3	18%	0.183	25%	0.247	C	C	.	.	H	α-helix	trans	-59.6	-45.4	175.2	-77.2	178.8	0	0	0	112	Q74 F106 F108 V112 T113 M114	Q74-L110 HydrophobicContact CB-CD2 4.14Å; Q74-L110 HydrophobicContact CG-CD2 4.1Å; F106-L110 HydrophobicContact CD1-CD1 4.08Å; F106-L110 HydrophobicContact CD2-CG 4.49Å; F106-L110 HydrophobicContact CE1-CD1 3.48Å; F106-L110 VanDerWaalsContact CE1-CD1 3.48Å; F106-L110 HydrophobicContact CE1-CG 4.41Å; F106-L110 HydrophobicContact CE2-CD1 3.95Å; F106-L110 HydrophobicContact CE2-CD2 4.49Å; F106-L110 HydrophobicContact CE2-CG 4.07Å; F106-L110 HydrophobicContact CZ-CD1 3.41Å; F106-L110 VanDerWaalsContact CZ-CD1 3.41Å; F106-L110 HydrophobicContact CZ-CG 4.05Å; F106-L110 PolarHBondContact O-N 2.9Å; F108-L110 PolarHBondContact O-N 3.06Å; L110-V112 PolarHBondContact O-N 3.43Å; L110-T113 WeakPolarHBondContact CA-OG1 3.3Å; L110-T113 PolarHBondContact O-N 3.47Å; L110-T113 PolarHBondContact O-OG1 3.44Å; L110-M114 WeakPolarHBondContact O-CG 3.12Å; L110-M114 PolarHBondContact O-N 2.98Å
111	L	88.8	Confident	85.3	Confident	95 Å²	95	42.3 Å²	42.3	50%	0.497	22%	0.221	S	C	.	.	H	α-helix	trans	-58.4	-46.6	178	-177.1	71	0	0	0	111.8	S107 F108 V109 T113 M114 I115	S107-L111 VanDerWaalsContact O-CB 3.31Å; S107-L111 WeakPolarHBondContact O-CB 3.25Å; S107-L111 PolarHBondContact O-N 3.11Å; F108-L111 PolarHBondContact O-N 3.4Å; V109-L111 PolarHBondContact O-N 3.39Å; L111-T113 VanDerWaalsContact C-N 3.34Å; L111-T113 PolarHBondContact O-N 3.45Å; L111-M114 PolarHBondContact O-N 2.83Å; L111-I115 HydrophobicContact CD1-CD1 4.46Å; L111-I115 HydrophobicContact CG-CD1 4.02Å; L111-I115 WeakPolarHBondContact O-CG1 3.19Å; L111-I115 PolarHBondContact O-N 2.66Å
112	V	86.9	Confident	85.5	Confident	41 Å²	41	46.1 Å²	46.1	25%	0.248	24%	0.241	C	C	.	.	H	α-helix	trans	-62.9	-41.4	178.8	180	0	0	0	0	110.8	F108 V109 L110 M114 I115 K116 I389	F108-V112 HydrophobicContact CD1-CG2 4.21Å; F108-V112 HydrophobicContact CE1-CG2 3.8Å; F108-V112 HydrophobicContact CE2-CG2 4.12Å; F108-V112 HydrophobicContact CZ-CG2 3.76Å; F108-V112 WeakPolarHBondContact O-CG2 3.47Å; F108-V112 PolarHBondContact O-N 2.8Å; V109-V112 PolarHBondContact O-N 3.36Å; L110-V112 PolarHBondContact O-N 3.43Å; V112-M114 VanDerWaalsContact C-N 3.34Å; V112-M114 PolarHBondContact O-N 3.43Å; V112-I115 PolarHBondContact O-N 3.39Å; V112-K116 WeakPolarHBondContact O-CB 3.4Å; V112-K116 PolarHBondContact O-N 2.97Å; V112-I389 HydrophobicContact CB-CD1 4.14Å; V112-I389 HydrophobicContact CB-CG1 4.4Å; V112-I389 HydrophobicContact CG1-CD1 3.55Å; V112-I389 HydrophobicContact CG1-CG1 3.94Å
113	T	85.1	Confident	85.5	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-62.5	-39.9	175.4	60.7	0	0	0	0	112.4	V109 L110 L111 K116 D117 I389	V109-T113 WeakPolarHBondContact O-CG2 3.43Å; V109-T113 PolarHBondContact O-N 3.48Å; V109-T113 PolarHBondContact O-OG1 3.45Å; L110-T113 WeakPolarHBondContact CA-OG1 3.3Å; L110-T113 PolarHBondContact O-N 3.47Å; L110-T113 PolarHBondContact O-OG1 3.44Å; L111-T113 VanDerWaalsContact C-N 3.34Å; L111-T113 PolarHBondContact O-N 3.45Å; T113-K116 PolarHBondContact O-N 2.88Å; T113-D117 PolarHBondContact O-N 3.38Å; T113-I389 HydrophobicContact CG2-CD1 3.83Å
114	M	87.7	Confident	85.1	Confident	38 Å²	38	50.2 Å²	50.2	19%	0.187	26%	0.259	C	S	.	.	H	α-helix	trans	-65.1	-46	177.2	-69.5	-176.5	179.9	0	0	112.2	F66 L67 I70 I71 L110 L111 V112 K116 D117 I118	F66-M114 HydrophobicContact CZ-CB 4.32Å; L67-M114 HydrophobicContact CD1-CE 4.24Å; I70-M114 HydrophobicContact CD1-CB 4.15Å; I70-M114 HydrophobicContact CD1-CG 3.85Å; I70-M114 HydrophobicContact CG1-CG 4.39Å; I70-M114 HydrophobicContact CG2-CE 4.09Å; I70-M114 HydrophobicContact CG2-CG 4.4Å; I71-M114 HydrophobicContact CG1-CE 4.41Å; L110-M114 WeakPolarHBondContact O-CG 3.12Å; L110-M114 PolarHBondContact O-N 2.98Å; L111-M114 PolarHBondContact O-N 2.83Å; V112-M114 VanDerWaalsContact C-N 3.34Å; V112-M114 PolarHBondContact O-N 3.43Å; M114-K116 VanDerWaalsContact C-N 3.31Å; M114-K116 PolarHBondContact O-N 3.09Å; M114-D117 PolarHBondContact O-N 2.97Å; M114-I118 VanDerWaalsContact O-CG1 3.27Å; M114-I118 WeakPolarHBondContact O-CG1 3.29Å; M114-I118 PolarHBondContact O-N 2.94Å
115	I	88.8	Confident	85	Confident	85 Å²	85	55.1 Å²	55.1	44%	0.436	27%	0.272	S	S	.	.	H	α-helix	trans	-58.6	-46.1	177.3	-69.1	167.6	0	0	0	110.3	L111 V112 D117 I118 I119	L111-I115 HydrophobicContact CD1-CD1 4.46Å; L111-I115 HydrophobicContact CG-CD1 4.02Å; L111-I115 WeakPolarHBondContact O-CG1 3.19Å; L111-I115 PolarHBondContact O-N 2.66Å; V112-I115 PolarHBondContact O-N 3.39Å; I115-D117 PolarHBondContact O-N 3.35Å; I115-I118 PolarHBondContact O-N 3Å; I115-I119 HydrophobicContact CG2-CD1 3.95Å; I115-I119 WeakPolarHBondContact O-CG1 3.04Å; I115-I119 PolarHBondContact O-N 2.92Å
116	K	85.5	Confident	85.1	Confident	23 Å²	23	61.1 Å²	61.1	10%	0.1	30%	0.295	C	S	.	.	H	α-helix	trans	-57.1	-50.3	177.4	178	-137.9	66.1	172.1	0	111.1	V112 T113 M114 I118 I119 Y120 E392 I396	V112-K116 WeakPolarHBondContact O-CB 3.4Å; V112-K116 PolarHBondContact O-N 2.97Å; T113-K116 PolarHBondContact O-N 2.88Å; M114-K116 VanDerWaalsContact C-N 3.31Å; M114-K116 PolarHBondContact O-N 3.09Å; K116-I118 VanDerWaalsContact C-N 3.34Å; K116-I118 PolarHBondContact O-N 2.91Å; K116-I119 PolarHBondContact O-N 3.04Å; K116-Y120 HydrophobicContact CG-CD2 4.2Å; K116-Y120 HydrophobicContact CG-CE2 4.01Å; K116-Y120 VanDerWaalsContact O-CD2 3.25Å; K116-Y120 WeakPolarHBondContact O-CD2 3.33Å; K116-Y120 PolarHBondContact O-N 3.36Å; K116-E392 IonicContact NZ-OE1 2.79Å; K116-E392 IonicContact NZ-OE2 2.71Å; K116-E392 PolarHBondContact NZ-OE2 3.25Å; K116-I396 HydrophobicContact CD-CD1 3.91Å; K116-I396 HydrophobicContact CG-CD1 3.93Å
117	D	83.6	Confident	84.5	Confident	9 Å²	9	65 Å²	65	5%	0.048	31%	0.313	C	S	.	.	H	α-helix	trans	-65.7	-34	-179.8	-72.5	-26.4	0	0	0	112.8	Y61 I70 T113 M114 I115 Y120 D121	Y61-D117 HydrophobicContact CE2-CB 4.38Å; I70-D117 HydrophobicContact CD1-CB 3.72Å; T113-D117 PolarHBondContact O-N 3.38Å; M114-D117 PolarHBondContact O-N 2.97Å; I115-D117 PolarHBondContact O-N 3.35Å; D117-Y120 PolarHBondContact O-N 2.97Å; D117-D121 PolarHBondContact O-N 3.49Å; D117-D121 VanDerWaalsContact O-N 3.08Å
118	I	87.3	Confident	84.3	Confident	67 Å²	67	62.1 Å²	62.1	34%	0.344	29%	0.292	S	S	.	.	H	α-helix	trans	-61.1	-48	172.9	-70.3	165.6	0	0	0	111	F66 M114 I115 K116 Y120 D121 L122	F66-I118 HydrophobicContact CD2-CG1 4.31Å; F66-I118 HydrophobicContact CE1-CD1 3.83Å; F66-I118 HydrophobicContact CE1-CG1 3.94Å; F66-I118 HydrophobicContact CE2-CD1 4.26Å; F66-I118 HydrophobicContact CE2-CG1 3.44Å; F66-I118 VanDerWaalsContact CE2-CG1 3.44Å; F66-I118 HydrophobicContact CZ-CD1 3.55Å; F66-I118 HydrophobicContact CZ-CG1 3.23Å; M114-I118 VanDerWaalsContact O-CG1 3.27Å; M114-I118 WeakPolarHBondContact O-CG1 3.29Å; M114-I118 PolarHBondContact O-N 2.94Å; I115-I118 PolarHBondContact O-N 3Å; K116-I118 VanDerWaalsContact C-N 3.34Å; K116-I118 PolarHBondContact O-N 2.91Å; I118-Y120 VanDerWaalsContact C-N 3.28Å; I118-Y120 PolarHBondContact O-N 3.45Å; I118-D121 PolarHBondContact O-N 3.21Å; I118-L122 HydrophobicContact CG2-CD1 3.81Å; I118-L122 HydrophobicContact CG2-CG 4.15Å; I118-L122 WeakPolarHBondContact O-CB 3.17Å; I118-L122 WeakPolarHBondContact O-CG 3.19Å; I118-L122 PolarHBondContact O-N 2.92Å
119	I	86.7	Confident	84.4	Confident	93 Å²	93	61.1 Å²	61.1	48%	0.477	29%	0.288	S	S	.	.	H	α-helix	trans	-58.2	-44.7	-179.3	-68.1	166	0	0	0	110.2	I115 K116 D121 L122 L123	I115-I119 HydrophobicContact CG2-CD1 3.95Å; I115-I119 WeakPolarHBondContact O-CG1 3.04Å; I115-I119 PolarHBondContact O-N 2.92Å; K116-I119 PolarHBondContact O-N 3.04Å; I119-D121 PolarHBondContact O-N 2.67Å; I119-L122 PolarHBondContact O-N 2.86Å; I119-L123 HydrophobicContact CG2-CD1 4.42Å; I119-L123 WeakPolarHBondContact O-CG 3.44Å; I119-L123 PolarHBondContact O-N 3.42Å; I119-L123 VanDerWaalsContact O-N 3.12Å
120	Y	77.5	Confident	84.4	Confident	76 Å²	76	67.8 Å²	67.8	30%	0.298	32%	0.318	S	S	.	.	H	α-helix	trans	-63.4	-40.1	178.1	-83.4	-71	0	0	0	113.2	K116 D117 I118 R124 I396 P422	K116-Y120 HydrophobicContact CG-CD2 4.2Å; K116-Y120 HydrophobicContact CG-CE2 4.01Å; K116-Y120 VanDerWaalsContact O-CD2 3.25Å; K116-Y120 WeakPolarHBondContact O-CD2 3.33Å; K116-Y120 PolarHBondContact O-N 3.36Å; D117-Y120 PolarHBondContact O-N 2.97Å; I118-Y120 VanDerWaalsContact C-N 3.28Å; I118-Y120 PolarHBondContact O-N 3.45Å; Y120-R124 PolarHBondContact O-N 3.38Å; Y120-I396 HydrophobicContact CE2-CD1 3.81Å; Y120-I396 HydrophobicContact CE2-CG1 4.42Å; Y120-I396 WeakPolarHBondContact OH-CD1 3.25Å; Y120-I396 WeakPolarHBondContact OH-CG1 3.45Å; Y120-I396 WeakPolarHBondContact OH-CG2 3.39Å; Y120-P422 HydrophobicContact CE1-CG 4.07Å
121	D	83.2	Confident	84.2	Confident	22 Å²	22	68.1 Å²	68.1	12%	0.118	32%	0.32	C	S	.	.	H	α-helix	trans	-73.6	-34.7	-179.9	-155.9	58.9	0	0	0	112.3	S59 I60 Y61 D117 I118 I119 L123 R124 Y125	S59-D121 WeakPolarHBondContact CA-OD1 3.38Å; S59-D121 WeakPolarHBondContact CB-OD1 3.39Å; I60-D121 PolarHBondContact N-OD1 2.74Å; Y61-D121 WeakPolarHBondContact CB-OD2 3.32Å; Y61-D121 HydrophobicContact CD2-CB 3.82Å; Y61-D121 HydrophobicContact CE2-CB 4.5Å; Y61-D121 PolarHBondContact N-OD1 3.09Å; Y61-D121 PolarHBondContact N-OD2 3.13Å; D117-D121 PolarHBondContact O-N 3.49Å; D117-D121 VanDerWaalsContact O-N 3.08Å; I118-D121 PolarHBondContact O-N 3.21Å; I119-D121 PolarHBondContact O-N 2.67Å; D121-L123 PolarHBondContact O-N 3.37Å; D121-R124 WeakPolarHBondContact O-CB 3.41Å; D121-R124 PolarHBondContact O-N 3.2Å; D121-Y125 PolarHBondContact O-N 3.38Å
122	L	84.9	Confident	84.1	Confident	80 Å²	80	64 Å²	64	42%	0.419	30%	0.298	S	S	.	.	H	α-helix	trans	-61.6	-43	172.3	-73.8	175.9	0	0	0	111.8	I118 I119 R124 Y125 Y126	I118-L122 HydrophobicContact CG2-CD1 3.81Å; I118-L122 HydrophobicContact CG2-CG 4.15Å; I118-L122 WeakPolarHBondContact O-CB 3.17Å; I118-L122 WeakPolarHBondContact O-CG 3.19Å; I118-L122 PolarHBondContact O-N 2.92Å; I119-L122 PolarHBondContact O-N 2.86Å; L122-R124 VanDerWaalsContact C-N 3.27Å; L122-R124 PolarHBondContact O-N 2.84Å; L122-Y125 WeakPolarHBondContact O-CB 3.48Å; L122-Y125 PolarHBondContact O-N 2.94Å; L122-Y126 HydrophobicContact CB-CE2 4.33Å; L122-Y126 WeakPolarHBondContact O-CD2 3.38Å; L122-Y126 PolarHBondContact O-N 3.02Å
123	L	82.4	Confident	84.3	Confident	96 Å²	96	65.3 Å²	65.3	50%	0.503	30%	0.302	S	S	.	.	H	α-helix	trans	-59.6	-37.6	175.7	-71.6	173.1	0	0	0	112.1	I119 D121 Q127	I119-L123 HydrophobicContact CG2-CD1 4.42Å; I119-L123 WeakPolarHBondContact O-CG 3.44Å; I119-L123 PolarHBondContact O-N 3.42Å; I119-L123 VanDerWaalsContact O-N 3.12Å; D121-L123 PolarHBondContact O-N 3.37Å; L123-Q127 WeakPolarHBondContact O-CG 3.47Å; L123-Q127 PolarHBondContact O-N 3.08Å
124	R	77.5	Confident	84.4	Confident	61 Å²	61	69.4 Å²	69.4	23%	0.23	32%	0.32	C	S	.	.	H	α-helix	trans	-68.5	-43.3	174	-68.3	-179.9	-176.9	-164	1.9	112	I60 Y120 D121 L122 Y126 Q127 D128	I60-R124 VanDerWaalsContact CD1-NH1 3.31Å; I60-R124 VanDerWaalsContact CG1-NH1 3.34Å; Y120-R124 PolarHBondContact O-N 3.38Å; D121-R124 WeakPolarHBondContact O-CB 3.41Å; D121-R124 PolarHBondContact O-N 3.2Å; L122-R124 VanDerWaalsContact C-N 3.27Å; L122-R124 PolarHBondContact O-N 2.84Å; R124-Y126 VanDerWaalsContact C-N 3.3Å; R124-Y126 PolarHBondContact O-N 3.28Å; R124-Q127 WeakPolarHBondContact O-CB 3.19Å; R124-Q127 PolarHBondContact O-N 3.19Å; R124-Q127 VanDerWaalsContact O-N 3.08Å; R124-D128 PolarHBondContact O-N 3.1Å
125	Y	82.9	Confident	84.5	Confident	124 Å²	124	73.7 Å²	73.7	49%	0.486	34%	0.337	S	S	.	.	H	α-helix	trans	-58.4	-40.9	176.5	174.6	-101.9	0	0	0	112.5	D121 L122 Q127 D128 K129	D121-Y125 PolarHBondContact O-N 3.38Å; L122-Y125 WeakPolarHBondContact O-CB 3.48Å; L122-Y125 PolarHBondContact O-N 2.94Å; Y125-Q127 VanDerWaalsContact C-N 3.32Å; Y125-Q127 PolarHBondContact O-N 3.41Å; Y125-D128 PolarHBondContact O-N 3.27Å; Y125-K129 WeakPolarHBondContact O-CB 3.24Å; Y125-K129 PolarHBondContact O-N 3.05Å
126	Y	85.4	Confident	84.6	Confident	134 Å²	134	70.2 Å²	70.2	53%	0.525	32%	0.319	S	S	.	.	H	α-helix	trans	-62.9	-37.8	175.3	-71.5	-60.6	0	0	0	112.6	L122 R124 K129 Q130	L122-Y126 HydrophobicContact CB-CE2 4.33Å; L122-Y126 WeakPolarHBondContact O-CD2 3.38Å; L122-Y126 PolarHBondContact O-N 3.02Å; R124-Y126 VanDerWaalsContact C-N 3.3Å; R124-Y126 PolarHBondContact O-N 3.28Å; Y126-K129 PolarHBondContact O-N 2.85Å; Y126-Q130 WeakPolarHBondContact O-CG 3.48Å; Y126-Q130 PolarHBondContact O-N 3.36Å
127	Q	76	Confident	84.8	Confident	102 Å²	102	70.5 Å²	70.5	48%	0.477	32%	0.32	S	S	.	.	H	α-helix	trans	-67	-44.2	175.3	-68.1	172.7	0.7	0	0	111.7	L123 R124 Y125 K129 Q130 I131	L123-Q127 WeakPolarHBondContact O-CG 3.47Å; L123-Q127 PolarHBondContact O-N 3.08Å; R124-Q127 WeakPolarHBondContact O-CB 3.19Å; R124-Q127 PolarHBondContact O-N 3.19Å; R124-Q127 VanDerWaalsContact O-N 3.08Å; Y125-Q127 VanDerWaalsContact C-N 3.32Å; Y125-Q127 PolarHBondContact O-N 3.41Å; Q127-K129 VanDerWaalsContact C-N 3.31Å; Q127-K129 PolarHBondContact O-N 3.06Å; Q127-Q130 PolarHBondContact O-N 2.92Å; Q127-I131 PolarHBondContact O-N 2.68Å
128	D	83.1	Confident	85	Confident	7 Å²	7	70.1 Å²	70.1	4%	0.037	32%	0.318	C	S	.	.	H	α-helix	trans	-60.9	-42.1	175.8	-71.3	-18.8	0	0	0	111.6	T58 S59 R124 Y125 Q130 I131 N132	T58-D128 WeakPolarHBondContact CB-OD1 3.38Å; T58-D128 VanDerWaalsContact CG2-OD1 3.31Å; T58-D128 WeakPolarHBondContact CG2-OD1 2.96Å; T58-D128 PolarHBondContact N-OD2 3.43Å; T58-D128 PolarHBondContact OG1-OD1 2.9Å; T58-D128 PolarHBondContact OG1-OD2 2.91Å; T58-D128 VanDerWaalsContact OG1-OD2 3.07Å; S59-D128 PolarHBondContact N-OD2 3.4Å; R124-D128 PolarHBondContact O-N 3.1Å; Y125-D128 PolarHBondContact O-N 3.27Å; D128-Q130 VanDerWaalsContact C-N 3.32Å; D128-Q130 PolarHBondContact O-N 2.94Å; D128-I131 PolarHBondContact O-N 3.46Å; D128-N132 WeakPolarHBondContact O-CB 3.46Å; D128-N132 VanDerWaalsContact O-CG 3.27Å; D128-N132 PolarHBondContact O-N 2.82Å; D128-N132 PolarHBondContact O-ND2 2.93Å
129	K	87.2	Confident	85	Confident	88 Å²	88	67 Å²	67	38%	0.383	30%	0.302	S	S	.	.	H	α-helix	trans	-58.2	-44.2	178	-174.1	178.6	176.5	-174.8	0	111.4	Y125 Y126 Q127 I131 N132 E133	Y125-K129 WeakPolarHBondContact O-CB 3.24Å; Y125-K129 PolarHBondContact O-N 3.05Å; Y126-K129 PolarHBondContact O-N 2.85Å; Q127-K129 VanDerWaalsContact C-N 3.31Å; Q127-K129 PolarHBondContact O-N 3.06Å; K129-I131 VanDerWaalsContact C-N 3.3Å; K129-I131 PolarHBondContact O-N 3.22Å; K129-N132 PolarHBondContact O-N 2.9Å; K129-E133 VanDerWaalsContact CE-OE2 3.26Å; K129-E133 WeakPolarHBondContact CE-OE2 3.38Å; K129-E133 HydrophobicContact CG-CG 4.11Å; K129-E133 WeakPolarHBondContact O-CB 3.32Å; K129-E133 VanDerWaalsContact O-CG 3.23Å; K129-E133 WeakPolarHBondContact O-CG 3.34Å; K129-E133 PolarHBondContact O-N 2.91Å
130	Q	85.1	Confident	84.8	Confident	146 Å²	146	65.4 Å²	65.4	68%	0.682	29%	0.292	S	S	*	.	H	α-helix	trans	-58.8	-40.6	177.9	-71.4	177.2	1.3	0	0	112.3	Y126 Q127 D128	Y126-Q130 WeakPolarHBondContact O-CG 3.48Å; Y126-Q130 PolarHBondContact O-N 3.36Å; Q127-Q130 PolarHBondContact O-N 2.92Å; D128-Q130 VanDerWaalsContact C-N 3.32Å; D128-Q130 PolarHBondContact O-N 2.94Å
131	I	82.2	Confident	84.7	Confident	42 Å²	42	63.3 Å²	63.3	22%	0.215	29%	0.285	C	S	.	.	H	α-helix	trans	-72.6	-43.9	179.1	-59.4	170	0	0	0	111	I56 Q127 D128 K129 E133 K134	I56-I131 HydrophobicContact CD1-CG2 3.76Å; Q127-I131 PolarHBondContact O-N 2.68Å; D128-I131 PolarHBondContact O-N 3.46Å; K129-I131 VanDerWaalsContact C-N 3.3Å; K129-I131 PolarHBondContact O-N 3.22Å; I131-E133 PolarHBondContact O-N 3.13Å; I131-K134 PolarHBondContact O-N 2.94Å
132	N	88	Confident	84.3	Confident	9 Å²	9	64.6 Å²	64.6	5%	0.048	29%	0.292	C	S	.	.	H	α-helix	trans	-67.4	-22.7	-178.7	-72.4	-30	0	0	0	113.2	I56 D128 K129 S155 K156	I56-N132 PolarHBondContact N-OD1 3.28Å; I56-N132 PolarHBondContact O-ND2 2.93Å; D128-N132 WeakPolarHBondContact O-CB 3.46Å; D128-N132 VanDerWaalsContact O-CG 3.27Å; D128-N132 PolarHBondContact O-N 2.82Å; D128-N132 PolarHBondContact O-ND2 2.93Å; K129-N132 PolarHBondContact O-N 2.9Å; N132-S155 PolarHBondContact O-N 3.26Å; N132-K156 HydrophobicContact CB-CB 4.29Å; N132-K156 PolarHBondContact O-N 3.15Å
133	E	90.3	Very high	83.5	Confident	68 Å²	68	63 Å²	63	32%	0.318	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-3.6	-179.9	-67.1	-165.2	133.6	0	0	115	K129 I131 K154	K129-E133 VanDerWaalsContact CE-OE2 3.26Å; K129-E133 WeakPolarHBondContact CE-OE2 3.38Å; K129-E133 HydrophobicContact CG-CG 4.11Å; K129-E133 WeakPolarHBondContact O-CB 3.32Å; K129-E133 VanDerWaalsContact O-CG 3.23Å; K129-E133 WeakPolarHBondContact O-CG 3.34Å; K129-E133 PolarHBondContact O-N 2.91Å; I131-E133 PolarHBondContact O-N 3.13Å; E133-K154 HydrophobicContact CB-CD 4.46Å; E133-K154 HydrophobicContact CG-CD 4.19Å; E133-K154 IonicContact OE1-NZ 3.34Å; E133-K154 PolarHBondContact OE1-NZ 2.87Å
134	K	87	Confident	82.7	Confident	88 Å²	88	67.1 Å²	67.1	38%	0.383	30%	0.301	S	S	.	.			trans	-53.8	139.1	169.7	-72	-171.2	179.6	-173.1	0	110.3	I131 F136 K154 S155 E171	I131-K134 PolarHBondContact O-N 2.94Å; K134-F136 HydrophobicContact CB-CE2 4.05Å; K134-K154 CarbonylContact O-C 3.55Å; K134-K154 WeakPolarHBondContact O-CA 3.34Å; K134-S155 WeakPolarHBondContact O-CB 3.47Å; K134-S155 PolarHBondContact O-N 2.84Å; K134-E171 IonicContact NZ-OE2 3.23Å; K134-E171 PolarHBondContact NZ-OE2 3.49Å
135	K	90.4	Very high	82.1	Confident	128 Å²	128	67.5 Å²	67.5	56%	0.557	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.5	139.9	-172.6	-61.1	-175.1	-171.6	173.7	0	111.6	L152 K153	K135-L152 HydrophobicContact CB-CD1 3.87Å; K135-L152 HydrophobicContact CB-CD2 4.09Å; K135-L152 HydrophobicContact CB-CG 3.82Å; K135-L152 HydrophobicContact CD-CD2 3.41Å; K135-L152 VanDerWaalsContact CD-CD2 3.41Å; K135-L152 HydrophobicContact CD-CG 3.94Å; K135-L152 HydrophobicContact CG-CD2 4.36Å; K135-L152 HydrophobicContact CG-CG 4.42Å; K135-K153 CarbonylContact C-O 3.51Å; K135-K153 VanDerWaalsContact CA-O 3.3Å; K135-K153 WeakPolarHBondContact CA-O 3.37Å
136	F	89.9	Confident	81.2	Confident	11 Å²	11	63.8 Å²	63.8	5%	0.048	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	149.5	177.5	-66.3	-87.6	0	0	0	110.5	K134 K153 I158 E171 P173	K134-F136 HydrophobicContact CB-CE2 4.05Å; F136-K153 PolarHBondContact N-O 3.38Å; F136-K153 PolarHBondContact O-N 2.84Å; F136-I158 HydrophobicContact CB-CD1 4.13Å; F136-I158 HydrophobicContact CD2-CD1 3.84Å; F136-I158 HydrophobicContact CG-CD1 4.17Å; F136-E171 WeakPolarHBondContact CE1-O 3.44Å; F136-E171 VanDerWaalsContact CZ-O 3.26Å; F136-E171 WeakPolarHBondContact CZ-O 3.09Å; F136-P173 HydrophobicContact CD1-CG 4.13Å; F136-P173 HydrophobicContact CD2-CB 3.98Å; F136-P173 HydrophobicContact CD2-CG 3.96Å; F136-P173 HydrophobicContact CE1-CB 4.47Å; F136-P173 HydrophobicContact CE1-CG 4.04Å; F136-P173 HydrophobicContact CE2-CB 3.57Å; F136-P173 HydrophobicContact CE2-CG 3.89Å; F136-P173 HydrophobicContact CG-CG 4.09Å; F136-P173 HydrophobicContact CZ-CB 3.84Å; F136-P173 HydrophobicContact CZ-CG 3.92Å
137	F	89.5	Confident	80.4	Confident	29 Å²	29	59.5 Å²	59.5	13%	0.127	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	126.2	175.2	-70.3	-85.7	0	0	0	109.7	W150 L152 I164 L165 Y226	F137-W150 HydrophobicContact CB-CE3 3.89Å; F137-W150 HydrophobicContact CB-CZ3 4.44Å; F137-W150 HydrophobicContact CD1-CB 4.35Å; F137-L152 HydrophobicContact CD1-CD1 4.21Å; F137-L152 HydrophobicContact CD2-CD1 4.2Å; F137-L152 HydrophobicContact CE1-CD1 4.13Å; F137-L152 HydrophobicContact CE2-CD1 4.09Å; F137-L152 HydrophobicContact CG-CD1 4.25Å; F137-L152 HydrophobicContact CZ-CD1 4.06Å; F137-I164 CarbonylContact O-C 3.49Å; F137-I164 VanDerWaalsContact O-CA 3.24Å; F137-I164 WeakPolarHBondContact O-CA 3.29Å; F137-L165 HydrophobicContact CB-CB 4.03Å; F137-L165 HydrophobicContact CB-CD2 4.41Å; F137-L165 HydrophobicContact CD2-CD2 4.48Å; F137-L165 PolarHBondContact O-N 3.28Å; F137-Y226 HydrophobicContact CE1-CE2 4.14Å
138	I	89.6	Confident	80.2	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	132.1	178.2	-60.3	-178	0	0	0	109.2	W150 I151 K153 I158 D162 I163 I164	I138-W150 WeakPolarHBondContact O-CA 3.38Å; I138-I151 PolarHBondContact N-O 3.41Å; I138-I151 PolarHBondContact O-N 3Å; I138-K153 HydrophobicContact CD1-CB 3.63Å; I138-K153 HydrophobicContact CD1-CD 3.82Å; I138-K153 HydrophobicContact CD1-CG 3.84Å; I138-K153 HydrophobicContact CG1-CB 4.35Å; I138-I158 HydrophobicContact CD1-CG1 4.18Å; I138-D162 HydrophobicContact CG2-CB 4.25Å; I138-I163 CarbonylContact C-O 3.46Å; I138-I163 VanDerWaalsContact CA-O 3.32Å; I138-I163 WeakPolarHBondContact CA-O 3.18Å; I138-I164 HydrophobicContact CG1-CG2 4.13Å
139	M	85.9	Confident	80	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.015	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	126.9	174.5	-160.4	168.5	76.4	0	0	110.4	H35 I148 W150 I163 Y214 L242	H35-M139 WeakPolarHBondContact NE2-CE 3.4Å; M139-I148 HydrophobicContact CG-CG2 3.54Å; M139-I148 HydrophobicContact SD-CG2 3.78Å; M139-W150 HydrophobicContact CB-CD2 4.43Å; M139-W150 HydrophobicContact CB-CE3 4.02Å; M139-W150 HydrophobicContact CB-CH2 3.88Å; M139-W150 HydrophobicContact CB-CZ2 4.29Å; M139-W150 HydrophobicContact CB-CZ3 3.73Å; M139-W150 HydrophobicContact CG-CH2 4.34Å; M139-W150 HydrophobicContact CG-CZ2 4.26Å; M139-W150 HydrophobicContact SD-CH2 4.25Å; M139-W150 HydrophobicContact SD-CZ2 4Å; M139-I163 HydrophobicContact CB-CB 4.17Å; M139-I163 HydrophobicContact CB-CG2 4.25Å; M139-I163 HydrophobicContact CE-CD1 3.94Å; M139-I163 HydrophobicContact CE-CG2 4.33Å; M139-I163 PolarHBondContact N-O 2.9Å; M139-Y214 HydrophobicContact CE-CD1 4.3Å; M139-Y214 HydrophobicContact CE-CE1 3.87Å; M139-L242 HydrophobicContact CE-CD2 4.38Å
140	K	83	Confident	79.8	Confident	58 Å²	58	59.5 Å²	59.5	25%	0.252	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	139.5	178	-82.8	-89.2	176.2	-174.8	0	109.7	I148 Y149 I151	K140-I148 WeakPolarHBondContact O-CA 3.42Å; K140-Y149 HydrophobicContact CB-CD1 4.44Å; K140-Y149 HydrophobicContact CB-CE1 3.95Å; K140-Y149 HydrophobicContact CB-CE2 4.1Å; K140-Y149 PolarHBondContact N-O 2.9Å; K140-Y149 PolarHBondContact O-N 3.26Å; K140-I151 HydrophobicContact CB-CD1 4.04Å; K140-I151 HydrophobicContact CB-CG1 4.28Å; K140-I151 HydrophobicContact CD-CD1 4.41Å; K140-I151 HydrophobicContact CG-CD1 3.65Å; K140-I151 HydrophobicContact CG-CG1 4.13Å
141	I	76.3	Confident	79.8	Confident	32 Å²	32	54.9 Å²	54.9	16%	0.164	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	121.7	175.1	-57.1	175.6	0	0	0	106.9	H35 I148 F239 L242	H35-I141 HydrophobicContact CB-CD1 4.34Å; I141-I148 HydrophobicContact CG1-CG1 4.41Å; I141-F239 HydrophobicContact CG2-CD1 3.88Å; I141-F239 HydrophobicContact CG2-CE1 3.9Å; I141-L242 HydrophobicContact CD1-CD1 4.5Å
142	N	73.3	Confident	80.2	Confident	50 Å²	50	55.4 Å²	55.4	27%	0.267	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	114.4	164.4	-169.7	-7.1	0	0	0	108.1	E144 T145 N146 E147 Y149	N142-E144 VanDerWaalsContact C-N 3.33Å; N142-E144 PolarHBondContact OD1-N 3.22Å; N142-T145 VanDerWaalsContact CB-OG1 3.25Å; N142-T145 WeakPolarHBondContact CB-OG1 3.32Å; N142-T145 PolarHBondContact ND2-OG1 2.95Å; N142-N146 WeakPolarHBondContact O-CA 3.36Å; N142-N146 PolarHBondContact O-N 3.43Å; N142-E147 HydrophobicContact CB-CB 4.47Å; N142-E147 PolarHBondContact N-O 2.73Å; N142-E147 PolarHBondContact O-N 3.09Å; N142-Y149 HydrophobicContact CB-CE1 4.07Å
143	I	67.8	Low	80.3	Confident	46 Å²	46	57.8 Å²	57.8	24%	0.236	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-28	-175.7	-59.6	172.4	0	0	0	110.8	I37 L43 Y45	I37-I143 HydrophobicContact CD1-CD1 4.41Å; L43-I143 HydrophobicContact CD1-CD1 3.69Å; L43-I143 HydrophobicContact CD2-CD1 3.52Å; L43-I143 HydrophobicContact CG-CD1 4.22Å; Y45-I143 WeakPolarHBondContact OH-CD1 3.45Å
144	E	66.4	Low	80.4	Confident	183 Å²	183	57.8 Å²	57.8	86%	0.855	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-41.8	179.9	-64.6	178.6	179.2	0	0	111.5	N142	N142-E144 VanDerWaalsContact C-N 3.33Å; N142-E144 PolarHBondContact OD1-N 3.22Å
145	T	65.6	Low	80.5	Confident	68 Å²	68	53.9 Å²	53.9	42%	0.417	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-6.9	-179.6	61.2	0	0	0	0	113.4	N142 E147	N142-T145 VanDerWaalsContact CB-OG1 3.25Å; N142-T145 WeakPolarHBondContact CB-OG1 3.32Å; N142-T145 PolarHBondContact ND2-OG1 2.95Å; T145-E147 WeakPolarHBondContact CB-OE2 3.36Å; T145-E147 PolarHBondContact O-N 2.73Å; T145-E147 WeakPolarHBondContact OG1-CB 3.26Å; T145-E147 VanDerWaalsContact OG1-CD 3.29Å; T145-E147 WeakPolarHBondContact OG1-CG 3.45Å; T145-E147 PolarHBondContact OG1-OE2 3.28Å
146	N	64.1	Low	80.5	Confident	47 Å²	47	51.1 Å²	51.1	25%	0.251	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	48.4	-168.9	-86.3	-16.1	0	0	0	110.4	N142 F239	N142-N146 WeakPolarHBondContact O-CA 3.36Å; N142-N146 PolarHBondContact O-N 3.43Å; N146-F239 HydrophobicContact CB-CD2 4.14Å; N146-F239 HydrophobicContact CB-CE2 3.5Å; N146-F239 HydrophobicContact CB-CZ 3.78Å; N146-F239 WeakPolarHBondContact O-CZ 3.25Å
147	E	67.6	Low	80.6	Confident	44 Å²	44	55.3 Å²	55.3	21%	0.206	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	138.7	178.1	-70.7	172.2	145.4	0	0	110.6	N142 T145	N142-E147 HydrophobicContact CB-CB 4.47Å; N142-E147 PolarHBondContact N-O 2.73Å; N142-E147 PolarHBondContact O-N 3.09Å; T145-E147 WeakPolarHBondContact CB-OE2 3.36Å; T145-E147 PolarHBondContact O-N 2.73Å; T145-E147 WeakPolarHBondContact OG1-CB 3.26Å; T145-E147 VanDerWaalsContact OG1-CD 3.29Å; T145-E147 WeakPolarHBondContact OG1-CG 3.45Å; T145-E147 PolarHBondContact OG1-OE2 3.28Å
148	I	71.4	Confident	80.6	Confident	40 Å²	40	54 Å²	54	21%	0.205	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	124.5	174	-54.9	174.8	0	0	0	108.1	M139 K140 I141 F217 F239 L242	M139-I148 HydrophobicContact CG-CG2 3.54Å; M139-I148 HydrophobicContact SD-CG2 3.78Å; K140-I148 WeakPolarHBondContact O-CA 3.42Å; I141-I148 HydrophobicContact CG1-CG1 4.41Å; I148-F217 HydrophobicContact CD1-CD1 3.7Å; I148-F217 HydrophobicContact CD1-CE1 3.39Å; I148-F217 HydrophobicContact CD1-CZ 3.99Å; I148-F239 HydrophobicContact CD1-CD1 4.5Å; I148-F239 HydrophobicContact CD1-CE1 3.86Å; I148-F239 HydrophobicContact CD1-CZ 4.4Å; I148-F239 HydrophobicContact CG1-CE1 3.58Å; I148-F239 HydrophobicContact CG1-CZ 4.17Å; I148-L242 HydrophobicContact CD1-CD1 3.45Å; I148-L242 VanDerWaalsContact CD1-CD1 3.45Å
149	Y	79	Confident	80.7	Confident	105 Å²	105	55.7 Å²	55.7	41%	0.412	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	154.5	179.5	63.6	-77.7	0	0	0	111.2	K140 N142 I151	K140-Y149 HydrophobicContact CB-CD1 4.44Å; K140-Y149 HydrophobicContact CB-CE1 3.95Å; K140-Y149 HydrophobicContact CB-CE2 4.1Å; K140-Y149 PolarHBondContact N-O 2.9Å; K140-Y149 PolarHBondContact O-N 3.26Å; N142-Y149 HydrophobicContact CB-CE1 4.07Å; Y149-I151 HydrophobicContact CD2-CD1 4.1Å; Y149-I151 HydrophobicContact CD2-CG1 3.59Å; Y149-I151 HydrophobicContact CE2-CD1 3.26Å; Y149-I151 HydrophobicContact CE2-CG1 3.29Å
150	W	82.5	Confident	80.9	Confident	51 Å²	51	56 Å²	56	19%	0.193	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	126	179.1	-69.1	96.6	0	0	0	110.4	F137 I138 M139 L165 I292	F137-W150 HydrophobicContact CB-CE3 3.89Å; F137-W150 HydrophobicContact CB-CZ3 4.44Å; F137-W150 HydrophobicContact CD1-CB 4.35Å; I138-W150 WeakPolarHBondContact O-CA 3.38Å; M139-W150 HydrophobicContact CB-CD2 4.43Å; M139-W150 HydrophobicContact CB-CE3 4.02Å; M139-W150 HydrophobicContact CB-CH2 3.88Å; M139-W150 HydrophobicContact CB-CZ2 4.29Å; M139-W150 HydrophobicContact CB-CZ3 3.73Å; M139-W150 HydrophobicContact CG-CH2 4.34Å; M139-W150 HydrophobicContact CG-CZ2 4.26Å; M139-W150 HydrophobicContact SD-CH2 4.25Å; M139-W150 HydrophobicContact SD-CZ2 4Å; W150-L165 HydrophobicContact CE3-CB 4.19Å; W150-L165 HydrophobicContact CH2-CB 3.74Å; W150-L165 HydrophobicContact CH2-CD1 4.47Å; W150-L165 HydrophobicContact CZ3-CB 3.54Å; W150-I292 HydrophobicContact CH2-CD1 4.27Å; W150-I292 HydrophobicContact CH2-CG1 4.36Å; W150-I292 HydrophobicContact CZ2-CD1 4.19Å
151	I	86.6	Confident	81.2	Confident	50 Å²	50	53.2 Å²	53.2	26%	0.256	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	132	175	-51.5	-178	0	0	0	109.6	I138 K140 Y149 K153	I138-I151 PolarHBondContact N-O 3.41Å; I138-I151 PolarHBondContact O-N 3Å; K140-I151 HydrophobicContact CB-CD1 4.04Å; K140-I151 HydrophobicContact CB-CG1 4.28Å; K140-I151 HydrophobicContact CD-CD1 4.41Å; K140-I151 HydrophobicContact CG-CD1 3.65Å; K140-I151 HydrophobicContact CG-CG1 4.13Å; Y149-I151 HydrophobicContact CD2-CD1 4.1Å; Y149-I151 HydrophobicContact CD2-CG1 3.59Å; Y149-I151 HydrophobicContact CE2-CD1 3.26Å; Y149-I151 HydrophobicContact CE2-CG1 3.29Å; I151-K153 HydrophobicContact CG2-CG 4.15Å; I151-K153 PolarHBondContact O-N 2.9Å
152	L	88.9	Confident	81.9	Confident	52 Å²	52	51.9 Å²	51.9	27%	0.272	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	115.9	170.9	-166.1	75.6	0	0	0	110.6	K135 F137 Y226	K135-L152 HydrophobicContact CB-CD1 3.87Å; K135-L152 HydrophobicContact CB-CD2 4.09Å; K135-L152 HydrophobicContact CB-CG 3.82Å; K135-L152 HydrophobicContact CD-CD2 3.41Å; K135-L152 VanDerWaalsContact CD-CD2 3.41Å; K135-L152 HydrophobicContact CD-CG 3.94Å; K135-L152 HydrophobicContact CG-CD2 4.36Å; K135-L152 HydrophobicContact CG-CG 4.42Å; F137-L152 HydrophobicContact CD1-CD1 4.21Å; F137-L152 HydrophobicContact CD2-CD1 4.2Å; F137-L152 HydrophobicContact CE1-CD1 4.13Å; F137-L152 HydrophobicContact CE2-CD1 4.09Å; F137-L152 HydrophobicContact CG-CD1 4.25Å; F137-L152 HydrophobicContact CZ-CD1 4.06Å; L152-Y226 WeakPolarHBondContact CB-OH 3.45Å
153	K	90.2	Very high	82.7	Confident	59 Å²	59	49.5 Å²	49.5	26%	0.257	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	153.9	175.2	-66.3	-154.5	-172.5	178	0	112.4	K135 F136 I138 I151 F157	K135-K153 CarbonylContact C-O 3.51Å; K135-K153 VanDerWaalsContact CA-O 3.3Å; K135-K153 WeakPolarHBondContact CA-O 3.37Å; F136-K153 PolarHBondContact N-O 3.38Å; F136-K153 PolarHBondContact O-N 2.84Å; I138-K153 HydrophobicContact CD1-CB 3.63Å; I138-K153 HydrophobicContact CD1-CD 3.82Å; I138-K153 HydrophobicContact CD1-CG 3.84Å; I138-K153 HydrophobicContact CG1-CB 4.35Å; I151-K153 HydrophobicContact CG2-CG 4.15Å; I151-K153 PolarHBondContact O-N 2.9Å; K153-F157 HydrophobicContact CD-CB 4.37Å
154	K	92.6	Very high	83.9	Confident	68 Å²	68	47.3 Å²	47.3	30%	0.296	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	148.1	171.9	-60.5	-178.7	172.1	-172.2	0	110.5	E133 K134 K156 F157	E133-K154 HydrophobicContact CB-CD 4.46Å; E133-K154 HydrophobicContact CG-CD 4.19Å; E133-K154 IonicContact OE1-NZ 3.34Å; E133-K154 PolarHBondContact OE1-NZ 2.87Å; K134-K154 CarbonylContact O-C 3.55Å; K134-K154 WeakPolarHBondContact O-CA 3.34Å; K154-K156 HydrophobicContact CB-CG 4.25Å; K154-K156 PolarHBondContact O-N 2.99Å; K154-F157 HydrophobicContact CB-CD2 3.87Å; K154-F157 HydrophobicContact CB-CE2 4.34Å; K154-F157 HydrophobicContact CD-CE2 4.28Å; K154-F157 HydrophobicContact CG-CD2 4.48Å; K154-F157 PolarHBondContact O-N 3.35Å
155	S	90.2	Very high	85.1	Confident	7 Å²	7	38.8 Å²	38.8	5%	0.049	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-53.3	-39.5	-177.5	-177.2	0	0	0	0	112.9	N54 N132 K134 F157 I158	N54-S155 PolarHBondContact ND2-O 3.22Å; N54-S155 PolarHBondContact ND2-OG 3.09Å; N132-S155 PolarHBondContact O-N 3.26Å; K134-S155 WeakPolarHBondContact O-CB 3.47Å; K134-S155 PolarHBondContact O-N 2.84Å; S155-F157 PolarHBondContact O-N 3.4Å; S155-F157 VanDerWaalsContact O-N 3.14Å; S155-I158 WeakPolarHBondContact O-CB 3.47Å; S155-I158 WeakPolarHBondContact O-CG1 3.26Å; S155-I158 PolarHBondContact O-N 3.45Å; S155-I158 VanDerWaalsContact O-N 3.13Å
156	K	90.4	Very high	86.3	Confident	69 Å²	69	35.6 Å²	35.6	30%	0.3	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-61	-21.3	176.9	71.3	178.2	-171.3	173.3	0	115.2	E55 N132 K154	E55-K156 HydrophobicContact CB-CB 4.49Å; N132-K156 HydrophobicContact CB-CB 4.29Å; N132-K156 PolarHBondContact O-N 3.15Å; K154-K156 HydrophobicContact CB-CG 4.25Å; K154-K156 PolarHBondContact O-N 2.99Å
157	F	90.8	Very high	87.5	Confident	100 Å²	100	36.4 Å²	36.4	44%	0.439	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-98.7	6.8	-178.9	-63	-57.8	0	0	0	113.1	K153 K154 S155 H159	K153-F157 HydrophobicContact CD-CB 4.37Å; K154-F157 HydrophobicContact CB-CD2 3.87Å; K154-F157 HydrophobicContact CB-CE2 4.34Å; K154-F157 HydrophobicContact CD-CE2 4.28Å; K154-F157 HydrophobicContact CG-CD2 4.48Å; K154-F157 PolarHBondContact O-N 3.35Å; S155-F157 PolarHBondContact O-N 3.4Å; S155-F157 VanDerWaalsContact O-N 3.14Å; F157-H159 PolarHBondContact O-CE1 3.18Å; F157-H159 PolarHBondContact O-ND1 2.78Å
158	I	90.8	Very high	88.3	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.167	C	C	.	.			trans	-78	126.9	171.9	-61.3	174.4	0	0	0	107.9	N54 F136 I138 S155 I164 P173 V295	N54-I158 WeakPolarHBondContact CB-O 3.32Å; F136-I158 HydrophobicContact CB-CD1 4.13Å; F136-I158 HydrophobicContact CD2-CD1 3.84Å; F136-I158 HydrophobicContact CG-CD1 4.17Å; I138-I158 HydrophobicContact CD1-CG1 4.18Å; S155-I158 WeakPolarHBondContact O-CB 3.47Å; S155-I158 WeakPolarHBondContact O-CG1 3.26Å; S155-I158 PolarHBondContact O-N 3.45Å; S155-I158 VanDerWaalsContact O-N 3.13Å; I158-I164 HydrophobicContact CG2-CG2 4.44Å; I158-P173 HydrophobicContact CD1-CB 3.67Å; I158-P173 HydrophobicContact CD1-CG 3.48Å; I158-P173 VanDerWaalsContact CD1-CG 3.48Å; I158-V295 HydrophobicContact CG2-CB 4.4Å; I158-V295 HydrophobicContact CG2-CG1 4.1Å; I158-V295 HydrophobicContact CG2-CG2 3.63Å
159	H	91.1	Very high	88.9	Confident	38 Å²	38	39 Å²	39	18%	0.176	18%	0.18	C	C	.	.			trans	-118.4	160.4	178.2	-59	80.3	0	0	0	110.4	I48 F157 G161 D162	I48-H159 VanDerWaalsContact CG2-CD2 3.44Å; I48-H159 WeakPolarHBondContact CG2-CD2 3.22Å; F157-H159 PolarHBondContact O-CE1 3.18Å; F157-H159 PolarHBondContact O-ND1 2.78Å; H159-G161 PolarHBondContact O-N 2.92Å; H159-D162 PolarHBondContact N-OD2 2.91Å; H159-D162 IonicContact ND1-OD2 2.92Å; H159-D162 WeakPolarHBondContact O-CB 3.49Å; H159-D162 PolarHBondContact O-N 3.41Å; H159-D162 VanDerWaalsContact O-N 3.14Å
160	V	90.7	Very high	89.2	Confident	8 Å²	8	36.9 Å²	36.9	5%	0.048	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	133.3	171.9	-178.1	0	0	0	0	110.2	V32 Y51 T298	V32-V160 HydrophobicContact CB-CG1 4.17Å; V32-V160 HydrophobicContact CG1-CG1 3.83Å; V32-V160 HydrophobicContact CG2-CG1 3.19Å; Y51-V160 HydrophobicContact CD1-CG1 4.47Å; Y51-V160 HydrophobicContact CD1-CG2 4.18Å; Y51-V160 HydrophobicContact CD2-CB 3.89Å; Y51-V160 HydrophobicContact CD2-CG1 4.17Å; Y51-V160 HydrophobicContact CD2-CG2 4.26Å; Y51-V160 HydrophobicContact CE2-CB 4.42Å; Y51-V160 HydrophobicContact CE2-CG1 4.24Å; Y51-V160 HydrophobicContact CG-CB 3.93Å; Y51-V160 HydrophobicContact CG-CG1 4.29Å; Y51-V160 HydrophobicContact CG-CG2 3.78Å; V160-T298 HydrophobicContact CG2-CG2 3.93Å; V160-T298 WeakPolarHBondContact CG2-OG1 3.49Å
161	G	88.1	Confident	89.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	-7.2	-176.7	0	0	0	0	0	115.5	H35 H159 V295	H35-G161 PolarHBondContact N-O 2.7Å; H159-G161 PolarHBondContact O-N 2.92Å; G161-V295 PolarHBondContact N-O 3.46Å
162	D	90.9	Very high	89.6	Confident	5 Å²	5	35.1 Å²	35.1	3%	0.027	17%	0.166	C	C	.	.			trans	-72.7	145.1	170.3	-70.5	-23.8	0	0	0	110.4	R36 I138 H159 V295	R36-D162 IonicContact CZ-OD1 3.72Å; R36-D162 VanDerWaalsContact CZ-OD1 3.27Å; R36-D162 IonicContact NE-OD1 3.74Å; R36-D162 PolarHBondContact NE-OD1 3.15Å; R36-D162 IonicContact NH2-OD1 2.9Å; R36-D162 PolarHBondContact NH2-OD1 3.14Å; R36-D162 IonicContact NH2-OD2 3.87Å; R36-D162 PolarHBondContact NH2-OD2 3.48Å; I138-D162 HydrophobicContact CG2-CB 4.25Å; H159-D162 PolarHBondContact N-OD2 2.91Å; H159-D162 IonicContact ND1-OD2 2.92Å; H159-D162 WeakPolarHBondContact O-CB 3.49Å; H159-D162 PolarHBondContact O-N 3.41Å; H159-D162 VanDerWaalsContact O-N 3.14Å; D162-V295 VanDerWaalsContact O-CG2 3.32Å; D162-V295 WeakPolarHBondContact O-CG2 3.36Å; D162-V295 PolarHBondContact O-N 3.08Å
163	I	91.8	Very high	89.7	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	125.7	176.2	-61.5	-173.8	0	0	0	108.4	A34 H35 I138 M139 L179 Y214 I292 G293 L294	A34-I163 HydrophobicContact CB-CD1 4.36Å; H35-I163 WeakPolarHBondContact CE1-CD1 3.43Å; I138-I163 CarbonylContact C-O 3.46Å; I138-I163 VanDerWaalsContact CA-O 3.32Å; I138-I163 WeakPolarHBondContact CA-O 3.18Å; M139-I163 HydrophobicContact CB-CB 4.17Å; M139-I163 HydrophobicContact CB-CG2 4.25Å; M139-I163 HydrophobicContact CE-CD1 3.94Å; M139-I163 HydrophobicContact CE-CG2 4.33Å; M139-I163 PolarHBondContact N-O 2.9Å; I163-L179 HydrophobicContact CD1-CD1 3.99Å; I163-L179 HydrophobicContact CG1-CD1 4.34Å; I163-L179 HydrophobicContact CG2-CD1 4.24Å; I163-Y214 HydrophobicContact CD1-CE1 3.55Å; I163-Y214 WeakPolarHBondContact CD1-OH 3.36Å; I163-I292 HydrophobicContact CG2-CG2 3.48Å; I163-I292 VanDerWaalsContact CG2-CG2 3.48Å; I163-G293 WeakPolarHBondContact CA-O 3.38Å; I163-L294 HydrophobicContact CG1-CD1 3.84Å
164	I	92.3	Very high	89.8	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	149.6	-175.1	72.1	171.7	0	0	0	112.1	F137 I138 I158 P173 L176 I292 G293 V295	F137-I164 CarbonylContact O-C 3.49Å; F137-I164 VanDerWaalsContact O-CA 3.24Å; F137-I164 WeakPolarHBondContact O-CA 3.29Å; I138-I164 HydrophobicContact CG1-CG2 4.13Å; I158-I164 HydrophobicContact CG2-CG2 4.44Å; I164-P173 HydrophobicContact CD1-CG 3.57Å; I164-L176 HydrophobicContact CD1-CD1 3.67Å; I164-L176 HydrophobicContact CD1-CD2 3.46Å; I164-L176 VanDerWaalsContact CD1-CD2 3.46Å; I164-L176 HydrophobicContact CD1-CG 4.19Å; I164-L176 HydrophobicContact CG1-CD1 4.02Å; I164-L176 HydrophobicContact CG1-CD2 3.86Å; I164-I292 WeakPolarHBondContact O-CA 3.19Å; I164-G293 PolarHBondContact N-O 3.12Å; I164-G293 PolarHBondContact O-N 3.5Å; I164-V295 HydrophobicContact CD1-CG2 4.32Å; I164-V295 HydrophobicContact CG1-CG2 4.4Å; I164-V295 HydrophobicContact CG2-CG2 3.89Å
165	L	91.4	Very high	89.8	Confident	3 Å²	3	26.9 Å²	26.9	2%	0.016	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126.8	170.9	-179.4	89.1	0	0	0	109	F137 W150 L218 I223 Y290 I291 I292	F137-L165 HydrophobicContact CB-CB 4.03Å; F137-L165 HydrophobicContact CB-CD2 4.41Å; F137-L165 HydrophobicContact CD2-CD2 4.48Å; F137-L165 PolarHBondContact O-N 3.28Å; W150-L165 HydrophobicContact CE3-CB 4.19Å; W150-L165 HydrophobicContact CH2-CB 3.74Å; W150-L165 HydrophobicContact CH2-CD1 4.47Å; W150-L165 HydrophobicContact CZ3-CB 3.54Å; L165-L218 HydrophobicContact CD1-CD1 4.39Å; L165-L218 HydrophobicContact CD1-CD2 4.43Å; L165-I223 HydrophobicContact CD2-CD1 3.88Å; L165-I223 HydrophobicContact CD2-CG1 4.32Å; L165-Y290 HydrophobicContact CD1-CD2 4.42Å; L165-Y290 HydrophobicContact CD1-CG 4.44Å; L165-I291 WeakPolarHBondContact CA-O 3.39Å; L165-I292 HydrophobicContact CD1-CG1 3.83Å
166	C	90.4	Very high	90	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.007	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	136.3	176.3	-61.3	0	0	0	0	109.9	F172 Y290 I291	C166-F172 HydrophobicContact CB-CD1 3.95Å; C166-F172 HydrophobicContact CB-CE1 3.77Å; C166-Y290 CarbonylContact O-C 3.48Å; C166-Y290 VanDerWaalsContact O-CA 3.27Å; C166-Y290 WeakPolarHBondContact O-CA 3.41Å; C166-I291 HydrophobicContact CB-CD1 4.26Å; C166-I291 HydrophobicContact CB-CG1 3.81Å; C166-I291 PolarHBondContact N-O 3.41Å; C166-I291 VanDerWaalsContact N-O 3.08Å; C166-I291 PolarHBondContact O-N 2.93Å
167	K	89.1	Confident	90.1	Very high	65 Å²	65	23.2 Å²	23.2	28%	0.283	11%	0.112	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	166.8	-178.4	-58.9	-179.9	176.7	-175.5	0	112.1	N169 E170 L285	K167-N169 PolarHBondContact O-N 3.21Å; K167-E170 HydrophobicContact CB-CG 4.12Å; K167-E170 PolarHBondContact N-OE2 3.15Å; K167-E170 WeakPolarHBondContact O-CB 3.43Å; K167-E170 PolarHBondContact O-N 3.48Å; K167-E170 VanDerWaalsContact O-N 3.13Å; K167-L285 WeakPolarHBondContact O-CD2 3.25Å
168	N	86	Confident	90.2	Very high	52 Å²	52	18.5 Å²	18.5	28%	0.278	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	138.4	173.9	-162.1	14	0	0	0	111.1	E170 L285 K286 N287 T288 K289	N168-E170 PolarHBondContact O-N 3.22Å; N168-L285 PolarHBondContact OD1-O 3.19Å; N168-K286 WeakPolarHBondContact OD1-CA 3.31Å; N168-N287 PolarHBondContact OD1-N 3.06Å; N168-T288 WeakPolarHBondContact CA-O 3.36Å; N168-T288 WeakPolarHBondContact CB-O 3.32Å; N168-K289 PolarHBondContact N-O 3.17Å
169	N	83.9	Confident	90.2	Very high	87 Å²	87	18.5 Å²	18.5	47%	0.465	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	5.2	-175.6	-59.5	-55.2	0	0	0	116.9	K167 L285 K286	K167-N169 PolarHBondContact O-N 3.21Å; N169-L285 WeakPolarHBondContact CA-O 3.36Å; N169-L285 PolarHBondContact N-O 2.8Å; N169-K286 VanDerWaalsContact OD1-CD 3.27Å; N169-K286 WeakPolarHBondContact OD1-CD 3.34Å; N169-K286 VanDerWaalsContact OD1-CE 3.27Å; N169-K286 WeakPolarHBondContact OD1-CE 3.47Å; N169-K286 PolarHBondContact OD1-NZ 3.41Å
170	E	85.4	Confident	90.1	Very high	60 Å²	60	16.7 Å²	16.7	28%	0.28	8%	0.083	S	C	.	.	P	Polyproline II helix	trans	-83.1	145.9	173.6	-68.2	-177.2	163.5	0	0	112.3	K167 N168 K284 L285	K167-E170 HydrophobicContact CB-CG 4.12Å; K167-E170 PolarHBondContact N-OE2 3.15Å; K167-E170 WeakPolarHBondContact O-CB 3.43Å; K167-E170 PolarHBondContact O-N 3.48Å; K167-E170 VanDerWaalsContact O-N 3.13Å; N168-E170 PolarHBondContact O-N 3.22Å; E170-K284 WeakPolarHBondContact O-CA 3.48Å; E170-L285 PolarHBondContact O-N 3.11Å; E170-L285 VanDerWaalsContact O-N 3.15Å
171	E	86	Confident	90	Very high	59 Å²	59	16.3 Å²	16.3	28%	0.276	8%	0.081	S	C	.	.	B	Isolated β-bridge	trans	-85.1	135.6	173.9	-71.5	172.2	174	0	0	110.7	K134 F136 N194 C283 K284	K134-E171 IonicContact NZ-OE2 3.23Å; K134-E171 PolarHBondContact NZ-OE2 3.49Å; F136-E171 WeakPolarHBondContact CE1-O 3.44Å; F136-E171 VanDerWaalsContact CZ-O 3.26Å; F136-E171 WeakPolarHBondContact CZ-O 3.09Å; E171-N194 PolarHBondContact OE1-ND2 2.92Å; E171-C283 WeakPolarHBondContact CA-O 3.39Å; E171-K284 HydrophobicContact CB-CG 4.44Å; E171-K284 HydrophobicContact CG-CD 4.08Å; E171-K284 HydrophobicContact CG-CG 3.48Å; E171-K284 VanDerWaalsContact CG-CG 3.48Å; E171-K284 WeakPolarHBondContact OE1-CE 3.47Å; E171-K284 IonicContact OE1-NZ 3.94Å; E171-K284 PolarHBondContact OE1-NZ 3.44Å
172	F	91.2	Very high	89.9	Confident	4 Å²	4	17.4 Å²	17.4	2%	0.018	9%	0.088	C	C	.	.	P	Polyproline II helix	trans	-70.7	134.3	177.8	-54	-51.4	0	0	0	111.9	C166 L176 I190 L279 G282 C283 L285 I291	C166-F172 HydrophobicContact CB-CD1 3.95Å; C166-F172 HydrophobicContact CB-CE1 3.77Å; F172-L176 HydrophobicContact CB-CD1 4.14Å; F172-L176 HydrophobicContact CD1-CD1 3.78Å; F172-L176 HydrophobicContact CG-CD1 4.04Å; F172-I190 HydrophobicContact CE2-CG2 3.98Å; F172-I190 HydrophobicContact CZ-CG2 4.18Å; F172-L279 HydrophobicContact CD2-CB 3.93Å; F172-L279 HydrophobicContact CE1-CD1 4.19Å; F172-L279 HydrophobicContact CE2-CB 3.91Å; F172-L279 HydrophobicContact CE2-CD1 3.93Å; F172-L279 HydrophobicContact CE2-CD2 4.23Å; F172-L279 HydrophobicContact CE2-CG 4.26Å; F172-L279 HydrophobicContact CZ-CD1 3.75Å; F172-G282 PolarHBondContact O-N 2.91Å; F172-C283 HydrophobicContact CD2-CB 3.73Å; F172-C283 WeakPolarHBondContact CD2-O 3.36Å; F172-C283 HydrophobicContact CE2-CB 3.84Å; F172-C283 PolarHBondContact N-O 3.2Å; F172-L285 HydrophobicContact CE1-CB 4.24Å; F172-L285 HydrophobicContact CZ-CB 3.98Å; F172-L285 HydrophobicContact CZ-CD1 3.97Å; F172-I291 HydrophobicContact CD1-CD1 4.18Å; F172-I291 HydrophobicContact CE1-CD1 3.3Å; F172-I291 HydrophobicContact CE1-CG1 4.13Å; F172-I291 HydrophobicContact CZ-CD1 3.66Å
173	P	90.2	Very high	89.3	Confident	6 Å²	6	19.1 Å²	19.1	4%	0.039	10%	0.097	C	C	.	.	S	Bend	trans	-78	-19.3	-175.9	28.5	-32.4	0	0	0	114.4	N54 F136 I158 I164 K281	N54-P173 PolarHBondContact ND2-O 3.42Å; N54-P173 PolarHBondContact OD1-O 3.05Å; F136-P173 HydrophobicContact CD1-CG 4.13Å; F136-P173 HydrophobicContact CD2-CB 3.98Å; F136-P173 HydrophobicContact CD2-CG 3.96Å; F136-P173 HydrophobicContact CE1-CB 4.47Å; F136-P173 HydrophobicContact CE1-CG 4.04Å; F136-P173 HydrophobicContact CE2-CB 3.57Å; F136-P173 HydrophobicContact CE2-CG 3.89Å; F136-P173 HydrophobicContact CG-CG 4.09Å; F136-P173 HydrophobicContact CZ-CB 3.84Å; F136-P173 HydrophobicContact CZ-CG 3.92Å; I158-P173 HydrophobicContact CD1-CB 3.67Å; I158-P173 HydrophobicContact CD1-CG 3.48Å; I158-P173 VanDerWaalsContact CD1-CG 3.48Å; I164-P173 HydrophobicContact CD1-CG 3.57Å; P173-K281 WeakPolarHBondContact O-CD 3.35Å; P173-K281 VanDerWaalsContact O-CE 3.26Å; P173-K281 WeakPolarHBondContact O-CE 3.49Å; P173-K281 PolarHBondContact O-NZ 2.84Å
174	S	91.9	Very high	88.3	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	-159.6	172.4	-168.6	52.4	0	0	0	0	108.9	L176 V295 Y297	S174-L176 WeakPolarHBondContact O-CG 3.04Å; S174-L176 WeakPolarHBondContact OG-CD2 3.46Å; S174-V295 WeakPolarHBondContact OG-CG1 3.3Å; S174-Y297 VanDerWaalsContact CB-O 3.27Å; S174-Y297 WeakPolarHBondContact CB-O 3.29Å
175	D	93.1	Very high	87.4	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	130.7	174.6	-58.2	-17.6	0	0	0	109.2	L279 Y280 K281 I296 Y297 T302 K303	D175-L279 CarbonylContact C-O 3.48Å; D175-L279 VanDerWaalsContact CA-O 3.27Å; D175-L279 WeakPolarHBondContact CA-O 3.36Å; D175-Y280 WeakPolarHBondContact OD1-CA 3.39Å; D175-K281 PolarHBondContact OD1-N 3.04Å; D175-I296 HydrophobicContact CB-CD1 4.44Å; D175-I296 HydrophobicContact CB-CG1 4.18Å; D175-I296 WeakPolarHBondContact O-CG1 3.39Å; D175-I296 PolarHBondContact O-N 3.28Å; D175-Y297 HydrophobicContact CB-CD2 3.95Å; D175-Y297 HydrophobicContact CB-CG 4.46Å; D175-Y297 PolarHBondContact N-O 3.38Å; D175-Y297 VanDerWaalsContact N-O 3.12Å; D175-Y297 WeakPolarHBondContact OD2-CD2 3.45Å; D175-T302 WeakPolarHBondContact OD2-CA 3.19Å; D175-K303 PolarHBondContact OD2-N 3.32Å
176	L	93.9	Very high	86.8	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	147.4	-170.6	-45.5	171.7	0	0	0	111.6	I164 F172 S174 I278 L279 L294 V295	I164-L176 HydrophobicContact CD1-CD1 3.67Å; I164-L176 HydrophobicContact CD1-CD2 3.46Å; I164-L176 VanDerWaalsContact CD1-CD2 3.46Å; I164-L176 HydrophobicContact CD1-CG 4.19Å; I164-L176 HydrophobicContact CG1-CD1 4.02Å; I164-L176 HydrophobicContact CG1-CD2 3.86Å; F172-L176 HydrophobicContact CB-CD1 4.14Å; F172-L176 HydrophobicContact CD1-CD1 3.78Å; F172-L176 HydrophobicContact CG-CD1 4.04Å; S174-L176 WeakPolarHBondContact O-CG 3.04Å; S174-L176 WeakPolarHBondContact OG-CD2 3.46Å; L176-I278 CarbonylContact O-C 3.53Å; L176-I278 WeakPolarHBondContact O-CA 3.47Å; L176-I278 WeakPolarHBondContact O-CG1 3.43Å; L176-L279 HydrophobicContact CB-CB 4.26Å; L176-L279 PolarHBondContact N-O 2.7Å; L176-L279 PolarHBondContact O-N 3.5Å; L176-L294 CarbonylContact C-O 3.44Å; L176-L294 VanDerWaalsContact CA-O 3.23Å; L176-L294 WeakPolarHBondContact CA-O 3.48Å; L176-V295 HydrophobicContact CD2-CB 4.27Å; L176-V295 HydrophobicContact CD2-CG2 3.58Å
177	I	93.3	Very high	86.5	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	132.8	164	-65.8	169.5	0	0	0	108.8	L179 V246 I262 I273 G293 L294 I296	I177-L179 PolarHBondContact O-N 3.5Å; I177-V246 HydrophobicContact CD1-CG1 3.69Å; I177-I262 HydrophobicContact CG2-CD1 4.21Å; I177-I273 HydrophobicContact CD1-CD1 3.81Å; I177-G293 CarbonylContact O-C 3.37Å; I177-G293 WeakPolarHBondContact O-CA 3.46Å; I177-L294 HydrophobicContact CB-CB 4.49Å; I177-L294 PolarHBondContact N-O 3.4Å; I177-L294 PolarHBondContact O-N 3.34Å; I177-I296 HydrophobicContact CD1-CD1 4.28Å; I177-I296 HydrophobicContact CD1-CG2 3.44Å; I177-I296 VanDerWaalsContact CD1-CG2 3.44Å; I177-I296 HydrophobicContact CG1-CD1 3.92Å; I177-I296 HydrophobicContact CG1-CG1 4.39Å; I177-I296 HydrophobicContact CG1-CG2 3.88Å
178	I	93.2	Very high	86.4	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	119.2	-179.3	-54.8	158.9	0	0	0	109.7	C188 H204 C206 N277 L279	I178-C188 WeakPolarHBondContact CD1-SG 3.49Å; I178-H204 HydrophobicContact CD1-CB 3.64Å; I178-C206 HydrophobicContact CG2-CB 3.76Å; I178-N277 WeakPolarHBondContact CG1-O 3.18Å; I178-N277 PolarHBondContact N-O 2.86Å; I178-L279 HydrophobicContact CD1-CD1 4.31Å; I178-L279 HydrophobicContact CD1-CD2 3.88Å; I178-L279 HydrophobicContact CD1-CG 3.93Å; I178-L279 HydrophobicContact CG1-CD1 3.67Å; I178-L279 HydrophobicContact CG1-CD2 4.12Å; I178-L279 HydrophobicContact CG1-CG 3.6Å
179	L	89.8	Confident	86.4	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-35.5	176.3	-65.3	175	0	0	0	112.6	I163 I177 C206 T210 H211 Y214 I244 I292 L294	I163-L179 HydrophobicContact CD1-CD1 3.99Å; I163-L179 HydrophobicContact CG1-CD1 4.34Å; I163-L179 HydrophobicContact CG2-CD1 4.24Å; I177-L179 PolarHBondContact O-N 3.5Å; L179-C206 PolarHBondContact O-SG 2.91Å; L179-T210 HydrophobicContact CD2-CG2 4.25Å; L179-T210 CarbonylContact O-C 3.59Å; L179-T210 VanDerWaalsContact O-C 3.25Å; L179-T210 PolarHBondContact O-OG1 3.41Å; L179-H211 WeakPolarHBondContact O-CA 3.31Å; L179-H211 PolarHBondContact O-N 2.95Å; L179-Y214 HydrophobicContact CB-CD2 3.8Å; L179-Y214 HydrophobicContact CB-CE2 4.1Å; L179-Y214 HydrophobicContact CB-CG 4.08Å; L179-Y214 HydrophobicContact CD1-CD1 4.29Å; L179-Y214 HydrophobicContact CD1-CD2 4.23Å; L179-Y214 HydrophobicContact CD1-CE1 3.86Å; L179-Y214 HydrophobicContact CD1-CE2 3.79Å; L179-Y214 HydrophobicContact CD1-CG 4.46Å; L179-Y214 HydrophobicContact CD2-CD2 4.42Å; L179-Y214 HydrophobicContact CD2-CE2 3.95Å; L179-Y214 HydrophobicContact CG-CD2 4.38Å; L179-Y214 HydrophobicContact CG-CE2 4.17Å; L179-I244 HydrophobicContact CD2-CD1 4.21Å; L179-I292 HydrophobicContact CB-CG2 4.13Å; L179-I292 HydrophobicContact CD1-CG2 4.16Å; L179-I292 PolarHBondContact N-O 3.34Å; L179-L294 HydrophobicContact CD1-CB 3.9Å; L179-L294 HydrophobicContact CG-CB 4.2Å
180	S	89.6	Confident	86.5	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	154.4	176.6	-169.6	0	0	0	0	112	H211 I291 I292	S180-H211 PolarHBondContact OG-CE1 3.33Å; S180-H211 PolarHBondContact OG-ND1 3.13Å; S180-I291 WeakPolarHBondContact O-CA 3.27Å; S180-I292 PolarHBondContact N-O 3.35Å; S180-I292 PolarHBondContact O-N 3.13Å
181	T	88.9	Confident	86.2	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	152.8	-179.2	160.5	0	0	0	0	109.9	N183 K187 C206 H211	T181-N183 VanDerWaalsContact C-N 3.28Å; T181-N183 PolarHBondContact O-N 2.69Å; T181-N183 PolarHBondContact OG1-N 2.92Å; T181-N183 VanDerWaalsContact OG1-N 3.15Å; T181-K187 PolarHBondContact OG1-O 3.44Å; T181-C206 HydrophobicContact CG2-CB 3.94Å; T181-H211 PolarHBondContact O-CE1 2.89Å; T181-H211 VanDerWaalsContact O-CE1 3.23Å
182	S	84.6	Confident	85.5	Confident	22 Å²	22	23.2 Å²	23.2	15%	0.154	12%	0.121	C	C	.	.	S	Bend	trans	-66.8	-26.1	173.5	59.2	0	0	0	0	113.8	K289 Y290	S182-K289 PolarHBondContact OG-N 2.69Å; S182-Y290 PolarHBondContact N-O 3.28Å; S182-Y290 VanDerWaalsContact N-O 3.13Å
183	N	80.3	Confident	84	Confident	41 Å²	41	23.9 Å²	23.9	22%	0.219	13%	0.125	C	C	.	.	S	Bend	trans	-79.8	139.7	-171.1	-66.5	5.9	0	0	0	111.3	T181 N185 N186 N287 T288	T181-N183 VanDerWaalsContact C-N 3.28Å; T181-N183 PolarHBondContact O-N 2.69Å; T181-N183 PolarHBondContact OG1-N 2.92Å; T181-N183 VanDerWaalsContact OG1-N 3.15Å; N183-N185 PolarHBondContact O-N 3.42Å; N183-N185 VanDerWaalsContact O-N 3.14Å; N183-N186 PolarHBondContact O-N 2.89Å; N183-N287 PolarHBondContact ND2-O 3.28Å; N183-T288 VanDerWaalsContact ND2-CG2 3.26Å; N183-T288 WeakPolarHBondContact ND2-CG2 3.44Å
184	L	70.3	Confident	82.7	Confident	148 Å²	148	24.6 Å²	24.6	78%	0.775	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.3	-178.9	-68.1	168.4	0	0	0	113.3	N186	L184-N186 VanDerWaalsContact C-N 3.34Å; L184-N186 PolarHBondContact O-N 3.24Å
185	N	72.6	Confident	81.3	Confident	113 Å²	113	25.2 Å²	25.2	60%	0.604	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.7	11.4	-173.9	-65.4	-14	0	0	0	114.4	N183 K187	N183-N185 PolarHBondContact O-N 3.42Å; N183-N185 VanDerWaalsContact O-N 3.14Å; N185-K187 HydrophobicContact CB-CD 4.31Å; N185-K187 HydrophobicContact CB-CG 4.28Å; N185-K187 PolarHBondContact O-N 3.33Å
186	N	79.8	Confident	79.4	Confident	33 Å²	33	26.2 Å²	26.2	18%	0.176	14%	0.137	C	C	.	.	S	Bend	trans	56.9	15.7	-173.4	-53.7	-44.4	0	0	0	114.7	N183 L184 C206 L208 H211	N183-N186 PolarHBondContact O-N 2.89Å; L184-N186 VanDerWaalsContact C-N 3.34Å; L184-N186 PolarHBondContact O-N 3.24Å; N186-C206 HydrophobicContact CB-CB 4.38Å; N186-C206 PolarHBondContact O-N 3.45Å; N186-L208 WeakPolarHBondContact ND2-CD1 3.25Å; N186-H211 PolarHBondContact OD1-CD2 2.93Å; N186-H211 PolarHBondContact OD1-NE2 3.3Å
187	K	83.8	Confident	77	Confident	65 Å²	65	26.2 Å²	26.2	28%	0.283	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	147.8	177.9	-66.6	178.5	-176.6	-177.2	0	109.8	T181 N185 H204 Y205	T181-K187 PolarHBondContact OG1-O 3.44Å; N185-K187 HydrophobicContact CB-CD 4.31Å; N185-K187 HydrophobicContact CB-CG 4.28Å; N185-K187 PolarHBondContact O-N 3.33Å; K187-H204 CarbonylContact C-O 3.58Å; K187-H204 WeakPolarHBondContact CA-O 3.45Å; K187-Y205 HydrophobicContact CD-CE1 4.31Å; K187-Y205 HydrophobicContact CG-CD1 4.03Å; K187-Y205 HydrophobicContact CG-CE1 3.82Å
188	C	86	Confident	74.9	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	151	159	64.4	0	0	0	0	110.2	I178 H204 T288 I291	I178-C188 WeakPolarHBondContact CD1-SG 3.49Å; C188-H204 PolarHBondContact N-O 2.99Å; C188-H204 PolarHBondContact O-N 3.49Å; C188-T288 HydrophobicContact CB-CG2 3.91Å; C188-I291 HydrophobicContact CB-CG2 4.09Å
189	Y	85.8	Confident	73	Confident	36 Å²	36	33.2 Å²	33.2	14%	0.141	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	127.6	-175.6	-63.9	-73.1	0	0	0	108.2	I201 K202 T203 K286 N287 T288	Y189-I201 HydrophobicContact CD1-CG2 3.8Å; Y189-I201 HydrophobicContact CG-CG2 4.04Å; Y189-K202 WeakPolarHBondContact CA-O 3.31Å; Y189-T203 HydrophobicContact CD1-CG2 3.7Å; Y189-T203 HydrophobicContact CE1-CG2 3.52Å; Y189-K286 VanDerWaalsContact CB-O 3.25Å; Y189-K286 WeakPolarHBondContact CB-O 3.22Å; Y189-K286 PolarHBondContact O-N 3.4Å; Y189-N287 HydrophobicContact CD2-CB 3.8Å; Y189-N287 WeakPolarHBondContact CD2-O 3.28Å; Y189-N287 HydrophobicContact CG-CB 4.22Å; Y189-T288 HydrophobicContact CD2-CG2 4.36Å
190	I	86.9	Confident	71.7	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	151.8	179.7	66.8	172.5	0	0	0	110.4	F172 T192 I201 K202 H204 L279 C283 K284 L285	F172-I190 HydrophobicContact CE2-CG2 3.98Å; F172-I190 HydrophobicContact CZ-CG2 4.18Å; I190-T192 HydrophobicContact CD1-CG2 4.21Å; I190-T192 HydrophobicContact CG1-CG2 4.48Å; I190-I201 CarbonylContact O-C 3.57Å; I190-I201 WeakPolarHBondContact O-CA 3.41Å; I190-K202 HydrophobicContact CG1-CB 4.14Å; I190-K202 PolarHBondContact N-O 3.44Å; I190-K202 PolarHBondContact O-N 3.35Å; I190-H204 VanDerWaalsContact CD1-CD2 3.45Å; I190-H204 WeakPolarHBondContact CD1-CD2 3.29Å; I190-H204 VanDerWaalsContact CD1-NE2 3.31Å; I190-H204 WeakPolarHBondContact CD1-NE2 3.4Å; I190-L279 HydrophobicContact CD1-CD2 3.87Å; I190-L279 HydrophobicContact CG2-CD2 3.67Å; I190-C283 HydrophobicContact CD1-CB 4.35Å; I190-K284 CarbonylContact C-O 2.89Å; I190-K284 VanDerWaalsContact CA-O 3.31Å; I190-K284 WeakPolarHBondContact CA-O 3.13Å; I190-L285 HydrophobicContact CG2-CD1 4.32Å
191	T	78.5	Confident	70.9	Confident	12 Å²	12	37.8 Å²	37.8	7%	0.074	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	126.6	168.5	56.9	0	0	0	0	109.1	I201 C283 K284 K286	T191-I201 HydrophobicContact CG2-CG1 4.03Å; T191-C283 WeakPolarHBondContact O-CA 2.96Å; T191-K284 PolarHBondContact N-O 3.47Å; T191-K284 PolarHBondContact O-N 2.94Å; T191-K284 WeakPolarHBondContact OG1-CB 3.44Å; T191-K284 PolarHBondContact OG1-O 3.3Å; T191-K286 HydrophobicContact CG2-CB 4.23Å; T191-K286 HydrophobicContact CG2-CG 3.44Å; T191-K286 VanDerWaalsContact CG2-CG 3.44Å
192	T	70.8	Confident	70.2	Confident	7 Å²	7	40.7 Å²	40.7	4%	0.043	21%	0.21	C	C	.	.			trans	-93.9	-5.1	179.6	52.8	0	0	0	0	113.8	I190 N194 I195 D196 K202	I190-T192 HydrophobicContact CD1-CG2 4.21Å; I190-T192 HydrophobicContact CG1-CG2 4.48Å; T192-N194 CarbonylContact O-C 3.51Å; T192-N194 PolarHBondContact O-N 2.93Å; T192-I195 WeakPolarHBondContact O-CA 3.44Å; T192-I195 PolarHBondContact O-N 3.33Å; T192-D196 WeakPolarHBondContact CB-OD1 3.21Å; T192-D196 VanDerWaalsContact CB-OD2 3.31Å; T192-D196 WeakPolarHBondContact CB-OD2 3.4Å; T192-D196 PolarHBondContact O-N 3.38Å; T192-D196 PolarHBondContact OG1-OD1 3.02Å; T192-D196 PolarHBondContact OG1-OD2 3.38Å; T192-K202 HydrophobicContact CG2-CD 3.73Å; T192-K202 HydrophobicContact CG2-CG 4.4Å; T192-K202 WeakPolarHBondContact OG1-CE 3.41Å; T192-K202 PolarHBondContact OG1-NZ 2.88Å
193	V	60.8	Low	70.1	Confident	18 Å²	18	42.4 Å²	42.4	11%	0.109	22%	0.22	C	C	.	.	H	α-helix	trans	1.2	-69.1	154.8	167	0	0	0	0	113.9	G197 E198 N199 E1053	V193-G197 WeakPolarHBondContact O-CA 3.27Å; V193-G197 PolarHBondContact O-N 3.17Å; V193-E198 WeakPolarHBondContact CG2-O 3.43Å; V193-E198 PolarHBondContact N-O 3.47Å; V193-N199 VanDerWaalsContact CG2-OD1 3.27Å; V193-N199 WeakPolarHBondContact CG2-OD1 3.15Å; V193-E1053 CarbonylContact C-O 3.46Å; V193-E1053 WeakPolarHBondContact CA-O 3.46Å; V193-E1053 WeakPolarHBondContact CB-O 3.38Å; V193-E1053 WeakPolarHBondContact CG1-O 3.23Å
194	N	61.7	Low	70.4	Confident	21 Å²	21	41.2 Å²	41.2	11%	0.112	21%	0.213	C	C	.	.	H	α-helix	trans	-58.3	-57.8	179.3	-77	-18.6	0	0	0	111.8	E171 T192 G282 E1056	E171-N194 PolarHBondContact OE1-ND2 2.92Å; T192-N194 CarbonylContact O-C 3.51Å; T192-N194 PolarHBondContact O-N 2.93Å; N194-G282 VanDerWaalsContact CB-O 3.3Å; N194-G282 WeakPolarHBondContact CB-O 3.24Å; N194-G282 PolarHBondContact ND2-O 2.92Å; N194-E1056 WeakPolarHBondContact CA-OE1 3.43Å; N194-E1056 HydrophobicContact CB-CG 4.15Å; N194-E1056 VanDerWaalsContact CB-OE1 3.24Å; N194-E1056 WeakPolarHBondContact CB-OE1 3.29Å; N194-E1056 WeakPolarHBondContact O-CB 3.26Å; N194-E1056 WeakPolarHBondContact O-CG 3.3Å; N194-E1056 VanDerWaalsContact O-OE1 3.11Å
195	I	62.7	Low	71.2	Confident	13 Å²	13	38.6 Å²	38.6	7%	0.067	19%	0.193	C	C	.	.	H	α-helix	trans	-65.4	-49.3	-174	-63.2	173	0	0	0	115	T192 F255 Y280 C283 L304 G1034	T192-I195 WeakPolarHBondContact O-CA 3.44Å; T192-I195 PolarHBondContact O-N 3.33Å; I195-F255 HydrophobicContact CB-CZ 4.5Å; I195-F255 HydrophobicContact CD1-CD1 4.34Å; I195-F255 HydrophobicContact CD1-CE1 3.81Å; I195-F255 HydrophobicContact CD1-CZ 4.48Å; I195-F255 HydrophobicContact CG1-CE1 4.27Å; I195-F255 HydrophobicContact CG1-CZ 4.46Å; I195-F255 HydrophobicContact CG2-CD1 3.85Å; I195-F255 HydrophobicContact CG2-CD2 3.95Å; I195-F255 HydrophobicContact CG2-CE1 3.5Å; I195-F255 VanDerWaalsContact CG2-CE1 3.5Å; I195-F255 HydrophobicContact CG2-CE2 3.59Å; I195-F255 HydrophobicContact CG2-CG 4.07Å; I195-F255 HydrophobicContact CG2-CZ 3.35Å; I195-Y280 HydrophobicContact CD1-CD2 4.29Å; I195-Y280 HydrophobicContact CD1-CG 4.15Å; I195-C283 WeakPolarHBondContact CD1-SG 3.35Å; I195-L304 HydrophobicContact CG1-CD1 4.27Å; I195-G1034 CarbonylContact O-C 3.59Å; I195-G1034 WeakPolarHBondContact O-CA 3.37Å
196	D	53.2	Low	71.9	Confident	20 Å²	20	33.8 Å²	33.8	11%	0.107	17%	0.168	C	C	.	.	H	α-helix	trans	-118.1	-3.4	-170.2	52	19.4	0	0	0	113.2	T192 E198 K202 N1035	T192-D196 WeakPolarHBondContact CB-OD1 3.21Å; T192-D196 VanDerWaalsContact CB-OD2 3.31Å; T192-D196 WeakPolarHBondContact CB-OD2 3.4Å; T192-D196 PolarHBondContact O-N 3.38Å; T192-D196 PolarHBondContact OG1-OD1 3.02Å; T192-D196 PolarHBondContact OG1-OD2 3.38Å; D196-E198 HydrophobicContact CB-CG 4.39Å; D196-E198 PolarHBondContact O-N 3.17Å; D196-E198 WeakPolarHBondContact OD1-CB 3.44Å; D196-E198 PolarHBondContact OD1-N 3.27Å; D196-K202 IonicContact OD2-NZ 3.57Å; D196-K202 PolarHBondContact OD2-NZ 3.44Å; D196-N1035 PolarHBondContact O-ND2 2.95Å
197	G	43.9	Very low	72	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.166	C	C	.	.			trans	81.1	-24.9	-169.8	0	0	0	0	0	112.8	V193 N199 E1053	V193-G197 WeakPolarHBondContact O-CA 3.27Å; V193-G197 PolarHBondContact O-N 3.17Å; G197-N199 PolarHBondContact O-N 3.21Å; G197-E1053 VanDerWaalsContact CA-OE2 3.32Å; G197-E1053 WeakPolarHBondContact CA-OE2 3.48Å; G197-E1053 VanDerWaalsContact O-CA 3.24Å; G197-E1053 WeakPolarHBondContact O-CA 3.35Å; G197-E1053 WeakPolarHBondContact O-CB 3.41Å; G197-E1053 WeakPolarHBondContact O-CG 3.32Å
198	E	50.3	Low	71.9	Confident	78 Å²	78	35.2 Å²	35.2	36%	0.364	18%	0.178	S	C	.	.			trans	-62.7	115	-167.8	-62.2	-179	168.9	0	0	111.8	V193 D196 T200 K202	V193-E198 WeakPolarHBondContact CG2-O 3.43Å; V193-E198 PolarHBondContact N-O 3.47Å; D196-E198 HydrophobicContact CB-CG 4.39Å; D196-E198 PolarHBondContact O-N 3.17Å; D196-E198 WeakPolarHBondContact OD1-CB 3.44Å; D196-E198 PolarHBondContact OD1-N 3.27Å; E198-T200 PolarHBondContact O-N 2.97Å; E198-K202 WeakPolarHBondContact OE2-CE 3.49Å; E198-K202 IonicContact OE2-NZ 2.82Å; E198-K202 PolarHBondContact OE2-NZ 3.46Å
199	N	51.9	Low	71.6	Confident	69 Å²	69	37.5 Å²	37.5	37%	0.369	19%	0.191	S	C	.	.			trans	-68.6	-6.6	173.2	-85.5	-30.3	0	0	0	113	V193 G197 I201 K1052 E1053	V193-N199 VanDerWaalsContact CG2-OD1 3.27Å; V193-N199 WeakPolarHBondContact CG2-OD1 3.15Å; G197-N199 PolarHBondContact O-N 3.21Å; N199-I201 PolarHBondContact O-N 2.95Å; N199-K1052 WeakPolarHBondContact ND2-CB 3Å; N199-K1052 PolarHBondContact OD1-O 2.97Å; N199-E1053 HydrophobicContact CB-CG 4.48Å; N199-E1053 WeakPolarHBondContact ND2-CG 3.25Å; N199-E1053 PolarHBondContact ND2-N 3.48Å; N199-E1053 VanDerWaalsContact OD1-CA 3.29Å; N199-E1053 WeakPolarHBondContact OD1-CA 3.49Å
200	T	63.5	Low	71.5	Confident	48 Å²	48	35.8 Å²	35.8	29%	0.294	18%	0.184	S	C	.	.	S	Bend	trans	-66.3	133.7	179.1	57.6	0	0	0	0	110.5	E198 K202	E198-T200 PolarHBondContact O-N 2.97Å; T200-K202 PolarHBondContact O-N 3.22Å
201	I	72.3	Confident	71.3	Confident	49 Å²	49	36 Å²	36	25%	0.251	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	115	171.6	-61.2	175.1	0	0	0	107.7	Y189 I190 T191 N199	Y189-I201 HydrophobicContact CD1-CG2 3.8Å; Y189-I201 HydrophobicContact CG-CG2 4.04Å; I190-I201 CarbonylContact O-C 3.57Å; I190-I201 WeakPolarHBondContact O-CA 3.41Å; T191-I201 HydrophobicContact CG2-CG1 4.03Å; N199-I201 PolarHBondContact O-N 2.95Å
202	K	74.2	Confident	71.3	Confident	61 Å²	61	39.8 Å²	39.8	27%	0.265	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	140.6	176.4	-61.8	-170.5	-175.5	177.4	0	110.1	Y189 I190 T192 D196 E198 T200	Y189-K202 WeakPolarHBondContact CA-O 3.31Å; I190-K202 HydrophobicContact CG1-CB 4.14Å; I190-K202 PolarHBondContact N-O 3.44Å; I190-K202 PolarHBondContact O-N 3.35Å; T192-K202 HydrophobicContact CG2-CD 3.73Å; T192-K202 HydrophobicContact CG2-CG 4.4Å; T192-K202 WeakPolarHBondContact OG1-CE 3.41Å; T192-K202 PolarHBondContact OG1-NZ 2.88Å; D196-K202 IonicContact OD2-NZ 3.57Å; D196-K202 PolarHBondContact OD2-NZ 3.44Å; E198-K202 WeakPolarHBondContact OE2-CE 3.49Å; E198-K202 IonicContact OE2-NZ 2.82Å; E198-K202 PolarHBondContact OE2-NZ 3.46Å; T200-K202 PolarHBondContact O-N 3.22Å
203	T	81.8	Confident	71.6	Confident	59 Å²	59	40.6 Å²	40.6	36%	0.362	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	124.3	178.7	63.4	0	0	0	0	109.8	Y189	Y189-T203 HydrophobicContact CD1-CG2 3.7Å; Y189-T203 HydrophobicContact CE1-CG2 3.52Å
204	H	86.7	Confident	72.6	Confident	16 Å²	16	39.8 Å²	39.8	7%	0.074	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	155.8	174.5	-77.2	-116	0	0	0	109.4	I178 K187 C188 I190 N275 N276 I278 L279	I178-H204 HydrophobicContact CD1-CB 3.64Å; K187-H204 CarbonylContact C-O 3.58Å; K187-H204 WeakPolarHBondContact CA-O 3.45Å; C188-H204 PolarHBondContact N-O 2.99Å; C188-H204 PolarHBondContact O-N 3.49Å; I190-H204 VanDerWaalsContact CD1-CD2 3.45Å; I190-H204 WeakPolarHBondContact CD1-CD2 3.29Å; I190-H204 VanDerWaalsContact CD1-NE2 3.31Å; I190-H204 WeakPolarHBondContact CD1-NE2 3.4Å; H204-N275 PolarHBondContact CE1-O 3.22Å; H204-N275 PolarHBondContact ND1-O 2.79Å; H204-N276 CarbonylContact C-O 3.6Å; H204-N276 WeakPolarHBondContact CA-O 3.32Å; H204-N276 WeakPolarHBondContact CB-O 3.35Å; H204-N276 PolarHBondContact ND1-O 3.5Å; H204-I278 PolarHBondContact CE1-O 2.94Å; H204-I278 PolarHBondContact ND1-O 3.22Å; H204-L279 HydrophobicContact CB-CD2 4.28Å
205	Y	87.3	Confident	73.3	Confident	92 Å²	92	42.3 Å²	42.3	36%	0.361	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	135.9	-170.3	-62.9	-94.5	0	0	0	111.3	K187 N276 N277	K187-Y205 HydrophobicContact CD-CE1 4.31Å; K187-Y205 HydrophobicContact CG-CD1 4.03Å; K187-Y205 HydrophobicContact CG-CE1 3.82Å; Y205-N276 HydrophobicContact CD2-CB 4.23Å; Y205-N276 PolarHBondContact N-O 2.96Å; Y205-N277 PolarHBondContact O-ND2 3.46Å
206	C	87.4	Confident	73.8	Confident	12 Å²	12	48.5 Å²	48.5	8%	0.081	24%	0.24	C	C	.	.			trans	-81.6	149.8	169.4	-173.2	0	0	0	0	110.9	I178 L179 T181 N186	I178-C206 HydrophobicContact CG2-CB 3.76Å; L179-C206 PolarHBondContact O-SG 2.91Å; T181-C206 HydrophobicContact CG2-CB 3.94Å; N186-C206 HydrophobicContact CB-CB 4.38Å; N186-C206 PolarHBondContact O-N 3.45Å
207	L	83.4	Confident	74.5	Confident	26 Å²	26	49.6 Å²	49.6	14%	0.136	24%	0.244	C	C	.	.			trans	-75.3	131.7	169.6	-68.1	167.1	0	0	0	110	D209 T210 H211 I262 L271	L207-D209 VanDerWaalsContact C-N 3.32Å; L207-D209 PolarHBondContact O-N 3.25Å; L207-T210 PolarHBondContact O-N 2.74Å; L207-T210 PolarHBondContact O-OG1 2.83Å; L207-H211 WeakPolarHBondContact O-CB 3.31Å; L207-H211 PolarHBondContact O-N 3.03Å; L207-I262 HydrophobicContact CD1-CD1 3.54Å; L207-I262 HydrophobicContact CD1-CG1 4.23Å; L207-L271 HydrophobicContact CD1-CB 4.29Å
208	L	81.5	Confident	75.5	Confident	102 Å²	102	50.5 Å²	50.5	53%	0.534	25%	0.249	S	C	.	.	H	α-helix	trans	-58.6	-43.3	-174.9	-157.9	85.8	0	0	0	112.6	N186 T210 H211 N212	N186-L208 WeakPolarHBondContact ND2-CD1 3.25Å; L208-T210 VanDerWaalsContact C-N 3.35Å; L208-T210 PolarHBondContact O-N 3.26Å; L208-H211 PolarHBondContact O-N 2.95Å; L208-N212 PolarHBondContact O-N 3.09Å
209	D	79.8	Confident	75.8	Confident	49 Å²	49	50.2 Å²	50.2	26%	0.262	25%	0.25	S	C	.	.	H	α-helix	trans	-64.1	-38.7	-177.2	-68.8	-9.8	0	0	0	111.6	L207 I213 I264 K269 L271	L207-D209 VanDerWaalsContact C-N 3.32Å; L207-D209 PolarHBondContact O-N 3.25Å; D209-I213 WeakPolarHBondContact O-CD1 3.47Å; D209-I213 WeakPolarHBondContact O-CG1 3.28Å; D209-I264 HydrophobicContact CB-CD1 4.07Å; D209-K269 IonicContact OD1-NZ 2.81Å; D209-K269 IonicContact OD2-NZ 3.54Å; D209-K269 PolarHBondContact OD2-NZ 2.76Å; D209-L271 HydrophobicContact CB-CD1 3.85Å; D209-L271 WeakPolarHBondContact OD2-CD2 3.31Å
210	T	81.9	Confident	75.8	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-78.6	-35.6	177.6	58.7	0	0	0	0	111.8	L179 L207 L208 N212 I213 Y214 I244	L179-T210 HydrophobicContact CD2-CG2 4.25Å; L179-T210 CarbonylContact O-C 3.59Å; L179-T210 VanDerWaalsContact O-C 3.25Å; L179-T210 PolarHBondContact O-OG1 3.41Å; L207-T210 PolarHBondContact O-N 2.74Å; L207-T210 PolarHBondContact O-OG1 2.83Å; L208-T210 VanDerWaalsContact C-N 3.35Å; L208-T210 PolarHBondContact O-N 3.26Å; T210-N212 PolarHBondContact O-N 3.37Å; T210-I213 PolarHBondContact O-N 3.43Å; T210-Y214 WeakPolarHBondContact O-CD2 3.47Å; T210-Y214 PolarHBondContact O-N 3.18Å; T210-I244 HydrophobicContact CG2-CD1 3.98Å
211	H	82.7	Confident	75.1	Confident	3 Å²	3	56 Å²	56	1%	0.014	28%	0.275	C	S	.	.	H	α-helix	trans	-55.5	-50.3	-178.7	-178.4	52	0	0	0	111.6	L179 S180 T181 N186 L207 L208 I213 Y214 K215	L179-H211 WeakPolarHBondContact O-CA 3.31Å; L179-H211 PolarHBondContact O-N 2.95Å; S180-H211 PolarHBondContact OG-CE1 3.33Å; S180-H211 PolarHBondContact OG-ND1 3.13Å; T181-H211 PolarHBondContact O-CE1 2.89Å; T181-H211 VanDerWaalsContact O-CE1 3.23Å; N186-H211 PolarHBondContact OD1-CD2 2.93Å; N186-H211 PolarHBondContact OD1-NE2 3.3Å; L207-H211 WeakPolarHBondContact O-CB 3.31Å; L207-H211 PolarHBondContact O-N 3.03Å; L208-H211 PolarHBondContact O-N 2.95Å; H211-I213 PolarHBondContact O-N 3.33Å; H211-Y214 PolarHBondContact O-N 3.21Å; H211-K215 WeakPolarHBondContact NE2-CD 3.32Å; H211-K215 PolarHBondContact NE2-NZ 2.83Å; H211-K215 VanDerWaalsContact NE2-NZ 3.19Å; H211-K215 WeakPolarHBondContact O-CB 3.4Å; H211-K215 PolarHBondContact O-N 3.46Å
212	N	79.3	Confident	74.1	Confident	92 Å²	92	57.2 Å²	57.2	49%	0.492	28%	0.282	S	S	.	.	H	α-helix	trans	-65.4	-26.8	-176.3	-69.3	-19.1	0	0	0	113.4	L208 T210 K216	L208-N212 PolarHBondContact O-N 3.09Å; T210-N212 PolarHBondContact O-N 3.37Å; N212-K216 WeakPolarHBondContact O-CE 3.45Å
213	I	78.2	Confident	73	Confident	25 Å²	25	56 Å²	56	13%	0.128	28%	0.277	C	S	.	.	H	α-helix	trans	-78.1	-55.6	177.9	-61.6	168.7	0	0	0	109.4	D209 T210 H211 K215 K216 F217 D241 L242	D209-I213 WeakPolarHBondContact O-CD1 3.47Å; D209-I213 WeakPolarHBondContact O-CG1 3.28Å; T210-I213 PolarHBondContact O-N 3.43Å; H211-I213 PolarHBondContact O-N 3.33Å; I213-K215 PolarHBondContact O-N 3.5Å; I213-K216 PolarHBondContact O-N 2.9Å; I213-F217 WeakPolarHBondContact O-CD2 3.36Å; I213-F217 WeakPolarHBondContact O-CE2 3.36Å; I213-D241 HydrophobicContact CD1-CB 4.38Å; I213-D241 HydrophobicContact CG2-CB 3.84Å; I213-L242 HydrophobicContact CG2-CD2 3.97Å
214	Y	80.8	Confident	71.3	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-73.7	-28.5	-173.7	-76.9	-83.2	0	0	0	113.7	M139 I163 L179 T210 H211 K216 F217 L242 I244 I292	M139-Y214 HydrophobicContact CE-CD1 4.3Å; M139-Y214 HydrophobicContact CE-CE1 3.87Å; I163-Y214 HydrophobicContact CD1-CE1 3.55Å; I163-Y214 WeakPolarHBondContact CD1-OH 3.36Å; L179-Y214 HydrophobicContact CB-CD2 3.8Å; L179-Y214 HydrophobicContact CB-CE2 4.1Å; L179-Y214 HydrophobicContact CB-CG 4.08Å; L179-Y214 HydrophobicContact CD1-CD1 4.29Å; L179-Y214 HydrophobicContact CD1-CD2 4.23Å; L179-Y214 HydrophobicContact CD1-CE1 3.86Å; L179-Y214 HydrophobicContact CD1-CE2 3.79Å; L179-Y214 HydrophobicContact CD1-CG 4.46Å; L179-Y214 HydrophobicContact CD2-CD2 4.42Å; L179-Y214 HydrophobicContact CD2-CE2 3.95Å; L179-Y214 HydrophobicContact CG-CD2 4.38Å; L179-Y214 HydrophobicContact CG-CE2 4.17Å; T210-Y214 WeakPolarHBondContact O-CD2 3.47Å; T210-Y214 PolarHBondContact O-N 3.18Å; H211-Y214 PolarHBondContact O-N 3.21Å; Y214-K216 PolarHBondContact O-N 3Å; Y214-F217 PolarHBondContact O-N 3.38Å; Y214-L242 HydrophobicContact CD1-CD2 3.87Å; Y214-L242 HydrophobicContact CE1-CD2 3.49Å; Y214-L242 VanDerWaalsContact CE1-CD2 3.49Å; Y214-L242 HydrophobicContact CE2-CD2 4.43Å; Y214-L242 HydrophobicContact CG-CD2 4.48Å; Y214-L242 PolarHBondContact OH-O 3.41Å; Y214-I244 HydrophobicContact CE2-CD1 3.67Å; Y214-I292 HydrophobicContact CD1-CG2 4.13Å
215	K	77.2	Confident	69.2	Low	75 Å²	75	67 Å²	67	33%	0.326	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-60.2	-29.9	177	-168.1	-176.1	-158.3	161.4	0	112.7	H211 I213 F217 L218	H211-K215 WeakPolarHBondContact NE2-CD 3.32Å; H211-K215 PolarHBondContact NE2-NZ 2.83Å; H211-K215 VanDerWaalsContact NE2-NZ 3.19Å; H211-K215 WeakPolarHBondContact O-CB 3.4Å; H211-K215 PolarHBondContact O-N 3.46Å; I213-K215 PolarHBondContact O-N 3.5Å; K215-F217 PolarHBondContact O-N 2.81Å; K215-L218 PolarHBondContact O-N 3.24Å
216	K	72.9	Confident	67	Low	142 Å²	142	69.5 Å²	69.5	62%	0.617	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-63.3	-24.1	178.4	-66.7	175.8	-176.2	176.5	0	113.5	N212 I213 Y214 L218	N212-K216 WeakPolarHBondContact O-CE 3.45Å; I213-K216 PolarHBondContact O-N 2.9Å; Y214-K216 PolarHBondContact O-N 3Å; K216-L218 VanDerWaalsContact C-N 3.3Å
217	F	67.8	Low	64.7	Low	43 Å²	43	75.4 Å²	75.4	19%	0.189	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-93.3	12	-176.8	-59.9	-75.5	0	0	0	113.1	I148 I213 Y214 K215 L242	I148-F217 HydrophobicContact CD1-CD1 3.7Å; I148-F217 HydrophobicContact CD1-CE1 3.39Å; I148-F217 HydrophobicContact CD1-CZ 3.99Å; I213-F217 WeakPolarHBondContact O-CD2 3.36Å; I213-F217 WeakPolarHBondContact O-CE2 3.36Å; Y214-F217 PolarHBondContact O-N 3.38Å; K215-F217 PolarHBondContact O-N 2.81Å; F217-L242 HydrophobicContact CD2-CD2 4.06Å; F217-L242 HydrophobicContact CE2-CD1 3.99Å; F217-L242 HydrophobicContact CE2-CD2 3.68Å; F217-L242 HydrophobicContact CE2-CG 4.07Å; F217-L242 HydrophobicContact CZ-CD1 3.92Å; F217-L242 HydrophobicContact CZ-CD2 4.42Å; F217-L242 HydrophobicContact CZ-CG 4.35Å
218	L	63.9	Low	62.5	Low	19 Å²	19	80.8 Å²	80.8	10%	0.099	39%	0.391	C	S	.	.			trans	-116.5	86.9	-176	-118.4	156.7	0	0	0	109.7	L165 K215 K216 I223 Y290 I292	L165-L218 HydrophobicContact CD1-CD1 4.39Å; L165-L218 HydrophobicContact CD1-CD2 4.43Å; K215-L218 PolarHBondContact O-N 3.24Å; K216-L218 VanDerWaalsContact C-N 3.3Å; L218-I223 HydrophobicContact CD2-CD1 4.25Å; L218-Y290 HydrophobicContact CD1-CD2 3.51Å; L218-Y290 HydrophobicContact CD1-CE2 3.23Å; L218-Y290 HydrophobicContact CD2-CD1 4.03Å; L218-Y290 HydrophobicContact CD2-CD2 3.67Å; L218-Y290 HydrophobicContact CD2-CE1 3.75Å; L218-Y290 HydrophobicContact CD2-CE2 3.42Å; L218-Y290 VanDerWaalsContact CD2-CE2 3.42Å; L218-Y290 HydrophobicContact CD2-CG 3.99Å; L218-Y290 VanDerWaalsContact CD2-CZ 3.42Å; L218-Y290 HydrophobicContact CG-CD2 4.22Å; L218-Y290 HydrophobicContact CG-CE2 3.87Å; L218-I292 HydrophobicContact CD1-CD1 3.41Å; L218-I292 VanDerWaalsContact CD1-CD1 3.41Å; L218-I292 HydrophobicContact CD1-CG1 3.76Å; L218-I292 HydrophobicContact CG-CD1 4.17Å
219	N	57.6	Low	60.4	Low	73 Å²	73	83.3 Å²	83.3	39%	0.39	41%	0.405	S	S	.	.			trans	-97.9	122.5	165	-89.1	-21.3	0	0	0	108.4	N221 I222 Y231	N219-N221 PolarHBondContact O-N 2.91Å; N219-I222 HydrophobicContact CB-CD1 3.77Å; N219-I222 HydrophobicContact CB-CG1 3.9Å; N219-I222 WeakPolarHBondContact O-CB 3.4Å; N219-I222 PolarHBondContact O-N 2.98Å; N219-Y231 PolarHBondContact ND2-OH 2.87Å
220	E	52.4	Low	58.7	Low	109 Å²	109	88.3 Å²	88.3	51%	0.509	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-53.6	-26	179.7	-71.1	-175.6	150	0	0	112.5	I222	E220-I222 VanDerWaalsContact C-N 3.35Å; E220-I222 PolarHBondContact O-N 2.8Å
221	N	48.9	Very low	56.8	Low	128 Å²	128	94.6 Å²	94.6	68%	0.684	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-72.7	-19.1	177.5	-65.1	-16.5	0	0	0	114.6	N219	N219-N221 PolarHBondContact O-N 2.91Å
222	I	50.6	Low	54.8	Low	76 Å²	76	100 Å²	100	39%	0.39	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-80.3	-25.6	-177.2	-60.6	176.4	0	0	0	111.4	N219 E220 Y224 Y231	N219-I222 HydrophobicContact CB-CD1 3.77Å; N219-I222 HydrophobicContact CB-CG1 3.9Å; N219-I222 WeakPolarHBondContact O-CB 3.4Å; N219-I222 PolarHBondContact O-N 2.98Å; E220-I222 VanDerWaalsContact C-N 3.35Å; E220-I222 PolarHBondContact O-N 2.8Å; I222-Y224 VanDerWaalsContact C-N 3.35Å; I222-Y231 HydrophobicContact CD1-CD2 4.32Å; I222-Y231 HydrophobicContact CD1-CE2 4.38Å
223	I	51.9	Low	53.2	Low	34 Å²	34	99.9 Å²	99.9	17%	0.174	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-23.2	-176.8	-61.5	170.5	0	0	0	111.9	L165 L218	L165-I223 HydrophobicContact CD2-CD1 3.88Å; L165-I223 HydrophobicContact CD2-CG1 4.32Å; L218-I223 HydrophobicContact CD2-CD1 4.25Å
224	Y	45.8	Very low	51.5	Low	196 Å²	196	105.7 Å²	105.7	77%	0.769	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-21.9	-178.3	-73.5	-81.1	0	0	0	114.5	I222 Y226	I222-Y224 VanDerWaalsContact C-N 3.35Å; Y224-Y226 PolarHBondContact O-N 3.32Å
225	N	41.6	Very low	49.9	Very low	111 Å²	111	110.5 Å²	110.5	59%	0.594	54%	0.537	S	S	*	.			trans	-98.6	74.7	179	-76.9	-17.9	0	0	0	112.1	N227	N225-N227 VanDerWaalsContact C-N 3.3Å; N225-N227 PolarHBondContact O-N 2.89Å
226	Y	41.3	Very low	48.5	Very low	144 Å²	144	112.7 Å²	112.7	57%	0.565	55%	0.552	S	S	*	*			trans	-69	85.2	166.2	-132.5	-86	0	0	0	108.2	F137 L152 Y224	F137-Y226 HydrophobicContact CE1-CE2 4.14Å; L152-Y226 WeakPolarHBondContact CB-OH 3.45Å; Y224-Y226 PolarHBondContact O-N 3.32Å
227	N	38.5	Very low	47.5	Very low	137 Å²	137	112 Å²	112	73%	0.733	56%	0.555	S	S	*	*	S	Bend	trans	163.9	-19.1	140.8	-83.4	-20.3	0	0	0	117	N225	N225-N227 VanDerWaalsContact C-N 3.3Å; N225-N227 PolarHBondContact O-N 2.89Å
228	N	37.7	Very low	47.1	Very low	139 Å²	139	112.9 Å²	112.9	74%	0.743	56%	0.56	S	S	*	*			trans	-151.8	87.2	-170.7	-77.9	-36.7	0	0	0	112.1
229	N	37.9	Very low	47	Very low	154 Å²	154	113.3 Å²	113.3	82%	0.824	56%	0.561	S	S	*	*			trans	-167.5	106.2	151.9	-88.8	-27.8	0	0	0	110.2
230	Q	43.3	Very low	47.2	Very low	154 Å²	154	113.1 Å²	113.1	72%	0.72	56%	0.559	S	S	*	*			trans	-68.8	126.2	171.3	-73.7	172.3	-44.6	0	0	109.5	N232	Q230-N232 PolarHBondContact O-N 3.41Å
231	Y	43.6	Very low	47.9	Very low	132 Å²	132	110.5 Å²	110.5	52%	0.518	55%	0.549	S	S	.	.			trans	-87	86.8	170.3	-135.8	-84.2	0	0	0	108.4	N219 I222 N233	N219-Y231 PolarHBondContact ND2-OH 2.87Å; I222-Y231 HydrophobicContact CD1-CD2 4.32Å; I222-Y231 HydrophobicContact CD1-CE2 4.38Å; Y231-N233 HydrophobicContact CD1-CB 4.4Å; Y231-N233 PolarHBondContact O-N 3.1Å; Y231-N233 VanDerWaalsContact O-N 3.15Å
232	N	39.3	Very low	49.1	Very low	118 Å²	118	104.4 Å²	104.4	63%	0.631	52%	0.516	S	S	*	.			trans	-76.8	92	168.2	-88.7	-13.7	0	0	0	109	Q230	Q230-N232 PolarHBondContact O-N 3.41Å
233	N	45.4	Very low	50.3	Low	88 Å²	88	101.5 Å²	101.5	47%	0.471	50%	0.501	S	S	.	.			trans	-101.5	106.3	165.4	-98.2	-2.2	0	0	0	109.1	Y231 N235	Y231-N233 HydrophobicContact CD1-CB 4.4Å; Y231-N233 PolarHBondContact O-N 3.1Å; Y231-N233 VanDerWaalsContact O-N 3.15Å; N233-N235 PolarHBondContact O-N 3.44Å
234	N	42.6	Very low	51.9	Low	147 Å²	147	100 Å²	100	79%	0.786	49%	0.494	S	S	*	.			trans	-68.1	26.7	178.9	-74.4	-19.3	0	0	0	115
235	N	47.7	Very low	53.8	Low	101 Å²	101	93.4 Å²	93.4	54%	0.54	47%	0.469	S	S	.	.			trans	-111.9	90.6	179.2	-74.1	-17.4	0	0	0	110.2	N233 N237 Q238	N233-N235 PolarHBondContact O-N 3.44Å; N235-N237 PolarHBondContact O-N 2.81Å; N235-Q238 HydrophobicContact CB-CG 4.36Å; N235-Q238 PolarHBondContact O-N 3.4Å
236	N	48.3	Very low	56	Low	122 Å²	122	88.1 Å²	88.1	65%	0.652	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-2.4	-174.5	-70.6	-18.4	0	0	0	116.2
237	N	52	Low	58.1	Low	127 Å²	127	82 Å²	82	68%	0.679	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	-0.8	-174.6	-71.3	-6.9	0	0	0	115.4	N235 F239	N235-N237 PolarHBondContact O-N 2.81Å; N237-F239 VanDerWaalsContact C-N 3.33Å; N237-F239 PolarHBondContact O-N 3.25Å
238	Q	58.3	Low	60.5	Low	62 Å²	62	75.7 Å²	75.7	29%	0.29	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-15	-177.8	-71	-175.6	-8.5	0	0	114.4	N235 I240	N235-Q238 HydrophobicContact CB-CG 4.36Å; N235-Q238 PolarHBondContact O-N 3.4Å; Q238-I240 VanDerWaalsContact C-N 3.35Å; Q238-I240 PolarHBondContact O-N 2.69Å
239	F	62.9	Low	62.8	Low	27 Å²	27	70.8 Å²	70.8	12%	0.118	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-31.1	-177.8	-74.1	-81.1	0	0	0	113.8	I141 N146 I148 N237 D241 L242	I141-F239 HydrophobicContact CG2-CD1 3.88Å; I141-F239 HydrophobicContact CG2-CE1 3.9Å; N146-F239 HydrophobicContact CB-CD2 4.14Å; N146-F239 HydrophobicContact CB-CE2 3.5Å; N146-F239 HydrophobicContact CB-CZ 3.78Å; N146-F239 WeakPolarHBondContact O-CZ 3.25Å; I148-F239 HydrophobicContact CD1-CD1 4.5Å; I148-F239 HydrophobicContact CD1-CE1 3.86Å; I148-F239 HydrophobicContact CD1-CZ 4.4Å; I148-F239 HydrophobicContact CG1-CE1 3.58Å; I148-F239 HydrophobicContact CG1-CZ 4.17Å; N237-F239 VanDerWaalsContact C-N 3.33Å; N237-F239 PolarHBondContact O-N 3.25Å; F239-D241 PolarHBondContact O-N 2.81Å; F239-L242 PolarHBondContact O-N 2.87Å
240	I	62	Low	65.1	Low	70 Å²	70	67.3 Å²	67.3	36%	0.359	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-68.9	-30.4	-174.2	-47.9	179.5	0	0	0	110	Q238 L242 L243 I266	Q238-I240 VanDerWaalsContact C-N 3.35Å; Q238-I240 PolarHBondContact O-N 2.69Å; I240-L242 PolarHBondContact O-N 3.07Å; I240-L243 PolarHBondContact O-N 2.9Å; I240-L243 VanDerWaalsContact O-N 3.14Å; I240-I266 HydrophobicContact CB-CD1 3.92Å; I240-I266 HydrophobicContact CB-CG1 4.18Å; I240-I266 HydrophobicContact CG2-CD1 3.77Å; I240-I266 HydrophobicContact CG2-CG1 3.45Å; I240-I266 VanDerWaalsContact CG2-CG1 3.45Å
241	D	67.2	Low	67	Low	54 Å²	54	61.3 Å²	61.3	29%	0.289	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-62.5	-24.1	178.7	-67.4	-7.7	0	0	0	112.4	I213 F239 I266	I213-D241 HydrophobicContact CD1-CB 4.38Å; I213-D241 HydrophobicContact CG2-CB 3.84Å; F239-D241 PolarHBondContact O-N 2.81Å; D241-I266 HydrophobicContact CB-CD1 4.39Å; D241-I266 WeakPolarHBondContact OD1-CD1 3.41Å
242	L	73.2	Confident	68.9	Low	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-87.4	-7	-178.8	-66.3	171.5	0	0	0	113.7	M139 I141 I148 I213 Y214 F217 F239 I240 I244	M139-L242 HydrophobicContact CE-CD2 4.38Å; I141-L242 HydrophobicContact CD1-CD1 4.5Å; I148-L242 HydrophobicContact CD1-CD1 3.45Å; I148-L242 VanDerWaalsContact CD1-CD1 3.45Å; I213-L242 HydrophobicContact CG2-CD2 3.97Å; Y214-L242 HydrophobicContact CD1-CD2 3.87Å; Y214-L242 HydrophobicContact CE1-CD2 3.49Å; Y214-L242 VanDerWaalsContact CE1-CD2 3.49Å; Y214-L242 HydrophobicContact CE2-CD2 4.43Å; Y214-L242 HydrophobicContact CG-CD2 4.48Å; Y214-L242 PolarHBondContact OH-O 3.41Å; F217-L242 HydrophobicContact CD2-CD2 4.06Å; F217-L242 HydrophobicContact CE2-CD1 3.99Å; F217-L242 HydrophobicContact CE2-CD2 3.68Å; F217-L242 HydrophobicContact CE2-CG 4.07Å; F217-L242 HydrophobicContact CZ-CD1 3.92Å; F217-L242 HydrophobicContact CZ-CD2 4.42Å; F217-L242 HydrophobicContact CZ-CG 4.35Å; F239-L242 PolarHBondContact O-N 2.87Å; I240-L242 PolarHBondContact O-N 3.07Å; L242-I244 PolarHBondContact O-N 3.29Å
243	L	77.1	Confident	70.5	Confident	14 Å²	14	57 Å²	57	7%	0.073	29%	0.292	C	S	.	.			trans	-87.8	103.6	-178.9	-63	174.6	0	0	0	109.7	I37 I240 L265	I37-L243 HydrophobicContact CB-CD2 3.94Å; I37-L243 HydrophobicContact CD1-CD2 4.05Å; I37-L243 HydrophobicContact CG2-CD2 4.07Å; I240-L243 PolarHBondContact O-N 2.9Å; I240-L243 VanDerWaalsContact O-N 3.14Å; L243-L265 HydrophobicContact CB-CD1 3.65Å
244	I	83.5	Confident	71.7	Confident	3 Å²	3	56.5 Å²	56.5	2%	0.015	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	132.6	-176.8	-65.2	-178.7	0	0	0	110	A34 L179 T210 Y214 L242 V246 I262	A34-I244 HydrophobicContact CB-CB 4.04Å; A34-I244 PolarHBondContact N-O 2.8Å; L179-I244 HydrophobicContact CD2-CD1 4.21Å; T210-I244 HydrophobicContact CG2-CD1 3.98Å; Y214-I244 HydrophobicContact CE2-CD1 3.67Å; L242-I244 PolarHBondContact O-N 3.29Å; I244-V246 HydrophobicContact CG2-CG2 3.91Å; I244-I262 HydrophobicContact CB-CG2 4.47Å; I244-I262 HydrophobicContact CG2-CB 4.48Å; I244-I262 HydrophobicContact CG2-CG2 3.12Å
245	K	86.9	Confident	73.2	Confident	57 Å²	57	51.7 Å²	51.7	25%	0.248	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	125.8	169.6	177.6	179.7	179.7	173.3	0	109.7	Y33 N247 I262 T263	Y33-K245 HydrophobicContact CD1-CB 4.23Å; Y33-K245 HydrophobicContact CD1-CG 4.32Å; Y33-K245 HydrophobicContact CE1-CB 4.15Å; Y33-K245 HydrophobicContact CE1-CD 3.88Å; Y33-K245 HydrophobicContact CE1-CG 3.93Å; K245-N247 VanDerWaalsContact CE-OD1 3.29Å; K245-N247 WeakPolarHBondContact CE-OD1 3.35Å; K245-I262 CarbonylContact O-C 3.57Å; K245-T263 PolarHBondContact N-O 2.9Å; K245-T263 PolarHBondContact O-N 3.37Å
246	V	86.7	Confident	74.4	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	123.8	178.5	-173.6	0	0	0	0	109.5	T31 V32 I177 I244 Y248 I262 I273 L294	T31-V246 CarbonylContact C-O 3.55Å; T31-V246 WeakPolarHBondContact CA-O 3.3Å; V32-V246 PolarHBondContact N-O 3.4Å; V32-V246 PolarHBondContact O-N 3.4Å; I177-V246 HydrophobicContact CD1-CG1 3.69Å; I244-V246 HydrophobicContact CG2-CG2 3.91Å; V246-Y248 HydrophobicContact CB-CD1 4.49Å; V246-Y248 HydrophobicContact CG1-CD1 3.92Å; V246-I262 HydrophobicContact CG2-CG1 4.27Å; V246-I273 HydrophobicContact CG1-CD1 3.88Å; V246-L294 HydrophobicContact CG2-CD2 3.61Å
247	N	86.9	Confident	75.7	Confident	17 Å²	17	50.4 Å²	50.4	9%	0.091	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	126.8	172.2	-73.4	3.8	0	0	0	108.7	R30 T31 K245 G260 Y261	R30-N247 WeakPolarHBondContact O-CA 3.44Å; T31-N247 WeakPolarHBondContact CB-OD1 2.99Å; T31-N247 WeakPolarHBondContact CG2-OD1 3.45Å; K245-N247 VanDerWaalsContact CE-OD1 3.29Å; K245-N247 WeakPolarHBondContact CE-OD1 3.35Å; N247-G260 CarbonylContact O-C 3.59Å; N247-G260 WeakPolarHBondContact O-CA 3.42Å; N247-Y261 HydrophobicContact CB-CD1 4.2Å; N247-Y261 HydrophobicContact CB-CD2 4.43Å; N247-Y261 HydrophobicContact CB-CE1 3.7Å; N247-Y261 HydrophobicContact CB-CE2 3.95Å; N247-Y261 PolarHBondContact N-O 3.34Å; N247-Y261 VanDerWaalsContact ND2-CZ 3.34Å; N247-Y261 PolarHBondContact ND2-OH 2.94Å; N247-Y261 PolarHBondContact O-N 2.81Å
248	Y	87.6	Confident	77.2	Confident	4 Å²	4	44.6 Å²	44.6	2%	0.016	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	166	-171.8	59.1	-77.4	0	0	0	111.5	R30 V32 V246 F258 I296 Y297	R30-Y248 HydrophobicContact CB-CD2 4.32Å; R30-Y248 HydrophobicContact CB-CE1 4.02Å; R30-Y248 HydrophobicContact CB-CE2 3.84Å; R30-Y248 PolarHBondContact N-O 3.48Å; R30-Y248 PolarHBondContact O-N 2.93Å; V32-Y248 HydrophobicContact CB-CE1 3.86Å; V32-Y248 HydrophobicContact CG2-CE1 3.49Å; V32-Y248 VanDerWaalsContact CG2-CE1 3.49Å; V32-Y248 WeakPolarHBondContact CG2-OH 3.49Å; V246-Y248 HydrophobicContact CB-CD1 4.49Å; V246-Y248 HydrophobicContact CG1-CD1 3.92Å; Y248-F258 HydrophobicContact CD2-CE2 4.42Å; Y248-I296 HydrophobicContact CE2-CB 4.33Å; Y248-I296 PolarHBondContact OH-O 2.53Å; Y248-Y297 AromaticContact CD2-CE1 3.97Å; Y248-Y297 HydrophobicContact CD2-CE1 3.97Å; Y248-Y297 AromaticContact CD2-CZ 3.83Å; Y248-Y297 HydrophobicContact CE2-CD1 4.07Å; Y248-Y297 AromaticContact CE2-CE1 3.43Å; Y248-Y297 HydrophobicContact CE2-CE1 3.43Å; Y248-Y297 VanDerWaalsContact CE2-CE1 3.43Å; Y248-Y297 AromaticContact CE2-CZ 3.77Å
249	Q	86.8	Confident	78.4	Confident	35 Å²	35	47.9 Å²	47.9	16%	0.164	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-61.9	166.1	178.3	67.6	-178	33.4	0	0	113.1	N252 N257 F258 E259 Y297	Q249-N252 VanDerWaalsContact NE2-CG 3.27Å; Q249-N252 PolarHBondContact NE2-ND2 2.8Å; Q249-N252 VanDerWaalsContact NE2-ND2 3.12Å; Q249-N252 PolarHBondContact NE2-OD1 3.25Å; Q249-N257 PolarHBondContact NE2-O 3.03Å; Q249-F258 HydrophobicContact CG-CD2 4.34Å; Q249-E259 PolarHBondContact N-O 2.81Å; Q249-E259 VanDerWaalsContact N-O 3.14Å; Q249-E259 VanDerWaalsContact OE1-N 3.12Å; Q249-Y297 PolarHBondContact O-OH 3.4Å
250	Q	85.6	Confident	79.4	Confident	81 Å²	81	47.2 Å²	47.2	38%	0.379	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-70.3	154.6	167.8	-73.7	-79.5	-15.5	0	0	110.5	L28 R30 N252 Y297	L28-Q250 WeakPolarHBondContact O-CG 3.49Å; L28-Q250 PolarHBondContact O-NE2 3.34Å; R30-Q250 HydrophobicContact CG-CG 4.5Å; Q250-N252 PolarHBondContact O-N 2.9Å; Q250-Y297 PolarHBondContact O-OH 2.98Å
251	P	84.2	Confident	80.6	Confident	29 Å²	29	47.5 Å²	47.5	19%	0.188	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-56.6	128.2	176.8	23.9	-32.7	0	0	0	110.6	R30 Y297 D301 L306	R30-P251 VanDerWaalsContact CZ-CD 3.47Å; P251-Y297 HydrophobicContact CB-CD1 4.11Å; P251-Y297 HydrophobicContact CB-CE1 3.8Å; P251-Y297 HydrophobicContact CG-CE1 4.26Å; P251-D301 HydrophobicContact CB-CB 4.14Å; P251-D301 VanDerWaalsContact CB-O 3.3Å; P251-D301 WeakPolarHBondContact CB-O 3.25Å; P251-D301 HydrophobicContact CG-CB 4.12Å; P251-L306 HydrophobicContact CB-CD1 3.82Å
252	N	82.5	Confident	81.5	Confident	36 Å²	36	45 Å²	45	19%	0.193	22%	0.223	C	C	.	.			trans	-126	156.9	179.4	65.9	-19.5	0	0	0	110	Q249 Q250 D254 N257 K303	Q249-N252 VanDerWaalsContact NE2-CG 3.27Å; Q249-N252 PolarHBondContact NE2-ND2 2.8Å; Q249-N252 VanDerWaalsContact NE2-ND2 3.12Å; Q249-N252 PolarHBondContact NE2-OD1 3.25Å; Q250-N252 PolarHBondContact O-N 2.9Å; N252-D254 VanDerWaalsContact C-N 3.29Å; N252-D254 PolarHBondContact O-N 3.46Å; N252-N257 PolarHBondContact ND2-O 3.24Å; N252-N257 VanDerWaalsContact ND2-O 3.1Å; N252-N257 PolarHBondContact OD1-O 3.33Å; N252-K303 WeakPolarHBondContact O-CG 2.96Å; N252-K303 WeakPolarHBondContact OD1-CE 3.16Å; N252-K303 PolarHBondContact OD1-NZ 3.36Å
253	E	74.2	Confident	82	Confident	124 Å²	124	45.6 Å²	45.6	58%	0.579	23%	0.227	S	C	*	.	S	Bend	trans	-73.7	-20.7	179.9	-69.2	169.1	-167.1	0	0	112.7	F255 L306 N307	E253-F255 PolarHBondContact O-N 3.05Å; E253-L306 HydrophobicContact CG-CB 4.01Å; E253-N307 PolarHBondContact O-ND2 3.37Å
254	D	69.4	Low	82	Confident	77 Å²	77	45.5 Å²	45.5	41%	0.412	23%	0.226	S	C	.	.			trans	-82.1	115.8	-173	-171.9	3.5	0	0	0	112.9	N252 N256 N257 K303	N252-D254 VanDerWaalsContact C-N 3.29Å; N252-D254 PolarHBondContact O-N 3.46Å; D254-N256 VanDerWaalsContact C-N 3.25Å; D254-N256 PolarHBondContact O-N 3.35Å; D254-N256 WeakPolarHBondContact OD1-CB 3.45Å; D254-N256 PolarHBondContact OD1-N 3Å; D254-N257 HydrophobicContact CB-CB 4.26Å; D254-N257 PolarHBondContact O-N 2.9Å; D254-K303 PolarHBondContact O-NZ 2.9Å
255	F	74.6	Confident	81.4	Confident	45 Å²	45	48.5 Å²	48.5	20%	0.197	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-21.6	174.9	-70.1	-81.6	0	0	0	113.6	I195 E253 N257 Y280 K303 N307	I195-F255 HydrophobicContact CB-CZ 4.5Å; I195-F255 HydrophobicContact CD1-CD1 4.34Å; I195-F255 HydrophobicContact CD1-CE1 3.81Å; I195-F255 HydrophobicContact CD1-CZ 4.48Å; I195-F255 HydrophobicContact CG1-CE1 4.27Å; I195-F255 HydrophobicContact CG1-CZ 4.46Å; I195-F255 HydrophobicContact CG2-CD1 3.85Å; I195-F255 HydrophobicContact CG2-CD2 3.95Å; I195-F255 HydrophobicContact CG2-CE1 3.5Å; I195-F255 VanDerWaalsContact CG2-CE1 3.5Å; I195-F255 HydrophobicContact CG2-CE2 3.59Å; I195-F255 HydrophobicContact CG2-CG 4.07Å; I195-F255 HydrophobicContact CG2-CZ 3.35Å; E253-F255 PolarHBondContact O-N 3.05Å; F255-N257 VanDerWaalsContact C-N 3.34Å; F255-Y280 HydrophobicContact CB-CE2 4.48Å; F255-Y280 HydrophobicContact CD1-CD1 4.18Å; F255-Y280 AromaticContact CD1-CD2 3.9Å; F255-Y280 HydrophobicContact CD1-CD2 3.9Å; F255-Y280 HydrophobicContact CD1-CE1 4.32Å; F255-Y280 HydrophobicContact CD1-CE2 4.01Å; F255-Y280 AromaticContact CD1-CG 3.98Å; F255-Y280 HydrophobicContact CD1-CG 3.98Å; F255-Y280 HydrophobicContact CE1-CD1 4.43Å; F255-Y280 HydrophobicContact CE1-CG 4.21Å; F255-Y280 PolarHBondContact O-OH 2.94Å; F255-K303 HydrophobicContact CD1-CB 3.92Å; F255-K303 HydrophobicContact CD1-CD 4.08Å; F255-K303 HydrophobicContact CE1-CB 3.47Å; F255-K303 VanDerWaalsContact CE1-CB 3.47Å; F255-K303 HydrophobicContact CE1-CD 4.48Å; F255-K303 HydrophobicContact CZ-CB 3.89Å; F255-N307 WeakPolarHBondContact CE2-ND2 3.33Å
256	N	73.1	Confident	80.4	Confident	134 Å²	134	49.6 Å²	49.6	72%	0.717	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.7	4.2	-179.3	-66.9	-32.6	0	0	0	113.5	D254 N275	D254-N256 VanDerWaalsContact C-N 3.25Å; D254-N256 PolarHBondContact O-N 3.35Å; D254-N256 WeakPolarHBondContact OD1-CB 3.45Å; D254-N256 PolarHBondContact OD1-N 3Å; N256-N275 PolarHBondContact O-ND2 3.16Å
257	N	76	Confident	79.4	Confident	63 Å²	63	55.2 Å²	55.2	34%	0.337	28%	0.28	S	S	.	.			trans	-129.7	113	178.8	-173	9.2	0	0	0	111.2	Q249 N252 D254 F255 K303	Q249-N257 PolarHBondContact NE2-O 3.03Å; N252-N257 PolarHBondContact ND2-O 3.24Å; N252-N257 VanDerWaalsContact ND2-O 3.1Å; N252-N257 PolarHBondContact OD1-O 3.33Å; D254-N257 HydrophobicContact CB-CB 4.26Å; D254-N257 PolarHBondContact O-N 2.9Å; F255-N257 VanDerWaalsContact C-N 3.34Å; N257-K303 PolarHBondContact O-NZ 3.1Å
258	F	83.1	Confident	78.6	Confident	4 Å²	4	60 Å²	60	2%	0.018	31%	0.305	C	S	.	.			trans	-148.9	117.2	171.8	-176.3	-96.9	0	0	0	109.4	Y248 Q249 I273 N275 I278 I296 Y297	Y248-F258 HydrophobicContact CD2-CE2 4.42Å; Q249-F258 HydrophobicContact CG-CD2 4.34Å; F258-I273 HydrophobicContact CD1-CG2 4.28Å; F258-I273 HydrophobicContact CE1-CB 4.28Å; F258-I273 HydrophobicContact CE1-CG2 3.76Å; F258-N275 WeakPolarHBondContact CB-OD1 3.44Å; F258-N275 PolarHBondContact N-OD1 2.81Å; F258-I278 HydrophobicContact CD1-CB 4.39Å; F258-I278 HydrophobicContact CD1-CD1 4.08Å; F258-I278 HydrophobicContact CD2-CD1 3.53Å; F258-I278 HydrophobicContact CE1-CD1 4.13Å; F258-I278 HydrophobicContact CE2-CD1 3.6Å; F258-I278 HydrophobicContact CG-CD1 3.78Å; F258-I278 HydrophobicContact CZ-CD1 3.9Å; F258-I296 HydrophobicContact CE2-CD1 3.78Å; F258-I296 HydrophobicContact CZ-CD1 3.71Å; F258-Y297 HydrophobicContact CD2-CE2 4.37Å; F258-Y297 AromaticContact CE2-CE2 3.98Å; F258-Y297 HydrophobicContact CE2-CE2 3.98Å
259	E	83.4	Confident	78	Confident	132 Å²	132	64.6 Å²	64.6	62%	0.617	33%	0.325	S	S	*	.			trans	-123.1	136.9	176.4	-62.5	-178.4	171.7	0	0	110.7	Q249	Q249-E259 PolarHBondContact N-O 2.81Å; Q249-E259 VanDerWaalsContact N-O 3.14Å; Q249-E259 VanDerWaalsContact OE1-N 3.12Å
260	G	84	Confident	77.6	Confident	13 Å²	13	69.8 Å²	69.8	13%	0.134	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	176.3	174.2	0	0	0	0	0	112.3	N247 I273	N247-G260 CarbonylContact O-C 3.59Å; N247-G260 WeakPolarHBondContact O-CA 3.42Å; G260-I273 PolarHBondContact N-O 3.46Å; G260-I273 PolarHBondContact O-N 3.17Å
261	Y	86.4	Confident	77.4	Confident	76 Å²	76	67 Å²	67	30%	0.298	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	143.8	171.1	64.7	-89.8	0	0	0	112	N247 T263 K270 L271	N247-Y261 HydrophobicContact CB-CD1 4.2Å; N247-Y261 HydrophobicContact CB-CD2 4.43Å; N247-Y261 HydrophobicContact CB-CE1 3.7Å; N247-Y261 HydrophobicContact CB-CE2 3.95Å; N247-Y261 PolarHBondContact N-O 3.34Å; N247-Y261 VanDerWaalsContact ND2-CZ 3.34Å; N247-Y261 PolarHBondContact ND2-OH 2.94Å; N247-Y261 PolarHBondContact O-N 2.81Å; Y261-T263 WeakPolarHBondContact CE2-OG1 3.49Å; Y261-K270 HydrophobicContact CD2-CB 4.33Å; Y261-K270 HydrophobicContact CD2-CD 4.16Å; Y261-K270 HydrophobicContact CD2-CG 4.09Å; Y261-K270 HydrophobicContact CE2-CD 4.09Å; Y261-K270 HydrophobicContact CE2-CG 4.33Å; Y261-L271 CarbonylContact C-O 3.48Å; Y261-L271 WeakPolarHBondContact CA-O 3.26Å; Y261-L271 WeakPolarHBondContact CB-O 3.35Å
262	I	85.8	Confident	77.4	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	132.2	172	-55.3	-166.9	0	0	0	108.8	I177 L207 I244 K245 V246 K270 L271 I273	I177-I262 HydrophobicContact CG2-CD1 4.21Å; L207-I262 HydrophobicContact CD1-CD1 3.54Å; L207-I262 HydrophobicContact CD1-CG1 4.23Å; I244-I262 HydrophobicContact CB-CG2 4.47Å; I244-I262 HydrophobicContact CG2-CB 4.48Å; I244-I262 HydrophobicContact CG2-CG2 3.12Å; K245-I262 CarbonylContact O-C 3.57Å; V246-I262 HydrophobicContact CG2-CG1 4.27Å; I262-K270 CarbonylContact O-C 3.17Å; I262-K270 VanDerWaalsContact O-CA 3.29Å; I262-K270 WeakPolarHBondContact O-CA 3.44Å; I262-L271 HydrophobicContact CB-CB 4.31Å; I262-L271 PolarHBondContact N-O 2.83Å; I262-L271 PolarHBondContact O-N 2.85Å; I262-I273 HydrophobicContact CB-CD1 4.41Å; I262-I273 HydrophobicContact CD1-CD1 3.82Å; I262-I273 HydrophobicContact CD1-CG1 4.18Å; I262-I273 HydrophobicContact CG1-CD1 3.16Å; I262-I273 HydrophobicContact CG1-CG1 3.58Å
263	T	84	Confident	77.5	Confident	14 Å²	14	70.4 Å²	70.4	9%	0.086	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	114.6	168.9	-47.7	0	0	0	0	108.5	K245 Y261	K245-T263 PolarHBondContact N-O 2.9Å; K245-T263 PolarHBondContact O-N 3.37Å; Y261-T263 WeakPolarHBondContact CE2-OG1 3.49Å
264	I	78.1	Confident	78	Confident	12 Å²	12	69 Å²	69	6%	0.062	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	120.6	172.4	-58.3	171.3	0	0	0	107.3	D209 I266 N267 N268 K269 L271	D209-I264 HydrophobicContact CB-CD1 4.07Å; I264-I266 VanDerWaalsContact C-N 3.28Å; I264-I266 PolarHBondContact O-N 3.35Å; I264-N267 PolarHBondContact O-N 2.87Å; I264-N268 WeakPolarHBondContact O-CA 3.3Å; I264-N268 PolarHBondContact O-N 3.37Å; I264-K269 PolarHBondContact N-O 3.14Å; I264-L271 HydrophobicContact CD1-CD1 3.92Å
265	L	70.5	Confident	78.7	Confident	66 Å²	66	67.3 Å²	67.3	35%	0.346	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-26.3	-168.1	-78.8	161.6	0	0	0	114.2	L243	L243-L265 HydrophobicContact CB-CD1 3.65Å
266	I	65.6	Low	79.3	Confident	80 Å²	80	69.4 Å²	69.4	41%	0.41	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-45.4	-179.7	-59.3	174	0	0	0	111.6	I240 D241 I264	I240-I266 HydrophobicContact CB-CD1 3.92Å; I240-I266 HydrophobicContact CB-CG1 4.18Å; I240-I266 HydrophobicContact CG2-CD1 3.77Å; I240-I266 HydrophobicContact CG2-CG1 3.45Å; I240-I266 VanDerWaalsContact CG2-CG1 3.45Å; D241-I266 HydrophobicContact CB-CD1 4.39Å; D241-I266 WeakPolarHBondContact OD1-CD1 3.41Å; I264-I266 VanDerWaalsContact C-N 3.28Å; I264-I266 PolarHBondContact O-N 3.35Å
267	N	66.2	Low	80	Confident	118 Å²	118	63.9 Å²	63.9	63%	0.631	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-7	-171.9	-67.8	-8.1	0	0	0	113	I264 K269	I264-N267 PolarHBondContact O-N 2.87Å; N267-K269 HydrophobicContact CB-CB 4.16Å; N267-K269 PolarHBondContact O-N 3.22Å
268	N	69.7	Low	80.8	Confident	117 Å²	117	60.9 Å²	60.9	63%	0.626	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	22.4	-167.6	-85	-26.2	0	0	0	113.9	I264 K270	I264-N268 WeakPolarHBondContact O-CA 3.3Å; I264-N268 PolarHBondContact O-N 3.37Å; N268-K270 PolarHBondContact O-N 2.8Å
269	K	75.5	Confident	81.2	Confident	101 Å²	101	60.7 Å²	60.7	44%	0.439	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	125.2	179.3	-169.8	-178.2	179.8	-167.5	0	108.7	D209 I264 N267 L271	D209-K269 IonicContact OD1-NZ 2.81Å; D209-K269 IonicContact OD2-NZ 3.54Å; D209-K269 PolarHBondContact OD2-NZ 2.76Å; I264-K269 PolarHBondContact N-O 3.14Å; N267-K269 HydrophobicContact CB-CB 4.16Å; N267-K269 PolarHBondContact O-N 3.22Å; K269-L271 HydrophobicContact CD-CD2 4.44Å
270	K	78.5	Confident	81.5	Confident	143 Å²	143	55.1 Å²	55.1	62%	0.622	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	120.9	176.3	-64.9	-178.5	-177.2	177	0	109.7	Y261 I262 N268	Y261-K270 HydrophobicContact CD2-CB 4.33Å; Y261-K270 HydrophobicContact CD2-CD 4.16Å; Y261-K270 HydrophobicContact CD2-CG 4.09Å; Y261-K270 HydrophobicContact CE2-CD 4.09Å; Y261-K270 HydrophobicContact CE2-CG 4.33Å; I262-K270 CarbonylContact O-C 3.17Å; I262-K270 VanDerWaalsContact O-CA 3.29Å; I262-K270 WeakPolarHBondContact O-CA 3.44Å; N268-K270 PolarHBondContact O-N 2.8Å
271	L	81.2	Confident	81.6	Confident	24 Å²	24	55.1 Å²	55.1	13%	0.126	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.5	176	-63	167.3	0	0	0	109	L207 D209 Y261 I262 I264 K269	L207-L271 HydrophobicContact CD1-CB 4.29Å; D209-L271 HydrophobicContact CB-CD1 3.85Å; D209-L271 WeakPolarHBondContact OD2-CD2 3.31Å; Y261-L271 CarbonylContact C-O 3.48Å; Y261-L271 WeakPolarHBondContact CA-O 3.26Å; Y261-L271 WeakPolarHBondContact CB-O 3.35Å; I262-L271 HydrophobicContact CB-CB 4.31Å; I262-L271 PolarHBondContact N-O 2.83Å; I262-L271 PolarHBondContact O-N 2.85Å; I264-L271 HydrophobicContact CD1-CD1 3.92Å; K269-L271 HydrophobicContact CD-CD2 4.44Å
272	L	84.2	Confident	81.2	Confident	136 Å²	136	52 Å²	52	71%	0.712	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	140.4	177.8	-69.6	155.7	0	0	0	110.3
273	I	85.1	Confident	81.2	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	126	177.1	-45.6	172.3	0	0	0	108	I177 V246 F258 G260 I262 N277	I177-I273 HydrophobicContact CD1-CD1 3.81Å; V246-I273 HydrophobicContact CG1-CD1 3.88Å; F258-I273 HydrophobicContact CD1-CG2 4.28Å; F258-I273 HydrophobicContact CE1-CB 4.28Å; F258-I273 HydrophobicContact CE1-CG2 3.76Å; G260-I273 PolarHBondContact N-O 3.46Å; G260-I273 PolarHBondContact O-N 3.17Å; I262-I273 HydrophobicContact CB-CD1 4.41Å; I262-I273 HydrophobicContact CD1-CD1 3.82Å; I262-I273 HydrophobicContact CD1-CG1 4.18Å; I262-I273 HydrophobicContact CG1-CD1 3.16Å; I262-I273 HydrophobicContact CG1-CG1 3.58Å; I273-N277 HydrophobicContact CG2-CB 3.63Å
274	N	84.4	Confident	81.3	Confident	93 Å²	93	54.4 Å²	54.4	50%	0.497	28%	0.275	S	S	.	.			trans	-116.8	-179.5	176	-62.2	-2.1	0	0	0	109.6	N276 N277	N274-N276 PolarHBondContact O-N 3.15Å; N274-N276 VanDerWaalsContact O-N 3.08Å; N274-N277 PolarHBondContact N-OD1 2.93Å; N274-N277 VanDerWaalsContact N-OD1 3.16Å; N274-N277 PolarHBondContact O-N 3.47Å
275	N	84	Confident	81.7	Confident	42 Å²	42	53.9 Å²	53.9	23%	0.225	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-54.3	-28.3	175.4	-65.3	-37.3	0	0	0	114.3	H204 N256 F258 N277 I278	H204-N275 PolarHBondContact CE1-O 3.22Å; H204-N275 PolarHBondContact ND1-O 2.79Å; N256-N275 PolarHBondContact O-ND2 3.16Å; F258-N275 WeakPolarHBondContact CB-OD1 3.44Å; F258-N275 PolarHBondContact N-OD1 2.81Å; N275-N277 PolarHBondContact O-N 3.3Å; N275-N277 VanDerWaalsContact O-N 3.13Å; N275-I278 WeakPolarHBondContact O-CG2 3.18Å; N275-I278 PolarHBondContact O-N 2.8Å
276	N	85.8	Confident	82.3	Confident	89 Å²	89	54 Å²	54	48%	0.476	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-68.4	-12	-179.3	-68	1	0	0	0	112.8	H204 Y205 N274	H204-N276 CarbonylContact C-O 3.6Å; H204-N276 WeakPolarHBondContact CA-O 3.32Å; H204-N276 WeakPolarHBondContact CB-O 3.35Å; H204-N276 PolarHBondContact ND1-O 3.5Å; Y205-N276 HydrophobicContact CD2-CB 4.23Å; Y205-N276 PolarHBondContact N-O 2.96Å; N274-N276 PolarHBondContact O-N 3.15Å; N274-N276 VanDerWaalsContact O-N 3.08Å
277	N	89.4	Confident	82.9	Confident	18 Å²	18	52.5 Å²	52.5	10%	0.096	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-108.2	-5	-176.3	-52.6	109.3	0	0	0	113.4	I178 Y205 I273 N274 N275	I178-N277 WeakPolarHBondContact CG1-O 3.18Å; I178-N277 PolarHBondContact N-O 2.86Å; Y205-N277 PolarHBondContact O-ND2 3.46Å; I273-N277 HydrophobicContact CG2-CB 3.63Å; N274-N277 PolarHBondContact N-OD1 2.93Å; N274-N277 VanDerWaalsContact N-OD1 3.16Å; N274-N277 PolarHBondContact O-N 3.47Å; N275-N277 PolarHBondContact O-N 3.3Å; N275-N277 VanDerWaalsContact O-N 3.13Å
278	I	91.3	Very high	83.6	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	150.5	179.8	-161.8	172.8	0	0	0	110.8	L176 H204 F258 N275 Y280 I296	L176-I278 CarbonylContact O-C 3.53Å; L176-I278 WeakPolarHBondContact O-CA 3.47Å; L176-I278 WeakPolarHBondContact O-CG1 3.43Å; H204-I278 PolarHBondContact CE1-O 2.94Å; H204-I278 PolarHBondContact ND1-O 3.22Å; F258-I278 HydrophobicContact CD1-CB 4.39Å; F258-I278 HydrophobicContact CD1-CD1 4.08Å; F258-I278 HydrophobicContact CD2-CD1 3.53Å; F258-I278 HydrophobicContact CE1-CD1 4.13Å; F258-I278 HydrophobicContact CE2-CD1 3.6Å; F258-I278 HydrophobicContact CG-CD1 3.78Å; F258-I278 HydrophobicContact CZ-CD1 3.9Å; N275-I278 WeakPolarHBondContact O-CG2 3.18Å; N275-I278 PolarHBondContact O-N 2.8Å; I278-Y280 HydrophobicContact CD1-CD1 4.37Å; I278-Y280 HydrophobicContact CD1-CE1 3.76Å; I278-Y280 HydrophobicContact CG1-CE1 4.21Å; I278-Y280 HydrophobicContact CG2-CE1 3.75Å; I278-Y280 HydrophobicContact CG2-CE2 3.97Å; I278-Y280 VanDerWaalsContact CG2-CZ 3.46Å; I278-I296 HydrophobicContact CD1-CD1 3.4Å; I278-I296 VanDerWaalsContact CD1-CD1 3.4Å; I278-I296 HydrophobicContact CG1-CD1 3.89Å
279	L	91.9	Very high	84.3	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	133.1	172.1	-60.3	177.4	0	0	0	108.5	F172 D175 L176 I178 I190 H204 I291	F172-L279 HydrophobicContact CD2-CB 3.93Å; F172-L279 HydrophobicContact CE1-CD1 4.19Å; F172-L279 HydrophobicContact CE2-CB 3.91Å; F172-L279 HydrophobicContact CE2-CD1 3.93Å; F172-L279 HydrophobicContact CE2-CD2 4.23Å; F172-L279 HydrophobicContact CE2-CG 4.26Å; F172-L279 HydrophobicContact CZ-CD1 3.75Å; D175-L279 CarbonylContact C-O 3.48Å; D175-L279 VanDerWaalsContact CA-O 3.27Å; D175-L279 WeakPolarHBondContact CA-O 3.36Å; L176-L279 HydrophobicContact CB-CB 4.26Å; L176-L279 PolarHBondContact N-O 2.7Å; L176-L279 PolarHBondContact O-N 3.5Å; I178-L279 HydrophobicContact CD1-CD1 4.31Å; I178-L279 HydrophobicContact CD1-CD2 3.88Å; I178-L279 HydrophobicContact CD1-CG 3.93Å; I178-L279 HydrophobicContact CG1-CD1 3.67Å; I178-L279 HydrophobicContact CG1-CD2 4.12Å; I178-L279 HydrophobicContact CG1-CG 3.6Å; I190-L279 HydrophobicContact CD1-CD2 3.87Å; I190-L279 HydrophobicContact CG2-CD2 3.67Å; H204-L279 HydrophobicContact CB-CD2 4.28Å; L279-I291 HydrophobicContact CD1-CD1 3.1Å
280	Y	90.3	Very high	84.8	Confident	15 Å²	15	44.7 Å²	44.7	6%	0.059	22%	0.217	C	C	.	.			trans	-97.6	150.2	-174	-62.2	-62.2	0	0	0	112.3	D175 I195 F255 I278 G282 C283 K303	D175-Y280 WeakPolarHBondContact OD1-CA 3.39Å; I195-Y280 HydrophobicContact CD1-CD2 4.29Å; I195-Y280 HydrophobicContact CD1-CG 4.15Å; F255-Y280 HydrophobicContact CB-CE2 4.48Å; F255-Y280 HydrophobicContact CD1-CD1 4.18Å; F255-Y280 AromaticContact CD1-CD2 3.9Å; F255-Y280 HydrophobicContact CD1-CD2 3.9Å; F255-Y280 HydrophobicContact CD1-CE1 4.32Å; F255-Y280 HydrophobicContact CD1-CE2 4.01Å; F255-Y280 AromaticContact CD1-CG 3.98Å; F255-Y280 HydrophobicContact CD1-CG 3.98Å; F255-Y280 HydrophobicContact CE1-CD1 4.43Å; F255-Y280 HydrophobicContact CE1-CG 4.21Å; F255-Y280 PolarHBondContact O-OH 2.94Å; I278-Y280 HydrophobicContact CD1-CD1 4.37Å; I278-Y280 HydrophobicContact CD1-CE1 3.76Å; I278-Y280 HydrophobicContact CG1-CE1 4.21Å; I278-Y280 HydrophobicContact CG2-CE1 3.75Å; I278-Y280 HydrophobicContact CG2-CE2 3.97Å; I278-Y280 VanDerWaalsContact CG2-CZ 3.46Å; Y280-G282 PolarHBondContact O-N 3.24Å; Y280-C283 WeakPolarHBondContact O-CB 3.5Å; Y280-C283 PolarHBondContact O-N 3.09Å; Y280-K303 HydrophobicContact CD1-CB 4.46Å; Y280-K303 HydrophobicContact CD1-CD 4.09Å; Y280-K303 HydrophobicContact CD1-CG 4.32Å; Y280-K303 HydrophobicContact CE1-CD 3.49Å; Y280-K303 VanDerWaalsContact CE1-CD 3.49Å; Y280-K303 HydrophobicContact CE1-CG 4.14Å; Y280-K303 PolarHBondContact OH-NZ 2.78Å
281	K	86.1	Confident	85.4	Confident	14 Å²	14	37.9 Å²	37.9	6%	0.061	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	132.3	170.8	-178.8	170.1	-175	153.1	0	110.2	N54 P173 D175 T302 L304	N54-K281 PolarHBondContact OD1-NZ 3.31Å; P173-K281 WeakPolarHBondContact O-CD 3.35Å; P173-K281 VanDerWaalsContact O-CE 3.26Å; P173-K281 WeakPolarHBondContact O-CE 3.49Å; P173-K281 PolarHBondContact O-NZ 2.84Å; D175-K281 PolarHBondContact OD1-N 3.04Å; K281-T302 HydrophobicContact CB-CG2 4.25Å; K281-T302 HydrophobicContact CD-CG2 3.88Å; K281-L304 HydrophobicContact CG-CD2 4.26Å
282	G	78.1	Confident	85.9	Confident	9 Å²	9	36.8 Å²	36.8	9%	0.093	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.2	-21.9	-178.9	0	0	0	0	0	114.5	F172 N194 Y280	F172-G282 PolarHBondContact O-N 2.91Å; N194-G282 VanDerWaalsContact CB-O 3.3Å; N194-G282 WeakPolarHBondContact CB-O 3.24Å; N194-G282 PolarHBondContact ND2-O 2.92Å; Y280-G282 PolarHBondContact O-N 3.24Å
283	C	86.3	Confident	86.3	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.148	C	C	.	.			trans	-63.8	148.6	170.3	-59.9	0	0	0	0	110.7	E171 F172 I190 T191 I195 Y280	E171-C283 WeakPolarHBondContact CA-O 3.39Å; F172-C283 HydrophobicContact CD2-CB 3.73Å; F172-C283 WeakPolarHBondContact CD2-O 3.36Å; F172-C283 HydrophobicContact CE2-CB 3.84Å; F172-C283 PolarHBondContact N-O 3.2Å; I190-C283 HydrophobicContact CD1-CB 4.35Å; T191-C283 WeakPolarHBondContact O-CA 2.96Å; I195-C283 WeakPolarHBondContact CD1-SG 3.35Å; Y280-C283 WeakPolarHBondContact O-CB 3.5Å; Y280-C283 PolarHBondContact O-N 3.09Å
284	K	84.4	Confident	86.7	Confident	66 Å²	66	30.4 Å²	30.4	29%	0.287	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	140.6	173.4	-69.1	176.6	179.9	173.6	0	110.5	E170 E171 I190 T191	E170-K284 WeakPolarHBondContact O-CA 3.48Å; E171-K284 HydrophobicContact CB-CG 4.44Å; E171-K284 HydrophobicContact CG-CD 4.08Å; E171-K284 HydrophobicContact CG-CG 3.48Å; E171-K284 VanDerWaalsContact CG-CG 3.48Å; E171-K284 WeakPolarHBondContact OE1-CE 3.47Å; E171-K284 IonicContact OE1-NZ 3.94Å; E171-K284 PolarHBondContact OE1-NZ 3.44Å; I190-K284 CarbonylContact C-O 2.89Å; I190-K284 VanDerWaalsContact CA-O 3.31Å; I190-K284 WeakPolarHBondContact CA-O 3.13Å; T191-K284 PolarHBondContact N-O 3.47Å; T191-K284 PolarHBondContact O-N 2.94Å; T191-K284 WeakPolarHBondContact OG1-CB 3.44Å; T191-K284 PolarHBondContact OG1-O 3.3Å
285	L	87.9	Confident	87.1	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	132.2	170.7	-165.6	70.4	0	0	0	109.9	K167 N168 N169 E170 F172 I190 T288 I291	K167-L285 WeakPolarHBondContact O-CD2 3.25Å; N168-L285 PolarHBondContact OD1-O 3.19Å; N169-L285 WeakPolarHBondContact CA-O 3.36Å; N169-L285 PolarHBondContact N-O 2.8Å; E170-L285 PolarHBondContact O-N 3.11Å; E170-L285 VanDerWaalsContact O-N 3.15Å; F172-L285 HydrophobicContact CE1-CB 4.24Å; F172-L285 HydrophobicContact CZ-CB 3.98Å; F172-L285 HydrophobicContact CZ-CD1 3.97Å; I190-L285 HydrophobicContact CG2-CD1 4.32Å; L285-T288 WeakPolarHBondContact CD1-OG1 3.44Å; L285-T288 WeakPolarHBondContact CD2-O 3.23Å; L285-T288 WeakPolarHBondContact CG-OG1 3.31Å; L285-I291 HydrophobicContact CD1-CD1 4.32Å; L285-I291 HydrophobicContact CD1-CG1 4.33Å; L285-I291 HydrophobicContact CD1-CG2 3.58Å; L285-I291 HydrophobicContact CD2-CG1 4.21Å; L285-I291 HydrophobicContact CD2-CG2 3.97Å; L285-I291 HydrophobicContact CG-CG2 4.46Å
286	K	82.5	Confident	87.5	Confident	70 Å²	70	24 Å²	24	30%	0.304	11%	0.114	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	157.4	174.6	-79.8	-62.5	-170.1	174.8	0	110	N168 N169 Y189 T191 T288	N168-K286 WeakPolarHBondContact OD1-CA 3.31Å; N169-K286 VanDerWaalsContact OD1-CD 3.27Å; N169-K286 WeakPolarHBondContact OD1-CD 3.34Å; N169-K286 VanDerWaalsContact OD1-CE 3.27Å; N169-K286 WeakPolarHBondContact OD1-CE 3.47Å; N169-K286 PolarHBondContact OD1-NZ 3.41Å; Y189-K286 VanDerWaalsContact CB-O 3.25Å; Y189-K286 WeakPolarHBondContact CB-O 3.22Å; Y189-K286 PolarHBondContact O-N 3.4Å; T191-K286 HydrophobicContact CG2-CB 4.23Å; T191-K286 HydrophobicContact CG2-CG 3.44Å; T191-K286 VanDerWaalsContact CG2-CG 3.44Å; K286-T288 PolarHBondContact O-N 3.44Å; K286-T288 PolarHBondContact O-OG1 3.26Å
287	N	77.2	Confident	87.8	Confident	48 Å²	48	19.8 Å²	19.8	26%	0.257	9%	0.091	S	C	.	.	S	Bend	trans	44.9	29.4	173.3	-55	2.1	0	0	0	114.9	N168 N183 Y189 Q630	N168-N287 PolarHBondContact OD1-N 3.06Å; N183-N287 PolarHBondContact ND2-O 3.28Å; Y189-N287 HydrophobicContact CD2-CB 3.8Å; Y189-N287 WeakPolarHBondContact CD2-O 3.28Å; Y189-N287 HydrophobicContact CG-CB 4.22Å; N287-Q630 PolarHBondContact ND2-OE1 3.22Å
288	T	82.2	Confident	88	Confident	2 Å²	2	19 Å²	19	1%	0.012	9%	0.087	C	C	.	.			trans	-147.6	124.6	179.9	27	0	0	0	0	107.8	N168 N183 C188 Y189 L285 K286	N168-T288 WeakPolarHBondContact CA-O 3.36Å; N168-T288 WeakPolarHBondContact CB-O 3.32Å; N183-T288 VanDerWaalsContact ND2-CG2 3.26Å; N183-T288 WeakPolarHBondContact ND2-CG2 3.44Å; C188-T288 HydrophobicContact CB-CG2 3.91Å; Y189-T288 HydrophobicContact CD2-CG2 4.36Å; L285-T288 WeakPolarHBondContact CD1-OG1 3.44Å; L285-T288 WeakPolarHBondContact CD2-O 3.23Å; L285-T288 WeakPolarHBondContact CG-OG1 3.31Å; K286-T288 PolarHBondContact O-N 3.44Å; K286-T288 PolarHBondContact O-OG1 3.26Å
289	K	83.5	Confident	87.7	Confident	139 Å²	139	19 Å²	19	60%	0.604	9%	0.087	S	C	*	.	S	Bend	trans	-63.6	-46.3	-174.4	-67.3	-175.2	178.2	-178.7	0	111.6	N168 S182	N168-K289 PolarHBondContact N-O 3.17Å; S182-K289 PolarHBondContact OG-N 2.69Å
290	Y	87.3	Confident	87.3	Confident	30 Å²	30	23.7 Å²	23.7	12%	0.118	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	158.2	178	54	-102.7	0	0	0	111.9	L165 C166 S182 L218	L165-Y290 HydrophobicContact CD1-CD2 4.42Å; L165-Y290 HydrophobicContact CD1-CG 4.44Å; C166-Y290 CarbonylContact O-C 3.48Å; C166-Y290 VanDerWaalsContact O-CA 3.27Å; C166-Y290 WeakPolarHBondContact O-CA 3.41Å; S182-Y290 PolarHBondContact N-O 3.28Å; S182-Y290 VanDerWaalsContact N-O 3.13Å; L218-Y290 HydrophobicContact CD1-CD2 3.51Å; L218-Y290 HydrophobicContact CD1-CE2 3.23Å; L218-Y290 HydrophobicContact CD2-CD1 4.03Å; L218-Y290 HydrophobicContact CD2-CD2 3.67Å; L218-Y290 HydrophobicContact CD2-CE1 3.75Å; L218-Y290 HydrophobicContact CD2-CE2 3.42Å; L218-Y290 VanDerWaalsContact CD2-CE2 3.42Å; L218-Y290 HydrophobicContact CD2-CG 3.99Å; L218-Y290 VanDerWaalsContact CD2-CZ 3.42Å; L218-Y290 HydrophobicContact CG-CD2 4.22Å; L218-Y290 HydrophobicContact CG-CE2 3.87Å
291	I	91	Very high	87.2	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.005	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	150.4	168.6	63	159.6	0	0	0	110.9	L165 C166 F172 S180 C188 L279 L285	L165-I291 WeakPolarHBondContact CA-O 3.39Å; C166-I291 HydrophobicContact CB-CD1 4.26Å; C166-I291 HydrophobicContact CB-CG1 3.81Å; C166-I291 PolarHBondContact N-O 3.41Å; C166-I291 VanDerWaalsContact N-O 3.08Å; C166-I291 PolarHBondContact O-N 2.93Å; F172-I291 HydrophobicContact CD1-CD1 4.18Å; F172-I291 HydrophobicContact CE1-CD1 3.3Å; F172-I291 HydrophobicContact CE1-CG1 4.13Å; F172-I291 HydrophobicContact CZ-CD1 3.66Å; S180-I291 WeakPolarHBondContact O-CA 3.27Å; C188-I291 HydrophobicContact CB-CG2 4.09Å; L279-I291 HydrophobicContact CD1-CD1 3.1Å; L285-I291 HydrophobicContact CD1-CD1 4.32Å; L285-I291 HydrophobicContact CD1-CG1 4.33Å; L285-I291 HydrophobicContact CD1-CG2 3.58Å; L285-I291 HydrophobicContact CD2-CG1 4.21Å; L285-I291 HydrophobicContact CD2-CG2 3.97Å; L285-I291 HydrophobicContact CG-CG2 4.46Å
292	I	91.5	Very high	87.3	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	125.4	165.4	-63.9	-176.7	0	0	0	108	W150 I163 I164 L165 L179 S180 Y214 L218	W150-I292 HydrophobicContact CH2-CD1 4.27Å; W150-I292 HydrophobicContact CH2-CG1 4.36Å; W150-I292 HydrophobicContact CZ2-CD1 4.19Å; I163-I292 HydrophobicContact CG2-CG2 3.48Å; I163-I292 VanDerWaalsContact CG2-CG2 3.48Å; I164-I292 WeakPolarHBondContact O-CA 3.19Å; L165-I292 HydrophobicContact CD1-CG1 3.83Å; L179-I292 HydrophobicContact CB-CG2 4.13Å; L179-I292 HydrophobicContact CD1-CG2 4.16Å; L179-I292 PolarHBondContact N-O 3.34Å; S180-I292 PolarHBondContact N-O 3.35Å; S180-I292 PolarHBondContact O-N 3.13Å; Y214-I292 HydrophobicContact CD1-CG2 4.13Å; L218-I292 HydrophobicContact CD1-CD1 3.41Å; L218-I292 VanDerWaalsContact CD1-CD1 3.41Å; L218-I292 HydrophobicContact CD1-CG1 3.76Å; L218-I292 HydrophobicContact CG-CD1 4.17Å
293	G	91.7	Very high	87.5	Confident	1 Å²	1	23.1 Å²	23.1	1%	0.01	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	145.3	-179.6	0	0	0	0	0	113.8	I163 I164 I177	I163-G293 WeakPolarHBondContact CA-O 3.38Å; I164-G293 PolarHBondContact N-O 3.12Å; I164-G293 PolarHBondContact O-N 3.5Å; I177-G293 CarbonylContact O-C 3.37Å; I177-G293 WeakPolarHBondContact O-CA 3.46Å
294	L	93.4	Very high	87.1	Confident	2 Å²	2	24.8 Å²	24.8	1%	0.01	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	127.5	172.1	178.7	70.1	0	0	0	110.5	A34 I163 L176 I177 L179 V246	A34-L294 HydrophobicContact CB-CD1 4.11Å; I163-L294 HydrophobicContact CG1-CD1 3.84Å; L176-L294 CarbonylContact C-O 3.44Å; L176-L294 VanDerWaalsContact CA-O 3.23Å; L176-L294 WeakPolarHBondContact CA-O 3.48Å; I177-L294 HydrophobicContact CB-CB 4.49Å; I177-L294 PolarHBondContact N-O 3.4Å; I177-L294 PolarHBondContact O-N 3.34Å; L179-L294 HydrophobicContact CD1-CB 3.9Å; L179-L294 HydrophobicContact CG-CB 4.2Å; V246-L294 HydrophobicContact CG2-CD2 3.61Å
295	V	94.1	Very high	86.8	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	125.1	-179.7	-179.9	0	0	0	0	111.5	I158 G161 D162 I164 S174 L176 T298	I158-V295 HydrophobicContact CG2-CB 4.4Å; I158-V295 HydrophobicContact CG2-CG1 4.1Å; I158-V295 HydrophobicContact CG2-CG2 3.63Å; G161-V295 PolarHBondContact N-O 3.46Å; D162-V295 VanDerWaalsContact O-CG2 3.32Å; D162-V295 WeakPolarHBondContact O-CG2 3.36Å; D162-V295 PolarHBondContact O-N 3.08Å; I164-V295 HydrophobicContact CD1-CG2 4.32Å; I164-V295 HydrophobicContact CG1-CG2 4.4Å; I164-V295 HydrophobicContact CG2-CG2 3.89Å; S174-V295 WeakPolarHBondContact OG-CG1 3.3Å; L176-V295 HydrophobicContact CD2-CB 4.27Å; L176-V295 HydrophobicContact CD2-CG2 3.58Å; V295-T298 HydrophobicContact CG1-CG2 3.49Å; V295-T298 VanDerWaalsContact CG1-CG2 3.49Å
296	I	92.1	Very high	86.2	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	-40.1	-178.6	48.5	164.3	0	0	0	114.9	D175 I177 Y248 F258 I278	D175-I296 HydrophobicContact CB-CD1 4.44Å; D175-I296 HydrophobicContact CB-CG1 4.18Å; D175-I296 WeakPolarHBondContact O-CG1 3.39Å; D175-I296 PolarHBondContact O-N 3.28Å; I177-I296 HydrophobicContact CD1-CD1 4.28Å; I177-I296 HydrophobicContact CD1-CG2 3.44Å; I177-I296 VanDerWaalsContact CD1-CG2 3.44Å; I177-I296 HydrophobicContact CG1-CD1 3.92Å; I177-I296 HydrophobicContact CG1-CG1 4.39Å; I177-I296 HydrophobicContact CG1-CG2 3.88Å; Y248-I296 HydrophobicContact CE2-CB 4.33Å; Y248-I296 PolarHBondContact OH-O 2.53Å; F258-I296 HydrophobicContact CE2-CD1 3.78Å; F258-I296 HydrophobicContact CZ-CD1 3.71Å; I278-I296 HydrophobicContact CD1-CD1 3.4Å; I278-I296 VanDerWaalsContact CD1-CD1 3.4Å; I278-I296 HydrophobicContact CG1-CD1 3.89Å
297	Y	92.4	Very high	85.5	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	131.9	174.2	-58	-57.9	0	0	0	109.4	S174 D175 Y248 Q249 Q250 P251 F258 D301 T302	S174-Y297 VanDerWaalsContact CB-O 3.27Å; S174-Y297 WeakPolarHBondContact CB-O 3.29Å; D175-Y297 HydrophobicContact CB-CD2 3.95Å; D175-Y297 HydrophobicContact CB-CG 4.46Å; D175-Y297 PolarHBondContact N-O 3.38Å; D175-Y297 VanDerWaalsContact N-O 3.12Å; D175-Y297 WeakPolarHBondContact OD2-CD2 3.45Å; Y248-Y297 AromaticContact CD2-CE1 3.97Å; Y248-Y297 HydrophobicContact CD2-CE1 3.97Å; Y248-Y297 AromaticContact CD2-CZ 3.83Å; Y248-Y297 HydrophobicContact CE2-CD1 4.07Å; Y248-Y297 AromaticContact CE2-CE1 3.43Å; Y248-Y297 HydrophobicContact CE2-CE1 3.43Å; Y248-Y297 VanDerWaalsContact CE2-CE1 3.43Å; Y248-Y297 AromaticContact CE2-CZ 3.77Å; Q249-Y297 PolarHBondContact O-OH 3.4Å; Q250-Y297 PolarHBondContact O-OH 2.98Å; P251-Y297 HydrophobicContact CB-CD1 4.11Å; P251-Y297 HydrophobicContact CB-CE1 3.8Å; P251-Y297 HydrophobicContact CG-CE1 4.26Å; F258-Y297 HydrophobicContact CD2-CE2 4.37Å; F258-Y297 AromaticContact CE2-CE2 3.98Å; F258-Y297 HydrophobicContact CE2-CE2 3.98Å; Y297-D301 HydrophobicContact CD1-CB 4.22Å; Y297-T302 VanDerWaalsContact O-CG2 3.23Å; Y297-T302 WeakPolarHBondContact O-CG2 3.32Å
298	T	92.1	Very high	84.8	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.006	13%	0.133	C	C	.	.			trans	-119.9	155.8	178.4	44.2	0	0	0	0	109.7	C52 N54 V160 V295 N300 D301	C52-T298 PolarHBondContact O-OG1 3.13Å; C52-T298 PolarHBondContact SG-O 3.27Å; N54-T298 HydrophobicContact CB-CG2 4.15Å; V160-T298 HydrophobicContact CG2-CG2 3.93Å; V160-T298 WeakPolarHBondContact CG2-OG1 3.49Å; V295-T298 HydrophobicContact CG1-CG2 3.49Å; V295-T298 VanDerWaalsContact CG1-CG2 3.49Å; T298-N300 PolarHBondContact O-N 2.81Å; T298-D301 PolarHBondContact O-N 2.96Å; T298-D301 VanDerWaalsContact O-N 3.11Å
299	G	85.6	Confident	83.7	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	51.9	-132.2	170	0	0	0	0	0	114.3	N53 N54 D301 T302 L305	N53-G299 VanDerWaalsContact O-CA 3.31Å; N53-G299 WeakPolarHBondContact O-CA 3.08Å; N54-G299 PolarHBondContact OD1-N 3.43Å; G299-D301 PolarHBondContact O-N 3.07Å; G299-D301 VanDerWaalsContact O-N 3.1Å; G299-T302 PolarHBondContact O-N 2.89Å; G299-T302 PolarHBondContact O-OG1 2.8Å; G299-L305 VanDerWaalsContact C-CD1 3.47Å; G299-L305 WeakPolarHBondContact O-CD1 3.45Å
300	N	83.8	Confident	82.5	Confident	99 Å²	99	32 Å²	32	53%	0.529	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-62	-16.5	-176.8	-67.6	-11.1	0	0	0	114.4	T298 L306	T298-N300 PolarHBondContact O-N 2.81Å; N300-L306 WeakPolarHBondContact O-CD2 3.45Å
301	D	88.7	Confident	81.2	Confident	26 Å²	26	34.6 Å²	34.6	14%	0.139	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-84.2	-11.9	177.3	-68.8	-28	0	0	0	112.9	R30 C52 P251 Y297 T298 G299	R30-D301 IonicContact CZ-OD2 2.73Å; R30-D301 IonicContact NH1-OD2 3.92Å; R30-D301 PolarHBondContact NH1-OD2 3.05Å; R30-D301 IonicContact NH2-OD1 3.79Å; R30-D301 PolarHBondContact NH2-OD1 3.45Å; R30-D301 IonicContact NH2-OD2 3.42Å; R30-D301 PolarHBondContact NH2-OD2 2.71Å; C52-D301 PolarHBondContact SG-OD2 2.77Å; P251-D301 HydrophobicContact CB-CB 4.14Å; P251-D301 VanDerWaalsContact CB-O 3.3Å; P251-D301 WeakPolarHBondContact CB-O 3.25Å; P251-D301 HydrophobicContact CG-CB 4.12Å; Y297-D301 HydrophobicContact CD1-CB 4.22Å; T298-D301 PolarHBondContact O-N 2.96Å; T298-D301 VanDerWaalsContact O-N 3.11Å; G299-D301 PolarHBondContact O-N 3.07Å; G299-D301 VanDerWaalsContact O-N 3.1Å
302	T	87	Confident	79.9	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.22	C	C	.	.	S	Bend	trans	-67.6	141	177.2	56.5	0	0	0	0	110.9	D175 K281 Y297 G299 L304 L305 L306	D175-T302 WeakPolarHBondContact OD2-CA 3.19Å; K281-T302 HydrophobicContact CB-CG2 4.25Å; K281-T302 HydrophobicContact CD-CG2 3.88Å; Y297-T302 VanDerWaalsContact O-CG2 3.23Å; Y297-T302 WeakPolarHBondContact O-CG2 3.32Å; G299-T302 PolarHBondContact O-N 2.89Å; G299-T302 PolarHBondContact O-OG1 2.8Å; T302-L304 PolarHBondContact O-N 3.2Å; T302-L304 VanDerWaalsContact O-N 3.14Å; T302-L305 PolarHBondContact O-N 2.94Å; T302-L306 PolarHBondContact O-N 3.27Å
303	K	82.3	Confident	78.7	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-57.2	-34.6	-176.6	-62.8	-159.4	-175.9	179.7	0	113.1	D175 N252 D254 F255 N257 Y280 N307	D175-K303 PolarHBondContact OD2-N 3.32Å; N252-K303 WeakPolarHBondContact O-CG 2.96Å; N252-K303 WeakPolarHBondContact OD1-CE 3.16Å; N252-K303 PolarHBondContact OD1-NZ 3.36Å; D254-K303 PolarHBondContact O-NZ 2.9Å; F255-K303 HydrophobicContact CD1-CB 3.92Å; F255-K303 HydrophobicContact CD1-CD 4.08Å; F255-K303 HydrophobicContact CE1-CB 3.47Å; F255-K303 VanDerWaalsContact CE1-CB 3.47Å; F255-K303 HydrophobicContact CE1-CD 4.48Å; F255-K303 HydrophobicContact CZ-CB 3.89Å; N257-K303 PolarHBondContact O-NZ 3.1Å; Y280-K303 HydrophobicContact CD1-CB 4.46Å; Y280-K303 HydrophobicContact CD1-CD 4.09Å; Y280-K303 HydrophobicContact CD1-CG 4.32Å; Y280-K303 HydrophobicContact CE1-CD 3.49Å; Y280-K303 VanDerWaalsContact CE1-CD 3.49Å; Y280-K303 HydrophobicContact CE1-CG 4.14Å; Y280-K303 PolarHBondContact OH-NZ 2.78Å; K303-N307 PolarHBondContact O-N 2.97Å; K303-N307 PolarHBondContact O-ND2 3.24Å
304	L	78.9	Confident	77.7	Confident	35 Å²	35	47.2 Å²	47.2	18%	0.183	24%	0.237	C	C	.	.	H	α-helix	trans	-61.2	-46	174.6	-177.2	68.6	0	0	0	112.5	I195 K281 T302 N307 S308 E1056	I195-L304 HydrophobicContact CG1-CD1 4.27Å; K281-L304 HydrophobicContact CG-CD2 4.26Å; T302-L304 PolarHBondContact O-N 3.2Å; T302-L304 VanDerWaalsContact O-N 3.14Å; L304-N307 PolarHBondContact O-N 2.91Å; L304-S308 PolarHBondContact O-N 2.84Å; L304-E1056 WeakPolarHBondContact CD1-OE1 3.43Å
305	L	78.1	Confident	76.8	Confident	33 Å²	33	51.7 Å²	51.7	17%	0.173	25%	0.254	C	S	.	.	H	α-helix	trans	-76.1	-28.7	-177.4	-78	167.6	0	0	0	112.7	I56 G299 T302 N307 S308	I56-L305 HydrophobicContact CG1-CD1 4.4Å; G299-L305 VanDerWaalsContact C-CD1 3.47Å; G299-L305 WeakPolarHBondContact O-CD1 3.45Å; T302-L305 PolarHBondContact O-N 2.94Å; L305-N307 VanDerWaalsContact C-N 3.31Å; L305-S308 WeakPolarHBondContact CA-OG 3.4Å; L305-S308 PolarHBondContact O-N 3.15Å; L305-S308 VanDerWaalsContact O-N 3.16Å; L305-S308 PolarHBondContact O-OG 2.8Å
306	L	75	Confident	76.3	Confident	55 Å²	55	51.9 Å²	51.9	29%	0.288	26%	0.255	S	S	.	.	H	α-helix	trans	-62.9	-38.6	170.3	-67.1	168.4	0	0	0	111.9	P251 E253 N300 T302 S308	P251-L306 HydrophobicContact CB-CD1 3.82Å; E253-L306 HydrophobicContact CG-CB 4.01Å; N300-L306 WeakPolarHBondContact O-CD2 3.45Å; T302-L306 PolarHBondContact O-N 3.27Å; L306-S308 VanDerWaalsContact C-N 3.27Å; L306-S308 PolarHBondContact O-N 3.17Å
307	N	66.9	Low	75.9	Confident	64 Å²	64	53.7 Å²	53.7	34%	0.342	27%	0.267	S	S	.	.	S	Bend	trans	-78.7	-8.6	175.1	-73.9	-64	0	0	0	113.7	E253 F255 K303 L304 L305	E253-N307 PolarHBondContact O-ND2 3.37Å; F255-N307 WeakPolarHBondContact CE2-ND2 3.33Å; K303-N307 PolarHBondContact O-N 2.97Å; K303-N307 PolarHBondContact O-ND2 3.24Å; L304-N307 PolarHBondContact O-N 2.91Å; L305-N307 VanDerWaalsContact C-N 3.31Å
308	S	63.7	Low	75.7	Confident	53 Å²	53	54 Å²	54	37%	0.371	27%	0.267	S	S	.	.	S	Bend	trans	-88.1	115.8	175.7	77.6	0	0	0	0	110.7	L304 L305 L306 K310	L304-S308 PolarHBondContact O-N 2.84Å; L305-S308 WeakPolarHBondContact CA-OG 3.4Å; L305-S308 PolarHBondContact O-N 3.15Å; L305-S308 VanDerWaalsContact O-N 3.16Å; L305-S308 PolarHBondContact O-OG 2.8Å; L306-S308 VanDerWaalsContact C-N 3.27Å; L306-S308 PolarHBondContact O-N 3.17Å; S308-K310 PolarHBondContact O-N 3.29Å
309	N	58.3	Low	75.4	Confident	95 Å²	95	54.4 Å²	54.4	51%	0.508	27%	0.269	S	S	.	.			trans	-69.1	137.1	172.3	-70.7	-47.7	0	0	0	110	V311 L1041	N309-V311 PolarHBondContact O-N 3.44Å; N309-V311 VanDerWaalsContact O-N 3.14Å; N309-L1041 HydrophobicContact CB-CD1 4.05Å
310	K	58.9	Low	75.5	Confident	177 Å²	177	58.2 Å²	58.2	77%	0.77	30%	0.296	S	S	*	.			trans	-56.9	121.9	167.3	-68.5	-179	-178.9	175.4	0	108.9	S308 K312	S308-K310 PolarHBondContact O-N 3.29Å; K310-K312 PolarHBondContact O-N 2.95Å
311	V	59	Low	75.7	Confident	85 Å²	85	56.4 Å²	56.4	52%	0.515	28%	0.284	S	S	.	.			trans	-59	108.9	179.5	-178.5	0	0	0	0	109	N309	N309-V311 PolarHBondContact O-N 3.44Å; N309-V311 VanDerWaalsContact O-N 3.14Å
312	K	63.7	Low	75.7	Confident	177 Å²	177	55.5 Å²	55.5	77%	0.77	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-95.5	146.9	172.1	-67.5	-179.8	-177	176.9	0	109.2	K310 K314	K310-K312 PolarHBondContact O-N 2.95Å; K312-K314 PolarHBondContact O-N 3.44Å
313	R	66.9	Low	75.9	Confident	38 Å²	38	56.9 Å²	56.9	14%	0.143	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-60.9	125	170.1	-174.5	173.6	-179.6	159.3	-0.3	109.1	E73 Y77 E392	E73-R313 WeakPolarHBondContact OE2-CD 3.45Å; E73-R313 IonicContact OE2-CZ 2.72Å; E73-R313 IonicContact OE2-NH1 3.17Å; E73-R313 PolarHBondContact OE2-NH1 3.4Å; Y77-R313 PolarHBondContact OH-NH2 3.4Å; R313-E392 IonicContact NH2-OE1 2.78Å; R313-E392 PolarHBondContact NH2-OE1 2.81Å
314	K	70.7	Confident	76.2	Confident	51 Å²	51	62.4 Å²	62.4	22%	0.222	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-89.7	129.2	174.2	-67	-176.4	-179.9	-177.6	0	108.4	K312 L424 A1043 N1044 D1062	K312-K314 PolarHBondContact O-N 3.44Å; K314-L424 HydrophobicContact CB-CD1 4.43Å; K314-L424 HydrophobicContact CB-CD2 4.13Å; K314-L424 HydrophobicContact CD-CD1 3.9Å; K314-A1043 PolarHBondContact NZ-O 3.09Å; K314-N1044 WeakPolarHBondContact CD-O 3.49Å; K314-N1044 PolarHBondContact NZ-O 3.11Å; K314-D1062 IonicContact NZ-OD1 2.73Å; K314-D1062 IonicContact NZ-OD2 3.99Å; K314-D1062 PolarHBondContact NZ-OD2 2.91Å
315	Y	74.5	Confident	76.8	Confident	97 Å²	97	61.3 Å²	61.3	38%	0.38	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-91.4	138.2	174.6	-64.9	-80.1	0	0	0	110.3	H76	H76-Y315 HydrophobicContact CB-CE1 4.31Å; H76-Y315 PolarHBondContact CD2-OH 3.43Å; H76-Y315 AromaticContact CG-CZ 3.97Å
316	T	83.1	Confident	77.5	Confident	3 Å²	3	60 Å²	60	2%	0.018	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-78.4	149.3	178.4	61	0	0	0	0	111	R318 E319 S320 Q423 L424 E427	T316-R318 PolarHBondContact O-N 3.48Å; T316-E319 PolarHBondContact N-OE2 3.18Å; T316-E319 PolarHBondContact O-N 2.81Å; T316-E319 WeakPolarHBondContact OG1-CB 3.32Å; T316-E319 VanDerWaalsContact OG1-CD 3.23Å; T316-E319 WeakPolarHBondContact OG1-CG 3.49Å; T316-E319 PolarHBondContact OG1-N 2.87Å; T316-E319 VanDerWaalsContact OG1-N 3.1Å; T316-E319 PolarHBondContact OG1-OE1 3.4Å; T316-S320 PolarHBondContact O-N 2.84Å; T316-Q423 WeakPolarHBondContact CG2-O 3.35Å; T316-L424 HydrophobicContact CG2-CD2 3.97Å; T316-E427 WeakPolarHBondContact CA-OE1 3.29Å; T316-E427 WeakPolarHBondContact CB-OE1 3.47Å; T316-E427 HydrophobicContact CG2-CG 3.81Å
317	T	84	Confident	78.3	Confident	39 Å²	39	62.5 Å²	62.5	24%	0.239	31%	0.309	C	S	.	.	H	α-helix	trans	-59.9	-30.3	169.5	64.1	0	0	0	0	111.2	K321 E427 I1026 Q1164	T317-K321 PolarHBondContact O-N 3.05Å; T317-E427 WeakPolarHBondContact CA-OE1 3.44Å; T317-E427 WeakPolarHBondContact CB-OE1 3.34Å; T317-E427 PolarHBondContact N-OE1 2.9Å; T317-E427 PolarHBondContact OG1-OE1 2.97Å; T317-E427 PolarHBondContact OG1-OE2 2.91Å; T317-I1026 HydrophobicContact CG2-CD1 3.84Å; T317-I1026 HydrophobicContact CG2-CG1 3.82Å; T317-Q1164 VanDerWaalsContact CB-NE2 3.3Å; T317-Q1164 PolarHBondContact O-NE2 3.46Å; T317-Q1164 PolarHBondContact OG1-NE2 3.47Å
318	R	88.2	Confident	79.5	Confident	5 Å²	5	62.4 Å²	62.4	2%	0.019	31%	0.308	C	S	.	.	H	α-helix	trans	-64	-48.4	174.8	178.9	-165.7	54.7	74.9	0.6	111.1	T316 S320 K321 A322 D426 I1086 M1090 Q1164 L1167	T316-R318 PolarHBondContact O-N 3.48Å; R318-S320 VanDerWaalsContact C-N 3.31Å; R318-S320 PolarHBondContact O-N 2.93Å; R318-K321 PolarHBondContact O-N 3.2Å; R318-K321 VanDerWaalsContact O-N 3.13Å; R318-A322 WeakPolarHBondContact O-CB 3.19Å; R318-A322 PolarHBondContact O-N 3.1Å; R318-D426 WeakPolarHBondContact CB-OD2 3.38Å; R318-D426 WeakPolarHBondContact CD-OD2 3.47Å; R318-D426 IonicContact CZ-OD2 2.66Å; R318-D426 IonicContact NE-OD2 3.5Å; R318-D426 PolarHBondContact NE-OD2 2.68Å; R318-I1086 VanDerWaalsContact CD-CG2 3.41Å; R318-M1090 HydrophobicContact CG-SD 3.84Å; R318-Q1164 VanDerWaalsContact N-NE2 3.1Å; R318-L1167 HydrophobicContact CG-CD1 3.77Å
319	E	87.3	Confident	80.8	Confident	10 Å²	10	60.4 Å²	60.4	5%	0.047	29%	0.292	C	S	.	.	H	α-helix	trans	-57.8	-44	177.2	-81.6	161.2	-158.1	0	0	111.9	Y77 T316 K321 A322 N323	Y77-E319 HydrophobicContact CE1-CG 4.29Å; T316-E319 PolarHBondContact N-OE2 3.18Å; T316-E319 PolarHBondContact O-N 2.81Å; T316-E319 WeakPolarHBondContact OG1-CB 3.32Å; T316-E319 VanDerWaalsContact OG1-CD 3.23Å; T316-E319 WeakPolarHBondContact OG1-CG 3.49Å; T316-E319 PolarHBondContact OG1-N 2.87Å; T316-E319 VanDerWaalsContact OG1-N 3.1Å; T316-E319 PolarHBondContact OG1-OE1 3.4Å; E319-K321 VanDerWaalsContact C-N 3.3Å; E319-K321 PolarHBondContact O-N 2.85Å; E319-A322 PolarHBondContact O-N 2.82Å; E319-N323 WeakPolarHBondContact O-CB 3.49Å; E319-N323 PolarHBondContact O-N 3.38Å
320	S	85.9	Confident	82.4	Confident	80 Å²	80	57 Å²	57	56%	0.559	27%	0.274	S	S	*	.	H	α-helix	trans	-58.8	-42.1	175.9	-175.7	0	0	0	0	112	T316 R318 Q324	T316-S320 PolarHBondContact O-N 2.84Å; R318-S320 VanDerWaalsContact C-N 3.31Å; R318-S320 PolarHBondContact O-N 2.93Å; S320-Q324 PolarHBondContact O-N 3.26Å; S320-Q324 VanDerWaalsContact O-N 3.15Å
321	K	87.8	Confident	84	Confident	62 Å²	62	52.2 Å²	52.2	27%	0.27	26%	0.256	S	S	.	.	H	α-helix	trans	-72.4	-36.8	176.8	-71.6	-138.6	-160.8	138.2	0	113	T317 R318 E319 Q324 I325 H1163	T317-K321 PolarHBondContact O-N 3.05Å; R318-K321 PolarHBondContact O-N 3.2Å; R318-K321 VanDerWaalsContact O-N 3.13Å; E319-K321 VanDerWaalsContact C-N 3.3Å; E319-K321 PolarHBondContact O-N 2.85Å; K321-Q324 WeakPolarHBondContact O-CB 3.44Å; K321-Q324 PolarHBondContact O-N 2.99Å; K321-I325 WeakPolarHBondContact O-CG1 3.4Å; K321-I325 PolarHBondContact O-N 2.92Å; K321-H1163 PolarHBondContact NZ-O 2.98Å
322	A	89.4	Confident	85.6	Confident	6 Å²	6	53.4 Å²	53.4	5%	0.05	25%	0.254	C	S	.	.	H	α-helix	trans	-62.3	-45.3	174.9	0	0	0	0	0	110.9	R318 E319 Q324 I325 L326 M1090	R318-A322 WeakPolarHBondContact O-CB 3.19Å; R318-A322 PolarHBondContact O-N 3.1Å; E319-A322 PolarHBondContact O-N 2.82Å; A322-Q324 VanDerWaalsContact C-N 3.28Å; A322-Q324 PolarHBondContact O-N 3.06Å; A322-I325 PolarHBondContact O-N 3.08Å; A322-I325 VanDerWaalsContact O-N 3.15Å; A322-L326 WeakPolarHBondContact O-CB 3.4Å; A322-L326 VanDerWaalsContact O-CG 3.29Å; A322-L326 WeakPolarHBondContact O-CG 3.32Å; A322-L326 PolarHBondContact O-N 3.28Å; A322-M1090 HydrophobicContact CB-CE 3.64Å; A322-M1090 HydrophobicContact CB-SD 4.31Å
323	N	90.6	Very high	87	Confident	30 Å²	30	45 Å²	45	16%	0.16	22%	0.218	C	C	.	.	H	α-helix	trans	-58	-39.5	172.8	-80.4	-18.2	0	0	0	112	H76 M78 E319 F327	H76-N323 PolarHBondContact O-ND2 3.23Å; M78-N323 HydrophobicContact CG-CB 4.19Å; M78-N323 PolarHBondContact N-OD1 2.92Å; E319-N323 WeakPolarHBondContact O-CB 3.49Å; E319-N323 PolarHBondContact O-N 3.38Å; N323-F327 VanDerWaalsContact O-CB 3.29Å; N323-F327 WeakPolarHBondContact O-CB 3.49Å; N323-F327 PolarHBondContact O-N 3.43Å
324	Q	90.4	Very high	88.2	Confident	115 Å²	115	47.4 Å²	47.4	54%	0.537	23%	0.232	S	C	.	.	H	α-helix	trans	-64.5	-43.1	174.9	-171.9	-178.2	5.2	0	0	112.5	S320 K321 A322 F327 I328	S320-Q324 PolarHBondContact O-N 3.26Å; S320-Q324 VanDerWaalsContact O-N 3.15Å; K321-Q324 WeakPolarHBondContact O-CB 3.44Å; K321-Q324 PolarHBondContact O-N 2.99Å; A322-Q324 VanDerWaalsContact C-N 3.28Å; A322-Q324 PolarHBondContact O-N 3.06Å; Q324-F327 PolarHBondContact O-N 3.14Å; Q324-I328 WeakPolarHBondContact O-CG1 3.27Å; Q324-I328 PolarHBondContact O-N 3.31Å; Q324-I328 VanDerWaalsContact O-N 3.12Å
325	I	91.4	Very high	89.2	Confident	12 Å²	12	48.6 Å²	48.6	6%	0.062	24%	0.24	C	C	.	.	H	α-helix	trans	-65.5	-45.8	177.2	-67	163.3	0	0	0	110.8	K321 A322 F327 I328 F329 Y1094 V1172	K321-I325 WeakPolarHBondContact O-CG1 3.4Å; K321-I325 PolarHBondContact O-N 2.92Å; A322-I325 PolarHBondContact O-N 3.08Å; A322-I325 VanDerWaalsContact O-N 3.15Å; I325-F327 VanDerWaalsContact C-N 3.27Å; I325-F327 PolarHBondContact O-N 3.01Å; I325-I328 WeakPolarHBondContact O-CB 3.21Å; I325-I328 PolarHBondContact O-N 3.5Å; I325-I328 VanDerWaalsContact O-N 3.11Å; I325-F329 HydrophobicContact CG2-CE1 4.3Å; I325-F329 HydrophobicContact CG2-CZ 4.35Å; I325-F329 PolarHBondContact O-N 3.32Å; I325-Y1094 HydrophobicContact CD1-CE2 4.32Å; I325-Y1094 HydrophobicContact CG2-CD2 4.46Å; I325-Y1094 HydrophobicContact CG2-CE1 4.42Å; I325-Y1094 HydrophobicContact CG2-CE2 3.95Å; I325-V1172 HydrophobicContact CD1-CG2 4.06Å; I325-V1172 HydrophobicContact CG2-CG1 4.32Å
326	L	91.2	Very high	90.1	Very high	5 Å²	5	48.3 Å²	48.3	3%	0.026	24%	0.241	C	C	.	.	H	α-helix	trans	-61.6	-37.2	176.8	-69.6	173.7	0	0	0	111.7	A322 I328 F329 M330 I383 P384 Y1094	A322-L326 WeakPolarHBondContact O-CB 3.4Å; A322-L326 VanDerWaalsContact O-CG 3.29Å; A322-L326 WeakPolarHBondContact O-CG 3.32Å; A322-L326 PolarHBondContact O-N 3.28Å; L326-I328 VanDerWaalsContact C-N 3.35Å; L326-I328 PolarHBondContact O-N 3.27Å; L326-F329 WeakPolarHBondContact O-CB 3.41Å; L326-F329 PolarHBondContact O-N 3.14Å; L326-M330 WeakPolarHBondContact O-CG 3.14Å; L326-M330 PolarHBondContact O-N 2.87Å; L326-I383 HydrophobicContact CD2-CG2 4.29Å; L326-P384 HydrophobicContact CD2-CG 4.36Å; L326-Y1094 HydrophobicContact CD2-CE1 3.86Å; L326-Y1094 HydrophobicContact CG-CE1 4.48Å
327	F	91.8	Very high	90.5	Very high	108 Å²	108	48.2 Å²	48.2	47%	0.474	24%	0.241	S	C	.	.	H	α-helix	trans	-62.6	-40.2	173.4	-174.9	-99.7	0	0	0	112.8	N323 Q324 I325 F329 M330 I331	N323-F327 VanDerWaalsContact O-CB 3.29Å; N323-F327 WeakPolarHBondContact O-CB 3.49Å; N323-F327 PolarHBondContact O-N 3.43Å; Q324-F327 PolarHBondContact O-N 3.14Å; I325-F327 VanDerWaalsContact C-N 3.27Å; I325-F327 PolarHBondContact O-N 3.01Å; F327-F329 VanDerWaalsContact C-N 3.33Å; F327-F329 PolarHBondContact O-N 2.97Å; F327-M330 HydrophobicContact CB-CE 4.03Å; F327-M330 HydrophobicContact CD2-CE 3.55Å; F327-M330 HydrophobicContact CE2-CE 4.46Å; F327-M330 HydrophobicContact CG-CE 4.21Å; F327-M330 PolarHBondContact O-N 2.82Å; F327-I331 HydrophobicContact CD1-CD1 3.81Å; F327-I331 HydrophobicContact CE1-CD1 3.39Å; F327-I331 HydrophobicContact CE1-CG1 4.27Å; F327-I331 HydrophobicContact CZ-CD1 3.98Å; F327-I331 HydrophobicContact CZ-CG1 4.48Å; F327-I331 WeakPolarHBondContact O-CG1 3.43Å; F327-I331 PolarHBondContact O-N 2.92Å; F327-I331 VanDerWaalsContact O-N 3.12Å
328	I	92.3	Very high	90.9	Very high	63 Å²	63	50.4 Å²	50.4	32%	0.323	25%	0.25	S	C	.	.	H	α-helix	trans	-62.5	-41.4	173.1	-67.1	164.4	0	0	0	110.8	Q324 I325 L326 I331 F332	Q324-I328 WeakPolarHBondContact O-CG1 3.27Å; Q324-I328 PolarHBondContact O-N 3.31Å; Q324-I328 VanDerWaalsContact O-N 3.12Å; I325-I328 WeakPolarHBondContact O-CB 3.21Å; I325-I328 PolarHBondContact O-N 3.5Å; I325-I328 VanDerWaalsContact O-N 3.11Å; L326-I328 VanDerWaalsContact C-N 3.35Å; L326-I328 PolarHBondContact O-N 3.27Å; I328-I331 PolarHBondContact O-N 2.91Å; I328-F332 HydrophobicContact CG2-CD2 3.64Å; I328-F332 HydrophobicContact CG2-CE2 3.43Å; I328-F332 VanDerWaalsContact CG2-CE2 3.43Å; I328-F332 VanDerWaalsContact O-CD2 3.25Å; I328-F332 WeakPolarHBondContact O-CD2 3.47Å; I328-F332 PolarHBondContact O-N 3.47Å
329	F	91.9	Very high	91.1	Very high	11 Å²	11	54 Å²	54	5%	0.048	27%	0.269	C	S	.	.	H	α-helix	trans	-62.7	-41.4	175.7	-76.1	7.8	0	0	0	112.5	I325 L326 F327 I331 F332 M333 L382 Y1094 I1176	I325-F329 HydrophobicContact CG2-CE1 4.3Å; I325-F329 HydrophobicContact CG2-CZ 4.35Å; I325-F329 PolarHBondContact O-N 3.32Å; L326-F329 WeakPolarHBondContact O-CB 3.41Å; L326-F329 PolarHBondContact O-N 3.14Å; F327-F329 VanDerWaalsContact C-N 3.33Å; F327-F329 PolarHBondContact O-N 2.97Å; F329-I331 VanDerWaalsContact C-N 3.33Å; F329-I331 PolarHBondContact O-N 2.82Å; F329-F332 PolarHBondContact O-N 3.16Å; F329-M333 VanDerWaalsContact O-CB 3.28Å; F329-M333 WeakPolarHBondContact O-CB 3.46Å; F329-M333 PolarHBondContact O-N 3.41Å; F329-L382 HydrophobicContact CB-CD2 4.2Å; F329-L382 HydrophobicContact CD2-CG 4.26Å; F329-L382 HydrophobicContact CG-CD2 4.49Å; F329-Y1094 AromaticContact CE2-CD1 3.75Å; F329-Y1094 HydrophobicContact CE2-CD1 3.75Å; F329-Y1094 HydrophobicContact CE2-CE1 4.47Å; F329-Y1094 HydrophobicContact CE2-CG 4.06Å; F329-Y1094 HydrophobicContact CZ-CD1 4.41Å; F329-Y1094 HydrophobicContact CZ-CG 4.31Å; F329-I1176 HydrophobicContact CE1-CD1 3.46Å; F329-I1176 VanDerWaalsContact CE1-CD1 3.46Å; F329-I1176 HydrophobicContact CE1-CG1 4.21Å; F329-I1176 HydrophobicContact CZ-CD1 3.66Å; F329-I1176 HydrophobicContact CZ-CG1 3.93Å
330	M	91.8	Very high	91.3	Very high	24 Å²	24	53.8 Å²	53.8	12%	0.118	27%	0.268	C	S	.	.	H	α-helix	trans	-58.5	-44.1	174.6	-72.2	-173.1	-63	0	0	111.9	M78 F82 L326 F327 M333 I334 I383	M78-M330 HydrophobicContact CB-CE 4.13Å; F82-M330 HydrophobicContact CB-SD 3.67Å; F82-M330 HydrophobicContact CD2-CG 4.2Å; F82-M330 HydrophobicContact CD2-SD 3.85Å; F82-M330 HydrophobicContact CG-CG 4.42Å; F82-M330 HydrophobicContact CG-SD 3.89Å; L326-M330 WeakPolarHBondContact O-CG 3.14Å; L326-M330 PolarHBondContact O-N 2.87Å; F327-M330 HydrophobicContact CB-CE 4.03Å; F327-M330 HydrophobicContact CD2-CE 3.55Å; F327-M330 HydrophobicContact CE2-CE 4.46Å; F327-M330 HydrophobicContact CG-CE 4.21Å; F327-M330 PolarHBondContact O-N 2.82Å; M330-M333 PolarHBondContact O-N 2.81Å; M330-I334 VanDerWaalsContact O-CG1 3.32Å; M330-I334 WeakPolarHBondContact O-CG1 3.21Å; M330-I334 PolarHBondContact O-N 3.1Å; M330-I383 HydrophobicContact CG-CD1 3.33Å; M330-I383 HydrophobicContact SD-CD1 4.21Å
331	I	92.9	Very high	91.4	Very high	76 Å²	76	50.6 Å²	50.6	39%	0.39	25%	0.246	S	C	.	.	H	α-helix	trans	-61.6	-50.4	177.5	-69.2	169	0	0	0	110.7	F327 I328 F329 M333 I334 I335	F327-I331 HydrophobicContact CD1-CD1 3.81Å; F327-I331 HydrophobicContact CE1-CD1 3.39Å; F327-I331 HydrophobicContact CE1-CG1 4.27Å; F327-I331 HydrophobicContact CZ-CD1 3.98Å; F327-I331 HydrophobicContact CZ-CG1 4.48Å; F327-I331 WeakPolarHBondContact O-CG1 3.43Å; F327-I331 PolarHBondContact O-N 2.92Å; F327-I331 VanDerWaalsContact O-N 3.12Å; I328-I331 PolarHBondContact O-N 2.91Å; F329-I331 VanDerWaalsContact C-N 3.33Å; F329-I331 PolarHBondContact O-N 2.82Å; I331-M333 VanDerWaalsContact C-N 3.31Å; I331-M333 PolarHBondContact O-N 2.87Å; I331-I334 PolarHBondContact O-N 3Å; I331-I335 HydrophobicContact CG2-CD1 3.72Å; I331-I335 HydrophobicContact CG2-CG1 4.47Å; I331-I335 VanDerWaalsContact O-CG1 3.3Å; I331-I335 WeakPolarHBondContact O-CG1 3.38Å; I331-I335 PolarHBondContact O-N 3.13Å
332	F	91.5	Very high	91.5	Very high	110 Å²	110	53.6 Å²	53.6	48%	0.482	26%	0.263	S	S	.	.	H	α-helix	trans	-60.6	-41.1	179	-81	-62.5	0	0	0	112.4	I328 F329 I335 F336	I328-F332 HydrophobicContact CG2-CD2 3.64Å; I328-F332 HydrophobicContact CG2-CE2 3.43Å; I328-F332 VanDerWaalsContact CG2-CE2 3.43Å; I328-F332 VanDerWaalsContact O-CD2 3.25Å; I328-F332 WeakPolarHBondContact O-CD2 3.47Å; I328-F332 PolarHBondContact O-N 3.47Å; F329-F332 PolarHBondContact O-N 3.16Å; F332-I335 PolarHBondContact O-N 3.49Å; F332-F336 WeakPolarHBondContact O-CD2 3.3Å; F332-F336 PolarHBondContact O-N 3.44Å
333	M	92.8	Very high	91.5	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-61.5	-46.2	177.4	-177.5	-166.9	63.6	0	0	111.8	F82 F329 M330 I331 I335 F336 C337 L376 L379 L382	F82-M333 HydrophobicContact CD2-CE 4.39Å; F82-M333 HydrophobicContact CE1-CE 4.37Å; F82-M333 HydrophobicContact CE2-CE 3.25Å; F82-M333 HydrophobicContact CE2-SD 4.36Å; F82-M333 HydrophobicContact CZ-CE 3.22Å; F82-M333 HydrophobicContact CZ-SD 3.73Å; F329-M333 VanDerWaalsContact O-CB 3.28Å; F329-M333 WeakPolarHBondContact O-CB 3.46Å; F329-M333 PolarHBondContact O-N 3.41Å; M330-M333 PolarHBondContact O-N 2.81Å; I331-M333 VanDerWaalsContact C-N 3.31Å; I331-M333 PolarHBondContact O-N 2.87Å; M333-I335 VanDerWaalsContact C-N 3.34Å; M333-I335 PolarHBondContact O-N 3.04Å; M333-F336 PolarHBondContact O-N 2.9Å; M333-C337 PolarHBondContact O-N 3.15Å; M333-C337 PolarHBondContact O-SG 3.38Å; M333-L376 HydrophobicContact CE-CD1 3.5Å; M333-L376 VanDerWaalsContact CE-CD1 3.5Å; M333-L376 HydrophobicContact SD-CD1 4.17Å; M333-L379 HydrophobicContact CG-CB 3.75Å; M333-L379 HydrophobicContact SD-CB 4.42Å; M333-L382 HydrophobicContact CB-CD2 4.11Å
334	I	91.9	Very high	91.3	Very high	87 Å²	87	54.4 Å²	54.4	45%	0.446	27%	0.268	S	S	.	.	H	α-helix	trans	-61.8	-43.4	176.9	-68.2	166.2	0	0	0	110.7	M330 I331 F336 C337 I338	M330-I334 VanDerWaalsContact O-CG1 3.32Å; M330-I334 WeakPolarHBondContact O-CG1 3.21Å; M330-I334 PolarHBondContact O-N 3.1Å; I331-I334 PolarHBondContact O-N 3Å; I334-F336 PolarHBondContact O-N 2.96Å; I334-C337 PolarHBondContact O-N 2.84Å; I334-I338 HydrophobicContact CG2-CD1 3.94Å; I334-I338 WeakPolarHBondContact O-CG1 3.12Å; I334-I338 PolarHBondContact O-N 3.49Å
335	I	93.6	Very high	91	Very high	77 Å²	77	53.3 Å²	53.3	40%	0.395	26%	0.261	S	S	.	.	H	α-helix	trans	-59.1	-46.6	176.5	-68.4	167.1	0	0	0	110.6	I331 F332 M333 C337 I338 I339	I331-I335 HydrophobicContact CG2-CD1 3.72Å; I331-I335 HydrophobicContact CG2-CG1 4.47Å; I331-I335 VanDerWaalsContact O-CG1 3.3Å; I331-I335 WeakPolarHBondContact O-CG1 3.38Å; I331-I335 PolarHBondContact O-N 3.13Å; F332-I335 PolarHBondContact O-N 3.49Å; M333-I335 VanDerWaalsContact C-N 3.34Å; M333-I335 PolarHBondContact O-N 3.04Å; I335-C337 PolarHBondContact O-N 3.45Å; I335-I338 PolarHBondContact O-N 3Å; I335-I339 HydrophobicContact CG2-CD1 3.71Å; I335-I339 HydrophobicContact CG2-CG1 4.43Å; I335-I339 VanDerWaalsContact O-CG1 3.31Å; I335-I339 WeakPolarHBondContact O-CG1 3.33Å; I335-I339 PolarHBondContact O-N 2.89Å
336	F	91.6	Very high	90.8	Very high	91 Å²	91	59.5 Å²	59.5	40%	0.399	29%	0.285	S	S	.	.	H	α-helix	trans	-62.4	-40.1	176.8	-76	-50.6	0	0	0	112.8	F332 M333 I334 I338 I339 F340 L379	F332-F336 WeakPolarHBondContact O-CD2 3.3Å; F332-F336 PolarHBondContact O-N 3.44Å; M333-F336 PolarHBondContact O-N 2.9Å; I334-F336 PolarHBondContact O-N 2.96Å; F336-I338 VanDerWaalsContact C-N 3.33Å; F336-I338 PolarHBondContact O-N 2.94Å; F336-I339 PolarHBondContact O-N 3.34Å; F336-F340 HydrophobicContact CB-CE2 4.36Å; F336-F340 WeakPolarHBondContact O-CB 3.43Å; F336-F340 VanDerWaalsContact O-CG 3.26Å; F336-F340 WeakPolarHBondContact O-CG 3.26Å; F336-F340 PolarHBondContact O-N 3.03Å; F336-L379 HydrophobicContact CB-CD1 3.85Å
337	C	92	Very high	90.4	Very high	1 Å²	1	62.6 Å²	62.6	1%	0.007	30%	0.296	C	S	.	.	H	α-helix	trans	-60.7	-42.1	176.4	-63.7	0	0	0	0	112.1	M333 I334 I335 A341 V372 F375 L376	M333-C337 PolarHBondContact O-N 3.15Å; M333-C337 PolarHBondContact O-SG 3.38Å; I334-C337 PolarHBondContact O-N 2.84Å; I335-C337 PolarHBondContact O-N 3.45Å; C337-A341 WeakPolarHBondContact O-CB 3.34Å; C337-A341 PolarHBondContact O-N 3.24Å; C337-V372 HydrophobicContact CB-CG1 4.07Å; C337-F375 HydrophobicContact CB-CB 4.13Å; C337-L376 VanDerWaalsContact SG-CA 3.53Å; C337-L376 PolarHBondContact SG-N 3.03Å
338	I	92.2	Very high	89.8	Confident	84 Å²	84	57.6 Å²	57.6	43%	0.431	28%	0.275	S	S	.	.	H	α-helix	trans	-66.4	-45.2	177.9	-65.8	166.2	0	0	0	110.4	I334 I335 F336 A341 M342	I334-I338 HydrophobicContact CG2-CD1 3.94Å; I334-I338 WeakPolarHBondContact O-CG1 3.12Å; I334-I338 PolarHBondContact O-N 3.49Å; I335-I338 PolarHBondContact O-N 3Å; F336-I338 VanDerWaalsContact C-N 3.33Å; F336-I338 PolarHBondContact O-N 2.94Å; I338-A341 PolarHBondContact O-N 2.69Å; I338-M342 VanDerWaalsContact O-CG 3.3Å; I338-M342 WeakPolarHBondContact O-CG 3.33Å; I338-M342 PolarHBondContact O-N 3.22Å
339	I	92.4	Very high	89.2	Confident	80 Å²	80	61.8 Å²	61.8	41%	0.41	29%	0.291	S	S	.	.	H	α-helix	trans	-60.6	-48.7	177.8	-68.4	168.6	0	0	0	110.3	I335 F336 A341 M342 V343	I335-I339 HydrophobicContact CG2-CD1 3.71Å; I335-I339 HydrophobicContact CG2-CG1 4.43Å; I335-I339 VanDerWaalsContact O-CG1 3.31Å; I335-I339 WeakPolarHBondContact O-CG1 3.33Å; I335-I339 PolarHBondContact O-N 2.89Å; F336-I339 PolarHBondContact O-N 3.34Å; I339-A341 PolarHBondContact O-N 3.12Å; I339-M342 WeakPolarHBondContact O-CB 3.33Å; I339-M342 PolarHBondContact O-N 2.96Å; I339-V343 HydrophobicContact CG2-CG2 4.39Å; I339-V343 WeakPolarHBondContact O-CG2 3.44Å; I339-V343 PolarHBondContact O-N 3.01Å
340	F	91.3	Very high	88.6	Confident	6 Å²	6	67.9 Å²	67.9	3%	0.026	32%	0.315	C	S	.	.	H	α-helix	trans	-62.3	-41.9	179.2	-65.5	-19.4	0	0	0	112.1	F336 M342 V343 T344 F375 L379 V1105 F1109 F1113	F336-F340 HydrophobicContact CB-CE2 4.36Å; F336-F340 WeakPolarHBondContact O-CB 3.43Å; F336-F340 VanDerWaalsContact O-CG 3.26Å; F336-F340 WeakPolarHBondContact O-CG 3.26Å; F336-F340 PolarHBondContact O-N 3.03Å; F340-M342 VanDerWaalsContact C-N 3.33Å; F340-M342 PolarHBondContact O-N 3.46Å; F340-V343 PolarHBondContact O-N 3.04Å; F340-T344 PolarHBondContact O-N 2.87Å; F340-T344 PolarHBondContact O-OG1 3.04Å; F340-F375 HydrophobicContact CB-CD1 3.93Å; F340-F375 HydrophobicContact CB-CD2 3.73Å; F340-F375 HydrophobicContact CB-CE1 3.87Å; F340-F375 HydrophobicContact CB-CE2 3.66Å; F340-F375 HydrophobicContact CB-CG 3.87Å; F340-F375 HydrophobicContact CB-CZ 3.73Å; F340-F375 AromaticContact CD2-CD1 3.98Å; F340-F375 HydrophobicContact CD2-CD1 3.98Å; F340-F375 HydrophobicContact CD2-CE1 4.34Å; F340-F375 HydrophobicContact CD2-CG 4.35Å; F340-F375 HydrophobicContact CG-CD1 4.43Å; F340-F375 HydrophobicContact CG-CE1 4.46Å; F340-L379 HydrophobicContact CD2-CD1 4.18Å; F340-L379 HydrophobicContact CE2-CD1 3.95Å; F340-L379 HydrophobicContact CE2-CD2 4.47Å; F340-V1105 HydrophobicContact CE2-CG1 4.5Å; F340-V1105 HydrophobicContact CE2-CG2 4.21Å; F340-V1105 HydrophobicContact CZ-CG1 3.81Å; F340-V1105 HydrophobicContact CZ-CG2 4.28Å; F340-F1109 HydrophobicContact CE1-CZ 4.14Å; F340-F1113 HydrophobicContact CB-CD1 4.28Å; F340-F1113 HydrophobicContact CD1-CD1 4.08Å; F340-F1113 AromaticContact CD1-CE1 3.71Å; F340-F1113 HydrophobicContact CD1-CE1 3.71Å; F340-F1113 HydrophobicContact CE1-CE1 4.19Å; F340-F1113 HydrophobicContact CG-CD1 4.34Å; F340-F1113 HydrophobicContact CG-CE1 4.42Å
341	A	88.4	Confident	87.8	Confident	13 Å²	13	70.1 Å²	70.1	11%	0.107	33%	0.325	C	S	.	.	H	α-helix	trans	-62.3	-38.5	175.2	0	0	0	0	0	113.1	C337 I338 I339 K345 N371 V372 F375	C337-A341 WeakPolarHBondContact O-CB 3.34Å; C337-A341 PolarHBondContact O-N 3.24Å; I338-A341 PolarHBondContact O-N 2.69Å; I339-A341 PolarHBondContact O-N 3.12Å; A341-K345 PolarHBondContact O-N 3Å; A341-N371 HydrophobicContact CB-CB 4.47Å; A341-V372 HydrophobicContact CB-CB 4.49Å; A341-V372 HydrophobicContact CB-CG2 3.49Å; A341-V372 VanDerWaalsContact CB-CG2 3.49Å; A341-F375 HydrophobicContact CB-CD2 4.33Å; A341-F375 HydrophobicContact CB-CE2 4.43Å
342	M	89.7	Confident	86.5	Confident	126 Å²	126	70.1 Å²	70.1	62%	0.621	33%	0.325	S	S	*	.	H	α-helix	trans	-64.2	-43	174	-73	-71.6	-133.7	0	0	111.7	I338 I339 F340 K345 Y346	I338-M342 VanDerWaalsContact O-CG 3.3Å; I338-M342 WeakPolarHBondContact O-CG 3.33Å; I338-M342 PolarHBondContact O-N 3.22Å; I339-M342 WeakPolarHBondContact O-CB 3.33Å; I339-M342 PolarHBondContact O-N 2.96Å; F340-M342 VanDerWaalsContact C-N 3.33Å; F340-M342 PolarHBondContact O-N 3.46Å; M342-K345 PolarHBondContact O-N 2.89Å; M342-Y346 PolarHBondContact O-N 3.42Å
343	V	90.1	Very high	85.2	Confident	49 Å²	49	72.2 Å²	72.2	30%	0.297	34%	0.341	S	S	.	.	H	α-helix	trans	-68.4	-40	178	-179.8	0	0	0	0	111.3	I339 F340 K345 Y346 W347 F1113	I339-V343 HydrophobicContact CG2-CG2 4.39Å; I339-V343 WeakPolarHBondContact O-CG2 3.44Å; I339-V343 PolarHBondContact O-N 3.01Å; F340-V343 PolarHBondContact O-N 3.04Å; V343-K345 VanDerWaalsContact C-N 3.31Å; V343-K345 PolarHBondContact O-N 3.32Å; V343-Y346 PolarHBondContact O-N 3.05Å; V343-W347 WeakPolarHBondContact O-CB 3.41Å; V343-W347 PolarHBondContact O-N 2.88Å; V343-F1113 HydrophobicContact CB-CD1 4.22Å; V343-F1113 HydrophobicContact CB-CD2 4.48Å; V343-F1113 HydrophobicContact CB-CE1 4.11Å; V343-F1113 HydrophobicContact CB-CE2 4.38Å; V343-F1113 HydrophobicContact CB-CG 4.4Å; V343-F1113 HydrophobicContact CB-CZ 4.17Å; V343-F1113 HydrophobicContact CG1-CD1 4.11Å; V343-F1113 HydrophobicContact CG1-CD2 3.59Å; V343-F1113 HydrophobicContact CG1-CE1 3.88Å; V343-F1113 HydrophobicContact CG1-CE2 3.32Å; V343-F1113 HydrophobicContact CG1-CG 3.97Å; V343-F1113 HydrophobicContact CG1-CZ 3.46Å; V343-F1113 VanDerWaalsContact CG1-CZ 3.46Å
344	T	85.9	Confident	84.1	Confident	4 Å²	4	75.8 Å²	75.8	3%	0.025	36%	0.358	C	S	.	.	H	α-helix	trans	-58.1	-43.5	173.1	-54.6	0	0	0	0	111.4	F340 W347 S348 F375 F1113	F340-T344 PolarHBondContact O-N 2.87Å; F340-T344 PolarHBondContact O-OG1 3.04Å; T344-W347 PolarHBondContact O-N 3.25Å; T344-S348 WeakPolarHBondContact O-CB 3.44Å; T344-S348 PolarHBondContact O-N 3.19Å; T344-F375 WeakPolarHBondContact OG1-CE2 3.01Å; T344-F375 WeakPolarHBondContact OG1-CZ 3.43Å; T344-F1113 WeakPolarHBondContact CG2-O 3.28Å; T344-F1113 VanDerWaalsContact OG1-CB 3.23Å; T344-F1113 WeakPolarHBondContact OG1-CB 3.48Å; T344-F1113 PolarHBondContact OG1-O 3.36Å
345	K	84.7	Confident	83.1	Confident	91 Å²	91	80.1 Å²	80.1	40%	0.396	38%	0.38	S	S	.	.	H	α-helix	trans	-61.5	-46.4	176.5	180	-177.8	179.8	175.6	0	111.3	A341 M342 V343 F349	A341-K345 PolarHBondContact O-N 3Å; M342-K345 PolarHBondContact O-N 2.89Å; V343-K345 VanDerWaalsContact C-N 3.31Å; V343-K345 PolarHBondContact O-N 3.32Å; K345-F349 PolarHBondContact O-N 3.49Å
346	Y	86	Confident	82.2	Confident	143 Å²	143	84.7 Å²	84.7	56%	0.561	39%	0.394	S	S	*	.	H	α-helix	trans	-61.8	-51.2	177.6	-177.2	-92.3	0	0	0	111.1	M342 V343 S348 F349 Y350	M342-Y346 PolarHBondContact O-N 3.42Å; V343-Y346 PolarHBondContact O-N 3.05Å; Y346-S348 VanDerWaalsContact C-N 3.33Å; Y346-S348 PolarHBondContact O-N 3.36Å; Y346-F349 WeakPolarHBondContact O-CB 3.36Å; Y346-F349 PolarHBondContact O-N 2.98Å; Y346-F349 VanDerWaalsContact O-N 3.11Å; Y346-Y350 HydrophobicContact CD1-CD2 4.07Å; Y346-Y350 HydrophobicContact CD1-CE2 4.09Å; Y346-Y350 AromaticContact CD2-CE2 3.97Å; Y346-Y350 HydrophobicContact CD2-CE2 3.97Å; Y346-Y350 AromaticContact CE1-CD2 3.76Å; Y346-Y350 HydrophobicContact CE1-CD2 3.76Å; Y346-Y350 AromaticContact CE1-CE2 3.51Å; Y346-Y350 HydrophobicContact CE1-CE2 3.51Å; Y346-Y350 HydrophobicContact CE2-CD2 4.3Å; Y346-Y350 AromaticContact CE2-CE2 3.4Å; Y346-Y350 HydrophobicContact CE2-CE2 3.4Å; Y346-Y350 VanDerWaalsContact CE2-CE2 3.4Å; Y346-Y350 HydrophobicContact CG-CD2 4.45Å; Y346-Y350 HydrophobicContact CG-CE2 4.29Å; Y346-Y350 AromaticContact CZ-CD2 3.89Å; Y346-Y350 AromaticContact CZ-CE2 3.13Å; Y346-Y350 AromaticContact CZ-CZ 3.76Å; Y346-Y350 WeakPolarHBondContact O-CD2 3.37Å; Y346-Y350 PolarHBondContact O-N 3.07Å; Y346-Y350 WeakPolarHBondContact OH-CE2 3.05Å; Y346-Y350 PolarHBondContact OH-OH 2.95Å
347	W	84.6	Confident	81.1	Confident	69 Å²	69	82.7 Å²	82.7	26%	0.261	39%	0.386	S	S	.	.	H	α-helix	trans	-60.3	-42	179.5	-177.4	85	0	0	0	112.3	V343 T344 F349 Y350 H351 I357 F359	V343-W347 WeakPolarHBondContact O-CB 3.41Å; V343-W347 PolarHBondContact O-N 2.88Å; T344-W347 PolarHBondContact O-N 3.25Å; W347-F349 VanDerWaalsContact C-N 3.34Å; W347-F349 PolarHBondContact O-N 2.91Å; W347-Y350 PolarHBondContact O-N 3.07Å; W347-H351 AromaticContact CD1-CD2 3.54Å; W347-H351 AromaticContact CD1-NE2 3.89Å; W347-H351 AromaticContact CD2-CD2 3.93Å; W347-H351 AromaticContact CE2-CD2 3.42Å; W347-H351 VanDerWaalsContact CE2-CD2 3.42Å; W347-H351 AromaticContact CG-CD2 4Å; W347-H351 HydrophobicContact CZ2-CB 4.37Å; W347-H351 AromaticContact CZ2-CD2 3.94Å; W347-H351 AromaticContact NE1-CD2 3.16Å; W347-H351 PolarHBondContact NE1-CD2 2.75Å; W347-H351 AromaticContact NE1-NE2 3.42Å; W347-H351 PolarHBondContact NE1-NE2 3.07Å; W347-H351 PolarHBondContact O-CD2 2.87Å; W347-H351 PolarHBondContact O-N 3.35Å; W347-H351 VanDerWaalsContact O-N 3.14Å; W347-I357 HydrophobicContact CH2-CD1 4.48Å; W347-F359 HydrophobicContact CH2-CE2 4.21Å; W347-F359 AromaticContact CZ3-CE2 3.54Å; W347-F359 HydrophobicContact CZ3-CE2 3.54Å; W347-F359 AromaticContact CZ3-CZ 3.8Å; W347-F359 HydrophobicContact CZ3-CZ 3.8Å
348	S	78.1	Confident	79.7	Confident	4 Å²	4	88.9 Å²	88.9	3%	0.028	43%	0.427	C	S	.	.	H	α-helix	trans	-58.8	-44.5	174	177.3	0	0	0	0	111.4	T344 Y346 Y350 H351 L352	T344-S348 WeakPolarHBondContact O-CB 3.44Å; T344-S348 PolarHBondContact O-N 3.19Å; Y346-S348 VanDerWaalsContact C-N 3.33Å; Y346-S348 PolarHBondContact O-N 3.36Å; S348-Y350 VanDerWaalsContact C-N 3.26Å; S348-Y350 PolarHBondContact O-N 3.01Å; S348-H351 PolarHBondContact O-N 3.42Å; S348-L352 WeakPolarHBondContact O-CD1 3.37Å; S348-L352 WeakPolarHBondContact O-CG 3.44Å; S348-L352 PolarHBondContact O-N 3.03Å
349	F	79.1	Confident	78.3	Confident	150 Å²	150	88.4 Å²	88.4	66%	0.658	42%	0.422	S	S	*	.	H	α-helix	trans	-55.9	-38.8	178.8	-175.3	-98.6	0	0	0	113.2	K345 Y346 W347	K345-F349 PolarHBondContact O-N 3.49Å; Y346-F349 WeakPolarHBondContact O-CB 3.36Å; Y346-F349 PolarHBondContact O-N 2.98Å; Y346-F349 VanDerWaalsContact O-N 3.11Å; W347-F349 VanDerWaalsContact C-N 3.34Å; W347-F349 PolarHBondContact O-N 2.91Å
350	Y	79.7	Confident	76.9	Confident	139 Å²	139	91.3 Å²	91.3	55%	0.545	43%	0.434	S	S	.	.	H	α-helix	trans	-79.9	-31.2	-179.7	-78.5	-87.9	0	0	0	114.1	Y346 W347 S348	Y346-Y350 HydrophobicContact CD1-CD2 4.07Å; Y346-Y350 HydrophobicContact CD1-CE2 4.09Å; Y346-Y350 AromaticContact CD2-CE2 3.97Å; Y346-Y350 HydrophobicContact CD2-CE2 3.97Å; Y346-Y350 AromaticContact CE1-CD2 3.76Å; Y346-Y350 HydrophobicContact CE1-CD2 3.76Å; Y346-Y350 AromaticContact CE1-CE2 3.51Å; Y346-Y350 HydrophobicContact CE1-CE2 3.51Å; Y346-Y350 HydrophobicContact CE2-CD2 4.3Å; Y346-Y350 AromaticContact CE2-CE2 3.4Å; Y346-Y350 HydrophobicContact CE2-CE2 3.4Å; Y346-Y350 VanDerWaalsContact CE2-CE2 3.4Å; Y346-Y350 HydrophobicContact CG-CD2 4.45Å; Y346-Y350 HydrophobicContact CG-CE2 4.29Å; Y346-Y350 AromaticContact CZ-CD2 3.89Å; Y346-Y350 AromaticContact CZ-CE2 3.13Å; Y346-Y350 AromaticContact CZ-CZ 3.76Å; Y346-Y350 WeakPolarHBondContact O-CD2 3.37Å; Y346-Y350 PolarHBondContact O-N 3.07Å; Y346-Y350 WeakPolarHBondContact OH-CE2 3.05Å; Y346-Y350 PolarHBondContact OH-OH 2.95Å; W347-Y350 PolarHBondContact O-N 3.07Å; S348-Y350 VanDerWaalsContact C-N 3.26Å; S348-Y350 PolarHBondContact O-N 3.01Å
351	H	76	Confident	75.5	Confident	72 Å²	72	95.9 Å²	95.9	33%	0.333	46%	0.458	S	S	.	.	H	α-helix	trans	-104.3	4.6	-172.5	-71	-70.1	0	0	0	115.1	W347 S348 N353 H354	W347-H351 AromaticContact CD1-CD2 3.54Å; W347-H351 AromaticContact CD1-NE2 3.89Å; W347-H351 AromaticContact CD2-CD2 3.93Å; W347-H351 AromaticContact CE2-CD2 3.42Å; W347-H351 VanDerWaalsContact CE2-CD2 3.42Å; W347-H351 AromaticContact CG-CD2 4Å; W347-H351 HydrophobicContact CZ2-CB 4.37Å; W347-H351 AromaticContact CZ2-CD2 3.94Å; W347-H351 AromaticContact NE1-CD2 3.16Å; W347-H351 PolarHBondContact NE1-CD2 2.75Å; W347-H351 AromaticContact NE1-NE2 3.42Å; W347-H351 PolarHBondContact NE1-NE2 3.07Å; W347-H351 PolarHBondContact O-CD2 2.87Å; W347-H351 PolarHBondContact O-N 3.35Å; W347-H351 VanDerWaalsContact O-N 3.14Å; S348-H351 PolarHBondContact O-N 3.42Å; H351-N353 PolarHBondContact O-N 3.23Å; H351-H354 AromaticContact ND1-CD2 3.76Å; H351-H354 AromaticContact ND1-NE2 3.61Å; H351-H354 PolarHBondContact O-N 3.41Å
352	L	65.1	Low	74.4	Confident	76 Å²	76	95.9 Å²	95.9	40%	0.398	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-20.4	177	-88.9	152.2	0	0	0	114.8	S348 H354	S348-L352 WeakPolarHBondContact O-CD1 3.37Å; S348-L352 WeakPolarHBondContact O-CG 3.44Å; S348-L352 PolarHBondContact O-N 3.03Å; L352-H354 PolarHBondContact O-N 2.99Å
353	N	64.3	Low	73.3	Confident	153 Å²	153	95.8 Å²	95.8	82%	0.818	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-2.4	-175.5	-68.9	-12.6	0	0	0	115	H351 I355	H351-N353 PolarHBondContact O-N 3.23Å; N353-I355 PolarHBondContact O-N 3.28Å
354	H	69.2	Low	72.8	Confident	76 Å²	76	96.7 Å²	96.7	35%	0.352	47%	0.467	S	S	.	.			trans	-84.4	116	179.8	-72.3	-66.9	0	0	0	112.2	H351 L352 Y356 I357	H351-H354 AromaticContact ND1-CD2 3.76Å; H351-H354 AromaticContact ND1-NE2 3.61Å; H351-H354 PolarHBondContact O-N 3.41Å; L352-H354 PolarHBondContact O-N 2.99Å; H354-Y356 HydrophobicContact CB-CD1 4.02Å; H354-Y356 HydrophobicContact CB-CE1 3.57Å; H354-Y356 AromaticContact CG-CE1 3.73Å; H354-Y356 AromaticContact CG-CZ 3.93Å; H354-Y356 AromaticContact ND1-CE1 3.61Å; H354-Y356 PolarHBondContact O-N 3.46Å; H354-Y356 VanDerWaalsContact O-N 3.08Å; H354-I357 HydrophobicContact CB-CD1 4.1Å; H354-I357 HydrophobicContact CB-CG1 4.2Å; H354-I357 PolarHBondContact O-N 2.84Å
355	I	70.9	Confident	72.7	Confident	178 Å²	178	102.5 Å²	102.5	91%	0.913	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-29.2	-177.3	-62.8	167.1	0	0	0	113.2	N353 I357	N353-I355 PolarHBondContact O-N 3.28Å; I355-I357 VanDerWaalsContact C-N 3.33Å; I355-I357 PolarHBondContact O-N 2.88Å
356	Y	75.6	Confident	72.7	Confident	173 Å²	173	104.2 Å²	104.2	68%	0.678	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-1.4	-175.2	62.1	-92.9	0	0	0	114.6	H354	H354-Y356 HydrophobicContact CB-CD1 4.02Å; H354-Y356 HydrophobicContact CB-CE1 3.57Å; H354-Y356 AromaticContact CG-CE1 3.73Å; H354-Y356 AromaticContact CG-CZ 3.93Å; H354-Y356 AromaticContact ND1-CE1 3.61Å; H354-Y356 PolarHBondContact O-N 3.46Å; H354-Y356 VanDerWaalsContact O-N 3.08Å
357	I	66.9	Low	72.5	Confident	49 Å²	49	98.6 Å²	98.6	25%	0.251	48%	0.48	S	S	.	.			trans	-117.9	109.2	-175.9	-46	179.8	0	0	0	111.1	W347 H354 I355 F359	W347-I357 HydrophobicContact CH2-CD1 4.48Å; H354-I357 HydrophobicContact CB-CD1 4.1Å; H354-I357 HydrophobicContact CB-CG1 4.2Å; H354-I357 PolarHBondContact O-N 2.84Å; I355-I357 VanDerWaalsContact C-N 3.33Å; I355-I357 PolarHBondContact O-N 2.88Å; I357-F359 HydrophobicContact CB-CD2 4.34Å; I357-F359 HydrophobicContact CG2-CD2 3.27Å; I357-F359 HydrophobicContact CG2-CE2 3.36Å; I357-F359 HydrophobicContact CG2-CG 4.35Å; I357-F359 HydrophobicContact CG2-CZ 4.5Å; I357-F359 PolarHBondContact O-N 2.84Å
358	P	62.7	Low	72.3	Confident	131 Å²	131	97.6 Å²	97.6	85%	0.851	48%	0.478	S	S	*	.			trans	-83	79	177.9	33.4	-33.3	0	0	0	110.5
359	F	64.4	Low	72.8	Confident	75 Å²	75	100.6 Å²	100.6	33%	0.329	49%	0.493	S	S	.	.			trans	-84.7	128.9	170.7	-91.9	-71.7	0	0	0	111.6	W347 I357	W347-F359 HydrophobicContact CH2-CE2 4.21Å; W347-F359 AromaticContact CZ3-CE2 3.54Å; W347-F359 HydrophobicContact CZ3-CE2 3.54Å; W347-F359 AromaticContact CZ3-CZ 3.8Å; W347-F359 HydrophobicContact CZ3-CZ 3.8Å; I357-F359 HydrophobicContact CB-CD2 4.34Å; I357-F359 HydrophobicContact CG2-CD2 3.27Å; I357-F359 HydrophobicContact CG2-CE2 3.36Å; I357-F359 HydrophobicContact CG2-CG 4.35Å; I357-F359 HydrophobicContact CG2-CZ 4.5Å; I357-F359 PolarHBondContact O-N 2.84Å
360	E	62.1	Low	73.1	Confident	141 Å²	141	96.5 Å²	96.5	66%	0.659	48%	0.475	S	S	*	.			trans	-61.1	134.2	159.3	-69.9	-176.5	177.4	0	0	109	L362 L367	E360-L362 PolarHBondContact O-N 3.08Å; E360-L367 HydrophobicContact CB-CD2 3.78Å; E360-L367 WeakPolarHBondContact OE2-CD1 3.45Å
361	N	62.7	Low	73.3	Confident	101 Å²	101	90.7 Å²	90.7	54%	0.54	45%	0.454	S	S	.	.			trans	-63.4	109.1	-178.1	-155.8	-7.1	0	0	0	109.8	N363	N361-N363 PolarHBondContact O-N 2.9Å; N361-N363 PolarHBondContact OD1-ND2 2.88Å
362	L	64.1	Low	73.9	Confident	13 Å²	13	89.1 Å²	89.1	7%	0.068	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	20.2	-173.1	-68.9	174.9	0	0	0	114.9	E360 S364 L367 Q368 N371	E360-L362 PolarHBondContact O-N 3.08Å; L362-S364 VanDerWaalsContact C-N 3.29Å; L362-S364 PolarHBondContact O-N 2.93Å; L362-L367 HydrophobicContact CD2-CD2 3.69Å; L362-L367 HydrophobicContact CD2-CG 3.74Å; L362-Q368 PolarHBondContact O-NE2 2.77Å; L362-N371 WeakPolarHBondContact CD2-ND2 3.33Å
363	N	67.3	Low	75.1	Confident	124 Å²	124	87.8 Å²	87.8	66%	0.663	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-23.6	-179.5	-72.9	-16.2	0	0	0	112.8	N361	N361-N363 PolarHBondContact O-N 2.9Å; N361-N363 PolarHBondContact OD1-ND2 2.88Å
364	S	80	Confident	76.2	Confident	68 Å²	68	84.7 Å²	84.7	48%	0.476	42%	0.417	S	S	.	.	S	Bend	trans	-74.8	128	177.2	-175.3	0	0	0	0	112.1	L362 W366 L367 Q368	L362-S364 VanDerWaalsContact C-N 3.29Å; L362-S364 PolarHBondContact O-N 2.93Å; S364-W366 PolarHBondContact O-N 3.35Å; S364-L367 PolarHBondContact O-N 3.29Å; S364-L367 VanDerWaalsContact O-N 3.11Å; S364-Q368 PolarHBondContact O-N 3.32Å
365	I	84	Confident	77.1	Confident	126 Å²	126	81.2 Å²	81.2	65%	0.646	40%	0.401	S	S	*	.	H	α-helix	trans	-56.1	-38.9	175.6	-62.3	169.7	0	0	0	110.6	L367 Q368 I369	I365-L367 VanDerWaalsContact C-N 3.33Å; I365-L367 PolarHBondContact O-N 2.84Å; I365-Q368 WeakPolarHBondContact O-CB 3.47Å; I365-Q368 PolarHBondContact O-N 2.87Å; I365-I369 HydrophobicContact CG2-CD1 4.05Å; I365-I369 WeakPolarHBondContact O-CG1 3.49Å; I365-I369 PolarHBondContact O-N 2.8Å
366	W	84.4	Confident	78.1	Confident	127 Å²	127	73.5 Å²	73.5	48%	0.481	36%	0.361	S	S	.	.	H	α-helix	trans	-63.5	-38	179.3	179.2	-120.8	0	0	0	112.6	S364 Q368 I369 K370	S364-W366 PolarHBondContact O-N 3.35Å; W366-Q368 VanDerWaalsContact C-N 3.32Å; W366-Q368 PolarHBondContact O-N 2.91Å; W366-I369 HydrophobicContact CE3-CB 4.4Å; W366-I369 HydrophobicContact CE3-CD1 4.44Å; W366-I369 HydrophobicContact CE3-CG2 4.36Å; W366-I369 HydrophobicContact CZ3-CG2 4.24Å; W366-I369 PolarHBondContact O-N 2.76Å; W366-K370 VanDerWaalsContact NE1-CE 3.31Å; W366-K370 PolarHBondContact O-N 3.16Å
367	L	80.6	Confident	78.7	Confident	25 Å²	25	65.2 Å²	65.2	13%	0.131	33%	0.329	C	S	.	.	H	α-helix	trans	-70	-32.6	178.1	-166.5	59.1	0	0	0	111.5	E360 L362 S364 I365 K370 N371	E360-L367 HydrophobicContact CB-CD2 3.78Å; E360-L367 WeakPolarHBondContact OE2-CD1 3.45Å; L362-L367 HydrophobicContact CD2-CD2 3.69Å; L362-L367 HydrophobicContact CD2-CG 3.74Å; S364-L367 PolarHBondContact O-N 3.29Å; S364-L367 VanDerWaalsContact O-N 3.11Å; I365-L367 VanDerWaalsContact C-N 3.33Å; I365-L367 PolarHBondContact O-N 2.84Å; L367-K370 HydrophobicContact CD1-CD 4.19Å; L367-K370 PolarHBondContact O-N 3Å; L367-N371 PolarHBondContact O-N 3.48Å
368	Q	81.8	Confident	79.6	Confident	49 Å²	49	63 Å²	63	23%	0.229	32%	0.318	C	S	.	.	H	α-helix	trans	-65.2	-41.8	170.8	-65.7	170.5	20.3	0	0	111.4	L362 S364 I365 W366 N371 V372	L362-Q368 PolarHBondContact O-NE2 2.77Å; S364-Q368 PolarHBondContact O-N 3.32Å; I365-Q368 WeakPolarHBondContact O-CB 3.47Å; I365-Q368 PolarHBondContact O-N 2.87Å; W366-Q368 VanDerWaalsContact C-N 3.32Å; W366-Q368 PolarHBondContact O-N 2.91Å; Q368-N371 PolarHBondContact O-N 3.15Å; Q368-V372 PolarHBondContact O-N 2.68Å
369	I	87.1	Confident	81	Confident	67 Å²	67	57 Å²	57	34%	0.344	28%	0.278	S	S	.	.	H	α-helix	trans	-63.8	-42.5	174.4	-66.7	168.3	0	0	0	111	I365 W366 N371 V372 F373	I365-I369 HydrophobicContact CG2-CD1 4.05Å; I365-I369 WeakPolarHBondContact O-CG1 3.49Å; I365-I369 PolarHBondContact O-N 2.8Å; W366-I369 HydrophobicContact CE3-CB 4.4Å; W366-I369 HydrophobicContact CE3-CD1 4.44Å; W366-I369 HydrophobicContact CE3-CG2 4.36Å; W366-I369 HydrophobicContact CZ3-CG2 4.24Å; W366-I369 PolarHBondContact O-N 2.76Å; I369-N371 VanDerWaalsContact C-N 3.27Å; I369-N371 PolarHBondContact O-N 3.44Å; I369-V372 WeakPolarHBondContact O-CB 3.27Å; I369-V372 PolarHBondContact O-N 3.39Å; I369-V372 VanDerWaalsContact O-N 3.11Å; I369-F373 HydrophobicContact CG2-CD2 4.11Å; I369-F373 HydrophobicContact CG2-CE1 4.4Å; I369-F373 HydrophobicContact CG2-CE2 3.5Å; I369-F373 HydrophobicContact CG2-CZ 3.67Å; I369-F373 PolarHBondContact O-N 3.49Å; I369-F373 VanDerWaalsContact O-N 3.08Å
370	K	85.4	Confident	82.2	Confident	63 Å²	63	53.5 Å²	53.5	27%	0.274	26%	0.263	S	S	.	.	H	α-helix	trans	-56.3	-41.3	173.7	-79.5	-172.8	170.2	-171.8	0	111.9	W366 L367 V372 F373 R374	W366-K370 VanDerWaalsContact NE1-CE 3.31Å; W366-K370 PolarHBondContact O-N 3.16Å; L367-K370 HydrophobicContact CD1-CD 4.19Å; L367-K370 PolarHBondContact O-N 3Å; K370-V372 PolarHBondContact O-N 2.88Å; K370-F373 PolarHBondContact O-N 3.26Å; K370-R374 WeakPolarHBondContact O-CG 3.43Å; K370-R374 PolarHBondContact O-N 3.19Å
371	N	83.8	Confident	83.5	Confident	17 Å²	17	47 Å²	47	9%	0.091	23%	0.232	C	C	.	.	H	α-helix	trans	-64.7	-38	176.8	-74.9	-15.3	0	0	0	112.7	A341 L362 L367 Q368 I369 F373 R374 F375	A341-N371 HydrophobicContact CB-CB 4.47Å; L362-N371 WeakPolarHBondContact CD2-ND2 3.33Å; L367-N371 PolarHBondContact O-N 3.48Å; Q368-N371 PolarHBondContact O-N 3.15Å; I369-N371 VanDerWaalsContact C-N 3.27Å; I369-N371 PolarHBondContact O-N 3.44Å; N371-F373 VanDerWaalsContact C-N 3.31Å; N371-F373 PolarHBondContact O-N 3.27Å; N371-R374 PolarHBondContact O-N 2.76Å; N371-F375 WeakPolarHBondContact O-CD2 3.35Å; N371-F375 PolarHBondContact O-N 3.07Å; N371-F375 VanDerWaalsContact O-N 3.1Å
372	V	89.5	Confident	84.9	Confident	40 Å²	40	43.1 Å²	43.1	24%	0.242	21%	0.212	C	C	.	.	H	α-helix	trans	-59.4	-43.9	172.4	177	0	0	0	0	110.7	C337 A341 Q368 I369 K370 F375 L376	C337-V372 HydrophobicContact CB-CG1 4.07Å; A341-V372 HydrophobicContact CB-CB 4.49Å; A341-V372 HydrophobicContact CB-CG2 3.49Å; A341-V372 VanDerWaalsContact CB-CG2 3.49Å; Q368-V372 PolarHBondContact O-N 2.68Å; I369-V372 WeakPolarHBondContact O-CB 3.27Å; I369-V372 PolarHBondContact O-N 3.39Å; I369-V372 VanDerWaalsContact O-N 3.11Å; K370-V372 PolarHBondContact O-N 2.88Å; V372-F375 PolarHBondContact O-N 2.66Å; V372-L376 PolarHBondContact O-N 3.33Å
373	F	90	Very high	86.2	Confident	48 Å²	48	42.6 Å²	42.6	21%	0.211	21%	0.209	C	C	.	.	H	α-helix	trans	-65.5	-37.7	176.4	-62.4	-31.6	0	0	0	113.1	I89 A93 I369 K370 N371 F375 L376 F377	I89-F373 HydrophobicContact CD1-CD1 4.47Å; I89-F373 HydrophobicContact CD1-CE1 4.32Å; I89-F373 HydrophobicContact CG2-CB 3.92Å; I89-F373 HydrophobicContact CG2-CD1 3.65Å; I89-F373 HydrophobicContact CG2-CD2 3.93Å; I89-F373 HydrophobicContact CG2-CE1 4.08Å; I89-F373 HydrophobicContact CG2-CE2 4.32Å; I89-F373 HydrophobicContact CG2-CG 3.57Å; I89-F373 HydrophobicContact CG2-CZ 4.4Å; A93-F373 HydrophobicContact CB-CB 4.01Å; A93-F373 HydrophobicContact CB-CD2 4Å; A93-F373 HydrophobicContact CB-CG 4.47Å; I369-F373 HydrophobicContact CG2-CD2 4.11Å; I369-F373 HydrophobicContact CG2-CE1 4.4Å; I369-F373 HydrophobicContact CG2-CE2 3.5Å; I369-F373 HydrophobicContact CG2-CZ 3.67Å; I369-F373 PolarHBondContact O-N 3.49Å; I369-F373 VanDerWaalsContact O-N 3.08Å; K370-F373 PolarHBondContact O-N 3.26Å; N371-F373 VanDerWaalsContact C-N 3.31Å; N371-F373 PolarHBondContact O-N 3.27Å; F373-F375 PolarHBondContact O-N 3.04Å; F373-L376 VanDerWaalsContact O-CB 3.31Å; F373-L376 WeakPolarHBondContact O-CB 3.3Å; F373-L376 PolarHBondContact O-N 2.89Å; F373-F377 WeakPolarHBondContact O-CD2 3.35Å; F373-F377 VanDerWaalsContact O-CG 3.3Å; F373-F377 WeakPolarHBondContact O-CG 3.47Å; F373-F377 PolarHBondContact O-N 2.96Å; F373-F377 VanDerWaalsContact O-N 3.11Å
374	R	86.9	Confident	87.1	Confident	87 Å²	87	36.8 Å²	36.8	33%	0.328	18%	0.178	S	C	.	.	H	α-helix	trans	-60.1	-43.9	174.7	-72.4	177.1	65.3	-172.6	-2.1	112.1	K370 N371 F377 S1114 A1115	K370-R374 WeakPolarHBondContact O-CG 3.43Å; K370-R374 PolarHBondContact O-N 3.19Å; N371-R374 PolarHBondContact O-N 2.76Å; R374-F377 PolarHBondContact O-N 3.47Å; R374-S1114 PolarHBondContact NH2-O 3.24Å; R374-A1115 HydrophobicContact CB-CB 4.1Å
375	F	90	Very high	87.4	Confident	3 Å²	3	34 Å²	34	1%	0.013	16%	0.158	C	C	.	.	H	α-helix	trans	-66.8	-36.4	174.3	-72.4	-59.9	0	0	0	112.8	C337 F340 A341 T344 N371 V372 F373 F377 I378 L379 T1108 F1113 A1115	C337-F375 HydrophobicContact CB-CB 4.13Å; F340-F375 HydrophobicContact CB-CD1 3.93Å; F340-F375 HydrophobicContact CB-CD2 3.73Å; F340-F375 HydrophobicContact CB-CE1 3.87Å; F340-F375 HydrophobicContact CB-CE2 3.66Å; F340-F375 HydrophobicContact CB-CG 3.87Å; F340-F375 HydrophobicContact CB-CZ 3.73Å; F340-F375 AromaticContact CD2-CD1 3.98Å; F340-F375 HydrophobicContact CD2-CD1 3.98Å; F340-F375 HydrophobicContact CD2-CE1 4.34Å; F340-F375 HydrophobicContact CD2-CG 4.35Å; F340-F375 HydrophobicContact CG-CD1 4.43Å; F340-F375 HydrophobicContact CG-CE1 4.46Å; A341-F375 HydrophobicContact CB-CD2 4.33Å; A341-F375 HydrophobicContact CB-CE2 4.43Å; T344-F375 WeakPolarHBondContact OG1-CE2 3.01Å; T344-F375 WeakPolarHBondContact OG1-CZ 3.43Å; N371-F375 WeakPolarHBondContact O-CD2 3.35Å; N371-F375 PolarHBondContact O-N 3.07Å; N371-F375 VanDerWaalsContact O-N 3.1Å; V372-F375 PolarHBondContact O-N 2.66Å; F373-F375 PolarHBondContact O-N 3.04Å; F375-F377 VanDerWaalsContact C-N 3.28Å; F375-F377 PolarHBondContact O-N 3.41Å; F375-I378 PolarHBondContact O-N 3.21Å; F375-L379 WeakPolarHBondContact O-CG 3.34Å; F375-L379 PolarHBondContact O-N 3.43Å; F375-T1108 HydrophobicContact CE1-CG2 3.69Å; F375-T1108 HydrophobicContact CZ-CG2 4.47Å; F375-F1113 HydrophobicContact CZ-CB 4.27Å; F375-F1113 WeakPolarHBondContact CZ-O 3.44Å; F375-A1115 HydrophobicContact CD1-CB 3.9Å; F375-A1115 HydrophobicContact CE1-CB 3.6Å; F375-A1115 HydrophobicContact CZ-CB 3.98Å
376	L	90.6	Very high	87.6	Confident	16 Å²	16	28.3 Å²	28.3	8%	0.084	13%	0.129	C	C	.	.	H	α-helix	trans	-57.2	-42.1	175.9	-173	73.3	0	0	0	111.5	V86 I89 M333 C337 V372 F373 I378 L379 N380	V86-L376 HydrophobicContact CG2-CD2 4.33Å; I89-L376 HydrophobicContact CD1-CD2 3.72Å; M333-L376 HydrophobicContact CE-CD1 3.5Å; M333-L376 VanDerWaalsContact CE-CD1 3.5Å; M333-L376 HydrophobicContact SD-CD1 4.17Å; C337-L376 VanDerWaalsContact SG-CA 3.53Å; C337-L376 PolarHBondContact SG-N 3.03Å; V372-L376 PolarHBondContact O-N 3.33Å; F373-L376 VanDerWaalsContact O-CB 3.31Å; F373-L376 WeakPolarHBondContact O-CB 3.3Å; F373-L376 PolarHBondContact O-N 2.89Å; L376-I378 VanDerWaalsContact C-N 3.35Å; L376-I378 PolarHBondContact O-N 2.81Å; L376-L379 PolarHBondContact O-N 3.03Å; L376-N380 WeakPolarHBondContact O-CB 3.27Å; L376-N380 PolarHBondContact O-N 3.24Å
377	F	87.8	Confident	87.8	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-65.6	-35.8	179.9	-58	-35.7	0	0	0	113.3	V86 I89 H90 A93 G95 F373 R374 F375	V86-F377 HydrophobicContact CG1-CD1 4.05Å; V86-F377 HydrophobicContact CG1-CE1 4.19Å; I89-F377 HydrophobicContact CB-CE1 4.27Å; I89-F377 HydrophobicContact CB-CZ 4.46Å; I89-F377 HydrophobicContact CG2-CE1 3.88Å; I89-F377 HydrophobicContact CG2-CZ 3.77Å; H90-F377 HydrophobicContact CB-CZ 4.42Å; H90-F377 AromaticContact CD2-CZ 3.92Å; H90-F377 AromaticContact CE1-CD1 3.03Å; H90-F377 WeakPolarHBondContact CE1-CD1 3.39Å; H90-F377 AromaticContact CE1-CE1 3.04Å; H90-F377 WeakPolarHBondContact CE1-CE1 3.4Å; H90-F377 AromaticContact CE1-CG 3.72Å; H90-F377 AromaticContact CE1-CZ 3.71Å; H90-F377 AromaticContact CG-CE1 3.77Å; H90-F377 AromaticContact CG-CZ 3.77Å; H90-F377 AromaticContact ND1-CD1 3.67Å; H90-F377 AromaticContact ND1-CE1 3.14Å; H90-F377 WeakPolarHBondContact ND1-CE1 3.09Å; H90-F377 AromaticContact ND1-CZ 3.65Å; H90-F377 AromaticContact NE2-CD1 3.54Å; H90-F377 AromaticContact NE2-CE1 3.65Å; H90-F377 AromaticContact NE2-CG 3.75Å; H90-F377 AromaticContact NE2-CZ 3.91Å; A93-F377 HydrophobicContact CB-CE2 4.23Å; A93-F377 HydrophobicContact CB-CZ 4.4Å; G95-F377 VanDerWaalsContact CA-CD2 3.42Å; F373-F377 WeakPolarHBondContact O-CD2 3.35Å; F373-F377 VanDerWaalsContact O-CG 3.3Å; F373-F377 WeakPolarHBondContact O-CG 3.47Å; F373-F377 PolarHBondContact O-N 2.96Å; F373-F377 VanDerWaalsContact O-N 3.11Å; R374-F377 PolarHBondContact O-N 3.47Å; F375-F377 VanDerWaalsContact C-N 3.28Å; F375-F377 PolarHBondContact O-N 3.41Å
378	I	87.5	Confident	88.1	Confident	2 Å²	2	22 Å²	22	1%	0.01	10%	0.104	C	C	.	.	H	α-helix	trans	-72.4	-42.1	176.3	-62	172.1	0	0	0	110.8	A96 F375 L376 Q1104 A1115	A96-I378 HydrophobicContact CB-CD1 4.08Å; A96-I378 HydrophobicContact CB-CG1 3.95Å; F375-I378 PolarHBondContact O-N 3.21Å; L376-I378 VanDerWaalsContact C-N 3.35Å; L376-I378 PolarHBondContact O-N 2.81Å; I378-Q1104 HydrophobicContact CG2-CB 4.01Å; I378-Q1104 HydrophobicContact CG2-CG 4.32Å; I378-A1115 HydrophobicContact CD1-CB 3.96Å; I378-A1115 WeakPolarHBondContact CD1-O 3.29Å
379	L	90.5	Very high	88.4	Confident	5 Å²	5	20.3 Å²	20.3	3%	0.026	10%	0.097	C	C	.	.	H	α-helix	trans	-83.8	-9.8	-176.8	-60.1	-178	0	0	0	114.1	M333 F336 F340 F375 L376 Y381 L382 V1101 V1105	M333-L379 HydrophobicContact CG-CB 3.75Å; M333-L379 HydrophobicContact SD-CB 4.42Å; F336-L379 HydrophobicContact CB-CD1 3.85Å; F340-L379 HydrophobicContact CD2-CD1 4.18Å; F340-L379 HydrophobicContact CE2-CD1 3.95Å; F340-L379 HydrophobicContact CE2-CD2 4.47Å; F375-L379 WeakPolarHBondContact O-CG 3.34Å; F375-L379 PolarHBondContact O-N 3.43Å; L376-L379 PolarHBondContact O-N 3.03Å; L379-Y381 PolarHBondContact O-N 2.87Å; L379-Y381 VanDerWaalsContact O-N 3.1Å; L379-L382 VanDerWaalsContact O-CB 3.24Å; L379-L382 WeakPolarHBondContact O-CB 3.36Å; L379-L382 PolarHBondContact O-N 3.39Å; L379-V1101 HydrophobicContact CD2-CG1 3.62Å; L379-V1105 HydrophobicContact CD2-CG2 3.55Å
380	N	90.2	Very high	88.5	Confident	1 Å²	1	17.5 Å²	17.5	1%	0.005	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-51.7	-33.9	177.6	-178.7	25.8	0	0	0	113.1	F82 F83 I102 L376 L382 I383	F82-N380 WeakPolarHBondContact CE1-OD1 3.38Å; F83-N380 WeakPolarHBondContact CE1-OD1 3.36Å; I102-N380 VanDerWaalsContact CD1-ND2 3.34Å; I102-N380 WeakPolarHBondContact CD1-ND2 3.49Å; I102-N380 WeakPolarHBondContact CG1-ND2 3.37Å; L376-N380 WeakPolarHBondContact O-CB 3.27Å; L376-N380 PolarHBondContact O-N 3.24Å; N380-L382 PolarHBondContact O-N 3.1Å; N380-I383 PolarHBondContact O-N 3.01Å; N380-I383 VanDerWaalsContact O-N 3.08Å
381	Y	88.9	Confident	88.7	Confident	4 Å²	4	14.7 Å²	14.7	2%	0.016	7%	0.071	C	C	.	.	G	3₁₀ helix	trans	-67.4	-3.1	179.8	-63.2	-81.8	0	0	0	114.5	T97 A101 L379 I383 F1100 F1124	T97-Y381 HydrophobicContact CG2-CE2 4.42Å; A101-Y381 WeakPolarHBondContact CB-OH 3.49Å; A101-Y381 PolarHBondContact O-OH 3.36Å; L379-Y381 PolarHBondContact O-N 2.87Å; L379-Y381 VanDerWaalsContact O-N 3.1Å; Y381-I383 PolarHBondContact O-N 3.01Å; Y381-F1100 HydrophobicContact CG-CE1 4.2Å; Y381-F1124 HydrophobicContact CD1-CD1 4.07Å; Y381-F1124 AromaticContact CD2-CD1 3.4Å; Y381-F1124 HydrophobicContact CD2-CD1 3.4Å; Y381-F1124 AromaticContact CD2-CE1 3.69Å; Y381-F1124 HydrophobicContact CD2-CE1 3.69Å; Y381-F1124 HydrophobicContact CD2-CG 4.42Å; Y381-F1124 HydrophobicContact CE1-CB 3.78Å; Y381-F1124 AromaticContact CE1-CD1 3.95Å; Y381-F1124 HydrophobicContact CE1-CD1 3.95Å; Y381-F1124 HydrophobicContact CE1-CG 4.31Å; Y381-F1124 HydrophobicContact CE2-CB 4.12Å; Y381-F1124 AromaticContact CE2-CD1 3.25Å; Y381-F1124 HydrophobicContact CE2-CD1 3.25Å; Y381-F1124 AromaticContact CE2-CE1 3.78Å; Y381-F1124 HydrophobicContact CE2-CE1 3.78Å; Y381-F1124 AromaticContact CE2-CG 3.86Å; Y381-F1124 HydrophobicContact CE2-CG 3.86Å; Y381-F1124 AromaticContact CG-CD1 3.83Å; Y381-F1124 HydrophobicContact CG-CD1 3.83Å; Y381-F1124 HydrophobicContact CG-CE1 4.34Å; Y381-F1124 AromaticContact CZ-CD1 3.56Å; Y381-F1124 AromaticContact CZ-CG 3.81Å; Y381-F1124 WeakPolarHBondContact OH-CB 3.19Å
382	L	91.8	Very high	88.9	Confident	21 Å²	21	14.1 Å²	14.1	11%	0.11	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-64.4	-28.4	168.5	-173.3	65.3	0	0	0	111.2	F329 M333 L379 N380 P384 V1098 V1101	F329-L382 HydrophobicContact CB-CD2 4.2Å; F329-L382 HydrophobicContact CD2-CG 4.26Å; F329-L382 HydrophobicContact CG-CD2 4.49Å; M333-L382 HydrophobicContact CB-CD2 4.11Å; L379-L382 VanDerWaalsContact O-CB 3.24Å; L379-L382 WeakPolarHBondContact O-CB 3.36Å; L379-L382 PolarHBondContact O-N 3.39Å; N380-L382 PolarHBondContact O-N 3.1Å; L382-P384 WeakPolarHBondContact O-CD 3.39Å; L382-V1098 HydrophobicContact CD1-CG2 3.8Å; L382-V1101 HydrophobicContact CB-CG2 4.12Å
383	I	91.2	Very high	88.9	Confident	1 Å²	1	14.6 Å²	14.6	1%	0.005	7%	0.068	C	C	.	.	S	Bend	trans	-92.4	117.9	179.1	-54.6	-162.2	0	0	0	109.3	F82 F83 L326 M330 N380 Y381 I385	F82-I383 HydrophobicContact CD1-CB 4.41Å; F82-I383 HydrophobicContact CD1-CD1 3.44Å; F82-I383 VanDerWaalsContact CD1-CD1 3.44Å; F82-I383 HydrophobicContact CD1-CG1 4.29Å; F82-I383 HydrophobicContact CD1-CG2 4.49Å; F82-I383 HydrophobicContact CD2-CD1 4.37Å; F82-I383 HydrophobicContact CE1-CB 4.22Å; F82-I383 HydrophobicContact CE1-CD1 3.39Å; F82-I383 HydrophobicContact CE1-CG1 3.94Å; F82-I383 HydrophobicContact CE2-CD1 4.43Å; F82-I383 HydrophobicContact CG-CD1 3.9Å; F82-I383 HydrophobicContact CZ-CD1 3.97Å; F83-I383 HydrophobicContact CE2-CG2 3.84Å; F83-I383 HydrophobicContact CZ-CB 3.84Å; F83-I383 HydrophobicContact CZ-CG2 3.65Å; L326-I383 HydrophobicContact CD2-CG2 4.29Å; M330-I383 HydrophobicContact CG-CD1 3.33Å; M330-I383 HydrophobicContact SD-CD1 4.21Å; N380-I383 PolarHBondContact O-N 3.01Å; N380-I383 VanDerWaalsContact O-N 3.08Å; Y381-I383 PolarHBondContact O-N 3.01Å; I383-I385 PolarHBondContact O-N 3.07Å; I383-I385 VanDerWaalsContact O-N 3.09Å
384	P	87.9	Confident	89.1	Confident	3 Å²	3	12.3 Å²	12.3	2%	0.019	6%	0.058	C	C	.	.			trans	-75.2	101.5	-176.8	28.6	-34.4	0	0	0	111.9	L326 L382 S386 L387 F1093 Y1094	L326-P384 HydrophobicContact CD2-CG 4.36Å; L382-P384 WeakPolarHBondContact O-CD 3.39Å; P384-S386 VanDerWaalsContact C-N 3.27Å; P384-S386 PolarHBondContact O-N 3.39Å; P384-L387 HydrophobicContact CB-CB 3.92Å; P384-L387 HydrophobicContact CG-CB 3.78Å; P384-L387 HydrophobicContact CG-CD2 3.79Å; P384-L387 HydrophobicContact CG-CG 4.37Å; P384-L387 WeakPolarHBondContact O-CB 3.44Å; P384-L387 PolarHBondContact O-N 3.25Å; P384-F1093 HydrophobicContact CB-CB 4.4Å; P384-F1093 HydrophobicContact CB-CD1 3.91Å; P384-Y1094 HydrophobicContact CG-CD1 4.3Å; P384-Y1094 HydrophobicContact CG-CE1 4.33Å
385	I	86.3	Confident	89.3	Confident	9 Å²	9	8.2 Å²	8.2	5%	0.046	4%	0.043	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-39.6	178.9	-60.6	163.4	0	0	0	111.9	F83 P105 V109 I383	F83-I385 HydrophobicContact CD1-CD1 4.41Å; F83-I385 HydrophobicContact CD1-CG1 4.13Å; F83-I385 HydrophobicContact CD2-CG1 4.21Å; F83-I385 HydrophobicContact CE1-CD1 3.86Å; F83-I385 HydrophobicContact CE1-CG1 3.41Å; F83-I385 VanDerWaalsContact CE1-CG1 3.41Å; F83-I385 HydrophobicContact CE2-CB 4.21Å; F83-I385 HydrophobicContact CE2-CG1 3.53Å; F83-I385 HydrophobicContact CZ-CB 4.18Å; F83-I385 HydrophobicContact CZ-CD1 4.07Å; F83-I385 HydrophobicContact CZ-CG1 3.1Å; P105-I385 HydrophobicContact CB-CD1 4.2Å; P105-I385 HydrophobicContact CB-CG2 4.37Å; V109-I385 HydrophobicContact CG2-CG2 4.08Å; I383-I385 PolarHBondContact O-N 3.07Å; I383-I385 VanDerWaalsContact O-N 3.09Å
386	S	87.6	Confident	89.3	Confident	6 Å²	6	10.1 Å²	10.1	4%	0.042	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	0.8	-175	49.7	0	0	0	0	114.9	P384 I388 I389 T390 F1093 N1128	P384-S386 VanDerWaalsContact C-N 3.27Å; P384-S386 PolarHBondContact O-N 3.39Å; S386-I388 PolarHBondContact O-N 3.36Å; S386-I389 WeakPolarHBondContact O-CG2 3.48Å; S386-T390 WeakPolarHBondContact O-CG2 3.37Å; S386-T390 PolarHBondContact O-N 3.46Å; S386-T390 VanDerWaalsContact O-N 3.17Å; S386-T390 PolarHBondContact O-OG1 3.36Å; S386-F1093 WeakPolarHBondContact OG-CE1 3.4Å; S386-N1128 WeakPolarHBondContact CB-O 3.03Å; S386-N1128 PolarHBondContact OG-O 2.88Å
387	L	89.3	Confident	89.5	Confident	4 Å²	4	13.2 Å²	13.2	2%	0.021	7%	0.068	C	C	.	.	H	α-helix	trans	-61.2	-47	-177.9	177.1	63	0	0	0	112.3	P384 T390 T391 M1090 F1093 Y1094	P384-L387 HydrophobicContact CB-CB 3.92Å; P384-L387 HydrophobicContact CG-CB 3.78Å; P384-L387 HydrophobicContact CG-CD2 3.79Å; P384-L387 HydrophobicContact CG-CG 4.37Å; P384-L387 WeakPolarHBondContact O-CB 3.44Å; P384-L387 PolarHBondContact O-N 3.25Å; L387-T390 PolarHBondContact O-N 3.17Å; L387-T390 PolarHBondContact O-OG1 2.97Å; L387-T391 HydrophobicContact CD1-CG2 4.09Å; L387-T391 WeakPolarHBondContact O-CG2 3.23Å; L387-T391 PolarHBondContact O-N 3.27Å; L387-T391 VanDerWaalsContact O-N 3.1Å; L387-T391 PolarHBondContact O-OG1 2.86Å; L387-M1090 HydrophobicContact CD1-CB 4.33Å; L387-M1090 HydrophobicContact CD1-CE 4.29Å; L387-M1090 HydrophobicContact CD1-CG 4.07Å; L387-M1090 HydrophobicContact CD2-CE 4.25Å; L387-M1090 HydrophobicContact CG-CE 4.32Å; L387-F1093 HydrophobicContact CB-CD1 4.29Å; L387-F1093 HydrophobicContact CD1-CB 3.75Å; L387-F1093 HydrophobicContact CD1-CD1 4.34Å; L387-F1093 HydrophobicContact CD1-CD2 3.97Å; L387-F1093 HydrophobicContact CD1-CG 3.78Å; L387-Y1094 HydrophobicContact CD2-CE1 3.8Å
388	I	87	Confident	89.7	Confident	15 Å²	15	13.5 Å²	13.5	8%	0.077	7%	0.07	C	C	.	.	H	α-helix	trans	-62.7	-53.7	-174.7	-66	168.8	0	0	0	109.9	Y77 S79 S386 T390 T391 E392	Y77-I388 HydrophobicContact CD1-CD1 3.81Å; Y77-I388 HydrophobicContact CD1-CG1 4.32Å; Y77-I388 HydrophobicContact CD2-CD1 4.04Å; Y77-I388 HydrophobicContact CD2-CG2 4.44Å; Y77-I388 HydrophobicContact CE1-CD1 4.42Å; Y77-I388 HydrophobicContact CE1-CG2 4.33Å; Y77-I388 HydrophobicContact CE2-CG2 4Å; Y77-I388 HydrophobicContact CG-CD1 3.59Å; S79-I388 WeakPolarHBondContact OG-CD1 3.28Å; S386-I388 PolarHBondContact O-N 3.36Å; I388-T390 VanDerWaalsContact C-N 3.32Å; I388-T390 PolarHBondContact O-N 3.18Å; I388-T391 PolarHBondContact O-N 3.01Å; I388-T391 PolarHBondContact O-OG1 3.18Å; I388-E392 HydrophobicContact CG2-CG 4.39Å; I388-E392 WeakPolarHBondContact O-CG 3.46Å; I388-E392 PolarHBondContact O-N 3.04Å
389	I	87.1	Confident	89.9	Confident	15 Å²	15	14 Å²	14	8%	0.077	7%	0.073	C	C	.	.	H	α-helix	trans	-63	-38	-176.6	-173.1	62.6	0	0	0	112.7	V109 V112 T113 S386 E392 I393	V109-I389 HydrophobicContact CG1-CB 4.1Å; V109-I389 HydrophobicContact CG1-CG2 4.04Å; V109-I389 HydrophobicContact CG2-CG2 4.07Å; V112-I389 HydrophobicContact CB-CD1 4.14Å; V112-I389 HydrophobicContact CB-CG1 4.4Å; V112-I389 HydrophobicContact CG1-CD1 3.55Å; V112-I389 HydrophobicContact CG1-CG1 3.94Å; T113-I389 HydrophobicContact CG2-CD1 3.83Å; S386-I389 WeakPolarHBondContact O-CG2 3.48Å; I389-E392 PolarHBondContact O-N 2.67Å; I389-I393 HydrophobicContact CD1-CD1 4.17Å; I389-I393 HydrophobicContact CD1-CG1 4.27Å; I389-I393 HydrophobicContact CG1-CD1 3.88Å; I389-I393 HydrophobicContact CG1-CG1 4.41Å; I389-I393 VanDerWaalsContact O-CG1 3.29Å; I389-I393 WeakPolarHBondContact O-CG1 3.26Å; I389-I393 PolarHBondContact O-N 2.81Å
390	T	90	Very high	90	Very high	7 Å²	7	19 Å²	19	4%	0.043	9%	0.092	C	C	.	.	H	α-helix	trans	-67	-40.9	178.1	49.6	0	0	0	0	111.9	S386 L387 I388 I393 Q394 F1093 M1137	S386-T390 WeakPolarHBondContact O-CG2 3.37Å; S386-T390 PolarHBondContact O-N 3.46Å; S386-T390 VanDerWaalsContact O-N 3.17Å; S386-T390 PolarHBondContact O-OG1 3.36Å; L387-T390 PolarHBondContact O-N 3.17Å; L387-T390 PolarHBondContact O-OG1 2.97Å; I388-T390 VanDerWaalsContact C-N 3.32Å; I388-T390 PolarHBondContact O-N 3.18Å; T390-I393 PolarHBondContact O-N 2.83Å; T390-Q394 WeakPolarHBondContact O-CB 3.49Å; T390-Q394 VanDerWaalsContact O-CG 3.25Å; T390-Q394 WeakPolarHBondContact O-CG 3.38Å; T390-Q394 PolarHBondContact O-N 3.48Å; T390-F1093 HydrophobicContact CG2-CE2 4.4Å; T390-F1093 HydrophobicContact CG2-CZ 3.77Å; T390-F1093 WeakPolarHBondContact OG1-CE2 3.37Å; T390-F1093 VanDerWaalsContact OG1-CZ 3.25Å; T390-F1093 WeakPolarHBondContact OG1-CZ 3.32Å; T390-M1137 HydrophobicContact CG2-CB 4.25Å
391	T	89.8	Confident	90.2	Very high	4 Å²	4	22 Å²	22	3%	0.025	11%	0.106	C	C	.	.	H	α-helix	trans	-68.5	-36.5	175.8	59.7	0	0	0	0	112.9	L387 I388 Q394 Q395 I1086 M1090	L387-T391 HydrophobicContact CD1-CG2 4.09Å; L387-T391 WeakPolarHBondContact O-CG2 3.23Å; L387-T391 PolarHBondContact O-N 3.27Å; L387-T391 VanDerWaalsContact O-N 3.1Å; L387-T391 PolarHBondContact O-OG1 2.86Å; I388-T391 PolarHBondContact O-N 3.01Å; I388-T391 PolarHBondContact O-OG1 3.18Å; T391-Q394 PolarHBondContact O-N 3.26Å; T391-Q395 WeakPolarHBondContact O-CG 2.95Å; T391-Q395 PolarHBondContact O-N 2.89Å; T391-I1086 HydrophobicContact CG2-CG2 4.28Å; T391-M1090 HydrophobicContact CG2-CE 4.15Å; T391-M1090 HydrophobicContact CG2-CG 4.13Å
392	E	87.1	Confident	90.4	Very high	5 Å²	5	21.9 Å²	21.9	2%	0.023	11%	0.105	C	C	.	.	H	α-helix	trans	-66.3	-42.7	175.1	-71.5	-168.3	167.6	0	0	111.6	Y77 K116 R313 I388 I389 Q394 Q395 I396	Y77-E392 PolarHBondContact OH-OE1 3.21Å; Y77-E392 VanDerWaalsContact OH-OE1 3.09Å; K116-E392 IonicContact NZ-OE1 2.79Å; K116-E392 IonicContact NZ-OE2 2.71Å; K116-E392 PolarHBondContact NZ-OE2 3.25Å; R313-E392 IonicContact NH2-OE1 2.78Å; R313-E392 PolarHBondContact NH2-OE1 2.81Å; I388-E392 HydrophobicContact CG2-CG 4.39Å; I388-E392 WeakPolarHBondContact O-CG 3.46Å; I388-E392 PolarHBondContact O-N 3.04Å; I389-E392 PolarHBondContact O-N 2.67Å; E392-Q394 VanDerWaalsContact C-N 3.35Å; E392-Q395 PolarHBondContact O-N 3.49Å; E392-I396 WeakPolarHBondContact O-CG1 3.41Å; E392-I396 PolarHBondContact O-N 3.38Å; E392-I396 VanDerWaalsContact O-N 3.15Å
393	I	89.9	Confident	90.5	Very high	50 Å²	50	26.7 Å²	26.7	26%	0.256	12%	0.122	S	C	.	.	H	α-helix	trans	-63.7	-41.8	175.4	-68.4	169.2	0	0	0	110.8	I389 T390 Q395 I396 M397 M1137	I389-I393 HydrophobicContact CD1-CD1 4.17Å; I389-I393 HydrophobicContact CD1-CG1 4.27Å; I389-I393 HydrophobicContact CG1-CD1 3.88Å; I389-I393 HydrophobicContact CG1-CG1 4.41Å; I389-I393 VanDerWaalsContact O-CG1 3.29Å; I389-I393 WeakPolarHBondContact O-CG1 3.26Å; I389-I393 PolarHBondContact O-N 2.81Å; T390-I393 PolarHBondContact O-N 2.83Å; I393-Q395 PolarHBondContact O-N 3.36Å; I393-I396 PolarHBondContact O-N 3.12Å; I393-M397 HydrophobicContact CG2-CG 4.43Å; I393-M397 WeakPolarHBondContact O-CG 3.37Å; I393-M397 PolarHBondContact O-N 3.34Å; I393-M1137 HydrophobicContact CB-SD 4.17Å; I393-M1137 HydrophobicContact CD1-SD 4.18Å; I393-M1137 HydrophobicContact CG2-SD 3.69Å
394	Q	93	Very high	90.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-57.9	-48.6	175.1	-79	174.5	-11.7	0	0	111.6	T390 T391 E392 I396 M397 L398 T1089 C1136 M1137 G1140 I1141	T390-Q394 WeakPolarHBondContact O-CB 3.49Å; T390-Q394 VanDerWaalsContact O-CG 3.25Å; T390-Q394 WeakPolarHBondContact O-CG 3.38Å; T390-Q394 PolarHBondContact O-N 3.48Å; T391-Q394 PolarHBondContact O-N 3.26Å; E392-Q394 VanDerWaalsContact C-N 3.35Å; Q394-I396 VanDerWaalsContact C-N 3.29Å; Q394-I396 PolarHBondContact O-N 2.79Å; Q394-M397 PolarHBondContact O-N 2.72Å; Q394-L398 WeakPolarHBondContact O-CB 3.15Å; Q394-L398 WeakPolarHBondContact O-CG 3.41Å; Q394-L398 PolarHBondContact O-N 3.47Å; Q394-T1089 PolarHBondContact NE2-OG1 3.02Å; Q394-C1136 PolarHBondContact NE2-O 3.09Å; Q394-M1137 HydrophobicContact CG-CG 4.41Å; Q394-M1137 PolarHBondContact NE2-O 2.99Å; Q394-G1140 VanDerWaalsContact NE2-CA 3.27Å; Q394-I1141 HydrophobicContact CG-CG1 3.92Å
395	Q	92.1	Very high	90.7	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.009	15%	0.146	C	C	.	.	H	α-helix	trans	-57	-41.2	177.6	-76.9	174.8	-27.3	0	0	112.4	T391 E392 I393 S399 P422 Q423 D426 I1086	T391-Q395 WeakPolarHBondContact O-CG 2.95Å; T391-Q395 PolarHBondContact O-N 2.89Å; E392-Q395 PolarHBondContact O-N 3.49Å; I393-Q395 PolarHBondContact O-N 3.36Å; Q395-S399 VanDerWaalsContact O-CB 3.27Å; Q395-S399 WeakPolarHBondContact O-CB 3.27Å; Q395-S399 PolarHBondContact O-N 3.05Å; Q395-P422 WeakPolarHBondContact CB-O 3.49Å; Q395-Q423 PolarHBondContact NE2-O 2.83Å; Q395-D426 PolarHBondContact NE2-OD1 3.4Å; Q395-I1086 HydrophobicContact CG-CD1 3.67Å
396	I	90.7	Very high	91	Very high	43 Å²	43	37 Å²	37	22%	0.221	18%	0.176	C	C	.	.	H	α-helix	trans	-64.3	-45.9	176.3	-65	170.5	0	0	0	111.4	K116 Y120 E392 I393 Q394 S399 Y400 P422	K116-I396 HydrophobicContact CD-CD1 3.91Å; K116-I396 HydrophobicContact CG-CD1 3.93Å; Y120-I396 HydrophobicContact CE2-CD1 3.81Å; Y120-I396 HydrophobicContact CE2-CG1 4.42Å; Y120-I396 WeakPolarHBondContact OH-CD1 3.25Å; Y120-I396 WeakPolarHBondContact OH-CG1 3.45Å; Y120-I396 WeakPolarHBondContact OH-CG2 3.39Å; E392-I396 WeakPolarHBondContact O-CG1 3.41Å; E392-I396 PolarHBondContact O-N 3.38Å; E392-I396 VanDerWaalsContact O-N 3.15Å; I393-I396 PolarHBondContact O-N 3.12Å; Q394-I396 VanDerWaalsContact C-N 3.29Å; Q394-I396 PolarHBondContact O-N 2.79Å; I396-S399 WeakPolarHBondContact O-CB 3.22Å; I396-S399 PolarHBondContact O-N 2.83Å; I396-Y400 PolarHBondContact O-N 2.8Å; I396-P422 HydrophobicContact CG1-CB 4.37Å; I396-P422 HydrophobicContact CG1-CG 4.48Å
397	M	92.9	Very high	91.1	Very high	81 Å²	81	41.2 Å²	41.2	40%	0.399	20%	0.198	S	C	.	.	H	α-helix	trans	-67.3	-40.5	179.8	-69.7	-62.2	178.2	0	0	112.2	I393 Q394 S399 Y400 F401 I1141	I393-M397 HydrophobicContact CG2-CG 4.43Å; I393-M397 WeakPolarHBondContact O-CG 3.37Å; I393-M397 PolarHBondContact O-N 3.34Å; Q394-M397 PolarHBondContact O-N 2.72Å; M397-S399 VanDerWaalsContact C-N 3.32Å; M397-S399 PolarHBondContact O-N 3.11Å; M397-Y400 WeakPolarHBondContact O-CB 3.42Å; M397-Y400 PolarHBondContact O-N 3.24Å; M397-Y400 VanDerWaalsContact O-N 3.11Å; M397-F401 WeakPolarHBondContact O-CG 3.49Å; M397-F401 PolarHBondContact O-N 2.92Å; M397-I1141 HydrophobicContact CB-CD1 4.3Å; M397-I1141 HydrophobicContact CB-CG1 4.26Å; M397-I1141 HydrophobicContact CB-CG2 4.22Å; M397-I1141 HydrophobicContact CG-CD1 4.08Å
398	L	94	Very high	91.2	Very high	6 Å²	6	41.1 Å²	41.1	3%	0.031	20%	0.198	C	C	.	.	H	α-helix	trans	-64.1	-39.7	174.6	-65.4	171.3	0	0	0	111.2	Q394 Y400 F401 I402 V425 A1082 I1086	Q394-L398 WeakPolarHBondContact O-CB 3.15Å; Q394-L398 WeakPolarHBondContact O-CG 3.41Å; Q394-L398 PolarHBondContact O-N 3.47Å; L398-Y400 VanDerWaalsContact C-N 3.27Å; L398-Y400 PolarHBondContact O-N 3.14Å; L398-F401 HydrophobicContact CD2-CD2 4.29Å; L398-F401 PolarHBondContact O-N 2.8Å; L398-I402 WeakPolarHBondContact O-CG1 3.15Å; L398-I402 PolarHBondContact O-N 2.85Å; L398-V425 HydrophobicContact CB-CG1 3.74Å; L398-V425 HydrophobicContact CD1-CG1 4.44Å; L398-A1082 HydrophobicContact CD1-CB 4Å; L398-I1086 HydrophobicContact CD1-CD1 3.83Å; L398-I1086 HydrophobicContact CD1-CG1 4.14Å
399	S	91.7	Very high	91.3	Very high	11 Å²	11	43.4 Å²	43.4	8%	0.077	21%	0.206	C	C	.	.	H	α-helix	trans	-62.2	-34.4	172.4	-179.5	0	0	0	0	112.8	Q395 I396 M397 R403 S419	Q395-S399 VanDerWaalsContact O-CB 3.27Å; Q395-S399 WeakPolarHBondContact O-CB 3.27Å; Q395-S399 PolarHBondContact O-N 3.05Å; I396-S399 WeakPolarHBondContact O-CB 3.22Å; I396-S399 PolarHBondContact O-N 2.83Å; M397-S399 VanDerWaalsContact C-N 3.32Å; M397-S399 PolarHBondContact O-N 3.11Å; S399-R403 PolarHBondContact O-N 3.24Å; S399-S419 WeakPolarHBondContact OG-CB 3.3Å; S399-S419 PolarHBondContact OG-OG 2.91Å
400	Y	92.6	Very high	91.3	Very high	112 Å²	112	43.1 Å²	43.1	44%	0.439	20%	0.204	S	C	.	.	H	α-helix	trans	-68.8	-40	174.7	176.4	-100.3	0	0	0	111.4	I396 M397 L398 I402 R403 N404	I396-Y400 PolarHBondContact O-N 2.8Å; M397-Y400 WeakPolarHBondContact O-CB 3.42Å; M397-Y400 PolarHBondContact O-N 3.24Å; M397-Y400 VanDerWaalsContact O-N 3.11Å; L398-Y400 VanDerWaalsContact C-N 3.27Å; L398-Y400 PolarHBondContact O-N 3.14Å; Y400-I402 PolarHBondContact O-N 2.95Å; Y400-R403 WeakPolarHBondContact O-CB 3.25Å; Y400-R403 PolarHBondContact O-N 3.15Å; Y400-N404 VanDerWaalsContact CE1-ND2 3.26Å; Y400-N404 WeakPolarHBondContact CE1-ND2 3.48Å; Y400-N404 PolarHBondContact O-N 2.83Å; Y400-N404 VanDerWaalsContact O-N 3.17Å; Y400-N404 PolarHBondContact OH-ND2 3.38Å
401	F	93.3	Very high	91	Very high	64 Å²	64	50.6 Å²	50.6	28%	0.281	24%	0.237	S	C	.	.	H	α-helix	trans	-63.2	-39.5	173.8	-63.3	-29.1	0	0	0	112.9	M397 L398 R403 N404 D405 I1141 F1142	M397-F401 WeakPolarHBondContact O-CG 3.49Å; M397-F401 PolarHBondContact O-N 2.92Å; L398-F401 HydrophobicContact CD2-CD2 4.29Å; L398-F401 PolarHBondContact O-N 2.8Å; F401-R403 VanDerWaalsContact C-N 3.26Å; F401-R403 PolarHBondContact O-N 3.35Å; F401-N404 PolarHBondContact O-N 3.27Å; F401-D405 PolarHBondContact O-N 2.84Å; F401-D405 VanDerWaalsContact O-N 3.12Å; F401-I1141 HydrophobicContact CE2-CG2 3.55Å; F401-I1141 HydrophobicContact CZ-CG2 3.75Å; F401-F1142 HydrophobicContact CE2-CE1 4.45Å; F401-F1142 HydrophobicContact CZ-CD1 4.34Å; F401-F1142 AromaticContact CZ-CE1 3.76Å; F401-F1142 HydrophobicContact CZ-CE1 3.76Å; F401-F1142 HydrophobicContact CZ-CZ 4.23Å
402	I	94	Very high	90.5	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-58.4	-40.9	173.4	-68.7	167.6	0	0	0	111	L398 Y400 N404 L408 T417 V425 L428 Y1063 L1074 H1078	L398-I402 WeakPolarHBondContact O-CG1 3.15Å; L398-I402 PolarHBondContact O-N 2.85Å; Y400-I402 PolarHBondContact O-N 2.95Å; I402-N404 VanDerWaalsContact C-N 3.31Å; I402-N404 PolarHBondContact O-N 3.13Å; I402-L408 HydrophobicContact CG2-CD1 4.04Å; I402-T417 HydrophobicContact CG2-CG2 3.83Å; I402-V425 HydrophobicContact CD1-CG1 3.86Å; I402-V425 HydrophobicContact CD1-CG2 4.22Å; I402-L428 HydrophobicContact CD1-CD1 4.28Å; I402-Y1063 HydrophobicContact CD1-CE1 4.33Å; I402-L1074 HydrophobicContact CD1-CD1 4.27Å; I402-L1074 HydrophobicContact CG2-CD1 3.75Å; I402-H1078 HydrophobicContact CD1-CB 4.11Å; I402-H1078 HydrophobicContact CG1-CB 3.87Å
403	R	92.1	Very high	89.9	Confident	121 Å²	121	63.2 Å²	63.2	46%	0.457	29%	0.292	S	S	.	.	H	α-helix	trans	-66.4	-33.4	179.9	-169.6	179.2	84.6	169.9	8.3	113	S399 Y400 F401 T417	S399-R403 PolarHBondContact O-N 3.24Å; Y400-R403 WeakPolarHBondContact O-CB 3.25Å; Y400-R403 PolarHBondContact O-N 3.15Å; F401-R403 VanDerWaalsContact C-N 3.26Å; F401-R403 PolarHBondContact O-N 3.35Å; R403-T417 WeakPolarHBondContact CA-O 3.13Å; R403-T417 WeakPolarHBondContact CG-O 3.32Å
404	N	91.4	Very high	89.6	Confident	76 Å²	76	66.4 Å²	66.4	41%	0.406	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	4.1	-174.5	-70.7	6.7	0	0	0	113.5	Y400 F401 I402 L406	Y400-N404 VanDerWaalsContact CE1-ND2 3.26Å; Y400-N404 WeakPolarHBondContact CE1-ND2 3.48Å; Y400-N404 PolarHBondContact O-N 2.83Å; Y400-N404 VanDerWaalsContact O-N 3.17Å; Y400-N404 PolarHBondContact OH-ND2 3.38Å; F401-N404 PolarHBondContact O-N 3.27Å; I402-N404 VanDerWaalsContact C-N 3.31Å; I402-N404 PolarHBondContact O-N 3.13Å; N404-L406 PolarHBondContact O-N 2.92Å
405	D	93.5	Very high	89.1	Confident	23 Å²	23	68.3 Å²	68.3	12%	0.123	32%	0.32	C	S	.	.			trans	-72.9	116.8	177.4	-172.8	-4.3	0	0	0	110.7	F401 N407 L408 R1073 H1078	F401-D405 PolarHBondContact O-N 2.84Å; F401-D405 VanDerWaalsContact O-N 3.12Å; D405-N407 PolarHBondContact O-N 3.47Å; D405-N407 PolarHBondContact OD1-N 3.19Å; D405-L408 HydrophobicContact CB-CB 4.19Å; D405-L408 HydrophobicContact CB-CD1 4.01Å; D405-L408 HydrophobicContact CB-CG 4.1Å; D405-L408 PolarHBondContact O-N 3.34Å; D405-R1073 IonicContact OD1-CZ 2.63Å; D405-R1073 IonicContact OD1-NE 2.64Å; D405-R1073 IonicContact OD1-NH2 2.7Å; D405-R1073 IonicContact OD2-CZ 2.92Å; D405-R1073 IonicContact OD2-NE 2.79Å; D405-R1073 PolarHBondContact OD2-NE 3.24Å; D405-R1073 IonicContact OD2-NH2 3.14Å; D405-R1073 PolarHBondContact OD2-NH2 2.92Å; D405-H1078 IonicContact OD2-CD2 3.67Å; D405-H1078 IonicContact OD2-CE1 3.49Å; D405-H1078 IonicContact OD2-NE2 3.99Å; D405-H1078 PolarHBondContact OD2-NE2 2.67Å
406	L	91.4	Very high	88.8	Confident	131 Å²	131	71.5 Å²	71.5	69%	0.686	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-62	-28.5	-179.6	-66.1	173.9	0	0	0	112.7	N404 L408 Y409	N404-L406 PolarHBondContact O-N 2.92Å; L406-L408 PolarHBondContact O-N 2.87Å; L406-Y409 WeakPolarHBondContact O-CB 3.38Å; L406-Y409 PolarHBondContact O-N 3.2Å
407	N	90.3	Very high	88.7	Confident	95 Å²	95	69.5 Å²	69.5	51%	0.508	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-78.1	-8.7	177.8	-67.8	-49.5	0	0	0	113	D405 H1070 R1073	D405-N407 PolarHBondContact O-N 3.47Å; D405-N407 PolarHBondContact OD1-N 3.19Å; N407-H1070 PolarHBondContact O-CD2 3.17Å; N407-R1073 VanDerWaalsContact CB-CD 3.43Å; N407-R1073 VanDerWaalsContact CB-NE 3.28Å; N407-R1073 PolarHBondContact ND2-NH1 2.9Å; N407-R1073 PolarHBondContact ND2-NH2 3.5Å; N407-R1073 VanDerWaalsContact ND2-NH2 3.16Å
408	L	91.6	Very high	88.3	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.005	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-103.9	10.2	173.4	-67.7	-178.6	0	0	0	112.2	I402 D405 L406 T417 H1070 R1073	I402-L408 HydrophobicContact CG2-CD1 4.04Å; D405-L408 HydrophobicContact CB-CB 4.19Å; D405-L408 HydrophobicContact CB-CD1 4.01Å; D405-L408 HydrophobicContact CB-CG 4.1Å; D405-L408 PolarHBondContact O-N 3.34Å; L406-L408 PolarHBondContact O-N 2.87Å; L408-T417 WeakPolarHBondContact CB-OG1 3.29Å; L408-T417 HydrophobicContact CD1-CG2 4.48Å; L408-T417 PolarHBondContact O-N 2.83Å; L408-T417 PolarHBondContact O-OG1 3.33Å; L408-T417 VanDerWaalsContact O-OG1 3.05Å; L408-H1070 HydrophobicContact CD2-CB 3.74Å; L408-H1070 WeakPolarHBondContact CD2-O 3.41Å; L408-R1073 HydrophobicContact CD2-CB 4.02Å; L408-R1073 HydrophobicContact CD2-CG 4.27Å
409	Y	89.9	Confident	87.9	Confident	63 Å²	63	70.3 Å²	70.3	25%	0.247	33%	0.33	C	S	.	.			trans	-103.6	133	176.7	173.3	-102.4	0	0	0	110.4	L406 F411 D414 L415 N416	L406-Y409 WeakPolarHBondContact O-CB 3.38Å; L406-Y409 PolarHBondContact O-N 3.2Å; Y409-F411 HydrophobicContact CD1-CD1 4.02Å; Y409-F411 HydrophobicContact CD1-CD2 4.38Å; Y409-F411 HydrophobicContact CD1-CE1 4Å; Y409-F411 HydrophobicContact CD1-CE2 4.37Å; Y409-F411 HydrophobicContact CD1-CG 4.2Å; Y409-F411 HydrophobicContact CD1-CZ 4.18Å; Y409-F411 HydrophobicContact CE1-CB 4.47Å; Y409-F411 AromaticContact CE1-CD1 3.55Å; Y409-F411 HydrophobicContact CE1-CD1 3.55Å; Y409-F411 AromaticContact CE1-CE1 3.82Å; Y409-F411 HydrophobicContact CE1-CE1 3.82Å; Y409-F411 AromaticContact CE1-CG 3.97Å; Y409-F411 HydrophobicContact CE1-CG 3.97Å; Y409-F411 HydrophobicContact CE1-CZ 4.45Å; Y409-D414 WeakPolarHBondContact CE2-OD1 3.08Å; Y409-D414 PolarHBondContact OH-OD1 2.82Å; Y409-L415 WeakPolarHBondContact CD2-O 3.26Å; Y409-N416 HydrophobicContact CD2-CB 4.13Å
410	D	86.6	Confident	87.4	Confident	9 Å²	9	71.8 Å²	71.8	5%	0.048	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-100.4	108.2	175.7	-173.1	21.5	0	0	0	111.1	K412 Q413 D414 L415 P1066 Q1067	D410-K412 PolarHBondContact O-N 3.11Å; D410-K412 PolarHBondContact OD1-N 3.45Å; D410-Q413 PolarHBondContact O-N 2.93Å; D410-Q413 WeakPolarHBondContact OD2-CG 3.27Å; D410-D414 PolarHBondContact O-N 2.79Å; D410-L415 PolarHBondContact N-O 3.26Å; D410-L415 PolarHBondContact O-N 3.31Å; D410-P1066 HydrophobicContact CB-CB 3.57Å; D410-P1066 HydrophobicContact CB-CG 4.15Å; D410-Q1067 PolarHBondContact OD1-NE2 2.85Å; D410-Q1067 PolarHBondContact OD2-NE2 2.97Å
411	F	84.4	Confident	86.9	Confident	165 Å²	165	67.9 Å²	67.9	72%	0.724	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-28.8	178.7	-66.2	-83.3	0	0	0	113.6	Y409	Y409-F411 HydrophobicContact CD1-CD1 4.02Å; Y409-F411 HydrophobicContact CD1-CD2 4.38Å; Y409-F411 HydrophobicContact CD1-CE1 4Å; Y409-F411 HydrophobicContact CD1-CE2 4.37Å; Y409-F411 HydrophobicContact CD1-CG 4.2Å; Y409-F411 HydrophobicContact CD1-CZ 4.18Å; Y409-F411 HydrophobicContact CE1-CB 4.47Å; Y409-F411 AromaticContact CE1-CD1 3.55Å; Y409-F411 HydrophobicContact CE1-CD1 3.55Å; Y409-F411 AromaticContact CE1-CE1 3.82Å; Y409-F411 HydrophobicContact CE1-CE1 3.82Å; Y409-F411 AromaticContact CE1-CG 3.97Å; Y409-F411 HydrophobicContact CE1-CG 3.97Å; Y409-F411 HydrophobicContact CE1-CZ 4.45Å
412	K	78.1	Confident	86.5	Confident	191 Å²	191	65.5 Å²	65.5	83%	0.83	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-34.2	-177.3	-69.4	-173.4	178.5	-175.5	0	113	D410	D410-K412 PolarHBondContact O-N 3.11Å; D410-K412 PolarHBondContact OD1-N 3.45Å
413	Q	74.5	Confident	86.1	Confident	82 Å²	82	67 Å²	67	38%	0.383	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-7.9	-175.5	-63.3	-176.1	1.4	0	0	113	D410 L415	D410-Q413 PolarHBondContact O-N 2.93Å; D410-Q413 WeakPolarHBondContact OD2-CG 3.27Å; Q413-L415 VanDerWaalsContact C-N 3.27Å; Q413-L415 HydrophobicContact CB-CB 4.32Å; Q413-L415 HydrophobicContact CB-CD1 3.92Å; Q413-L415 HydrophobicContact CB-CG 3.96Å; Q413-L415 PolarHBondContact O-N 2.73Å
414	D	82.9	Confident	86	Confident	118 Å²	118	61.5 Å²	61.5	63%	0.631	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	46	-170.5	-168.2	22.5	0	0	0	111.9	Y409 D410	Y409-D414 WeakPolarHBondContact CE2-OD1 3.08Å; Y409-D414 PolarHBondContact OH-OD1 2.82Å; D410-D414 PolarHBondContact O-N 2.79Å
415	L	82.7	Confident	86	Confident	40 Å²	40	57.9 Å²	57.9	21%	0.209	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-121.7	132.2	-178.6	-67	177.6	0	0	0	111	Y409 D410 Q413 Y1050 P1066	Y409-L415 WeakPolarHBondContact CD2-O 3.26Å; D410-L415 PolarHBondContact N-O 3.26Å; D410-L415 PolarHBondContact O-N 3.31Å; Q413-L415 VanDerWaalsContact C-N 3.27Å; Q413-L415 HydrophobicContact CB-CB 4.32Å; Q413-L415 HydrophobicContact CB-CD1 3.92Å; Q413-L415 HydrophobicContact CB-CG 3.96Å; Q413-L415 PolarHBondContact O-N 2.73Å; L415-Y1050 HydrophobicContact CD1-CD1 3.84Å; L415-Y1050 HydrophobicContact CD1-CD2 4.26Å; L415-Y1050 HydrophobicContact CD1-CE1 4.43Å; L415-Y1050 HydrophobicContact CD1-CG 3.73Å; L415-Y1050 HydrophobicContact CD2-CE1 4.43Å; L415-P1066 HydrophobicContact CB-CB 4.31Å; L415-P1066 HydrophobicContact CB-CG 4.1Å; L415-P1066 VanDerWaalsContact O-CG 3.23Å; L415-P1066 WeakPolarHBondContact O-CG 3.35Å
416	N	86.4	Confident	85.9	Confident	68 Å²	68	56.9 Å²	56.9	36%	0.364	28%	0.278	S	S	.	.			trans	-98.4	161.7	170.7	61.9	4.2	0	0	0	111.8	Y409 K418 Y1050	Y409-N416 HydrophobicContact CD2-CB 4.13Å; N416-K418 PolarHBondContact O-N 3.43Å; N416-Y1050 PolarHBondContact O-OH 2.96Å
417	T	88.3	Confident	85.9	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.006	25%	0.246	C	C	.	.			trans	-69	130.8	169.5	-68.3	0	0	0	0	109.9	I402 R403 L408 A1064 I1065 P1066	I402-T417 HydrophobicContact CG2-CG2 3.83Å; R403-T417 WeakPolarHBondContact CA-O 3.13Å; R403-T417 WeakPolarHBondContact CG-O 3.32Å; L408-T417 WeakPolarHBondContact CB-OG1 3.29Å; L408-T417 HydrophobicContact CD1-CG2 4.48Å; L408-T417 PolarHBondContact O-N 2.83Å; L408-T417 PolarHBondContact O-OG1 3.33Å; L408-T417 VanDerWaalsContact O-OG1 3.05Å; T417-A1064 CarbonylContact C-O 3.57Å; T417-A1064 WeakPolarHBondContact CA-O 3.43Å; T417-A1064 WeakPolarHBondContact CG2-O 3.33Å; T417-I1065 HydrophobicContact CG2-CG2 3.89Å; T417-P1066 WeakPolarHBondContact OG1-CD 3.35Å
418	K	84.2	Confident	86	Confident	82 Å²	82	46.3 Å²	46.3	36%	0.357	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	141.3	179.1	-171	-176.6	178.2	-165	0	110.1	N416 N420 Y1063 A1064	N416-K418 PolarHBondContact O-N 3.43Å; K418-N420 WeakPolarHBondContact CE-OD1 3.26Å; K418-N420 PolarHBondContact NZ-OD1 3.03Å; K418-Y1063 CarbonylContact O-C 3.47Å; K418-Y1063 WeakPolarHBondContact O-CA 3.46Å; K418-A1064 HydrophobicContact CB-CB 4.28Å; K418-A1064 PolarHBondContact N-O 2.9Å; K418-A1064 PolarHBondContact O-N 3.16Å
419	S	85.8	Confident	86	Confident	22 Å²	22	46.2 Å²	46.2	15%	0.154	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	113.2	171.5	174.1	0	0	0	0	108.8	S399 Y1063	S399-S419 WeakPolarHBondContact OG-CB 3.3Å; S399-S419 PolarHBondContact OG-OG 2.91Å; S419-Y1063 WeakPolarHBondContact OG-CE1 3.44Å
420	N	81	Confident	86	Confident	43 Å²	43	43.3 Å²	43.3	23%	0.23	21%	0.21	C	C	.	.	S	Bend	trans	-86.6	-30.4	176.5	-64.1	-34.2	0	0	0	111	K418 V1058 S1061 D1062	K418-N420 WeakPolarHBondContact CE-OD1 3.26Å; K418-N420 PolarHBondContact NZ-OD1 3.03Å; N420-V1058 PolarHBondContact ND2-O 3.16Å; N420-S1061 WeakPolarHBondContact CB-O 3.33Å; N420-S1061 PolarHBondContact ND2-O 2.96Å; N420-D1062 PolarHBondContact N-O 2.89Å
421	T	83.5	Confident	86.2	Confident	29 Å²	29	42.9 Å²	42.9	18%	0.178	21%	0.208	C	C	.	.			trans	-122.2	85.4	-179.3	-49.1	0	0	0	0	111.1	Q423 L424 D1062 Y1063	T421-Q423 PolarHBondContact O-N 3.08Å; T421-Q423 VanDerWaalsContact O-N 3.13Å; T421-L424 HydrophobicContact CG2-CD1 3.74Å; T421-L424 HydrophobicContact CG2-CG 3.87Å; T421-L424 PolarHBondContact O-N 2.85Å; T421-D1062 WeakPolarHBondContact CB-OD1 3.38Å; T421-D1062 PolarHBondContact N-O 3.21Å; T421-D1062 VanDerWaalsContact N-O 3.11Å; T421-D1062 PolarHBondContact OG1-OD1 2.98Å; T421-Y1063 PolarHBondContact O-OH 3.13Å
422	P	85	Confident	86.4	Confident	14 Å²	14	35.9 Å²	35.9	9%	0.091	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-64.6	-19.4	-176.6	25.3	-34.4	0	0	0	114	Y120 Q395 I396 L424 V425	Y120-P422 HydrophobicContact CE1-CG 4.07Å; Q395-P422 WeakPolarHBondContact CB-O 3.49Å; I396-P422 HydrophobicContact CG1-CB 4.37Å; I396-P422 HydrophobicContact CG1-CG 4.48Å; P422-L424 PolarHBondContact O-N 2.63Å; P422-V425 WeakPolarHBondContact O-CG2 3.4Å
423	Q	85.1	Confident	87	Confident	34 Å²	34	27.5 Å²	27.5	16%	0.159	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-70	-12.6	-177.8	-66.4	173.4	1	0	0	114.1	T316 Q395 T421	T316-Q423 WeakPolarHBondContact CG2-O 3.35Å; Q395-Q423 PolarHBondContact NE2-O 2.83Å; T421-Q423 PolarHBondContact O-N 3.08Å; T421-Q423 VanDerWaalsContact O-N 3.13Å
424	L	89.1	Confident	88	Confident	4 Å²	4	23.6 Å²	23.6	2%	0.021	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-102	8	-174.7	-62.5	173.3	0	0	0	113.9	K314 T316 T421 P422 D426 E427 D1062 Y1063	K314-L424 HydrophobicContact CB-CD1 4.43Å; K314-L424 HydrophobicContact CB-CD2 4.13Å; K314-L424 HydrophobicContact CD-CD1 3.9Å; T316-L424 HydrophobicContact CG2-CD2 3.97Å; T421-L424 HydrophobicContact CG2-CD1 3.74Å; T421-L424 HydrophobicContact CG2-CG 3.87Å; T421-L424 PolarHBondContact O-N 2.85Å; P422-L424 PolarHBondContact O-N 2.63Å; L424-D426 PolarHBondContact O-N 3.17Å; L424-E427 HydrophobicContact CD2-CG 4.29Å; L424-E427 WeakPolarHBondContact O-CB 3.13Å; L424-E427 PolarHBondContact O-N 3.41Å; L424-D1062 HydrophobicContact CD1-CB 4.03Å; L424-D1062 VanDerWaalsContact CD1-CG 3.48Å; L424-Y1063 VanDerWaalsContact C-OH 3.31Å; L424-Y1063 HydrophobicContact CB-CE2 4.38Å
425	V	92.7	Very high	88.6	Confident	1 Å²	1	18 Å²	18	1%	0.006	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-33.3	-171.8	174.1	0	0	0	0	112.5	L398 I402 P422 L428 Y1063 A1082	L398-V425 HydrophobicContact CB-CG1 3.74Å; L398-V425 HydrophobicContact CD1-CG1 4.44Å; I402-V425 HydrophobicContact CD1-CG1 3.86Å; I402-V425 HydrophobicContact CD1-CG2 4.22Å; P422-V425 WeakPolarHBondContact O-CG2 3.4Å; V425-L428 WeakPolarHBondContact O-CB 3.07Å; V425-Y1063 WeakPolarHBondContact CA-OH 3.32Å; V425-Y1063 HydrophobicContact CG2-CE1 4.28Å; V425-Y1063 WeakPolarHBondContact CG2-OH 3.48Å; V425-Y1063 PolarHBondContact N-OH 3.47Å; V425-A1082 HydrophobicContact CG1-CB 3.52Å
426	D	91.2	Very high	89.1	Confident	1 Å²	1	16.1 Å²	16.1	1%	0.005	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-22.6	175.8	53.9	-52	0	0	0	114.7	R318 Q395 L424 L428 G429 N1083 I1086	R318-D426 WeakPolarHBondContact CB-OD2 3.38Å; R318-D426 WeakPolarHBondContact CD-OD2 3.47Å; R318-D426 IonicContact CZ-OD2 2.66Å; R318-D426 IonicContact NE-OD2 3.5Å; R318-D426 PolarHBondContact NE-OD2 2.68Å; Q395-D426 PolarHBondContact NE2-OD1 3.4Å; L424-D426 PolarHBondContact O-N 3.17Å; D426-L428 VanDerWaalsContact C-N 3.3Å; D426-G429 PolarHBondContact O-N 2.92Å; D426-N1083 PolarHBondContact O-ND2 2.99Å; D426-I1086 HydrophobicContact CB-CD1 3.78Å
427	E	91.2	Very high	89.3	Confident	4 Å²	4	13.2 Å²	13.2	2%	0.019	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-71.8	-26.9	176.1	-70.4	-72.4	147.1	0	0	111.5	T316 T317 L424 G429 Q430 I1026 I1045	T316-E427 WeakPolarHBondContact CA-OE1 3.29Å; T316-E427 WeakPolarHBondContact CB-OE1 3.47Å; T316-E427 HydrophobicContact CG2-CG 3.81Å; T317-E427 WeakPolarHBondContact CA-OE1 3.44Å; T317-E427 WeakPolarHBondContact CB-OE1 3.34Å; T317-E427 PolarHBondContact N-OE1 2.9Å; T317-E427 PolarHBondContact OG1-OE1 2.97Å; T317-E427 PolarHBondContact OG1-OE2 2.91Å; L424-E427 HydrophobicContact CD2-CG 4.29Å; L424-E427 WeakPolarHBondContact O-CB 3.13Å; L424-E427 PolarHBondContact O-N 3.41Å; E427-G429 PolarHBondContact O-N 2.83Å; E427-G429 VanDerWaalsContact O-N 3.15Å; E427-Q430 PolarHBondContact O-N 3.01Å; E427-I1026 WeakPolarHBondContact OE2-CD1 3.22Å; E427-I1026 WeakPolarHBondContact OE2-CG1 3.46Å; E427-I1045 VanDerWaalsContact C-CD1 3.47Å; E427-I1045 HydrophobicContact CB-CD1 3.65Å; E427-I1045 HydrophobicContact CB-CG1 4.13Å
428	L	93	Very high	89.2	Confident	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-56.6	-29.3	174.2	-68.8	172.8	0	0	0	112.1	I402 V425 D426 Q430 I1045 Y1063 L1074 L1075 Y1158	I402-L428 HydrophobicContact CD1-CD1 4.28Å; V425-L428 WeakPolarHBondContact O-CB 3.07Å; D426-L428 VanDerWaalsContact C-N 3.3Å; L428-Q430 VanDerWaalsContact C-N 3.28Å; L428-Q430 PolarHBondContact O-N 3.44Å; L428-I1045 HydrophobicContact CD2-CD1 3.93Å; L428-I1045 HydrophobicContact CD2-CG2 3.97Å; L428-I1045 HydrophobicContact CG-CD1 4.32Å; L428-Y1063 HydrophobicContact CD1-CD2 4.42Å; L428-Y1063 HydrophobicContact CD1-CE1 4.07Å; L428-Y1063 HydrophobicContact CD1-CE2 3.91Å; L428-Y1063 HydrophobicContact CD2-CD2 4.09Å; L428-Y1063 HydrophobicContact CD2-CE2 3.98Å; L428-Y1063 HydrophobicContact CG-CE2 4.02Å; L428-L1074 HydrophobicContact CD1-CD1 3.94Å; L428-L1074 HydrophobicContact CD1-CG 4.24Å; L428-L1075 HydrophobicContact CB-CD2 4.22Å; L428-L1075 HydrophobicContact CD2-CD2 3.83Å; L428-L1075 WeakPolarHBondContact O-CD2 3.36Å; L428-Y1158 PolarHBondContact O-OH 3.12Å
429	G	90.4	Very high	89	Confident	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.06	C	C	.	.	G	3₁₀ helix	trans	-80.6	2.7	176.4	0	0	0	0	0	115.6	D426 E427 G1079 Y1158	D426-G429 PolarHBondContact O-N 2.92Å; E427-G429 PolarHBondContact O-N 2.83Å; E427-G429 VanDerWaalsContact O-N 3.15Å; G429-G1079 WeakPolarHBondContact CA-O 3.05Å; G429-G1079 PolarHBondContact N-O 3.01Å; G429-Y1158 VanDerWaalsContact C-OH 3.22Å
430	Q	89.9	Confident	88.5	Confident	1 Å²	1	10 Å²	10	1%	0.005	6%	0.056	C	C	.	.	G	3₁₀ helix	trans	-128.6	5.2	-173.3	-63.8	-69.3	-39.4	0	0	114	E427 L428 N432 I1026 N1083 Y1158 L1161 H1163 Q1164	E427-Q430 PolarHBondContact O-N 3.01Å; L428-Q430 VanDerWaalsContact C-N 3.28Å; L428-Q430 PolarHBondContact O-N 3.44Å; Q430-N432 PolarHBondContact O-N 2.96Å; Q430-N432 PolarHBondContact O-OD1 2.98Å; Q430-I1026 HydrophobicContact CB-CD1 3.29Å; Q430-I1026 HydrophobicContact CG-CD1 4.21Å; Q430-N1083 WeakPolarHBondContact CG-ND2 3.22Å; Q430-N1083 VanDerWaalsContact NE2-CG 3.29Å; Q430-N1083 PolarHBondContact NE2-ND2 3.32Å; Q430-N1083 PolarHBondContact NE2-OD1 3.4Å; Q430-N1083 VanDerWaalsContact NE2-OD1 3.13Å; Q430-Y1158 PolarHBondContact N-OH 2.98Å; Q430-L1161 PolarHBondContact NE2-O 3.37Å; Q430-L1161 PolarHBondContact OE1-O 3.13Å; Q430-H1163 VanDerWaalsContact OE1-N 3.08Å; Q430-Q1164 HydrophobicContact CG-CG 4.45Å
431	V	91	Very high	88.8	Confident	0 Å²	0	8 Å²	8	0%	0	5%	0.045	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	125	-179.1	-179.9	0	0	0	0	110.7	Y433 I825 I1026 A1028 I1045 L1075 Y1158	V431-Y433 WeakPolarHBondContact CG1-O 3.38Å; V431-I825 HydrophobicContact CG1-CG2 4.31Å; V431-I1026 HydrophobicContact CG2-CG2 4.44Å; V431-A1028 HydrophobicContact CB-CB 4.46Å; V431-A1028 HydrophobicContact CG1-CB 3.59Å; V431-A1028 HydrophobicContact CG2-CB 3.95Å; V431-I1045 HydrophobicContact CG2-CD1 3.86Å; V431-L1075 HydrophobicContact CG2-CD2 3.98Å; V431-Y1158 WeakPolarHBondContact CB-OH 3.48Å; V431-Y1158 PolarHBondContact N-OH 3.45Å
432	N	88.4	Confident	89	Confident	18 Å²	18	6.7 Å²	6.7	10%	0.096	4%	0.037	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	-43.4	177.2	-76.3	86.1	0	0	0	111.7	Q430 Q826 P1025 I1026	Q430-N432 PolarHBondContact O-N 2.96Å; Q430-N432 PolarHBondContact O-OD1 2.98Å; N432-Q826 PolarHBondContact O-N 3.4Å; N432-P1025 HydrophobicContact CB-CB 3.94Å; N432-I1026 PolarHBondContact N-O 3.44Å
433	Y	91.4	Very high	89.1	Confident	16 Å²	16	6 Å²	6	6%	0.063	3%	0.032	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	132.9	-178.7	-68.6	-95	0	0	0	109.3	V431 Q826 W828 V1014 F1018 P1025 I1026 T1027 A1028	V431-Y433 WeakPolarHBondContact CG1-O 3.38Å; Y433-Q826 WeakPolarHBondContact CA-O 3.34Å; Y433-Q826 HydrophobicContact CD1-CB 3.8Å; Y433-Q826 HydrophobicContact CE1-CB 3.9Å; Y433-Q826 HydrophobicContact CE1-CG 4.38Å; Y433-Q826 PolarHBondContact OH-OE1 3.22Å; Y433-W828 HydrophobicContact CD1-CZ2 4.46Å; Y433-W828 AromaticContact CD1-NE1 3.76Å; Y433-W828 HydrophobicContact CE1-CZ2 4.18Å; Y433-W828 AromaticContact CE1-NE1 3.89Å; Y433-V1014 HydrophobicContact CD1-CG1 4.3Å; Y433-V1014 HydrophobicContact CD2-CG1 4.03Å; Y433-V1014 HydrophobicContact CE2-CG1 4.39Å; Y433-V1014 HydrophobicContact CG-CG1 3.99Å; Y433-F1018 HydrophobicContact CE1-CE2 4.36Å; Y433-F1018 HydrophobicContact CE2-CD2 4.41Å; Y433-F1018 HydrophobicContact CE2-CE2 4.34Å; Y433-F1018 AromaticContact CZ-CE2 3.92Å; Y433-P1025 HydrophobicContact CD2-CB 3.63Å; Y433-P1025 HydrophobicContact CD2-CG 4.13Å; Y433-P1025 HydrophobicContact CE2-CB 3.67Å; Y433-P1025 HydrophobicContact CE2-CG 4.05Å; Y433-I1026 PolarHBondContact N-O 2.98Å; Y433-T1027 WeakPolarHBondContact O-CA 3.2Å; Y433-A1028 PolarHBondContact O-N 3.06Å
434	L	94.5	Very high	88.9	Confident	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.036	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	118.8	172.8	176.7	69.6	0	0	0	108.4	L820 I825 Q826 V827 W828 A1028 I1030 L1071	L434-L820 HydrophobicContact CD2-CD1 3.78Å; L434-I825 HydrophobicContact CB-CG2 3.86Å; L434-Q826 PolarHBondContact N-O 3.18Å; L434-V827 HydrophobicContact CB-CG2 4.39Å; L434-V827 HydrophobicContact CD2-CG1 4.36Å; L434-V827 HydrophobicContact CD2-CG2 4.19Å; L434-V827 CarbonylContact O-C 3.49Å; L434-V827 WeakPolarHBondContact O-CA 3.32Å; L434-W828 PolarHBondContact O-N 3.12Å; L434-A1028 CarbonylContact C-O 3.52Å; L434-A1028 WeakPolarHBondContact CA-O 3.39Å; L434-A1028 HydrophobicContact CD1-CB 3.93Å; L434-I1030 HydrophobicContact CD1-CB 4.5Å; L434-I1030 HydrophobicContact CD1-CG2 4.06Å; L434-I1030 HydrophobicContact CG-CG2 4.45Å; L434-L1071 HydrophobicContact CD1-CD2 4.33Å; L434-L1071 HydrophobicContact CD2-CD2 3.61Å
435	F	95.6	Very high	88.1	Confident	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	118.6	170.6	-59.9	-76.9	0	0	0	108.8	W828 L830 V1010 V1011 V1014 T1027 A1028 A1029 I1030 M1039	F435-W828 CarbonylContact C-O 3.46Å; F435-W828 WeakPolarHBondContact CA-O 2.98Å; F435-W828 HydrophobicContact CD1-CB 3.74Å; F435-W828 HydrophobicContact CD1-CE3 4.41Å; F435-W828 HydrophobicContact CD1-CG 4.35Å; F435-W828 HydrophobicContact CE1-CB 4Å; F435-W828 AromaticContact CE1-CD2 3.92Å; F435-W828 HydrophobicContact CE1-CD2 3.92Å; F435-W828 AromaticContact CE1-CE3 3.66Å; F435-W828 HydrophobicContact CE1-CE3 3.66Å; F435-W828 HydrophobicContact CE1-CG 4.12Å; F435-W828 HydrophobicContact CE1-CZ3 4.38Å; F435-L830 HydrophobicContact CB-CD1 4.08Å; F435-L830 HydrophobicContact CB-CG 4.49Å; F435-L830 HydrophobicContact CD1-CD1 3.77Å; F435-L830 HydrophobicContact CD1-CD2 4.44Å; F435-L830 HydrophobicContact CD1-CG 4.16Å; F435-L830 HydrophobicContact CG-CD1 4.21Å; F435-V1010 HydrophobicContact CE1-CG1 4.06Å; F435-V1011 HydrophobicContact CB-CG2 4.31Å; F435-V1011 HydrophobicContact CD1-CG2 4.39Å; F435-V1011 HydrophobicContact CD2-CB 4.36Å; F435-V1011 HydrophobicContact CD2-CG1 4.2Å; F435-V1011 HydrophobicContact CD2-CG2 3.67Å; F435-V1011 HydrophobicContact CE2-CB 4.25Å; F435-V1011 HydrophobicContact CE2-CG1 4.08Å; F435-V1011 HydrophobicContact CE2-CG2 4.02Å; F435-V1011 HydrophobicContact CG-CG2 3.87Å; F435-V1014 HydrophobicContact CE1-CG2 4.2Å; F435-V1014 HydrophobicContact CE2-CB 4.47Å; F435-V1014 HydrophobicContact CE2-CG1 4.4Å; F435-V1014 HydrophobicContact CZ-CB 3.7Å; F435-V1014 HydrophobicContact CZ-CG1 3.84Å; F435-V1014 HydrophobicContact CZ-CG2 3.72Å; F435-T1027 HydrophobicContact CE2-CG2 3.76Å; F435-T1027 HydrophobicContact CZ-CG2 4.48Å; F435-A1028 WeakPolarHBondContact CD2-O 3.42Å; F435-A1028 PolarHBondContact N-O 3.34Å; F435-A1029 HydrophobicContact CB-CB 4.23Å; F435-A1029 CarbonylContact O-C 3.58Å; F435-A1029 VanDerWaalsContact O-CA 3.24Å; F435-A1029 WeakPolarHBondContact O-CA 3.3Å; F435-I1030 PolarHBondContact O-N 3.12Å; F435-M1039 HydrophobicContact CB-SD 4.09Å
436	S	94	Very high	87.3	Confident	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	136.2	177.1	-169.4	0	0	0	0	109.7	W828 V829 L830	S436-W828 PolarHBondContact N-O 2.6Å; S436-V829 CarbonylContact O-C 3.48Å; S436-V829 WeakPolarHBondContact O-CA 3.49Å; S436-L830 PolarHBondContact O-N 3.41Å
437	D	90.3	Very high	86.9	Confident	8 Å²	8	12 Å²	12	4%	0.043	6%	0.063	C	C	.	.			trans	-67.4	169.1	155.5	-169.3	52.6	0	0	0	110.3	T439 T441 L442 K1007 I1030 D1036	D437-T439 PolarHBondContact OD2-N 2.83Å; D437-T441 HydrophobicContact CB-CG2 4.14Å; D437-T441 WeakPolarHBondContact CB-OG1 3.47Å; D437-T441 PolarHBondContact O-OG1 3.38Å; D437-L442 WeakPolarHBondContact O-CG 3.43Å; D437-K1007 IonicContact OD1-NZ 3.89Å; D437-K1007 PolarHBondContact OD1-NZ 2.94Å; D437-I1030 PolarHBondContact N-O 3.02Å; D437-D1036 VanDerWaalsContact CB-OD2 3.28Å; D437-D1036 WeakPolarHBondContact CB-OD2 3.15Å
438	K	86.3	Confident	86.5	Confident	2 Å²	2	13.9 Å²	13.9	1%	0.009	7%	0.073	C	C	.	.	S	Bend	trans	-101	-53.3	176.9	179.5	-149.1	154.3	-179.5	0	111.3	T441 L442 T443 D807 V829 D833 T837 V841	K438-T441 VanDerWaalsContact C-OG1 3.31Å; K438-T441 PolarHBondContact N-OG1 2.87Å; K438-T441 PolarHBondContact O-OG1 3.14Å; K438-L442 WeakPolarHBondContact O-CB 3.39Å; K438-L442 PolarHBondContact O-N 3.17Å; K438-T443 PolarHBondContact O-N 2.7Å; K438-T443 VanDerWaalsContact O-N 3.16Å; K438-D807 IonicContact NZ-OD2 3.12Å; K438-V829 HydrophobicContact CB-CG1 4.17Å; K438-D833 HydrophobicContact CD-CB 4.46Å; K438-D833 WeakPolarHBondContact CD-OD2 3.41Å; K438-D833 WeakPolarHBondContact CE-OD2 3.36Å; K438-D833 IonicContact NZ-OD2 2.76Å; K438-D833 PolarHBondContact NZ-OD2 3.47Å; K438-T837 PolarHBondContact NZ-O 2.86Å; K438-V841 HydrophobicContact CD-CB 4.27Å; K438-V841 HydrophobicContact CD-CG1 4.28Å; K438-V841 HydrophobicContact CG-CB 4.36Å; K438-V841 HydrophobicContact CG-CG1 3.85Å
439	T	80.1	Confident	86.2	Confident	29 Å²	29	14.5 Å²	14.5	18%	0.178	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	133.6	-166.8	-56.1	0	0	0	0	108.1	D437 T441 D1032	D437-T439 PolarHBondContact OD2-N 2.83Å; T439-T441 PolarHBondContact O-N 2.83Å; T439-T441 PolarHBondContact O-OG1 3.22Å; T439-D1032 VanDerWaalsContact O-OD1 3.13Å
440	G	74.7	Confident	85.9	Confident	7 Å²	7	18.2 Å²	18.2	7%	0.072	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.5	-14.7	-179.6	0	0	0	0	0	115.9	T443 Q810 D1032	G440-T443 CarbonylContact C-O 3.56Å; G440-T443 WeakPolarHBondContact CA-O 3.43Å; G440-T443 PolarHBondContact N-O 3.33Å; G440-T443 PolarHBondContact N-OG1 2.64Å; G440-Q810 PolarHBondContact O-NE2 2.88Å; G440-D1032 WeakPolarHBondContact CA-OD2 3.36Å
441	T	86.4	Confident	85.8	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-61.1	175.4	39	0	0	0	0	113	D437 K438 T439 Q810 G1031 D1032 V1049	D437-T441 HydrophobicContact CB-CG2 4.14Å; D437-T441 WeakPolarHBondContact CB-OG1 3.47Å; D437-T441 PolarHBondContact O-OG1 3.38Å; K438-T441 VanDerWaalsContact C-OG1 3.31Å; K438-T441 PolarHBondContact N-OG1 2.87Å; K438-T441 PolarHBondContact O-OG1 3.14Å; T439-T441 PolarHBondContact O-N 2.83Å; T439-T441 PolarHBondContact O-OG1 3.22Å; T441-Q810 PolarHBondContact O-NE2 3.01Å; T441-Q810 VanDerWaalsContact O-NE2 3.09Å; T441-G1031 VanDerWaalsContact CG2-C 3.48Å; T441-G1031 VanDerWaalsContact CG2-CA 3.41Å; T441-D1032 HydrophobicContact CG2-CB 3.96Å; T441-V1049 HydrophobicContact CG2-CB 4.5Å; T441-V1049 HydrophobicContact CG2-CG2 4.18Å
442	L	88.8	Confident	85.7	Confident	1 Å²	1	19.9 Å²	19.9	1%	0.005	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-34	174.1	-63	177.1	0	0	0	111	D437 K438 L809 Q810 V813 L817 V829 F1068	D437-L442 WeakPolarHBondContact O-CG 3.43Å; K438-L442 WeakPolarHBondContact O-CB 3.39Å; K438-L442 PolarHBondContact O-N 3.17Å; L442-L809 WeakPolarHBondContact O-CA 3.48Å; L442-Q810 PolarHBondContact O-N 2.83Å; L442-V813 HydrophobicContact CB-CG1 4.49Å; L442-V813 HydrophobicContact CD2-CG1 3.75Å; L442-L817 HydrophobicContact CD2-CD1 4.25Å; L442-V829 HydrophobicContact CD1-CG1 4.36Å; L442-V829 HydrophobicContact CD1-CG2 4.11Å; L442-F1068 HydrophobicContact CD2-CD1 4.41Å; L442-F1068 HydrophobicContact CD2-CD2 3.95Å; L442-F1068 HydrophobicContact CD2-CE1 4.05Å; L442-F1068 HydrophobicContact CD2-CE2 3.54Å; L442-F1068 HydrophobicContact CD2-CG 4.37Å; L442-F1068 HydrophobicContact CD2-CZ 3.6Å
443	T	86.5	Confident	85.8	Confident	0 Å²	0	19 Å²	19	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	156.1	176.2	72.3	0	0	0	0	111	K438 G440 N445 D807 K808 L809 V841	K438-T443 PolarHBondContact O-N 2.7Å; K438-T443 VanDerWaalsContact O-N 3.16Å; G440-T443 CarbonylContact C-O 3.56Å; G440-T443 WeakPolarHBondContact CA-O 3.43Å; G440-T443 PolarHBondContact N-O 3.33Å; G440-T443 PolarHBondContact N-OG1 2.64Å; T443-N445 PolarHBondContact O-N 2.66Å; T443-D807 VanDerWaalsContact CB-OD1 3.22Å; T443-D807 WeakPolarHBondContact CB-OD1 3.48Å; T443-D807 WeakPolarHBondContact CG2-OD1 3.4Å; T443-D807 PolarHBondContact OG1-OD1 2.75Å; T443-K808 CarbonylContact C-O 3.2Å; T443-K808 WeakPolarHBondContact CA-O 3.38Å; T443-L809 HydrophobicContact CG2-CD2 4.18Å; T443-V841 HydrophobicContact CG2-CG1 3.81Å; T443-V841 HydrophobicContact CG2-CG2 4.39Å
444	L	80.4	Confident	85.6	Confident	45 Å²	45	18.4 Å²	18.4	24%	0.236	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-3.8	171.4	-72.1	167.9	0	0	0	112.4	E446 K808 Q810	L444-E446 HydrophobicContact CB-CB 4.25Å; L444-E446 HydrophobicContact CB-CG 4.21Å; L444-E446 PolarHBondContact O-N 3.2Å; L444-K808 HydrophobicContact CD1-CD 3.97Å; L444-K808 HydrophobicContact CD1-CG 4.13Å; L444-K808 PolarHBondContact N-O 2.95Å; L444-Q810 HydrophobicContact CD2-CB 4.43Å; L444-Q810 HydrophobicContact CD2-CG 3.77Å; L444-Q810 HydrophobicContact CG-CB 4.5Å; L444-Q810 HydrophobicContact CG-CG 3.97Å
445	N	72.8	Confident	85.2	Confident	54 Å²	54	18.5 Å²	18.5	29%	0.289	9%	0.092	S	C	.	.	E	Extended strand (participates in β ladder)	trans	53.1	32.6	-167.2	-151	11.4	0	0	0	112.2	T443 E1053	T443-N445 PolarHBondContact O-N 2.66Å; N445-E1053 PolarHBondContact ND2-OE1 3Å
446	E	76.9	Confident	84.5	Confident	55 Å²	55	24 Å²	24	26%	0.257	12%	0.121	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	112.5	173.7	-74.4	177.3	-176.6	0	0	107.9	L444 K808 K1052	L444-E446 HydrophobicContact CB-CB 4.25Å; L444-E446 HydrophobicContact CB-CG 4.21Å; L444-E446 PolarHBondContact O-N 3.2Å; E446-K808 HydrophobicContact CB-CB 4.48Å; E446-K808 WeakPolarHBondContact O-CB 3.3Å; E446-K808 PolarHBondContact O-N 3.24Å; E446-K808 VanDerWaalsContact O-N 3.11Å; E446-K808 IonicContact OE2-NZ 2.77Å; E446-K1052 IonicContact OE1-NZ 3.72Å; E446-K1052 PolarHBondContact OE1-NZ 3.35Å
447	M	81.8	Confident	83.8	Confident	12 Å²	12	26.3 Å²	26.3	6%	0.059	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124.6	177.7	-61.2	-54.9	-70.7	0	0	108.6	P634 D635 A638 R750 V805 E806 D807	M447-P634 HydrophobicContact CB-CB 4.37Å; M447-P634 HydrophobicContact CG-CB 3.78Å; M447-P634 HydrophobicContact CG-CG 4.09Å; M447-D635 WeakPolarHBondContact CE-OD1 3.35Å; M447-A638 HydrophobicContact CB-CB 3.74Å; M447-A638 WeakPolarHBondContact O-CB 3.32Å; M447-R750 VanDerWaalsContact CE-CD 3.48Å; M447-R750 HydrophobicContact CE-CG 4.21Å; M447-R750 VanDerWaalsContact CE-CZ 3.44Å; M447-V805 HydrophobicContact CB-CG1 3.94Å; M447-V805 HydrophobicContact CE-CB 4.43Å; M447-V805 HydrophobicContact CE-CG1 3.73Å; M447-E806 WeakPolarHBondContact CA-O 3.24Å; M447-D807 HydrophobicContact CE-CB 3.96Å; M447-D807 HydrophobicContact SD-CB 3.62Å
448	N	83.8	Confident	83.4	Confident	43 Å²	43	29.9 Å²	29.9	23%	0.23	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.9	179.5	-74.8	-13.7	0	0	0	110.4	Y450 V805 E806	N448-Y450 PolarHBondContact O-N 2.97Å; N448-Y450 VanDerWaalsContact O-N 3.14Å; N448-V805 CarbonylContact O-C 3.55Å; N448-V805 WeakPolarHBondContact O-CA 3.37Å; N448-V805 WeakPolarHBondContact O-CG1 3.16Å; N448-E806 PolarHBondContact N-O 3.04Å; N448-E806 PolarHBondContact O-N 3.45Å
449	L	86.4	Confident	83.1	Confident	13 Å²	13	33.5 Å²	33.5	7%	0.068	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	111.5	168.6	-175.8	57	0	0	0	108.8	I452 L463 L639 T803 V805	L449-I452 HydrophobicContact CD1-CG1 3.97Å; L449-I452 HydrophobicContact CD2-CD1 3.61Å; L449-I452 HydrophobicContact CD2-CG1 3.98Å; L449-I452 HydrophobicContact CG-CD1 4.22Å; L449-I452 HydrophobicContact CG-CG1 4.07Å; L449-L463 HydrophobicContact CB-CD1 4.38Å; L449-L463 HydrophobicContact CD2-CD1 3.95Å; L449-L463 HydrophobicContact CG-CD1 3.68Å; L449-L463 WeakPolarHBondContact O-CB 3.04Å; L449-L639 HydrophobicContact CD1-CD2 3.83Å; L449-L639 HydrophobicContact CD2-CD2 4.45Å; L449-T803 HydrophobicContact CD1-CG2 4.05Å; L449-V805 HydrophobicContact CD1-CG2 4.31Å
450	Y	83.5	Confident	83.3	Confident	78 Å²	78	33.2 Å²	33.2	31%	0.306	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	-39.5	-172.2	-175.4	-111.3	0	0	0	112.6	N448 V462 L463 L749 G804 E806	N448-Y450 PolarHBondContact O-N 2.97Å; N448-Y450 VanDerWaalsContact O-N 3.14Å; Y450-V462 HydrophobicContact CE1-CG1 4.38Å; Y450-V462 HydrophobicContact CE2-CG1 4.31Å; Y450-V462 WeakPolarHBondContact O-CA 3.17Å; Y450-L463 WeakPolarHBondContact CD2-O 3.49Å; Y450-L463 PolarHBondContact O-N 2.67Å; Y450-L749 HydrophobicContact CD1-CD1 3.95Å; Y450-L749 HydrophobicContact CD1-CD2 3.8Å; Y450-L749 HydrophobicContact CG-CD2 4.34Å; Y450-G804 PolarHBondContact N-O 3.01Å; Y450-E806 HydrophobicContact CG-CB 4.43Å
451	K	88.4	Confident	83.6	Confident	36 Å²	36	33.6 Å²	33.6	16%	0.157	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	145.9	175.7	-65.3	-171.6	179.3	-178.6	0	111.7	V460 Y461 V462 F744 L749 G804	K451-V460 HydrophobicContact CB-CG1 4.39Å; K451-V460 HydrophobicContact CD-CG1 4.34Å; K451-Y461 CarbonylContact C-O 3.55Å; K451-Y461 VanDerWaalsContact CA-O 3.3Å; K451-Y461 WeakPolarHBondContact CA-O 3.17Å; K451-V462 HydrophobicContact CD-CG2 4.36Å; K451-V462 HydrophobicContact CG-CG1 4.47Å; K451-V462 HydrophobicContact CG-CG2 4.17Å; K451-F744 HydrophobicContact CB-CE1 4.04Å; K451-F744 HydrophobicContact CB-CE2 3.95Å; K451-F744 HydrophobicContact CB-CZ 3.66Å; K451-F744 HydrophobicContact CD-CD1 4.14Å; K451-F744 HydrophobicContact CD-CE1 3.76Å; K451-F744 HydrophobicContact CD-CZ 4.27Å; K451-L749 HydrophobicContact CB-CD1 4.22Å; K451-L749 HydrophobicContact CD-CD1 3.89Å; K451-L749 HydrophobicContact CG-CD1 4.02Å; K451-G804 PolarHBondContact N-O 3.47Å; K451-G804 PolarHBondContact O-N 2.94Å
452	I	88.9	Confident	83.2	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	122.2	169.3	-55.5	175.8	0	0	0	107.8	L449 V460 Y461 L463 L597 L600 L646 I802 T803	L449-I452 HydrophobicContact CD1-CG1 3.97Å; L449-I452 HydrophobicContact CD2-CD1 3.61Å; L449-I452 HydrophobicContact CD2-CG1 3.98Å; L449-I452 HydrophobicContact CG-CD1 4.22Å; L449-I452 HydrophobicContact CG-CG1 4.07Å; I452-V460 CarbonylContact O-C 3.6Å; I452-V460 WeakPolarHBondContact O-CA 3.44Å; I452-Y461 PolarHBondContact N-O 3.42Å; I452-Y461 PolarHBondContact O-N 3.27Å; I452-L463 HydrophobicContact CD1-CD1 3.84Å; I452-L463 HydrophobicContact CG1-CD1 3.98Å; I452-L597 HydrophobicContact CD1-CD2 3.98Å; I452-L600 HydrophobicContact CD1-CD1 4.28Å; I452-L646 HydrophobicContact CD1-CD1 4.33Å; I452-I802 CarbonylContact C-O 3.47Å; I452-I802 WeakPolarHBondContact CA-O 3.17Å; I452-T803 HydrophobicContact CG1-CG2 4.34Å
453	A	89.4	Confident	82.2	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	127.5	169.5	0	0	0	0	0	109.7	K459 V460 Y740 F744 S801 I802	A453-K459 WeakPolarHBondContact CA-O 3.47Å; A453-V460 HydrophobicContact CB-CG2 3.97Å; A453-Y740 HydrophobicContact CB-CD2 3.95Å; A453-Y740 HydrophobicContact CB-CE2 4.44Å; A453-Y740 HydrophobicContact CB-CG 4.08Å; A453-F744 HydrophobicContact CB-CE2 4.14Å; A453-F744 HydrophobicContact CB-CZ 3.88Å; A453-S801 CarbonylContact O-C 3.45Å; A453-S801 VanDerWaalsContact O-CA 3.26Å; A453-S801 WeakPolarHBondContact O-CA 3.25Å; A453-S801 WeakPolarHBondContact O-CB 3.4Å; A453-I802 HydrophobicContact CB-CB 4.27Å; A453-I802 PolarHBondContact N-O 3.01Å; A453-I802 PolarHBondContact O-N 3.28Å
454	I	88.5	Confident	80.8	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	118.4	172.7	-55.3	-178	0	0	0	108.1	I457 D458 K459 Y461 E592 L593	I454-I457 HydrophobicContact CD1-CD1 4.29Å; I454-I457 HydrophobicContact CG2-CD1 4.13Å; I454-I457 HydrophobicContact CG2-CG1 4.21Å; I454-D458 PolarHBondContact O-N 2.82Å; I454-D458 VanDerWaalsContact O-N 3.14Å; I454-K459 PolarHBondContact N-O 3.04Å; I454-K459 PolarHBondContact O-N 2.86Å; I454-Y461 HydrophobicContact CD1-CD2 4.12Å; I454-Y461 HydrophobicContact CD1-CE2 3.52Å; I454-Y461 HydrophobicContact CG1-CD2 4.24Å; I454-Y461 HydrophobicContact CG1-CE2 3.96Å; I454-E592 HydrophobicContact CG2-CB 4.1Å; I454-L593 VanDerWaalsContact CD1-CA 3.44Å; I454-L593 HydrophobicContact CD1-CB 3.51Å; I454-L593 HydrophobicContact CD1-CD1 3.77Å; I454-L593 HydrophobicContact CD1-CG 4.18Å
455	L	84.8	Confident	79.4	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.016	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-34	-171.6	-64.4	171.9	0	0	0	112.5	L733 L736 A737 Y740 L799 V800 I802	L455-L733 HydrophobicContact CB-CD2 4.22Å; L455-L736 HydrophobicContact CD2-CD2 3.35Å; L455-A737 HydrophobicContact CD1-CB 4.21Å; L455-A737 HydrophobicContact CD2-CB 3.84Å; L455-Y740 HydrophobicContact CD2-CD2 4.44Å; L455-L799 HydrophobicContact CD1-CB 3.48Å; L455-L799 VanDerWaalsContact CD1-CB 3.48Å; L455-L799 HydrophobicContact CD1-CD1 4.36Å; L455-V800 PolarHBondContact N-O 2.97Å; L455-I802 HydrophobicContact CD1-CG1 4.5Å; L455-I802 HydrophobicContact CD2-CD1 3.75Å; L455-I802 HydrophobicContact CD2-CG1 4.32Å
456	N	81	Confident	77.7	Confident	114 Å²	114	44.2 Å²	44.2	61%	0.61	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-27.8	-177.8	-75.3	-3	0	0	0	114.2
457	I	80.5	Confident	75.4	Confident	49 Å²	49	50.8 Å²	50.8	25%	0.251	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-6.6	-179.4	-44.7	161.6	0	0	0	111.4	I454 K459 P590 E592	I454-I457 HydrophobicContact CD1-CD1 4.29Å; I454-I457 HydrophobicContact CG2-CD1 4.13Å; I454-I457 HydrophobicContact CG2-CG1 4.21Å; I457-K459 VanDerWaalsContact C-N 3.3Å; I457-K459 HydrophobicContact CB-CG 4.45Å; I457-K459 HydrophobicContact CG2-CD 3.68Å; I457-K459 HydrophobicContact CG2-CG 3.98Å; I457-K459 PolarHBondContact O-N 3.36Å; I457-P590 HydrophobicContact CD1-CB 4.17Å; I457-E592 HydrophobicContact CD1-CB 3.65Å; I457-E592 HydrophobicContact CD1-CG 3.96Å; I457-E592 WeakPolarHBondContact CD1-OE2 3.38Å; I457-E592 HydrophobicContact CG1-CB 4.16Å; I457-E592 HydrophobicContact CG1-CG 4.05Å
458	D	82.2	Confident	72.8	Confident	84 Å²	84	56.3 Å²	56.3	45%	0.449	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	47	-172.8	-162	21.4	0	0	0	112.9	I454 L736 Y740	I454-D458 PolarHBondContact O-N 2.82Å; I454-D458 VanDerWaalsContact O-N 3.14Å; D458-L736 HydrophobicContact CB-CD1 4.25Å; D458-L736 WeakPolarHBondContact OD1-CD1 3.4Å; D458-Y740 VanDerWaalsContact OD1-CE2 3.23Å; D458-Y740 WeakPolarHBondContact OD1-CE2 3.34Å; D458-Y740 VanDerWaalsContact OD1-CZ 3.23Å; D458-Y740 PolarHBondContact OD1-OH 3.16Å
459	K	80	Confident	70.1	Confident	77 Å²	77	62.5 Å²	62.5	34%	0.335	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	139.5	-178.7	-74.5	-177.4	-175.3	177.6	0	112	A453 I454 I457 Y461	A453-K459 WeakPolarHBondContact CA-O 3.47Å; I454-K459 PolarHBondContact N-O 3.04Å; I454-K459 PolarHBondContact O-N 2.86Å; I457-K459 VanDerWaalsContact C-N 3.3Å; I457-K459 HydrophobicContact CB-CG 4.45Å; I457-K459 HydrophobicContact CG2-CD 3.68Å; I457-K459 HydrophobicContact CG2-CG 3.98Å; I457-K459 PolarHBondContact O-N 3.36Å; K459-Y461 HydrophobicContact CB-CE2 4.02Å
460	V	82.6	Confident	67.2	Low	24 Å²	24	68.2 Å²	68.2	15%	0.145	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.4	175	-178.4	0	0	0	0	110.1	K451 I452 A453 Y740 F744	K451-V460 HydrophobicContact CB-CG1 4.39Å; K451-V460 HydrophobicContact CD-CG1 4.34Å; I452-V460 CarbonylContact O-C 3.6Å; I452-V460 WeakPolarHBondContact O-CA 3.44Å; A453-V460 HydrophobicContact CB-CG2 3.97Å; V460-Y740 HydrophobicContact CG2-CD1 3.9Å; V460-Y740 HydrophobicContact CG2-CE1 3.5Å; V460-Y740 VanDerWaalsContact CG2-CE1 3.5Å; V460-F744 HydrophobicContact CG1-CE1 3.96Å; V460-F744 HydrophobicContact CG1-CZ 3.79Å; V460-F744 HydrophobicContact CG2-CZ 4.39Å
461	Y	81	Confident	64.5	Low	15 Å²	15	68.9 Å²	68.9	6%	0.059	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	133.5	174.4	-62.3	-91.6	0	0	0	109.3	K451 I452 I454 K459 I516 V518 P590 L593	K451-Y461 CarbonylContact C-O 3.55Å; K451-Y461 VanDerWaalsContact CA-O 3.3Å; K451-Y461 WeakPolarHBondContact CA-O 3.17Å; I452-Y461 PolarHBondContact N-O 3.42Å; I452-Y461 PolarHBondContact O-N 3.27Å; I454-Y461 HydrophobicContact CD1-CD2 4.12Å; I454-Y461 HydrophobicContact CD1-CE2 3.52Å; I454-Y461 HydrophobicContact CG1-CD2 4.24Å; I454-Y461 HydrophobicContact CG1-CE2 3.96Å; K459-Y461 HydrophobicContact CB-CE2 4.02Å; Y461-I516 HydrophobicContact CD1-CG2 4.29Å; Y461-V518 HydrophobicContact CD1-CG2 4.05Å; Y461-V518 HydrophobicContact CE1-CG2 3.92Å; Y461-P590 VanDerWaalsContact OH-CG 3.26Å; Y461-P590 WeakPolarHBondContact OH-CG 3.49Å; Y461-L593 HydrophobicContact CD1-CD2 4.24Å; Y461-L593 HydrophobicContact CD2-CD1 4.35Å; Y461-L593 HydrophobicContact CE1-CD2 4.02Å; Y461-L593 HydrophobicContact CE2-CD2 4.48Å
462	V	78.8	Confident	61.6	Low	19 Å²	19	73.2 Å²	73.2	12%	0.115	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	128.1	175.9	-173.7	0	0	0	0	109.3	Y450 K451 G517 V519	Y450-V462 HydrophobicContact CE1-CG1 4.38Å; Y450-V462 HydrophobicContact CE2-CG1 4.31Å; Y450-V462 WeakPolarHBondContact O-CA 3.17Å; K451-V462 HydrophobicContact CD-CG2 4.36Å; K451-V462 HydrophobicContact CG-CG1 4.47Å; K451-V462 HydrophobicContact CG-CG2 4.17Å; V462-G517 PolarHBondContact N-O 3.12Å; V462-G517 VanDerWaalsContact N-O 3.15Å; V462-G517 PolarHBondContact O-N 3.07Å; V462-G517 VanDerWaalsContact O-N 3.1Å; V462-V519 HydrophobicContact CG2-CG2 3.98Å
463	L	68.8	Low	58.7	Low	23 Å²	23	79.5 Å²	79.5	12%	0.12	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	96.4	-177.8	-65.7	153.2	0	0	0	107.5	L449 Y450 I452 I516 L646	L449-L463 HydrophobicContact CB-CD1 4.38Å; L449-L463 HydrophobicContact CD2-CD1 3.95Å; L449-L463 HydrophobicContact CG-CD1 3.68Å; L449-L463 WeakPolarHBondContact O-CB 3.04Å; Y450-L463 WeakPolarHBondContact CD2-O 3.49Å; Y450-L463 PolarHBondContact O-N 2.67Å; I452-L463 HydrophobicContact CD1-CD1 3.84Å; I452-L463 HydrophobicContact CG1-CD1 3.98Å; L463-I516 HydrophobicContact CD2-CG1 4.45Å; L463-L646 HydrophobicContact CD1-CD1 4.25Å; L463-L646 HydrophobicContact CD2-CD1 3.7Å; L463-L646 HydrophobicContact CD2-CD2 3.61Å; L463-L646 HydrophobicContact CD2-CG 3.87Å
464	S	56.6	Low	55.7	Low	42 Å²	42	86.6 Å²	86.6	29%	0.294	45%	0.446	S	S	.	.			trans	-117.6	117.9	179.2	63.1	0	0	0	0	110.7	Q466	S464-Q466 PolarHBondContact O-N 2.82Å
465	D	50.1	Low	52.9	Low	89 Å²	89	93.1 Å²	93.1	48%	0.476	48%	0.48	S	S	.	.	S	Bend	trans	-74.6	3.8	173.2	-75	-23.7	0	0	0	113.4	H515 K645	D465-H515 IonicContact OD1-CE1 3.16Å; D465-H515 PolarHBondContact OD1-CE1 3.13Å; D465-H515 IonicContact OD1-CG 3.61Å; D465-H515 IonicContact OD1-ND1 3.51Å; D465-H515 PolarHBondContact OD1-ND1 2.84Å; D465-K645 IonicContact OD1-NZ 3.5Å; D465-K645 IonicContact OD2-NZ 2.68Å; D465-K645 PolarHBondContact OD2-NZ 2.93Å
466	Q	37.6	Very low	50.2	Low	149 Å²	149	101.2 Å²	101.2	70%	0.696	52%	0.518	S	S	*	.	S	Bend	trans	-114.5	123	-177	-67.6	-177.7	-11.9	0	0	109.8	S464 L468	S464-Q466 PolarHBondContact O-N 2.82Å; Q466-L468 PolarHBondContact O-N 2.77Å; Q466-L468 VanDerWaalsContact O-N 3.09Å
467	K	29.2	Very low	47.6	Very low	193 Å²	193	101 Å²	101	84%	0.839	51%	0.509	S	S	*	.			trans	-43.2	122.5	151.5	-74.1	175.8	178.6	171.6	0	105.8	Q469	K467-Q469 PolarHBondContact O-N 3.28Å
468	L	26.7	Very low	45.3	Very low	129 Å²	129	105.9 Å²	105.9	68%	0.675	54%	0.536	S	S	*	.			trans	-45.1	88.1	168.5	-97.8	134.1	0	0	0	109	Q466 N470 T471	Q466-L468 PolarHBondContact O-N 2.77Å; Q466-L468 VanDerWaalsContact O-N 3.09Å; L468-N470 PolarHBondContact O-N 3.32Å; L468-T471 HydrophobicContact CD2-CG2 4.2Å
469	Q	26.5	Very low	42.9	Very low	173 Å²	173	105.4 Å²	105.4	81%	0.808	53%	0.533	S	S	*	.			trans	-92.4	95.6	168.2	-85.8	-173.4	-23.8	0	0	103.8	K467	K467-Q469 PolarHBondContact O-N 3.28Å
470	N	25.9	Very low	40.5	Very low	133 Å²	133	107.5 Å²	107.5	71%	0.711	55%	0.548	S	S	*	.			trans	51.2	74.8	161.8	-58.5	-9.5	0	0	0	114.9	L468 N472	L468-N470 PolarHBondContact O-N 3.32Å; N470-N472 PolarHBondContact O-N 2.71Å
471	T	26.2	Very low	38.1	Very low	91 Å²	91	114.4 Å²	114.4	56%	0.558	58%	0.579	S	S	*	*			trans	-65.9	82.8	140.6	46.7	0	0	0	0	107.3	L468 D473	L468-T471 HydrophobicContact CD2-CG2 4.2Å; T471-D473 PolarHBondContact O-N 3.27Å
472	N	27.5	Very low	35.8	Very low	128 Å²	128	120 Å²	120	68%	0.684	61%	0.61	S	S	*	*			trans	-76.2	65.7	153.5	-74.3	-5.4	0	0	0	106.8	N470 D474	N470-N472 PolarHBondContact O-N 2.71Å; N472-D474 VanDerWaalsContact C-N 3.27Å
473	D	28.5	Very low	33.4	Very low	133 Å²	133	127.2 Å²	127.2	71%	0.711	64%	0.642	S	S	*	*			trans	-99.5	41.9	164.6	-82.9	-28.9	0	0	0	108.8	T471 N475	T471-D473 PolarHBondContact O-N 3.27Å; D473-N475 VanDerWaalsContact C-N 3.28Å; D473-N475 PolarHBondContact O-N 3.41Å
474	D	27.3	Very low	31.6	Very low	148 Å²	148	133 Å²	133	79%	0.791	67%	0.673	S	S	*	*			trans	-93	65.7	164.4	-70.3	-21.1	0	0	0	108.3	N472 H476	N472-D474 VanDerWaalsContact C-N 3.27Å; D474-H476 VanDerWaalsContact C-N 3.33Å
475	N	28	Very low	30.3	Very low	139 Å²	139	136.4 Å²	136.4	74%	0.743	68%	0.684	S	S	*	*			trans	-101.6	62.2	159.2	-75.8	-48.7	0	0	0	108.1	D473	D473-N475 VanDerWaalsContact C-N 3.28Å; D473-N475 PolarHBondContact O-N 3.41Å
476	H	30.1	Very low	29.3	Very low	174 Å²	174	141 Å²	141	81%	0.806	70%	0.703	S	S	*	*			trans	-79.8	117.7	159.2	-119.8	41.8	0	0	0	107.8	D474	D474-H476 VanDerWaalsContact C-N 3.33Å
477	Y	26.3	Very low	29.1	Very low	108 Å²	108	143.3 Å²	143.3	42%	0.424	71%	0.71	S	S	.	*			trans	-63.2	128.3	163.2	-71.9	-102.2	0	0	0	107.5	Y535 F537	Y477-Y535 AromaticContact CD1-CD1 3.8Å; Y477-Y535 HydrophobicContact CD1-CD1 3.8Å; Y477-Y535 HydrophobicContact CD1-CE1 4.23Å; Y477-Y535 HydrophobicContact CD2-CD1 4.25Å; Y477-Y535 AromaticContact CD2-CE1 3.87Å; Y477-Y535 HydrophobicContact CD2-CE1 3.87Å; Y477-Y535 HydrophobicContact CE1-CD1 4.27Å; Y477-Y535 HydrophobicContact CE2-CE1 4.47Å; Y477-Y535 AromaticContact CG-CD1 3.79Å; Y477-Y535 HydrophobicContact CG-CD1 3.79Å; Y477-Y535 AromaticContact CG-CE1 3.74Å; Y477-Y535 HydrophobicContact CG-CE1 3.74Å; Y477-F537 HydrophobicContact CE1-CD2 4.11Å; Y477-F537 HydrophobicContact CE1-CE1 4.27Å; Y477-F537 AromaticContact CE1-CE2 3.83Å; Y477-F537 HydrophobicContact CE1-CE2 3.83Å; Y477-F537 HydrophobicContact CE1-CG 4.44Å; Y477-F537 AromaticContact CE1-CZ 3.92Å; Y477-F537 HydrophobicContact CE1-CZ 3.92Å; Y477-F537 VanDerWaalsContact OH-CZ 3.3Å; Y477-F537 WeakPolarHBondContact OH-CZ 3.45Å
478	D	31.6	Very low	29.2	Very low	153 Å²	153	140.4 Å²	140.4	82%	0.818	70%	0.698	S	S	*	*			trans	-147.4	125.5	151.8	-89.4	-35.6	0	0	0	109.5
479	D	32	Very low	29.6	Very low	73 Å²	73	137.4 Å²	137.4	39%	0.39	68%	0.682	S	S	.	*			trans	-66.3	156.7	179.8	-83.9	-43.3	0	0	0	112.2	G536	D479-G536 VanDerWaalsContact OD1-C 3.31Å; D479-G536 WeakPolarHBondContact OD1-CA 3.32Å; D479-G536 PolarHBondContact OD1-N 3.44Å; D479-G536 PolarHBondContact OD2-N 3.26Å; D479-G536 VanDerWaalsContact OD2-N 3.13Å
480	D	29.4	Very low	30	Very low	121 Å²	121	137.1 Å²	137.1	65%	0.647	68%	0.678	S	S	*	*			trans	-26.4	136.4	171	-55.6	-44.9	0	0	0	117.2
481	H	31.5	Very low	30.3	Very low	169 Å²	169	138.4 Å²	138.4	78%	0.782	68%	0.678	S	S	*	*				175.8	121.1	123.9	-93.2	-68.4	0	0	0	113.2
482	D	32.7	Very low	30.7	Very low	133 Å²	133	140.6 Å²	140.6	71%	0.711	68%	0.679	S	S	*	*			trans	65.1	119.1	140.5	-56.8	-36	0	0	0	123.2
483	H	28.4	Very low	31.1	Very low	170 Å²	170	142.9 Å²	142.9	79%	0.787	68%	0.678	S	S	*	*			trans	3.4	129.5	147.8	-71.7	-78	0	0	0	119.4
484	D	31.3	Very low	31.3	Very low	145 Å²	145	142.8 Å²	142.8	78%	0.775	67%	0.674	S	S	*	*			trans	135.6	21.5	143	-71	-17.4	0	0	0	117.6
485	H	29.4	Very low	31.6	Very low	114 Å²	114	143 Å²	143	53%	0.528	67%	0.668	S	S	.	*			trans	-132.8	37.7	-175.7	-85.1	-18.4	0	0	0	119.4	K487 K488	H485-K487 VanDerWaalsContact C-N 3.25Å; H485-K487 PolarHBondContact O-N 2.83Å; H485-K487 VanDerWaalsContact O-N 3.15Å; H485-K488 PolarHBondContact CE1-NZ 3.3Å; H485-K488 PolarHBondContact NE2-NZ 3.34Å; H485-K488 PolarHBondContact O-N 3.11Å
486	E	29.5	Very low	32	Very low	186 Å²	186	140.5 Å²	140.5	87%	0.869	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	0.3	176.4	-139	178	-173.7	0	0	116.1
487	K	32.8	Very low	32.4	Very low	197 Å²	197	135.8 Å²	135.8	86%	0.857	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	-8.8	172.2	-79	-177.5	179.5	175.3	0	114.8	H485	H485-K487 VanDerWaalsContact C-N 3.25Å; H485-K487 PolarHBondContact O-N 2.83Å; H485-K487 VanDerWaalsContact O-N 3.15Å
488	K	31.4	Very low	32.7	Very low	131 Å²	131	135.5 Å²	135.5	57%	0.57	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-25.2	176.2	-77.7	-177.5	-176.6	169.4	0	112.7	H485 K490 K491 K492	H485-K488 PolarHBondContact CE1-NZ 3.3Å; H485-K488 PolarHBondContact NE2-NZ 3.34Å; H485-K488 PolarHBondContact O-N 3.11Å; K488-K490 PolarHBondContact O-N 3.27Å; K488-K491 PolarHBondContact O-N 3.28Å; K488-K492 PolarHBondContact O-N 3.45Å
489	D	35.1	Very low	32.8	Very low	67 Å²	67	134 Å²	134	36%	0.358	63%	0.632	S	S	.	*	H	α-helix	trans	-75.3	-21.4	-179.7	-73.7	-18.4	0	0	0	114.7	K491 K492 R493	D489-K491 VanDerWaalsContact C-N 3.33Å; D489-K492 PolarHBondContact O-N 3.45Å; D489-R493 VanDerWaalsContact O-CB 3.26Å; D489-R493 WeakPolarHBondContact O-CB 3.09Å; D489-R493 WeakPolarHBondContact O-CG 3.36Å; D489-R493 PolarHBondContact O-N 2.72Å
490	K	34.8	Very low	33.1	Very low	167 Å²	167	133 Å²	133	73%	0.726	63%	0.63	S	S	*	*	H	α-helix	trans	-67.4	-31.5	167.8	-85.5	-176.2	174.6	178.9	0	112.8	K488 E494	K488-K490 PolarHBondContact O-N 3.27Å; K490-E494 PolarHBondContact O-N 3.31Å
491	K	33.4	Very low	33.4	Very low	160 Å²	160	131 Å²	131	70%	0.696	62%	0.619	S	S	*	*	H	α-helix	trans	-84.3	-20.5	176.4	-78.4	-175.6	175	-179.5	0	113.8	K488 D489	K488-K491 PolarHBondContact O-N 3.28Å; D489-K491 VanDerWaalsContact C-N 3.33Å
492	K	34.7	Very low	33.5	Very low	136 Å²	136	131.2 Å²	131.2	59%	0.591	61%	0.613	S	S	*	*	H	α-helix	trans	-81.2	-42.4	170.7	-114	-178.4	175.3	-173.2	0	111.4	K488 D489 E494 K495 D496	K488-K492 PolarHBondContact O-N 3.45Å; D489-K492 PolarHBondContact O-N 3.45Å; K492-E494 PolarHBondContact O-N 2.67Å; K492-K495 WeakPolarHBondContact O-CA 3.45Å; K492-K495 PolarHBondContact O-N 3.42Å; K492-D496 PolarHBondContact O-N 3.09Å
493	R	34.1	Very low	33.6	Very low	176 Å²	176	129.8 Å²	129.8	66%	0.664	61%	0.605	S	S	*	*	H	α-helix	trans	-61.9	-26.7	174.2	-70.3	174	-159.5	-171.9	7.2	113.6	D489 T497	D489-R493 VanDerWaalsContact O-CB 3.26Å; D489-R493 WeakPolarHBondContact O-CB 3.09Å; D489-R493 WeakPolarHBondContact O-CG 3.36Å; D489-R493 PolarHBondContact O-N 2.72Å; R493-T497 WeakPolarHBondContact O-CB 3.39Å; R493-T497 WeakPolarHBondContact O-CG2 3.38Å; R493-T497 PolarHBondContact O-N 3.48Å; R493-T497 PolarHBondContact O-OG1 2.83Å
494	E	33.2	Very low	33.9	Very low	132 Å²	132	127.1 Å²	127.1	62%	0.617	59%	0.591	S	S	*	*	H	α-helix	trans	-79.9	-20.8	170.4	-80.5	179.8	164	0	0	114.3	K490 K492 T497 N498	K490-E494 PolarHBondContact O-N 3.31Å; K492-E494 PolarHBondContact O-N 2.67Å; E494-T497 VanDerWaalsContact CA-OG1 3.31Å; E494-T497 WeakPolarHBondContact CA-OG1 3.4Å; E494-T497 PolarHBondContact O-OG1 2.7Å; E494-N498 PolarHBondContact O-ND2 3.4Å
495	K	34.2	Very low	33.9	Very low	152 Å²	152	125.2 Å²	125.2	66%	0.661	58%	0.578	S	S	*	*	H	α-helix	trans	-85.9	-36.4	173.8	-79.8	-177.1	174.9	-176.7	0	111.9	K492 N498 Q499	K492-K495 WeakPolarHBondContact O-CA 3.45Å; K492-K495 PolarHBondContact O-N 3.42Å; K495-N498 PolarHBondContact O-N 3.49Å; K495-Q499 PolarHBondContact O-N 2.62Å
496	D	36.7	Very low	34	Very low	86 Å²	86	124.4 Å²	124.4	46%	0.46	58%	0.576	S	S	.	*	H	α-helix	trans	-77.2	-29.9	179.6	-60.9	-22.8	0	0	0	112	K492 N498 Q499 S500	K492-D496 PolarHBondContact O-N 3.09Å; D496-N498 VanDerWaalsContact C-N 3.34Å; D496-Q499 PolarHBondContact O-N 3.5Å; D496-S500 VanDerWaalsContact O-CB 3.3Å; D496-S500 WeakPolarHBondContact O-CB 3.35Å; D496-S500 PolarHBondContact O-N 3.1Å
497	T	37.5	Very low	34.1	Very low	75 Å²	75	120.9 Å²	120.9	46%	0.46	56%	0.563	S	S	.	*	H	α-helix	trans	-67.5	-33.3	167	40	0	0	0	0	112.1	R493 E494 N501	R493-T497 WeakPolarHBondContact O-CB 3.39Å; R493-T497 WeakPolarHBondContact O-CG2 3.38Å; R493-T497 PolarHBondContact O-N 3.48Å; R493-T497 PolarHBondContact O-OG1 2.83Å; E494-T497 VanDerWaalsContact CA-OG1 3.31Å; E494-T497 WeakPolarHBondContact CA-OG1 3.4Å; E494-T497 PolarHBondContact O-OG1 2.7Å; T497-N501 WeakPolarHBondContact O-CB 3.22Å; T497-N501 PolarHBondContact O-N 3.19Å; T497-N501 PolarHBondContact O-ND2 2.96Å; T497-N501 VanDerWaalsContact O-ND2 3.13Å
498	N	33	Very low	34.1	Very low	103 Å²	103	121.6 Å²	121.6	55%	0.551	56%	0.56	S	S	*	*	H	α-helix	trans	-74.7	-29.6	173.4	-82.2	-42.7	0	0	0	113.1	E494 K495 D496 R502	E494-N498 PolarHBondContact O-ND2 3.4Å; K495-N498 PolarHBondContact O-N 3.49Å; D496-N498 VanDerWaalsContact C-N 3.34Å; N498-R502 VanDerWaalsContact O-CB 3.26Å; N498-R502 WeakPolarHBondContact O-CB 3.38Å; N498-R502 WeakPolarHBondContact O-CG 3.41Å; N498-R502 PolarHBondContact O-N 3.33Å
499	Q	34.6	Very low	33.9	Very low	122 Å²	122	125.1 Å²	125.1	57%	0.57	57%	0.57	S	S	*	*	H	α-helix	trans	-74.9	-41	171.4	-105.1	174.7	-21	0	0	112.3	K495 D496 N501 R502 L503	K495-Q499 PolarHBondContact O-N 2.62Å; D496-Q499 PolarHBondContact O-N 3.5Å; Q499-N501 VanDerWaalsContact C-N 3.33Å; Q499-R502 PolarHBondContact O-N 3.3Å; Q499-L503 WeakPolarHBondContact O-CB 3.15Å; Q499-L503 PolarHBondContact O-N 2.62Å
500	S	38.4	Very low	33.6	Very low	51 Å²	51	126.2 Å²	126.2	36%	0.357	58%	0.579	S	S	.	*	H	α-helix	trans	-63.6	-38.5	170.8	-177.5	0	0	0	0	111.4	D496 K504	D496-S500 VanDerWaalsContact O-CB 3.3Å; D496-S500 WeakPolarHBondContact O-CB 3.35Å; D496-S500 PolarHBondContact O-N 3.1Å; S500-K504 VanDerWaalsContact O-CB 3.25Å; S500-K504 WeakPolarHBondContact O-CB 3.46Å; S500-K504 WeakPolarHBondContact O-CD 3.46Å; S500-K504 WeakPolarHBondContact O-CG 3.44Å; S500-K504 PolarHBondContact O-N 3.08Å
501	N	34.2	Very low	33.5	Very low	78 Å²	78	123.2 Å²	123.2	42%	0.417	57%	0.571	S	S	.	*	H	α-helix	trans	-72.8	-32.5	174	-72.9	-22.4	0	0	0	112.7	T497 Q499 K504 Q505	T497-N501 WeakPolarHBondContact O-CB 3.22Å; T497-N501 PolarHBondContact O-N 3.19Å; T497-N501 PolarHBondContact O-ND2 2.96Å; T497-N501 VanDerWaalsContact O-ND2 3.13Å; Q499-N501 VanDerWaalsContact C-N 3.33Å; N501-K504 CarbonylContact O-C 3.59Å; N501-Q505 VanDerWaalsContact O-CB 3.29Å; N501-Q505 WeakPolarHBondContact O-CB 3.31Å; N501-Q505 WeakPolarHBondContact O-CG 3.46Å; N501-Q505 PolarHBondContact O-N 3.48Å
502	R	34.1	Very low	33.7	Very low	174 Å²	174	125.1 Å²	125.1	66%	0.657	58%	0.58	S	S	*	*	H	α-helix	trans	-68.5	-42.7	170.3	-88.2	-179.8	168.2	178.6	-3.4	111.9	N498 Q499 Q505 I506	N498-R502 VanDerWaalsContact O-CB 3.26Å; N498-R502 WeakPolarHBondContact O-CB 3.38Å; N498-R502 WeakPolarHBondContact O-CG 3.41Å; N498-R502 PolarHBondContact O-N 3.33Å; Q499-R502 PolarHBondContact O-N 3.3Å; R502-Q505 CarbonylContact O-C 2.88Å; R502-Q505 PolarHBondContact O-N 3.39Å; R502-Q505 VanDerWaalsContact O-N 3.14Å; R502-I506 WeakPolarHBondContact O-CB 3.41Å; R502-I506 WeakPolarHBondContact O-CD1 3.5Å; R502-I506 WeakPolarHBondContact O-CG1 3.18Å; R502-I506 PolarHBondContact O-N 2.8Å
503	L	34.8	Very low	33.8	Very low	103 Å²	103	121.4 Å²	121.4	54%	0.539	56%	0.563	S	S	.	*	H	α-helix	trans	-64	-40.4	172.7	-87.7	156.5	0	0	0	111.2	Q499 Q505 I506 L507	Q499-L503 WeakPolarHBondContact O-CB 3.15Å; Q499-L503 PolarHBondContact O-N 2.62Å; L503-Q505 VanDerWaalsContact C-N 3.32Å; L503-Q505 PolarHBondContact O-N 2.63Å; L503-I506 PolarHBondContact O-N 2.94Å; L503-L507 VanDerWaalsContact O-CB 3.22Å; L503-L507 WeakPolarHBondContact O-CB 3.36Å; L503-L507 WeakPolarHBondContact O-CD1 3.18Å; L503-L507 VanDerWaalsContact O-CG 3.27Å; L503-L507 WeakPolarHBondContact O-CG 3.44Å; L503-L507 PolarHBondContact O-N 3.23Å
504	K	34.6	Very low	34	Very low	114 Å²	114	116.3 Å²	116.3	50%	0.496	57%	0.566	S	S	.	*	H	α-helix	trans	-65.1	-31.6	170.7	-74.9	168.2	-177.4	171.1	0	112.7	S500 N501 R508	S500-K504 VanDerWaalsContact O-CB 3.25Å; S500-K504 WeakPolarHBondContact O-CB 3.46Å; S500-K504 WeakPolarHBondContact O-CD 3.46Å; S500-K504 WeakPolarHBondContact O-CG 3.44Å; S500-K504 PolarHBondContact O-N 3.08Å; N501-K504 CarbonylContact O-C 3.59Å; K504-R508 VanDerWaalsContact O-CB 3.27Å; K504-R508 WeakPolarHBondContact O-CB 3.37Å; K504-R508 WeakPolarHBondContact O-CD 3.36Å; K504-R508 WeakPolarHBondContact O-CG 3.42Å; K504-R508 PolarHBondContact O-N 2.9Å; K504-R508 VanDerWaalsContact O-N 3.12Å
505	Q	31.8	Very low	34.7	Very low	105 Å²	105	114 Å²	114	49%	0.491	56%	0.555	S	S	.	*	H	α-helix	trans	-78.4	-33.6	173.8	-83.3	179.2	-13.1	0	0	112.5	N501 R502 L503 R508 R509	N501-Q505 VanDerWaalsContact O-CB 3.29Å; N501-Q505 WeakPolarHBondContact O-CB 3.31Å; N501-Q505 WeakPolarHBondContact O-CG 3.46Å; N501-Q505 PolarHBondContact O-N 3.48Å; R502-Q505 CarbonylContact O-C 2.88Å; R502-Q505 PolarHBondContact O-N 3.39Å; R502-Q505 VanDerWaalsContact O-N 3.14Å; L503-Q505 VanDerWaalsContact C-N 3.32Å; L503-Q505 PolarHBondContact O-N 2.63Å; Q505-R508 PolarHBondContact O-N 2.98Å; Q505-R509 WeakPolarHBondContact O-CB 3.34Å; Q505-R509 VanDerWaalsContact O-CG 3.26Å; Q505-R509 WeakPolarHBondContact O-CG 3.5Å; Q505-R509 PolarHBondContact O-N 2.82Å; Q505-R509 VanDerWaalsContact O-N 3.11Å
506	I	31.9	Very low	35.2	Very low	97 Å²	97	109 Å²	109	50%	0.497	54%	0.535	S	S	.	.	H	α-helix	trans	-71.2	-43.4	175.4	-69.6	161.3	0	0	0	109.6	R502 L503 R508 R509 T510	R502-I506 WeakPolarHBondContact O-CB 3.41Å; R502-I506 WeakPolarHBondContact O-CD1 3.5Å; R502-I506 WeakPolarHBondContact O-CG1 3.18Å; R502-I506 PolarHBondContact O-N 2.8Å; L503-I506 PolarHBondContact O-N 2.94Å; I506-R508 VanDerWaalsContact C-N 3.26Å; I506-R508 PolarHBondContact O-N 2.97Å; I506-R509 PolarHBondContact O-N 3.38Å; I506-T510 PolarHBondContact O-N 2.99Å
507	L	30.2	Very low	35.4	Very low	113 Å²	113	106.4 Å²	106.4	59%	0.592	53%	0.528	S	S	*	.	H	α-helix	trans	-68.3	-22.2	172.4	-74.2	161.5	0	0	0	113.1	L503	L503-L507 VanDerWaalsContact O-CB 3.22Å; L503-L507 WeakPolarHBondContact O-CB 3.36Å; L503-L507 WeakPolarHBondContact O-CD1 3.18Å; L503-L507 VanDerWaalsContact O-CG 3.27Å; L503-L507 WeakPolarHBondContact O-CG 3.44Å; L503-L507 PolarHBondContact O-N 3.23Å
508	R	33.1	Very low	35.5	Very low	211 Å²	211	105.9 Å²	105.9	80%	0.796	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-15.3	169.7	-80.6	173.5	-175.6	-168.2	2.3	113.3	K504 Q505 I506	K504-R508 VanDerWaalsContact O-CB 3.27Å; K504-R508 WeakPolarHBondContact O-CB 3.37Å; K504-R508 WeakPolarHBondContact O-CD 3.36Å; K504-R508 WeakPolarHBondContact O-CG 3.42Å; K504-R508 PolarHBondContact O-N 2.9Å; K504-R508 VanDerWaalsContact O-N 3.12Å; Q505-R508 PolarHBondContact O-N 2.98Å; I506-R508 VanDerWaalsContact C-N 3.26Å; I506-R508 PolarHBondContact O-N 2.97Å
509	R	28.1	Very low	35.9	Very low	205 Å²	205	105.3 Å²	105.3	77%	0.774	53%	0.525	S	S	*	.	S	Bend	trans	-95.5	-5	-177.6	-83.3	176	175	173.9	-1.3	113.7	Q505 I506	Q505-R509 WeakPolarHBondContact O-CB 3.34Å; Q505-R509 VanDerWaalsContact O-CG 3.26Å; Q505-R509 WeakPolarHBondContact O-CG 3.5Å; Q505-R509 PolarHBondContact O-N 2.82Å; Q505-R509 VanDerWaalsContact O-N 3.11Å; I506-R509 PolarHBondContact O-N 3.38Å
510	T	28.4	Very low	35.7	Very low	91 Å²	91	107.8 Å²	107.8	56%	0.558	53%	0.53	S	S	*	.	S	Bend	trans	-104.5	103.3	-179	48.8	0	0	0	0	111.9	I506	I506-T510 PolarHBondContact O-N 2.99Å
511	N	32.5	Very low	35.4	Very low	103 Å²	103	111 Å²	111	55%	0.551	54%	0.539	S	S	*	.			trans	60.6	131.4	155.3	-64.2	-9.1	0	0	0	120.4	F513	N511-F513 CarbonylContact O-C 3.6Å; N511-F513 PolarHBondContact O-N 2.73Å
512	K	36.8	Very low	35	Very low	201 Å²	201	116.2 Å²	116.2	87%	0.874	56%	0.561	S	S	*	*	S	Bend	trans	-55.6	2.9	169.2	-87.6	178.3	171.1	-178.9	0	115
513	F	38.5	Very low	34.7	Very low	57 Å²	57	113.8 Å²	113.8	25%	0.25	56%	0.561	C	S	.	*			trans	-100.8	80.2	167.8	-63.2	-78.3	0	0	0	109.5	N511 H515 I516 F672	N511-F513 CarbonylContact O-C 3.6Å; N511-F513 PolarHBondContact O-N 2.73Å; F513-H515 PolarHBondContact O-N 2.91Å; F513-I516 HydrophobicContact CB-CD1 4.22Å; F513-F672 HydrophobicContact CE2-CB 4.27Å; F513-F672 HydrophobicContact CZ-CB 3.65Å; F513-F672 HydrophobicContact CZ-CD2 4.33Å; F513-F672 HydrophobicContact CZ-CG 4.14Å
514	G	36.6	Very low	34.3	Very low	69 Å²	69	115.7 Å²	115.7	71%	0.711	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	12	-175.5	0	0	0	0	0	116.7
515	H	48.6	Very low	34	Very low	85 Å²	85	119 Å²	119	39%	0.394	59%	0.589	S	S	.	*	T	Hydrogen-bonded Turn	trans	-117.2	-2.3	-172.4	-62.7	-79.3	0	0	0	114.5	D465 F513	D465-H515 IonicContact OD1-CE1 3.16Å; D465-H515 PolarHBondContact OD1-CE1 3.13Å; D465-H515 IonicContact OD1-CG 3.61Å; D465-H515 IonicContact OD1-ND1 3.51Å; D465-H515 PolarHBondContact OD1-ND1 2.84Å; F513-H515 PolarHBondContact O-N 2.91Å
516	I	44.7	Very low	33.8	Very low	47 Å²	47	123.5 Å²	123.5	24%	0.241	60%	0.603	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-119	112.7	-173.4	-53.9	170.2	0	0	0	110.7	Y461 L463 F513 L589 L646	Y461-I516 HydrophobicContact CD1-CG2 4.29Å; L463-I516 HydrophobicContact CD2-CG1 4.45Å; F513-I516 HydrophobicContact CB-CD1 4.22Å; I516-L589 HydrophobicContact CD1-CD2 4.21Å; I516-L646 HydrophobicContact CD1-CD2 3.32Å; I516-L646 HydrophobicContact CG1-CD2 3.5Å
517	G	41.2	Very low	33.6	Very low	31 Å²	31	126.8 Å²	126.8	32%	0.32	62%	0.616	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.2	119.4	163.5	0	0	0	0	0	110.3	V462	V462-G517 PolarHBondContact N-O 3.12Å; V462-G517 VanDerWaalsContact N-O 3.15Å; V462-G517 PolarHBondContact O-N 3.07Å; V462-G517 VanDerWaalsContact O-N 3.1Å
518	V	40	Very low	33.4	Very low	63 Å²	63	129.2 Å²	129.2	38%	0.382	63%	0.63	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.1	113.3	166.8	-178.6	0	0	0	0	107.4	Y461 Y520	Y461-V518 HydrophobicContact CD1-CG2 4.05Å; Y461-V518 HydrophobicContact CE1-CG2 3.92Å; V518-Y520 HydrophobicContact CG1-CD2 4.27Å; V518-Y520 HydrophobicContact CG1-CE2 3.99Å
519	V	39.9	Very low	33.1	Very low	91 Å²	91	127.2 Å²	127.2	55%	0.552	63%	0.629	S	S	*	*			trans	-90.5	108.3	172	-176.7	0	0	0	0	107.3	V462	V462-V519 HydrophobicContact CG2-CG2 3.98Å
520	Y	31.3	Very low	33	Very low	175 Å²	175	128 Å²	128	69%	0.686	63%	0.633	S	S	*	*			trans	-74.9	119.3	164.3	-68.9	-86	0	0	0	107.9	V518 E522	V518-Y520 HydrophobicContact CG1-CD2 4.27Å; V518-Y520 HydrophobicContact CG1-CE2 3.99Å; Y520-E522 VanDerWaalsContact C-N 3.27Å; Y520-E522 PolarHBondContact O-N 3.14Å
521	E	32.5	Very low	32.8	Very low	118 Å²	118	131 Å²	131	55%	0.551	65%	0.647	S	S	*	*			trans	-75.6	81.7	165.2	-99.9	-177.4	-176.4	0	0	108.9
522	E	26.1	Very low	32.5	Very low	187 Å²	187	133.9 Å²	133.9	87%	0.874	66%	0.657	S	S	*	*			trans	-89.6	77.9	152.6	-80.5	-174.5	172.6	0	0	107.9	Y520	Y520-E522 VanDerWaalsContact C-N 3.27Å; Y520-E522 PolarHBondContact O-N 3.14Å
523	L	27.3	Very low	31.9	Very low	123 Å²	123	130 Å²	130	64%	0.644	65%	0.645	S	S	*	*			trans	-146.5	27.7	175.2	-107.4	162.2	0	0	0	114.3
524	N	26.5	Very low	31.4	Very low	144 Å²	144	131.1 Å²	131.1	77%	0.77	65%	0.654	S	S	*	*	S	Bend	trans	-102.4	9.5	175.4	-87.4	-17	0	0	0	115.5
525	E	27.2	Very low	30.8	Very low	184 Å²	184	137.1 Å²	137.1	86%	0.86	66%	0.656	S	S	*	*	S	Bend	trans	-113.3	1.3	177.5	-80.7	-169.8	157.9	0	0	116.2
526	Y	27.8	Very low	29.7	Very low	199 Å²	199	134.3 Å²	134.3	78%	0.78	65%	0.65	S	S	*	*	S	Bend	trans	-115.6	1.5	-179.9	-87.5	-86	0	0	0	116.2
527	Q	28.2	Very low	28.7	Very low	165 Å²	165	139.8 Å²	139.8	77%	0.771	67%	0.673	S	S	*	*	S	Bend	trans	-96	5.7	-179.6	-76.2	-166.1	-24.7	0	0	115.8
528	N	26.8	Very low	28	Very low	165 Å²	165	144.9 Å²	144.9	88%	0.882	69%	0.691	S	S	*	*	S	Bend	trans	-106.5	14.7	178.7	-85.6	-20.4	0	0	0	115.4
529	Q	26.2	Very low	27.3	Very low	168 Å²	168	145.1 Å²	145.1	79%	0.785	70%	0.696	S	S	*	*	S	Bend	trans	-129.1	1.4	-177	-103.4	178.8	-7	0	0	117.8
530	Y	26.2	Very low	26.7	Very low	221 Å²	221	145.9 Å²	145.9	87%	0.867	71%	0.705	S	S	*	*			trans	-124.2	63.2	173.4	-81.3	-86.2	0	0	0	111.7
531	N	24	Very low	26.5	Very low	156 Å²	156	141.9 Å²	141.9	83%	0.834	70%	0.703	S	S	*	*			trans	-84.5	98.8	147.6	-85.4	-33	0	0	0	106.9
532	Q	25.2	Very low	26.1	Very low	163 Å²	163	143.8 Å²	143.8	76%	0.762	72%	0.717	S	S	*	*	S	Bend	trans	160.5	117	147.3	-91.3	163.9	-10	0	0	110.3
533	D	25.6	Very low	26.2	Very low	119 Å²	119	140.4 Å²	140.4	64%	0.636	71%	0.714	S	S	*	*			trans	69.5	124	140.9	-50.7	-18.1	0	0	0	120.5
534	N	26.6	Very low	26	Very low	80 Å²	80	142.4 Å²	142.4	43%	0.428	72%	0.72	S	S	.	*			trans	100.2	104.1	153.2	-53.9	-48.5	0	0	0	118.6	K911	N534-K911 WeakPolarHBondContact OD1-CD 3.49Å; N534-K911 WeakPolarHBondContact OD1-CE 3.1Å; N534-K911 PolarHBondContact OD1-NZ 3.28Å
535	Y	25.8	Very low	26.1	Very low	195 Å²	195	144.9 Å²	144.9	77%	0.765	72%	0.724	S	S	*	*			trans	-113.5	105.2	155	-83.3	-79.7	0	0	0	109.7	Y477	Y477-Y535 AromaticContact CD1-CD1 3.8Å; Y477-Y535 HydrophobicContact CD1-CD1 3.8Å; Y477-Y535 HydrophobicContact CD1-CE1 4.23Å; Y477-Y535 HydrophobicContact CD2-CD1 4.25Å; Y477-Y535 AromaticContact CD2-CE1 3.87Å; Y477-Y535 HydrophobicContact CD2-CE1 3.87Å; Y477-Y535 HydrophobicContact CE1-CD1 4.27Å; Y477-Y535 HydrophobicContact CE2-CE1 4.47Å; Y477-Y535 AromaticContact CG-CD1 3.79Å; Y477-Y535 HydrophobicContact CG-CD1 3.79Å; Y477-Y535 AromaticContact CG-CE1 3.74Å; Y477-Y535 HydrophobicContact CG-CE1 3.74Å
536	G	25.2	Very low	26.1	Very low	26 Å²	26	141.8 Å²	141.8	27%	0.268	71%	0.714	S	S	.	*			trans	-104.5	158	160.3	0	0	0	0	0	111.9	D479	D479-G536 VanDerWaalsContact OD1-C 3.31Å; D479-G536 WeakPolarHBondContact OD1-CA 3.32Å; D479-G536 PolarHBondContact OD1-N 3.44Å; D479-G536 PolarHBondContact OD2-N 3.26Å; D479-G536 VanDerWaalsContact OD2-N 3.13Å
537	F	24	Very low	26.1	Very low	162 Å²	162	140.2 Å²	140.2	71%	0.711	71%	0.713	S	S	*	*			trans	-116.8	143.6	177.7	-98.5	-93.4	0	0	0	107.6	Y477	Y477-F537 HydrophobicContact CE1-CD2 4.11Å; Y477-F537 HydrophobicContact CE1-CE1 4.27Å; Y477-F537 AromaticContact CE1-CE2 3.83Å; Y477-F537 HydrophobicContact CE1-CE2 3.83Å; Y477-F537 HydrophobicContact CE1-CG 4.44Å; Y477-F537 AromaticContact CE1-CZ 3.92Å; Y477-F537 HydrophobicContact CE1-CZ 3.92Å; Y477-F537 VanDerWaalsContact OH-CZ 3.3Å; Y477-F537 WeakPolarHBondContact OH-CZ 3.45Å
538	I	25.9	Very low	26	Very low	138 Å²	138	139.9 Å²	139.9	71%	0.708	71%	0.711	S	S	*	*			trans	172.9	108.3	149.5	-88.2	146.4	0	0	0	106.5
539	S	25.2	Very low	26.2	Very low	68 Å²	68	138.2 Å²	138.2	48%	0.476	70%	0.703	S	S	.	*				78	126.2	74.6	83.2	0	0	0	0	117.8
540	S	26.5	Very low	26.3	Very low	107 Å²	107	136.2 Å²	136.2	75%	0.748	70%	0.698	S	S	*	*			trans	69.1	150.9	150.1	55.9	0	0	0	0	117.9
541	S	27.2	Very low	26.4	Very low	91 Å²	91	133.7 Å²	133.7	64%	0.636	70%	0.699	S	S	*	*			cis	-175.7	153.1	6.8	29.7	0	0	0	0	109
542	D	24.8	Very low	26.4	Very low	159 Å²	159	134.1 Å²	134.1	85%	0.85	70%	0.696	S	S	*	*			trans	56.5	129.3	140.5	-50.4	-21.9	0	0	0	122.4
543	S	27.7	Very low	26.4	Very low	115 Å²	115	134.3 Å²	134.3	80%	0.804	70%	0.697	S	S	*	*			trans	-156.3	120	132.9	63.7	0	0	0	0	110.7
544	E	23.9	Very low	26.3	Very low	165 Å²	165	134.5 Å²	134.5	77%	0.771	70%	0.702	S	S	*	*			trans	-55.2	159.5	166.2	-64.7	158.9	148.3	0	0	112.7
545	F	29	Very low	26.1	Very low	196 Å²	196	134.9 Å²	134.9	86%	0.86	71%	0.711	S	S	*	*			trans	-169.6	93.1	141.5	-94.1	-66.1	0	0	0	109.4
546	D	25.5	Very low	26	Very low	120 Å²	120	134 Å²	134	64%	0.642	71%	0.714	S	S	*	*				37.7	150.1	114.5	-62.4	-25.8	0	0	0	123.9
547	E	28.7	Very low	25.9	Very low	165 Å²	165	141 Å²	141	77%	0.771	74%	0.744	S	S	*	*			trans	78.1	128.7	154.5	-76.5	170	-160	0	0	116.1
548	E	26.1	Very low	26	Very low	158 Å²	158	139.1 Å²	139.1	74%	0.738	75%	0.745	S	S	*	*			cis	147.6	126.7	18.4	-111.4	-177.7	-179.5	0	0	102
549	D	31	Very low	25.9	Very low	131 Å²	131	140.4 Å²	140.4	70%	0.701	75%	0.753	S	S	*	*			trans	154.8	104.4	133.5	-90.9	-33	0	0	0	114
550	N	27.3	Very low	25.8	Very low	126 Å²	126	144.3 Å²	144.3	67%	0.674	77%	0.768	S	S	*	*				33.3	107.2	120.4	-58.4	-47.3	0	0	0	117.9
551	N	28.9	Very low	25.7	Very low	167 Å²	167	148 Å²	148	89%	0.893	77%	0.771	S	S	*	*				-174.9	135.2	103.5	-93.3	-39.2	0	0	0	112.7
552	E	25.4	Very low	25.7	Very low	166 Å²	166	151.4 Å²	151.4	78%	0.776	78%	0.78	S	S	*	*			trans	-64.1	172.4	176.7	-68.9	179.4	146.6	0	0	113.8
553	Q	24.5	Very low	25.6	Very low	167 Å²	167	153.5 Å²	153.5	78%	0.78	78%	0.778	S	S	*	*			trans	99	124.8	149	-77.1	170.1	30.7	0	0	118.2
554	V	24.1	Very low	25.4	Very low	122 Å²	122	157.9 Å²	157.9	74%	0.739	78%	0.782	S	S	*	*			trans	99.5	82.6	149.6	-164.3	0	0	0	0	117
555	S	21.9	Very low	25.5	Very low	89 Å²	89	155.8 Å²	155.8	62%	0.622	79%	0.786	S	S	*	*				35.5	136.5	114.5	60.5	0	0	0	0	121.7
556	H	23.7	Very low	25.2	Very low	177 Å²	177	153.7 Å²	153.7	82%	0.819	78%	0.784	S	S	*	*			trans	55.4	82.8	146.5	-73.4	-72.6	0	0	0	117.3
557	L	23	Very low	25.1	Very low	171 Å²	171	156.9 Å²	156.9	90%	0.895	80%	0.795	S	S	*	*			trans	179.5	79.8	152.1	-105.4	145.1	0	0	0	112.4
558	V	25.5	Very low	24.8	Very low	123 Å²	123	155.5 Å²	155.5	75%	0.745	80%	0.798	S	S	*	*			trans	-142.4	68.9	154.5	-165.5	0	0	0	0	109.8	K561	V558-K561 HydrophobicContact CG1-CB 4.13Å
559	L	23.6	Very low	24.9	Very low	165 Å²	165	155 Å²	155	86%	0.864	80%	0.799	S	S	*	*	S	Bend	trans	-104.8	10.4	163.4	-120	163.7	0	0	0	111.7
560	N	23.2	Very low	24.5	Very low	151 Å²	151	155 Å²	155	81%	0.807	80%	0.803	S	S	*	*			trans	-157.7	68.6	-175.3	-91.3	-27.2	0	0	0	113.5
561	K	24.7	Very low	24.3	Very low	183 Å²	183	154.3 Å²	154.3	80%	0.796	81%	0.808	S	S	*	*			trans	-136.2	22.2	173.5	-99.8	-174	-179.8	178.8	0	116.1	V558	V558-K561 HydrophobicContact CG1-CB 4.13Å
562	I	26.4	Very low	24.1	Very low	164 Å²	164	150.7 Å²	150.7	84%	0.841	80%	0.796	S	S	*	*	S	Bend	trans	-95.8	-3.2	169.5	-66.5	177.4	0	0	0	112.2
563	Y	23.9	Very low	24.2	Very low	202 Å²	202	149.9 Å²	149.9	79%	0.792	80%	0.797	S	S	*	*	S	Bend	trans	-116.4	130.7	176.4	-77.7	-89.3	0	0	0	111
564	K	23.3	Very low	24.2	Very low	208 Å²	208	150.5 Å²	150.5	90%	0.904	80%	0.8	S	S	*	*			trans	97.1	90.5	177.5	-62.8	-177.4	172.2	-175.9	0	116.9
565	S	25.7	Very low	24.4	Very low	121 Å²	121	151.7 Å²	151.7	85%	0.846	80%	0.803	S	S	*	*			trans	-143	62	138.9	65.8	0	0	0	0	109.5
566	N	23.3	Very low	24.6	Very low	152 Å²	152	155.7 Å²	155.7	81%	0.813	82%	0.816	S	S	*	*			trans	-107.9	146	154.6	-86.5	-10.8	0	0	0	106.8
567	E	23.6	Very low	24.7	Very low	187 Å²	187	154.7 Å²	154.7	87%	0.874	82%	0.817	S	S	*	*			trans	85.5	101.2	-176.5	-56.7	-177.8	171.5	0	0	115.6
568	T	22.7	Very low	24.9	Very low	136 Å²	136	153.7 Å²	153.7	83%	0.834	81%	0.812	S	S	*	*				-169.6	147.1	123	20.8	0	0	0	0	109.8
569	I	26.3	Very low	25	Very low	148 Å²	148	156.5 Å²	156.5	76%	0.759	82%	0.822	S	S	*	*			trans	93.8	60	172.9	-41.2	161.6	0	0	0	114.6
570	T	23.1	Very low	25.3	Very low	130 Å²	130	153.7 Å²	153.7	80%	0.798	82%	0.816	S	S	*	*			trans	-75.8	151.4	131.2	43.2	0	0	0	0	108.9
571	S	23.7	Very low	25.4	Very low	111 Å²	111	153.9 Å²	153.9	78%	0.776	82%	0.817	S	S	*	*			trans	64.9	94.9	174	69.8	0	0	0	0	117.3
572	S	24.5	Very low	25.7	Very low	92 Å²	92	152.5 Å²	152.5	64%	0.643	82%	0.819	S	S	*	*			trans	-175.9	134.3	133.6	33.5	0	0	0	0	111.1
573	N	27.5	Very low	26	Very low	148 Å²	148	152.4 Å²	152.4	79%	0.791	82%	0.82	S	S	*	*			trans	99.4	62.4	164	-48.1	-27.4	0	0	0	116.5
574	E	25.5	Very low	26.2	Very low	180 Å²	180	149.9 Å²	149.9	84%	0.841	82%	0.82	S	S	*	*				-50.2	145.6	127.7	-66.8	176.6	155.1	0	0	109.3
575	N	26.8	Very low	26.6	Very low	148 Å²	148	147.4 Å²	147.4	79%	0.791	82%	0.817	S	S	*	*			trans	95.9	72.1	-174.8	-52.7	-34.3	0	0	0	115.5
576	L	27.3	Very low	27.2	Very low	173 Å²	173	149.4 Å²	149.4	91%	0.906	82%	0.818	S	S	*	*			trans	-168.5	49	141.4	-102.2	142.3	0	0	0	110.7
577	N	25	Very low	28.2	Very low	155 Å²	155	148.8 Å²	148.8	83%	0.829	81%	0.814	S	S	*	*			trans	-78.8	128.3	159.2	-75.1	-18.6	0	0	0	107.3
578	N	28.1	Very low	29.6	Very low	151 Å²	151	146 Å²	146	81%	0.807	80%	0.802	S	S	*	*	S	Bend	trans	121.2	55.3	170	-59.6	-18.7	0	0	0	114.6
579	L	27.5	Very low	31.5	Very low	182 Å²	182	141.1 Å²	141.1	95%	0.953	77%	0.77	S	S	*	*			trans	-171.5	60.4	155.2	-111.4	131.4	0	0	0	111.7
580	S	28.6	Very low	33.7	Very low	105 Å²	105	136.2 Å²	136.2	73%	0.734	75%	0.748	S	S	*	*			trans	-152.4	85.5	171.6	63.3	0	0	0	0	110.6
581	N	26.7	Very low	36.4	Very low	155 Å²	155	135.4 Å²	135.4	83%	0.829	74%	0.739	S	S	*	*			trans	-124.5	122.9	156.6	-83.9	-22.2	0	0	0	105.8
582	N	29.6	Very low	39.2	Very low	155 Å²	155	134 Å²	134	83%	0.829	72%	0.72	S	S	*	*	S	Bend	trans	99.6	122.7	178	-52.8	-19.8	0	0	0	114.9
583	D	32.7	Very low	42	Very low	161 Å²	161	129.7 Å²	129.7	86%	0.861	69%	0.69	S	S	*	*			trans	96.2	50.8	174.3	-52.6	-14.5	0	0	0	118.4
584	N	28	Very low	44.7	Very low	150 Å²	150	124.1 Å²	124.1	80%	0.802	66%	0.659	S	S	*	*			trans	-101.2	107.3	161.7	-74.7	-27.7	0	0	0	109.1
585	N	33	Very low	47.6	Very low	156 Å²	156	120.2 Å²	120.2	83%	0.834	64%	0.643	S	S	*	*			trans	179.8	5.5	155.3	-91.2	-11.1	0	0	0	118.6	N587	N585-N587 PolarHBondContact O-N 3.19Å
586	N	37.1	Very low	50.5	Low	162 Å²	162	113.1 Å²	113.1	87%	0.866	61%	0.606	S	S	*	*			trans	-103.6	51	-168.7	-75	-12.3	0	0	0	117.4
587	N	44.7	Very low	53.3	Low	139 Å²	139	105 Å²	105	74%	0.743	56%	0.563	S	S	*	*			trans	-107.7	14.2	179.7	-81.2	-9.3	0	0	0	115.8	N585	N585-N587 PolarHBondContact O-N 3.19Å
588	Q	54	Low	56.4	Low	130 Å²	130	98.1 Å²	98.1	61%	0.607	53%	0.527	S	S	*	.	S	Bend	trans	-101.2	138.7	-177.7	-70.4	176.5	-15.5	0	0	112.4	N675	Q588-N675 PolarHBondContact NE2-OD1 3.24Å
589	L	62	Low	59.4	Low	33 Å²	33	91.1 Å²	91.1	17%	0.173	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-64.9	137.2	168.4	-81	148.5	0	0	0	108.8	I516 N591 L593 I594 L673	I516-L589 HydrophobicContact CD1-CD2 4.21Å; L589-N591 PolarHBondContact O-N 3.47Å; L589-L593 HydrophobicContact CD2-CD2 3.48Å; L589-L593 VanDerWaalsContact CD2-CD2 3.48Å; L589-I594 HydrophobicContact CB-CG1 4.38Å; L589-L673 HydrophobicContact CB-CD2 4.25Å; L589-L673 HydrophobicContact CD1-CD2 3.4Å; L589-L673 VanDerWaalsContact CD1-CD2 3.4Å; L589-L673 HydrophobicContact CG-CD2 4.44Å
590	P	72.5	Confident	62.4	Low	44 Å²	44	82.5 Å²	82.5	29%	0.286	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-60.5	137.5	-177.8	17.4	-24.9	0	0	0	111.2	I457 Y461 E592 L593 I594	I457-P590 HydrophobicContact CD1-CB 4.17Å; Y461-P590 VanDerWaalsContact OH-CG 3.26Å; Y461-P590 WeakPolarHBondContact OH-CG 3.49Å; P590-E592 PolarHBondContact O-N 2.76Å; P590-E592 VanDerWaalsContact O-N 3.15Å; P590-L593 HydrophobicContact CG-CB 3.99Å; P590-L593 HydrophobicContact CG-CD2 4.48Å; P590-L593 WeakPolarHBondContact O-CA 3.45Å; P590-L593 VanDerWaalsContact O-CB 3.31Å; P590-L593 WeakPolarHBondContact O-CB 3.49Å; P590-L593 PolarHBondContact O-N 3.49Å; P590-I594 PolarHBondContact O-N 3.49Å
591	N	79.2	Confident	65.4	Low	114 Å²	114	77.5 Å²	77.5	61%	0.61	41%	0.409	S	S	*	.	H	α-helix	trans	-56.3	-34.8	-174.9	-72.7	-17.2	0	0	0	112.4	L589 L593 I594 I595	L589-N591 PolarHBondContact O-N 3.47Å; N591-L593 VanDerWaalsContact C-N 3.29Å; N591-L593 PolarHBondContact O-N 3.04Å; N591-I594 PolarHBondContact O-N 2.77Å; N591-I595 WeakPolarHBondContact O-CG1 3.31Å; N591-I595 PolarHBondContact O-N 3.1Å
592	E	82.7	Confident	68.5	Low	80 Å²	80	70.1 Å²	70.1	37%	0.374	37%	0.37	S	S	.	.	H	α-helix	trans	-67	-29.7	177.5	-56.8	82	173.1	0	0	112.7	I454 I457 P590 S596	I454-E592 HydrophobicContact CG2-CB 4.1Å; I457-E592 HydrophobicContact CD1-CB 3.65Å; I457-E592 HydrophobicContact CD1-CG 3.96Å; I457-E592 WeakPolarHBondContact CD1-OE2 3.38Å; I457-E592 HydrophobicContact CG1-CB 4.16Å; I457-E592 HydrophobicContact CG1-CG 4.05Å; P590-E592 PolarHBondContact O-N 2.76Å; P590-E592 VanDerWaalsContact O-N 3.15Å; E592-S596 WeakPolarHBondContact O-CB 3.37Å; E592-S596 PolarHBondContact O-N 3.2Å; E592-S596 PolarHBondContact O-OG 3.15Å
593	L	83.1	Confident	71.4	Confident	3 Å²	3	62.8 Å²	62.8	2%	0.016	33%	0.33	C	S	.	.	H	α-helix	trans	-71.3	-42.7	172.6	178.8	60.2	0	0	0	110.1	I454 Y461 L589 P590 N591 I595 S596 L597	I454-L593 VanDerWaalsContact CD1-CA 3.44Å; I454-L593 HydrophobicContact CD1-CB 3.51Å; I454-L593 HydrophobicContact CD1-CD1 3.77Å; I454-L593 HydrophobicContact CD1-CG 4.18Å; Y461-L593 HydrophobicContact CD1-CD2 4.24Å; Y461-L593 HydrophobicContact CD2-CD1 4.35Å; Y461-L593 HydrophobicContact CE1-CD2 4.02Å; Y461-L593 HydrophobicContact CE2-CD2 4.48Å; L589-L593 HydrophobicContact CD2-CD2 3.48Å; L589-L593 VanDerWaalsContact CD2-CD2 3.48Å; P590-L593 HydrophobicContact CG-CB 3.99Å; P590-L593 HydrophobicContact CG-CD2 4.48Å; P590-L593 WeakPolarHBondContact O-CA 3.45Å; P590-L593 VanDerWaalsContact O-CB 3.31Å; P590-L593 WeakPolarHBondContact O-CB 3.49Å; P590-L593 PolarHBondContact O-N 3.49Å; N591-L593 VanDerWaalsContact C-N 3.29Å; N591-L593 PolarHBondContact O-N 3.04Å; L593-I595 PolarHBondContact O-N 3.39Å; L593-S596 WeakPolarHBondContact O-CB 3.24Å; L593-S596 PolarHBondContact O-N 3.34Å; L593-S596 VanDerWaalsContact O-N 3.15Å; L593-L597 HydrophobicContact CD1-CD1 4.16Å; L593-L597 HydrophobicContact CD1-CG 4.08Å; L593-L597 HydrophobicContact CG-CD1 3.99Å; L593-L597 HydrophobicContact CG-CG 4.34Å; L593-L597 WeakPolarHBondContact O-CB 3.49Å; L593-L597 VanDerWaalsContact O-CG 3.26Å; L593-L597 WeakPolarHBondContact O-CG 3.43Å; L593-L597 PolarHBondContact O-N 3.08Å
594	I	84.4	Confident	74.1	Confident	30 Å²	30	55.1 Å²	55.1	15%	0.154	29%	0.29	C	S	.	.	H	α-helix	trans	-59.9	-47.2	175.4	-58.6	175.4	0	0	0	109.9	L589 P590 N591 S596 L597 T598 I648 Y669 L673	L589-I594 HydrophobicContact CB-CG1 4.38Å; P590-I594 PolarHBondContact O-N 3.49Å; N591-I594 PolarHBondContact O-N 2.77Å; I594-S596 VanDerWaalsContact C-N 3.3Å; I594-S596 PolarHBondContact O-N 3Å; I594-L597 PolarHBondContact O-N 3.37Å; I594-T598 HydrophobicContact CG2-CG2 4.3Å; I594-T598 VanDerWaalsContact O-CG2 3.25Å; I594-T598 WeakPolarHBondContact O-CG2 3.38Å; I594-T598 PolarHBondContact O-N 3.37Å; I594-T598 PolarHBondContact O-OG1 3.44Å; I594-I648 HydrophobicContact CG2-CD1 4.33Å; I594-Y669 HydrophobicContact CG2-CE1 4.37Å; I594-L673 HydrophobicContact CD1-CD2 4.13Å; I594-L673 HydrophobicContact CG1-CD2 4.19Å
595	I	86.5	Confident	76.9	Confident	98 Å²	98	49.7 Å²	49.7	50%	0.503	26%	0.262	S	S	.	.	H	α-helix	trans	-57.6	-44.5	174.5	-66	165.2	0	0	0	110.7	N591 L593 L597 T598 T599	N591-I595 WeakPolarHBondContact O-CG1 3.31Å; N591-I595 PolarHBondContact O-N 3.1Å; L593-I595 PolarHBondContact O-N 3.39Å; I595-L597 PolarHBondContact O-N 3.39Å; I595-T598 WeakPolarHBondContact CA-OG1 3.1Å; I595-T598 PolarHBondContact O-N 2.99Å; I595-T598 PolarHBondContact O-OG1 2.97Å; I595-T599 WeakPolarHBondContact O-CG2 3.45Å; I595-T599 PolarHBondContact O-N 3.04Å; I595-T599 PolarHBondContact O-OG1 2.73Å
596	S	87.5	Confident	79.4	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.8	-44.2	177.2	-62	0	0	0	0	112.2	E592 L593 I594 T599 L600	E592-S596 WeakPolarHBondContact O-CB 3.37Å; E592-S596 PolarHBondContact O-N 3.2Å; E592-S596 PolarHBondContact O-OG 3.15Å; L593-S596 WeakPolarHBondContact O-CB 3.24Å; L593-S596 PolarHBondContact O-N 3.34Å; L593-S596 VanDerWaalsContact O-N 3.15Å; I594-S596 VanDerWaalsContact C-N 3.3Å; I594-S596 PolarHBondContact O-N 3Å; S596-T599 PolarHBondContact O-N 2.79Å; S596-T599 PolarHBondContact O-OG1 3.15Å; S596-L600 WeakPolarHBondContact O-CD1 3.43Å; S596-L600 WeakPolarHBondContact O-CG 3.26Å; S596-L600 PolarHBondContact O-N 2.84Å
597	L	87.2	Confident	81.6	Confident	2 Å²	2	39 Å²	39	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-67.9	-35.7	179.2	-66.5	172.9	0	0	0	112.9	I452 L593 I594 I595 L600 A601 L646 I648	I452-L597 HydrophobicContact CD1-CD2 3.98Å; L593-L597 HydrophobicContact CD1-CD1 4.16Å; L593-L597 HydrophobicContact CD1-CG 4.08Å; L593-L597 HydrophobicContact CG-CD1 3.99Å; L593-L597 HydrophobicContact CG-CG 4.34Å; L593-L597 WeakPolarHBondContact O-CB 3.49Å; L593-L597 VanDerWaalsContact O-CG 3.26Å; L593-L597 WeakPolarHBondContact O-CG 3.43Å; L593-L597 PolarHBondContact O-N 3.08Å; I594-L597 PolarHBondContact O-N 3.37Å; I595-L597 PolarHBondContact O-N 3.39Å; L597-L600 HydrophobicContact CD2-CD1 3.99Å; L597-L600 WeakPolarHBondContact O-CB 3.48Å; L597-L600 PolarHBondContact O-N 3.37Å; L597-A601 WeakPolarHBondContact O-CB 3.42Å; L597-A601 PolarHBondContact O-N 3.19Å; L597-L646 HydrophobicContact CD1-CB 3.77Å; L597-L646 HydrophobicContact CD1-CD1 3.9Å; L597-L646 HydrophobicContact CD1-CG 4.45Å; L597-L646 HydrophobicContact CD2-CB 4.35Å; L597-L646 HydrophobicContact CD2-CD1 3.39Å; L597-L646 HydrophobicContact CG-CD1 4.28Å; L597-I648 HydrophobicContact CB-CD1 3.58Å; L597-I648 HydrophobicContact CB-CG1 4.5Å
598	T	89.6	Confident	83.3	Confident	11 Å²	11	34.2 Å²	34.2	7%	0.067	18%	0.178	C	C	.	.	H	α-helix	trans	-67.4	-41.4	173.5	55.8	0	0	0	0	111.4	I594 I595 L600 A601 L602 I648 Y669	I594-T598 HydrophobicContact CG2-CG2 4.3Å; I594-T598 VanDerWaalsContact O-CG2 3.25Å; I594-T598 WeakPolarHBondContact O-CG2 3.38Å; I594-T598 PolarHBondContact O-N 3.37Å; I594-T598 PolarHBondContact O-OG1 3.44Å; I595-T598 WeakPolarHBondContact CA-OG1 3.1Å; I595-T598 PolarHBondContact O-N 2.99Å; I595-T598 PolarHBondContact O-OG1 2.97Å; T598-L600 VanDerWaalsContact C-N 3.28Å; T598-L600 PolarHBondContact O-N 3.39Å; T598-A601 CarbonylContact O-C 3.56Å; T598-A601 PolarHBondContact O-N 2.9Å; T598-A601 VanDerWaalsContact O-N 3.16Å; T598-L602 WeakPolarHBondContact O-CB 3.44Å; T598-L602 VanDerWaalsContact O-CG 3.28Å; T598-L602 WeakPolarHBondContact O-CG 3.48Å; T598-L602 PolarHBondContact O-N 3.23Å; T598-I648 HydrophobicContact CG2-CD1 3.67Å; T598-Y669 HydrophobicContact CG2-CE1 3.67Å; T598-Y669 WeakPolarHBondContact CG2-OH 3.31Å
599	T	90.3	Very high	83.9	Confident	3 Å²	3	28.6 Å²	28.6	2%	0.018	15%	0.152	C	C	.	.	H	α-helix	trans	-62.9	-35.2	174	62.8	0	0	0	0	112.8	I595 S596 L602 C603 H714	I595-T599 WeakPolarHBondContact O-CG2 3.45Å; I595-T599 PolarHBondContact O-N 3.04Å; I595-T599 PolarHBondContact O-OG1 2.73Å; S596-T599 PolarHBondContact O-N 2.79Å; S596-T599 PolarHBondContact O-OG1 3.15Å; T599-L602 PolarHBondContact O-N 3.45Å; T599-C603 WeakPolarHBondContact O-CB 3.22Å; T599-C603 PolarHBondContact O-N 2.91Å; T599-C603 VanDerWaalsContact O-N 3.07Å; T599-H714 WeakPolarHBondContact CG2-ND1 3.19Å
600	L	90.9	Very high	83.7	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-62.4	-44.5	172.2	-76.4	158	0	0	0	111.8	I452 S596 L597 T598 L602 L639 Y754 T803	I452-L600 HydrophobicContact CD1-CD1 4.28Å; S596-L600 WeakPolarHBondContact O-CD1 3.43Å; S596-L600 WeakPolarHBondContact O-CG 3.26Å; S596-L600 PolarHBondContact O-N 2.84Å; L597-L600 HydrophobicContact CD2-CD1 3.99Å; L597-L600 WeakPolarHBondContact O-CB 3.48Å; L597-L600 PolarHBondContact O-N 3.37Å; T598-L600 VanDerWaalsContact C-N 3.28Å; T598-L600 PolarHBondContact O-N 3.39Å; L600-L602 VanDerWaalsContact C-N 3.35Å; L600-L639 HydrophobicContact CD2-CB 3.97Å; L600-L639 HydrophobicContact CD2-CD1 4.45Å; L600-L639 HydrophobicContact CD2-CD2 3.45Å; L600-L639 VanDerWaalsContact CD2-CD2 3.45Å; L600-L639 HydrophobicContact CD2-CG 4.14Å; L600-Y754 HydrophobicContact CD2-CD2 4.41Å; L600-Y754 HydrophobicContact CD2-CE1 4.03Å; L600-Y754 HydrophobicContact CD2-CE2 3.61Å; L600-Y754 WeakPolarHBondContact CD2-OH 3.38Å; L600-Y754 HydrophobicContact CG-CE1 4.34Å; L600-T803 HydrophobicContact CD1-CG2 4.19Å; L600-T803 HydrophobicContact CD2-CG2 3.73Å
601	A	90.8	Very high	82.7	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-78.7	-8.7	179.8	0	0	0	0	0	114.8	L597 T598 H604 A643 I648 L667	L597-A601 WeakPolarHBondContact O-CB 3.42Å; L597-A601 PolarHBondContact O-N 3.19Å; T598-A601 CarbonylContact O-C 3.56Å; T598-A601 PolarHBondContact O-N 2.9Å; T598-A601 VanDerWaalsContact O-N 3.16Å; A601-H604 VanDerWaalsContact C-CD2 3.47Å; A601-H604 PolarHBondContact O-CD2 2.77Å; A601-H604 PolarHBondContact O-NE2 3.15Å; A601-A643 HydrophobicContact CB-CB 4.17Å; A601-I648 HydrophobicContact CB-CG2 4.08Å; A601-L667 HydrophobicContact CB-CD1 4.19Å; A601-L667 HydrophobicContact CB-CD2 3.84Å
602	L	91.7	Very high	81.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-101.7	-47.5	175.9	-70.8	171.9	0	0	0	112.5	T598 T599 L600 H604 L667 Y685 I702	T598-L602 WeakPolarHBondContact O-CB 3.44Å; T598-L602 VanDerWaalsContact O-CG 3.28Å; T598-L602 WeakPolarHBondContact O-CG 3.48Å; T598-L602 PolarHBondContact O-N 3.23Å; T599-L602 PolarHBondContact O-N 3.45Å; L600-L602 VanDerWaalsContact C-N 3.35Å; L602-H604 VanDerWaalsContact C-N 3.29Å; L602-H604 PolarHBondContact O-N 3.44Å; L602-L667 HydrophobicContact CD2-CD1 3.76Å; L602-L667 HydrophobicContact CD2-CG 4.48Å; L602-L667 HydrophobicContact CG-CD1 4Å; L602-Y685 HydrophobicContact CD1-CD1 3.72Å; L602-Y685 HydrophobicContact CD1-CE1 3.82Å; L602-Y685 HydrophobicContact CD1-CG 4.27Å; L602-Y685 HydrophobicContact CD2-CD1 3.87Å; L602-Y685 HydrophobicContact CD2-CD2 3.89Å; L602-Y685 HydrophobicContact CD2-CE1 4.49Å; L602-Y685 HydrophobicContact CD2-CG 3.54Å; L602-Y685 HydrophobicContact CG-CD1 4.44Å; L602-I702 HydrophobicContact CB-CD1 3.77Å; L602-I702 WeakPolarHBondContact O-CD1 3.3Å
603	C	91.1	Very high	79.3	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	-81.2	69.5	-171.3	-172.5	0	0	0	0	111.4	T599 I702 H714 K716	T599-C603 WeakPolarHBondContact O-CB 3.22Å; T599-C603 PolarHBondContact O-N 2.91Å; T599-C603 VanDerWaalsContact O-N 3.07Å; C603-I702 HydrophobicContact CB-CD1 4.02Å; C603-I702 HydrophobicContact CB-CG1 4.04Å; C603-H714 HydrophobicContact CB-CB 4.31Å; C603-K716 VanDerWaalsContact O-CD 3.31Å; C603-K716 WeakPolarHBondContact O-CD 3.33Å; C603-K716 WeakPolarHBondContact O-CE 3.23Å; C603-K716 PolarHBondContact O-NZ 3.24Å
604	H	90.8	Very high	77.3	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	24%	0.235	C	C	.	.			trans	-154.7	170.9	178.9	68.1	72.4	0	0	0	114.3	A601 L602 V606 E636 V640 F650 Y665	A601-H604 VanDerWaalsContact C-CD2 3.47Å; A601-H604 PolarHBondContact O-CD2 2.77Å; A601-H604 PolarHBondContact O-NE2 3.15Å; L602-H604 VanDerWaalsContact C-N 3.29Å; L602-H604 PolarHBondContact O-N 3.44Å; H604-V606 HydrophobicContact CB-CG2 4.08Å; H604-V606 WeakPolarHBondContact ND1-CB 3.28Å; H604-V606 PolarHBondContact ND1-N 2.59Å; H604-V606 VanDerWaalsContact ND1-N 3.15Å; H604-E636 HydrophobicContact CB-CB 4.47Å; H604-V640 HydrophobicContact CB-CG2 4.17Å; H604-V640 WeakPolarHBondContact CD2-CG2 3.34Å; H604-F650 AromaticContact CE1-CD1 3.72Å; H604-F650 AromaticContact CE1-CE1 3.66Å; H604-F650 AromaticContact CE1-CG 3.98Å; H604-F650 AromaticContact CE1-CZ 3.86Å; H604-F650 AromaticContact NE2-CG 3.94Å; H604-Y665 AromaticContact CE1-CE2 3.96Å; H604-Y665 PolarHBondContact O-OH 3.4Å
605	T	86.1	Confident	75.3	Confident	36 Å²	36	52.8 Å²	52.8	22%	0.221	26%	0.259	C	S	.	.			trans	-107.9	-1.5	175	55.2	0	0	0	0	114.8	E636 K653 V690 M700	T605-E636 PolarHBondContact N-OE2 3.46Å; T605-E636 PolarHBondContact OG1-OE2 2.86Å; T605-K653 PolarHBondContact O-NZ 2.65Å; T605-V690 HydrophobicContact CG2-CG1 4.49Å; T605-M700 HydrophobicContact CG2-CE 3.41Å; T605-M700 VanDerWaalsContact CG2-CE 3.41Å; T605-M700 HydrophobicContact CG2-SD 4.38Å
606	V	86	Confident	73.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.266	C	S	.	.			trans	-44.2	137	178.1	-170.3	0	0	0	0	113	H604 Y629 Q630 A631 E636 V640 K653	H604-V606 HydrophobicContact CB-CG2 4.08Å; H604-V606 WeakPolarHBondContact ND1-CB 3.28Å; H604-V606 PolarHBondContact ND1-N 2.59Å; H604-V606 VanDerWaalsContact ND1-N 3.15Å; V606-Y629 HydrophobicContact CG1-CD1 3.79Å; V606-Y629 HydrophobicContact CG1-CG 4.19Å; V606-Q630 CarbonylContact C-O 3.6Å; V606-Q630 WeakPolarHBondContact CA-O 3.31Å; V606-Q630 WeakPolarHBondContact CG1-O 3.45Å; V606-A631 HydrophobicContact CB-CB 4.35Å; V606-A631 HydrophobicContact CG1-CB 4.37Å; V606-A631 HydrophobicContact CG2-CB 3.81Å; V606-E636 HydrophobicContact CG2-CB 4.13Å; V606-V640 HydrophobicContact CB-CG2 4.42Å; V606-V640 HydrophobicContact CG2-CB 4.33Å; V606-V640 HydrophobicContact CG2-CG2 3.71Å; V606-K653 WeakPolarHBondContact O-CE 3.46Å; V606-K653 PolarHBondContact O-NZ 3.41Å
607	E	82.2	Confident	70.7	Confident	93 Å²	93	62.2 Å²	62.2	44%	0.435	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	155.7	175	-64.9	-176.4	167.1	0	0	110	Q630	E607-Q630 PolarHBondContact N-O 3.42Å; E607-Q630 PolarHBondContact O-N 3.12Å
608	V	79.8	Confident	68.1	Low	39 Å²	39	64.6 Å²	64.6	24%	0.236	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	135.6	178.1	177.4	0	0	0	0	108.4	F628 Y629 F650	V608-F628 WeakPolarHBondContact CA-O 3.06Å; V608-F628 HydrophobicContact CB-CZ 4.46Å; V608-F628 HydrophobicContact CG1-CD1 4.2Å; V608-F628 HydrophobicContact CG1-CD2 3.96Å; V608-F628 HydrophobicContact CG1-CE1 3.69Å; V608-F628 HydrophobicContact CG1-CE2 3.43Å; V608-F628 VanDerWaalsContact CG1-CE2 3.43Å; V608-F628 HydrophobicContact CG1-CG 4.34Å; V608-F628 HydrophobicContact CG1-CZ 3.29Å; V608-F628 HydrophobicContact CG2-CE1 4.02Å; V608-F628 HydrophobicContact CG2-CZ 4.33Å; V608-Y629 HydrophobicContact CG2-CD1 4.37Å; V608-Y629 HydrophobicContact CG2-CE1 4.33Å; V608-F650 HydrophobicContact CG2-CD1 4.05Å; V608-F650 HydrophobicContact CG2-CE1 4.06Å
609	S	67.3	Low	65.3	Low	11 Å²	11	70.8 Å²	70.8	8%	0.077	37%	0.369	C	S	.	.			trans	-73.9	125.3	-179.1	61.5	0	0	0	0	112.5	D611 S627 F628	S609-D611 VanDerWaalsContact C-N 3.29Å; S609-D611 PolarHBondContact O-N 2.82Å; S609-S627 PolarHBondContact OG-O 2.94Å; S609-F628 PolarHBondContact N-O 2.91Å; S609-F628 VanDerWaalsContact N-O 3.13Å
610	E	58.3	Low	62.5	Low	164 Å²	164	77.1 Å²	77.1	77%	0.766	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-66.4	-24.3	178.5	-66.7	176.7	-178.2	0	0	113.5	N612 E613	E610-N612 PolarHBondContact O-N 3.45Å; E610-E613 PolarHBondContact O-N 2.92Å
611	D	52.1	Low	59.8	Low	121 Å²	121	86.4 Å²	86.4	65%	0.647	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-63.1	-5.3	-174.2	-71.3	-20.5	0	0	0	115.2	S609	S609-D611 VanDerWaalsContact C-N 3.29Å; S609-D611 PolarHBondContact O-N 2.82Å
612	N	48.6	Very low	57.2	Low	47 Å²	47	92.5 Å²	92.5	25%	0.251	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-115.3	1.1	180	-71.4	-41.4	0	0	0	114.6	E610 E614 K615	E610-N612 PolarHBondContact O-N 3.45Å; N612-E614 PolarHBondContact O-N 3.27Å; N612-K615 PolarHBondContact O-N 3.43Å
613	E	40.2	Very low	54.8	Low	138 Å²	138	97.7 Å²	97.7	65%	0.645	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-59.9	-31.8	175.1	-71.4	-170.4	163.3	0	0	111.5	E610 K615	E610-E613 PolarHBondContact O-N 2.92Å; E613-K615 VanDerWaalsContact C-N 3.29Å; E613-K615 PolarHBondContact O-N 3.24Å
614	E	42.2	Very low	53	Low	189 Å²	189	101.7 Å²	101.7	88%	0.883	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-73.7	-12.8	176.6	-68.4	-174.8	166.2	0	0	114.4	N612	N612-E614 PolarHBondContact O-N 3.27Å
615	K	41.6	Very low	51.6	Low	154 Å²	154	103.9 Å²	103.9	67%	0.67	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-96.2	-0.9	179.6	-73.9	-174.5	-179.9	176.1	0	114.5	N612 E613 N617 G618	N612-K615 PolarHBondContact O-N 3.43Å; E613-K615 VanDerWaalsContact C-N 3.29Å; E613-K615 PolarHBondContact O-N 3.24Å; K615-N617 PolarHBondContact O-N 3.43Å; K615-G618 PolarHBondContact O-N 2.82Å
616	Q	40.2	Very low	50.3	Low	135 Å²	135	106.7 Å²	106.7	63%	0.631	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-7.8	179.4	-71.2	-177	-9.3	0	0	114.3
617	N	37.4	Very low	49	Very low	160 Å²	160	109.7 Å²	109.7	86%	0.856	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	5.9	178.3	-68.2	-24.5	0	0	0	114.7	K615	K615-N617 PolarHBondContact O-N 3.43Å
618	G	32.1	Very low	48.4	Very low	53 Å²	53	105.9 Å²	105.9	55%	0.546	57%	0.565	S	S	.	*	S	Bend	trans	-110.5	121.8	-178.3	0	0	0	0	0	113.4	K615 D620	K615-G618 PolarHBondContact O-N 2.82Å; G618-D620 PolarHBondContact O-N 2.92Å
619	T	31.1	Very low	48.4	Very low	140 Å²	140	104 Å²	104	86%	0.859	55%	0.554	S	S	*	*			trans	-70.1	60	177.5	52.5	0	0	0	0	113.4
620	D	32.9	Very low	48.8	Very low	136 Å²	136	105.8 Å²	105.8	73%	0.727	56%	0.561	S	S	*	*			trans	-111.6	89	169.7	-78.1	-22.2	0	0	0	109	G618 T622	G618-D620 PolarHBondContact O-N 2.92Å; D620-T622 PolarHBondContact O-N 3.39Å
621	E	32.9	Very low	49.6	Very low	196 Å²	196	99.5 Å²	99.5	92%	0.916	54%	0.536	S	S	*	.			trans	-69.2	39.1	-176	-68.8	-176.9	156.6	0	0	115.1
622	T	36.1	Very low	50.5	Low	129 Å²	129	98.5 Å²	98.5	79%	0.791	54%	0.535	S	S	*	.			trans	-135.9	63.5	164.1	29.2	0	0	0	0	109.7	D620 C624	D620-T622 PolarHBondContact O-N 3.39Å; T622-C624 PolarHBondContact O-N 3.41Å
623	M	41.9	Very low	51.8	Low	109 Å²	109	98 Å²	98	54%	0.537	54%	0.535	S	S	.	.			trans	-59.8	110.4	169.8	-164.1	171.7	154.4	0	0	108.5	L625 F628	M623-L625 VanDerWaalsContact C-N 3.31Å; M623-L625 PolarHBondContact O-N 3.2Å; M623-F628 HydrophobicContact CE-CB 4.17Å; M623-F628 HydrophobicContact CE-CD1 4.13Å; M623-F628 HydrophobicContact CE-CD2 3.17Å; M623-F628 HydrophobicContact CE-CE1 4.29Å; M623-F628 HydrophobicContact CE-CE2 3.37Å; M623-F628 HydrophobicContact CE-CG 3.57Å; M623-F628 HydrophobicContact CE-CZ 3.93Å
624	C	53	Low	53.5	Low	85 Å²	85	93.9 Å²	93.9	57%	0.574	52%	0.521	S	S	*	.			trans	-67	89.9	175.5	-108.9	0	0	0	0	108.8	T622 D626 S627 F628	T622-C624 PolarHBondContact O-N 3.41Å; C624-D626 PolarHBondContact O-N 2.85Å; C624-S627 PolarHBondContact O-N 3.15Å; C624-S627 PolarHBondContact O-OG 3.47Å; C624-F628 PolarHBondContact O-N 3.31Å
625	L	61	Low	55.5	Low	47 Å²	47	86.5 Å²	86.5	25%	0.246	49%	0.487	C	S	.	.	H	α-helix	trans	-48	-30.2	176.6	-75.4	154.9	0	0	0	112.4	M623 S627 F628 Y629 A644	M623-L625 VanDerWaalsContact C-N 3.31Å; M623-L625 PolarHBondContact O-N 3.2Å; L625-S627 PolarHBondContact O-N 3.3Å; L625-F628 PolarHBondContact O-N 2.97Å; L625-Y629 HydrophobicContact CD2-CE2 3.92Å; L625-Y629 WeakPolarHBondContact O-CD2 3.31Å; L625-Y629 PolarHBondContact O-N 3.45Å; L625-A644 HydrophobicContact CD2-CB 4.18Å
626	D	59	Low	57.6	Low	95 Å²	95	79.8 Å²	79.8	51%	0.508	46%	0.458	S	S	.	.	H	α-helix	trans	-64.7	-31	176.3	-77.8	-26.5	0	0	0	114.7	C624 K637 I641	C624-D626 PolarHBondContact O-N 2.85Å; D626-K637 WeakPolarHBondContact O-CE 3.24Å; D626-K637 PolarHBondContact O-NZ 2.89Å; D626-I641 WeakPolarHBondContact OD1-CD1 3.34Å
627	S	58.8	Low	59.7	Low	63 Å²	63	75.9 Å²	75.9	44%	0.441	44%	0.439	S	S	.	.	H	α-helix	trans	-86.5	-25	176.1	58.2	0	0	0	0	112.2	S609 C624 L625	S609-S627 PolarHBondContact OG-O 2.94Å; C624-S627 PolarHBondContact O-N 3.15Å; C624-S627 PolarHBondContact O-OG 3.47Å; L625-S627 PolarHBondContact O-N 3.3Å
628	F	70.4	Confident	62.1	Low	12 Å²	12	68.4 Å²	68.4	5%	0.053	40%	0.4	C	S	.	.	H	α-helix	trans	-69.4	-43.2	-179.2	-172	-107.2	0	0	0	112.7	V608 S609 M623 C624 L625	V608-F628 WeakPolarHBondContact CA-O 3.06Å; V608-F628 HydrophobicContact CB-CZ 4.46Å; V608-F628 HydrophobicContact CG1-CD1 4.2Å; V608-F628 HydrophobicContact CG1-CD2 3.96Å; V608-F628 HydrophobicContact CG1-CE1 3.69Å; V608-F628 HydrophobicContact CG1-CE2 3.43Å; V608-F628 VanDerWaalsContact CG1-CE2 3.43Å; V608-F628 HydrophobicContact CG1-CG 4.34Å; V608-F628 HydrophobicContact CG1-CZ 3.29Å; V608-F628 HydrophobicContact CG2-CE1 4.02Å; V608-F628 HydrophobicContact CG2-CZ 4.33Å; S609-F628 PolarHBondContact N-O 2.91Å; S609-F628 VanDerWaalsContact N-O 3.13Å; M623-F628 HydrophobicContact CE-CB 4.17Å; M623-F628 HydrophobicContact CE-CD1 4.13Å; M623-F628 HydrophobicContact CE-CD2 3.17Å; M623-F628 HydrophobicContact CE-CE1 4.29Å; M623-F628 HydrophobicContact CE-CE2 3.37Å; M623-F628 HydrophobicContact CE-CG 3.57Å; M623-F628 HydrophobicContact CE-CZ 3.93Å; C624-F628 PolarHBondContact O-N 3.31Å; L625-F628 PolarHBondContact O-N 2.97Å
629	Y	79.8	Confident	64.9	Low	0 Å²	0	66 Å²	66	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	127.6	-179.5	-65.6	-63.6	0	0	0	113	V606 V608 L625 K637 V640 I641 A644 Q649 F650	V606-Y629 HydrophobicContact CG1-CD1 3.79Å; V606-Y629 HydrophobicContact CG1-CG 4.19Å; V608-Y629 HydrophobicContact CG2-CD1 4.37Å; V608-Y629 HydrophobicContact CG2-CE1 4.33Å; L625-Y629 HydrophobicContact CD2-CE2 3.92Å; L625-Y629 WeakPolarHBondContact O-CD2 3.31Å; L625-Y629 PolarHBondContact O-N 3.45Å; Y629-K637 WeakPolarHBondContact O-CE 3.41Å; Y629-K637 PolarHBondContact O-NZ 3.31Å; Y629-V640 HydrophobicContact CD1-CG1 4.1Å; Y629-V640 HydrophobicContact CE1-CG1 3.84Å; Y629-V640 HydrophobicContact CE2-CG1 4.34Å; Y629-V640 HydrophobicContact CG-CG1 4.46Å; Y629-I641 HydrophobicContact CD2-CG1 3.76Å; Y629-I641 HydrophobicContact CE2-CG1 4.41Å; Y629-A644 HydrophobicContact CE2-CB 4.25Å; Y629-Q649 VanDerWaalsContact OH-CG 3.26Å; Y629-Q649 WeakPolarHBondContact OH-CG 3.25Å; Y629-F650 HydrophobicContact CD1-CD1 4.49Å; Y629-F650 HydrophobicContact CE1-CB 3.94Å; Y629-F650 AromaticContact CE1-CD1 4Å; Y629-F650 HydrophobicContact CE1-CD1 4Å; Y629-F650 HydrophobicContact CE1-CG 4.48Å; Y629-F650 VanDerWaalsContact CE1-O 3.28Å; Y629-F650 WeakPolarHBondContact CE1-O 3.48Å; Y629-F650 PolarHBondContact OH-N 2.8Å; Y629-F650 PolarHBondContact OH-O 2.92Å
630	Q	75.1	Confident	67.7	Low	49 Å²	49	59.4 Å²	59.4	23%	0.229	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	130.8	174.2	-61.4	-172.4	3	0	0	109.9	N287 V606 E607	N287-Q630 PolarHBondContact ND2-OE1 3.22Å; V606-Q630 CarbonylContact C-O 3.6Å; V606-Q630 WeakPolarHBondContact CA-O 3.31Å; V606-Q630 WeakPolarHBondContact CG1-O 3.45Å; E607-Q630 PolarHBondContact N-O 3.42Å; E607-Q630 PolarHBondContact O-N 3.12Å
631	A	76.4	Confident	70.3	Confident	31 Å²	31	53.5 Å²	53.5	26%	0.256	30%	0.302	S	S	.	.			trans	-141.3	151.8	179.7	0	0	0	0	0	110.5	V606 S633 K637	V606-A631 HydrophobicContact CB-CB 4.35Å; V606-A631 HydrophobicContact CG1-CB 4.37Å; V606-A631 HydrophobicContact CG2-CB 3.81Å; A631-S633 VanDerWaalsContact C-N 3.32Å; A631-S633 WeakPolarHBondContact CB-O 3.48Å; A631-K637 HydrophobicContact CB-CB 3.82Å
632	T	70.3	Confident	72.7	Confident	101 Å²	101	44.4 Å²	44.4	62%	0.62	26%	0.261	S	S	*	.	S	Bend	trans	-70	-33	170.6	50.8	0	0	0	0	111.6
633	S	75	Confident	75.1	Confident	35 Å²	35	38.3 Å²	38.3	25%	0.245	22%	0.223	C	C	.	.	S	Bend	trans	-110.8	125.8	176.6	172.3	0	0	0	0	111.1	A631 D635 E636 K637	A631-S633 VanDerWaalsContact C-N 3.32Å; A631-S633 WeakPolarHBondContact CB-O 3.48Å; S633-D635 VanDerWaalsContact C-N 3.26Å; S633-D635 PolarHBondContact O-N 3.07Å; S633-D635 PolarHBondContact OG-N 3.5Å; S633-E636 PolarHBondContact O-N 3.25Å; S633-K637 PolarHBondContact O-N 3.11Å
634	P	77	Confident	77	Confident	53 Å²	53	33.8 Å²	33.8	34%	0.344	20%	0.203	S	C	.	.	H	α-helix	trans	-67.3	-27.6	177.8	29	-35.1	0	0	0	112.3	M447 E636 K637 A638	M447-P634 HydrophobicContact CB-CB 4.37Å; M447-P634 HydrophobicContact CG-CB 3.78Å; M447-P634 HydrophobicContact CG-CG 4.09Å; P634-E636 VanDerWaalsContact C-N 3.34Å; P634-E636 PolarHBondContact O-N 3.34Å; P634-K637 PolarHBondContact O-N 2.99Å; P634-A638 WeakPolarHBondContact O-CB 3.47Å; P634-A638 PolarHBondContact O-N 3.37Å
635	D	82.7	Confident	78.1	Confident	33 Å²	33	33.4 Å²	33.4	18%	0.176	19%	0.192	C	C	.	.	H	α-helix	trans	-62.4	-42.9	175.3	-60.8	-15.9	0	0	0	110.2	M447 S633 A638 L639 R750	M447-D635 WeakPolarHBondContact CE-OD1 3.35Å; S633-D635 VanDerWaalsContact C-N 3.26Å; S633-D635 PolarHBondContact O-N 3.07Å; S633-D635 PolarHBondContact OG-N 3.5Å; D635-A638 WeakPolarHBondContact O-CB 2.88Å; D635-A638 PolarHBondContact O-N 2.91Å; D635-L639 VanDerWaalsContact O-CD1 3.32Å; D635-L639 WeakPolarHBondContact O-CD1 2.84Å; D635-L639 WeakPolarHBondContact O-CG 3.42Å; D635-L639 PolarHBondContact O-N 2.98Å; D635-L639 VanDerWaalsContact O-N 3.07Å; D635-R750 IonicContact OD1-NH1 3.37Å; D635-R750 PolarHBondContact OD1-NH1 2.82Å; D635-R750 IonicContact OD2-NH1 3.51Å
636	E	86.3	Confident	78.8	Confident	13 Å²	13	31.4 Å²	31.4	6%	0.061	18%	0.182	C	C	.	.	H	α-helix	trans	-65.2	-43.4	176.9	-60.4	-164.1	159.2	0	0	111.9	H604 T605 V606 S633 P634 A638 L639 V640 M700 K716	H604-E636 HydrophobicContact CB-CB 4.47Å; T605-E636 PolarHBondContact N-OE2 3.46Å; T605-E636 PolarHBondContact OG1-OE2 2.86Å; V606-E636 HydrophobicContact CG2-CB 4.13Å; S633-E636 PolarHBondContact O-N 3.25Å; P634-E636 VanDerWaalsContact C-N 3.34Å; P634-E636 PolarHBondContact O-N 3.34Å; E636-A638 VanDerWaalsContact C-N 3.32Å; E636-A638 PolarHBondContact O-N 2.95Å; E636-L639 PolarHBondContact O-N 2.7Å; E636-V640 WeakPolarHBondContact O-CG2 3.24Å; E636-V640 PolarHBondContact O-N 2.93Å; E636-M700 VanDerWaalsContact OE1-CE 3.23Å; E636-M700 WeakPolarHBondContact OE1-CE 3.45Å; E636-K716 VanDerWaalsContact CG-NZ 3.27Å; E636-K716 VanDerWaalsContact OE1-CE 3.31Å; E636-K716 WeakPolarHBondContact OE1-CE 3.31Å; E636-K716 IonicContact OE1-NZ 3.6Å; E636-K716 PolarHBondContact OE1-NZ 3.23Å; E636-K716 IonicContact OE2-NZ 2.73Å
637	K	85.7	Confident	79.4	Confident	53 Å²	53	27.3 Å²	27.3	23%	0.23	16%	0.162	C	C	.	.	H	α-helix	trans	-58.5	-45.6	175.5	178.8	169.9	174.8	164.2	0	111.1	D626 Y629 A631 S633 P634 L639 V640 I641	D626-K637 WeakPolarHBondContact O-CE 3.24Å; D626-K637 PolarHBondContact O-NZ 2.89Å; Y629-K637 WeakPolarHBondContact O-CE 3.41Å; Y629-K637 PolarHBondContact O-NZ 3.31Å; A631-K637 HydrophobicContact CB-CB 3.82Å; S633-K637 PolarHBondContact O-N 3.11Å; P634-K637 PolarHBondContact O-N 2.99Å; K637-L639 VanDerWaalsContact C-N 3.3Å; K637-L639 PolarHBondContact O-N 3.33Å; K637-V640 PolarHBondContact O-N 3.26Å; K637-I641 HydrophobicContact CD-CD1 4.3Å; K637-I641 HydrophobicContact CG-CD1 3.58Å; K637-I641 HydrophobicContact CG-CG1 4.3Å; K637-I641 WeakPolarHBondContact O-CB 3.49Å; K637-I641 VanDerWaalsContact O-CG1 3.23Å; K637-I641 WeakPolarHBondContact O-CG1 3.28Å; K637-I641 PolarHBondContact O-N 3.16Å
638	A	87.3	Confident	80.6	Confident	4 Å²	4	24.3 Å²	24.3	3%	0.033	14%	0.141	C	C	.	.	H	α-helix	trans	-59.7	-40.4	177.9	0	0	0	0	0	112.6	M447 P634 D635 E636 G642 V805	M447-A638 HydrophobicContact CB-CB 3.74Å; M447-A638 WeakPolarHBondContact O-CB 3.32Å; P634-A638 WeakPolarHBondContact O-CB 3.47Å; P634-A638 PolarHBondContact O-N 3.37Å; D635-A638 WeakPolarHBondContact O-CB 2.88Å; D635-A638 PolarHBondContact O-N 2.91Å; E636-A638 VanDerWaalsContact C-N 3.32Å; E636-A638 PolarHBondContact O-N 2.95Å; A638-G642 PolarHBondContact O-N 2.69Å; A638-V805 HydrophobicContact CB-CG1 3.96Å
639	L	90.8	Very high	81.3	Confident	2 Å²	2	26 Å²	26	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-68.5	-44	179.4	-67	161.4	0	0	0	111.7	L449 L600 D635 E636 K637 G642 A643 L752 Y754 T803 V805	L449-L639 HydrophobicContact CD1-CD2 3.83Å; L449-L639 HydrophobicContact CD2-CD2 4.45Å; L600-L639 HydrophobicContact CD2-CB 3.97Å; L600-L639 HydrophobicContact CD2-CD1 4.45Å; L600-L639 HydrophobicContact CD2-CD2 3.45Å; L600-L639 VanDerWaalsContact CD2-CD2 3.45Å; L600-L639 HydrophobicContact CD2-CG 4.14Å; D635-L639 VanDerWaalsContact O-CD1 3.32Å; D635-L639 WeakPolarHBondContact O-CD1 2.84Å; D635-L639 WeakPolarHBondContact O-CG 3.42Å; D635-L639 PolarHBondContact O-N 2.98Å; D635-L639 VanDerWaalsContact O-N 3.07Å; E636-L639 PolarHBondContact O-N 2.7Å; K637-L639 VanDerWaalsContact C-N 3.3Å; K637-L639 PolarHBondContact O-N 3.33Å; L639-G642 PolarHBondContact O-N 3.3Å; L639-A643 PolarHBondContact O-N 2.79Å; L639-L752 HydrophobicContact CD1-CD1 3.77Å; L639-Y754 WeakPolarHBondContact CD1-OH 3.28Å; L639-T803 HydrophobicContact CD2-CG2 3.89Å; L639-V805 HydrophobicContact CD2-CG2 3.92Å; L639-V805 HydrophobicContact CG-CG2 4.31Å
640	V	89.8	Confident	81.7	Confident	1 Å²	1	26 Å²	26	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-67.8	-41.3	177	176	0	0	0	0	111.4	H604 V606 Y629 E636 K637 G642 A643 A644 F650	H604-V640 HydrophobicContact CB-CG2 4.17Å; H604-V640 WeakPolarHBondContact CD2-CG2 3.34Å; V606-V640 HydrophobicContact CB-CG2 4.42Å; V606-V640 HydrophobicContact CG2-CB 4.33Å; V606-V640 HydrophobicContact CG2-CG2 3.71Å; Y629-V640 HydrophobicContact CD1-CG1 4.1Å; Y629-V640 HydrophobicContact CE1-CG1 3.84Å; Y629-V640 HydrophobicContact CE2-CG1 4.34Å; Y629-V640 HydrophobicContact CG-CG1 4.46Å; E636-V640 WeakPolarHBondContact O-CG2 3.24Å; E636-V640 PolarHBondContact O-N 2.93Å; K637-V640 PolarHBondContact O-N 3.26Å; V640-G642 VanDerWaalsContact C-N 3.31Å; V640-G642 PolarHBondContact O-N 3.45Å; V640-A643 PolarHBondContact O-N 2.77Å; V640-A644 WeakPolarHBondContact O-CB 3.45Å; V640-A644 PolarHBondContact O-N 3.26Å; V640-F650 HydrophobicContact CG1-CB 4.1Å
641	I	86.2	Confident	82	Confident	12 Å²	12	26.1 Å²	26.1	6%	0.062	15%	0.15	C	C	.	.	H	α-helix	trans	-63.4	-40.4	173.2	-69.1	171.7	0	0	0	110.5	D626 Y629 K637 A643 A644 K645	D626-I641 WeakPolarHBondContact OD1-CD1 3.34Å; Y629-I641 HydrophobicContact CD2-CG1 3.76Å; Y629-I641 HydrophobicContact CE2-CG1 4.41Å; K637-I641 HydrophobicContact CD-CD1 4.3Å; K637-I641 HydrophobicContact CG-CD1 3.58Å; K637-I641 HydrophobicContact CG-CG1 4.3Å; K637-I641 WeakPolarHBondContact O-CB 3.49Å; K637-I641 VanDerWaalsContact O-CG1 3.23Å; K637-I641 WeakPolarHBondContact O-CG1 3.28Å; K637-I641 PolarHBondContact O-N 3.16Å; I641-A643 VanDerWaalsContact C-N 3.34Å; I641-A643 PolarHBondContact O-N 2.95Å; I641-A644 PolarHBondContact O-N 3.13Å; I641-K645 HydrophobicContact CG2-CD 4.31Å; I641-K645 HydrophobicContact CG2-CG 4.39Å; I641-K645 WeakPolarHBondContact O-CB 3.49Å; I641-K645 WeakPolarHBondContact O-CG 3.34Å; I641-K645 PolarHBondContact O-N 2.83Å
642	G	83.5	Confident	82.3	Confident	6 Å²	6	25 Å²	25	6%	0.062	14%	0.142	C	C	.	.	H	α-helix	trans	-60.1	-42.2	174.6	0	0	0	0	0	112.4	A638 L639 V640 L646	A638-G642 PolarHBondContact O-N 2.69Å; L639-G642 PolarHBondContact O-N 3.3Å; V640-G642 VanDerWaalsContact C-N 3.31Å; V640-G642 PolarHBondContact O-N 3.45Å; G642-L646 WeakPolarHBondContact O-CD1 3.21Å; G642-L646 VanDerWaalsContact O-CG 3.32Å; G642-L646 WeakPolarHBondContact O-CG 3.48Å; G642-L646 PolarHBondContact O-N 2.95Å
643	A	86.5	Confident	82.8	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.4	-42	173.5	0	0	0	0	0	112.2	A601 L639 V640 I641 L646 G647 I648	A601-A643 HydrophobicContact CB-CB 4.17Å; L639-A643 PolarHBondContact O-N 2.79Å; V640-A643 PolarHBondContact O-N 2.77Å; I641-A643 VanDerWaalsContact C-N 3.34Å; I641-A643 PolarHBondContact O-N 2.95Å; A643-L646 CarbonylContact O-C 3.57Å; A643-L646 WeakPolarHBondContact O-CA 3.2Å; A643-L646 PolarHBondContact O-N 3.18Å; A643-L646 VanDerWaalsContact O-N 3.08Å; A643-G647 PolarHBondContact O-N 3.48Å; A643-I648 CarbonylContact C-O 3.56Å; A643-I648 PolarHBondContact O-N 2.85Å
644	A	83.3	Confident	83	Confident	14 Å²	14	24.8 Å²	24.8	12%	0.116	13%	0.13	C	C	.	.	H	α-helix	trans	-63.8	-42.2	177.3	0	0	0	0	0	112.5	L625 Y629 V640 I641 L646 G647 I648	L625-A644 HydrophobicContact CD2-CB 4.18Å; Y629-A644 HydrophobicContact CE2-CB 4.25Å; V640-A644 WeakPolarHBondContact O-CB 3.45Å; V640-A644 PolarHBondContact O-N 3.26Å; I641-A644 PolarHBondContact O-N 3.13Å; A644-L646 PolarHBondContact O-N 2.91Å; A644-G647 PolarHBondContact O-N 3.28Å; A644-I648 WeakPolarHBondContact CA-O 3.42Å; A644-I648 PolarHBondContact N-O 3.25Å; A644-I648 VanDerWaalsContact N-O 3.14Å
645	K	75.9	Confident	82.6	Confident	77 Å²	77	28.8 Å²	28.8	34%	0.335	15%	0.148	S	C	.	.	H	α-helix	trans	-61.4	-22.6	173.6	-75.8	-178.5	178.5	-178	0	113.2	D465 I641	D465-K645 IonicContact OD1-NZ 3.5Å; D465-K645 IonicContact OD2-NZ 2.68Å; D465-K645 PolarHBondContact OD2-NZ 2.93Å; I641-K645 HydrophobicContact CG2-CD 4.31Å; I641-K645 HydrophobicContact CG2-CG 4.39Å; I641-K645 WeakPolarHBondContact O-CB 3.49Å; I641-K645 WeakPolarHBondContact O-CG 3.34Å; I641-K645 PolarHBondContact O-N 2.83Å
646	L	74.7	Confident	82	Confident	6 Å²	6	29 Å²	29	3%	0.031	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	8.3	178.2	-69.7	172.3	0	0	0	113.3	I452 L463 I516 L597 G642 A643 A644	I452-L646 HydrophobicContact CD1-CD1 4.33Å; L463-L646 HydrophobicContact CD1-CD1 4.25Å; L463-L646 HydrophobicContact CD2-CD1 3.7Å; L463-L646 HydrophobicContact CD2-CD2 3.61Å; L463-L646 HydrophobicContact CD2-CG 3.87Å; I516-L646 HydrophobicContact CD1-CD2 3.32Å; I516-L646 HydrophobicContact CG1-CD2 3.5Å; L597-L646 HydrophobicContact CD1-CB 3.77Å; L597-L646 HydrophobicContact CD1-CD1 3.9Å; L597-L646 HydrophobicContact CD1-CG 4.45Å; L597-L646 HydrophobicContact CD2-CB 4.35Å; L597-L646 HydrophobicContact CD2-CD1 3.39Å; L597-L646 HydrophobicContact CG-CD1 4.28Å; G642-L646 WeakPolarHBondContact O-CD1 3.21Å; G642-L646 VanDerWaalsContact O-CG 3.32Å; G642-L646 WeakPolarHBondContact O-CG 3.48Å; G642-L646 PolarHBondContact O-N 2.95Å; A643-L646 CarbonylContact O-C 3.57Å; A643-L646 WeakPolarHBondContact O-CA 3.2Å; A643-L646 PolarHBondContact O-N 3.18Å; A643-L646 VanDerWaalsContact O-N 3.08Å; A644-L646 PolarHBondContact O-N 2.91Å
647	G	72.7	Confident	81	Confident	9 Å²	9	37.6 Å²	37.6	9%	0.093	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.3	10.9	173.4	0	0	0	0	0	115.7	A643 A644 D670 L673	A643-G647 PolarHBondContact O-N 3.48Å; A644-G647 PolarHBondContact O-N 3.28Å; G647-D670 WeakPolarHBondContact O-CB 3.23Å; G647-D670 PolarHBondContact O-N 2.93Å; G647-L673 WeakPolarHBondContact O-CD1 3.49Å
648	I	83.7	Confident	79.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	99.1	174.2	-52.7	-174.7	0	0	0	109.6	I594 L597 T598 A601 A643 A644 L667 E668 Y669 L673	I594-I648 HydrophobicContact CG2-CD1 4.33Å; L597-I648 HydrophobicContact CB-CD1 3.58Å; L597-I648 HydrophobicContact CB-CG1 4.5Å; T598-I648 HydrophobicContact CG2-CD1 3.67Å; A601-I648 HydrophobicContact CB-CG2 4.08Å; A643-I648 CarbonylContact C-O 3.56Å; A643-I648 PolarHBondContact O-N 2.85Å; A644-I648 WeakPolarHBondContact CA-O 3.42Å; A644-I648 PolarHBondContact N-O 3.25Å; A644-I648 VanDerWaalsContact N-O 3.14Å; I648-L667 HydrophobicContact CG2-CD1 4.42Å; I648-E668 WeakPolarHBondContact CA-O 3.5Å; I648-Y669 HydrophobicContact CD1-CD1 4.2Å; I648-Y669 HydrophobicContact CD1-CE1 3.81Å; I648-Y669 HydrophobicContact CG1-CD1 4.06Å; I648-Y669 HydrophobicContact CG1-CE1 4.13Å; I648-Y669 HydrophobicContact CG2-CE1 4.32Å; I648-L673 HydrophobicContact CG1-CD1 4.07Å
649	Q	84.9	Confident	78.6	Confident	48 Å²	48	45.8 Å²	45.8	22%	0.224	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	134.6	-173.6	-173.2	171.9	-20.6	0	0	112	Y629 M651 L667 E668	Y629-Q649 VanDerWaalsContact OH-CG 3.26Å; Y629-Q649 WeakPolarHBondContact OH-CG 3.25Å; Q649-M651 HydrophobicContact CG-SD 4Å; Q649-L667 CarbonylContact O-C 3.55Å; Q649-L667 WeakPolarHBondContact O-CA 3.42Å; Q649-E668 HydrophobicContact CB-CB 4.38Å; Q649-E668 PolarHBondContact N-O 2.89Å; Q649-E668 PolarHBondContact O-N 2.93Å
650	F	87.5	Confident	77.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	116.7	175.3	175.3	-110.7	0	0	0	111.3	H604 V608 Y629 V640 G652 K653 Y665 L667	H604-F650 AromaticContact CE1-CD1 3.72Å; H604-F650 AromaticContact CE1-CE1 3.66Å; H604-F650 AromaticContact CE1-CG 3.98Å; H604-F650 AromaticContact CE1-CZ 3.86Å; H604-F650 AromaticContact NE2-CG 3.94Å; V608-F650 HydrophobicContact CG2-CD1 4.05Å; V608-F650 HydrophobicContact CG2-CE1 4.06Å; Y629-F650 HydrophobicContact CD1-CD1 4.49Å; Y629-F650 HydrophobicContact CE1-CB 3.94Å; Y629-F650 AromaticContact CE1-CD1 4Å; Y629-F650 HydrophobicContact CE1-CD1 4Å; Y629-F650 HydrophobicContact CE1-CG 4.48Å; Y629-F650 VanDerWaalsContact CE1-O 3.28Å; Y629-F650 WeakPolarHBondContact CE1-O 3.48Å; Y629-F650 PolarHBondContact OH-N 2.8Å; Y629-F650 PolarHBondContact OH-O 2.92Å; V640-F650 HydrophobicContact CG1-CB 4.1Å; F650-G652 WeakPolarHBondContact CE2-O 3.46Å; F650-G652 WeakPolarHBondContact CZ-O 3.39Å; F650-K653 HydrophobicContact CZ-CG 3.72Å; F650-Y665 HydrophobicContact CD2-CD2 4.2Å; F650-Y665 HydrophobicContact CE2-CD1 4.45Å; F650-Y665 AromaticContact CE2-CD2 3.36Å; F650-Y665 HydrophobicContact CE2-CD2 3.36Å; F650-Y665 AromaticContact CE2-CE2 3.99Å; F650-Y665 HydrophobicContact CE2-CE2 3.99Å; F650-Y665 AromaticContact CE2-CG 3.64Å; F650-Y665 HydrophobicContact CE2-CG 3.64Å; F650-Y665 AromaticContact CZ-CD2 3.9Å; F650-Y665 HydrophobicContact CZ-CD2 3.9Å; F650-Y665 HydrophobicContact CZ-CE2 4.08Å; F650-Y665 HydrophobicContact CZ-CG 4.22Å; F650-L667 HydrophobicContact CB-CD2 3.93Å; F650-L667 HydrophobicContact CD2-CD2 3.82Å; F650-L667 HydrophobicContact CG-CD2 4.39Å
651	M	82.2	Confident	76	Confident	51 Å²	51	56.2 Å²	56.2	25%	0.251	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-5	-170.5	-65.4	-59.7	-79.5	0	0	114.3	Q649 R666 E668	Q649-M651 HydrophobicContact CG-SD 4Å; M651-R666 HydrophobicContact CB-CB 4.15Å; M651-R666 PolarHBondContact N-O 2.62Å; M651-E668 HydrophobicContact CG-CB 3.98Å
652	G	81.9	Confident	75.4	Confident	7 Å²	7	55.7 Å²	55.7	7%	0.072	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	123.4	-172.3	176.5	0	0	0	0	0	114.2	F650 R666	F650-G652 WeakPolarHBondContact CE2-O 3.46Å; F650-G652 WeakPolarHBondContact CZ-O 3.39Å; G652-R666 PolarHBondContact O-N 3.09Å
653	K	81.3	Confident	75.3	Confident	60 Å²	60	61 Å²	61	26%	0.261	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	129.7	-173.2	-53.5	175.6	-170.4	163.3	0	109.8	T605 V606 F650 I664 Y665	T605-K653 PolarHBondContact O-NZ 2.65Å; V606-K653 WeakPolarHBondContact O-CE 3.46Å; V606-K653 PolarHBondContact O-NZ 3.41Å; F650-K653 HydrophobicContact CZ-CG 3.72Å; K653-I664 CarbonylContact C-O 3.56Å; K653-I664 WeakPolarHBondContact CA-O 3.46Å; K653-Y665 HydrophobicContact CB-CE1 4.43Å; K653-Y665 HydrophobicContact CD-CE1 3.76Å; K653-Y665 WeakPolarHBondContact CE-OH 3.46Å; K653-Y665 HydrophobicContact CG-CD1 3.99Å; K653-Y665 HydrophobicContact CG-CE1 3.65Å
654	L	78.9	Confident	75.3	Confident	71 Å²	71	62.4 Å²	62.4	37%	0.372	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	147	168.9	-68.2	162.1	0	0	0	109.8	R663 I664 R666	L654-R663 WeakPolarHBondContact O-CA 3.2Å; L654-I664 HydrophobicContact CB-CB 4.24Å; L654-I664 PolarHBondContact N-O 3.45Å; L654-I664 PolarHBondContact O-N 2.89Å; L654-R666 HydrophobicContact CD1-CG 4.29Å
655	L	69.4	Low	75.5	Confident	138 Å²	138	61.8 Å²	61.8	72%	0.723	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	129.5	168.9	-77.3	162.4	0	0	0	108.4	E657	L655-E657 PolarHBondContact O-N 3.42Å
656	N	68.7	Low	76	Confident	38 Å²	38	62.2 Å²	62.2	20%	0.203	31%	0.312	C	S	.	.			trans	-78.2	116.9	173	-169.7	-0.3	0	0	0	108.8	N658 N659 S662 I664	N656-N658 PolarHBondContact O-N 3.43Å; N656-N658 VanDerWaalsContact O-N 3.13Å; N656-N658 PolarHBondContact OD1-N 3.35Å; N656-N659 CarbonylContact O-C 3.52Å; N656-N659 PolarHBondContact O-N 3.18Å; N656-S662 WeakPolarHBondContact CB-OG 3.48Å; N656-S662 PolarHBondContact N-O 2.93Å; N656-S662 PolarHBondContact ND2-OG 2.65Å; N656-I664 HydrophobicContact CB-CD1 4.27Å; N656-I664 HydrophobicContact CB-CG1 4.26Å
657	E	65.8	Low	76.6	Confident	192 Å²	192	61.9 Å²	61.9	90%	0.897	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.2	-178.7	-63.6	-175	164	0	0	112.5	L655	L655-E657 PolarHBondContact O-N 3.42Å
658	N	61.1	Low	77.2	Confident	141 Å²	141	63.6 Å²	63.6	75%	0.754	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-20.2	-176.3	-64.9	-29.3	0	0	0	114	N656	N656-N658 PolarHBondContact O-N 3.43Å; N656-N658 VanDerWaalsContact O-N 3.13Å; N656-N658 PolarHBondContact OD1-N 3.35Å
659	N	62.4	Low	77.1	Confident	89 Å²	89	64.2 Å²	64.2	48%	0.476	32%	0.318	S	S	.	.			trans	-150.7	108.7	-177.7	-104.8	-17.1	0	0	0	110.1	N656 H661 S662	N656-N659 CarbonylContact O-C 3.52Å; N656-N659 PolarHBondContact O-N 3.18Å; N659-H661 PolarHBondContact O-N 2.9Å; N659-S662 WeakPolarHBondContact CB-OG 3.21Å; N659-S662 PolarHBondContact O-N 3.1Å; N659-S662 PolarHBondContact O-OG 3.48Å
660	S	59.8	Low	76.4	Confident	98 Å²	98	65 Å²	65	69%	0.685	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-18.8	-178.7	58.1	0	0	0	0	114.5
661	H	65.5	Low	75	Confident	124 Å²	124	69.3 Å²	69.3	57%	0.574	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-19.8	178.4	-63.2	-62.8	0	0	0	114.3	N659 Y772	N659-H661 PolarHBondContact O-N 2.9Å; H661-Y772 HydrophobicContact CB-CE1 3.63Å; H661-Y772 WeakPolarHBondContact CB-OH 3.48Å; H661-Y772 AromaticContact CG-CE1 3.77Å
662	S	74.1	Confident	73.6	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.007	36%	0.358	C	S	.	.			trans	-94	142.9	-176.3	65.7	0	0	0	0	112.2	N656 N659	N656-S662 WeakPolarHBondContact CB-OG 3.48Å; N656-S662 PolarHBondContact N-O 2.93Å; N656-S662 PolarHBondContact ND2-OG 2.65Å; N659-S662 WeakPolarHBondContact CB-OG 3.21Å; N659-S662 PolarHBondContact O-N 3.1Å; N659-S662 PolarHBondContact O-OG 3.48Å
663	R	81.5	Confident	72.4	Confident	116 Å²	116	73.3 Å²	73.3	44%	0.438	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	140.4	179.9	-62.4	177.4	-178	163.5	0.6	109.8	L654 Y665 I687	L654-R663 WeakPolarHBondContact O-CA 3.2Å; R663-Y665 HydrophobicContact CB-CD1 4.35Å; R663-Y665 HydrophobicContact CB-CE1 4.12Å; R663-I687 PolarHBondContact N-O 2.88Å; R663-I687 PolarHBondContact O-N 3.43Å
664	I	85.5	Confident	71	Confident	31 Å²	31	74.8 Å²	74.8	16%	0.159	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	119.8	175.4	-57.8	170	0	0	0	108.1	K653 L654 N656 E684 Y685	K653-I664 CarbonylContact C-O 3.56Å; K653-I664 WeakPolarHBondContact CA-O 3.46Å; L654-I664 HydrophobicContact CB-CB 4.24Å; L654-I664 PolarHBondContact N-O 3.45Å; L654-I664 PolarHBondContact O-N 2.89Å; N656-I664 HydrophobicContact CB-CD1 4.27Å; N656-I664 HydrophobicContact CB-CG1 4.26Å; I664-E684 HydrophobicContact CG2-CB 3.84Å; I664-E684 HydrophobicContact CG2-CG 4.34Å; I664-Y685 CarbonylContact C-O 3.49Å; I664-Y685 WeakPolarHBondContact CA-O 3.45Å
665	Y	87.1	Confident	69.4	Low	1 Å²	1	77.9 Å²	77.9	0%	0.004	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.5	175.8	-82.8	37.2	0	0	0	108.1	H604 F650 K653 R663 Y685 I687	H604-Y665 AromaticContact CE1-CE2 3.96Å; H604-Y665 PolarHBondContact O-OH 3.4Å; F650-Y665 HydrophobicContact CD2-CD2 4.2Å; F650-Y665 HydrophobicContact CE2-CD1 4.45Å; F650-Y665 AromaticContact CE2-CD2 3.36Å; F650-Y665 HydrophobicContact CE2-CD2 3.36Å; F650-Y665 AromaticContact CE2-CE2 3.99Å; F650-Y665 HydrophobicContact CE2-CE2 3.99Å; F650-Y665 AromaticContact CE2-CG 3.64Å; F650-Y665 HydrophobicContact CE2-CG 3.64Å; F650-Y665 AromaticContact CZ-CD2 3.9Å; F650-Y665 HydrophobicContact CZ-CD2 3.9Å; F650-Y665 HydrophobicContact CZ-CE2 4.08Å; F650-Y665 HydrophobicContact CZ-CG 4.22Å; K653-Y665 HydrophobicContact CB-CE1 4.43Å; K653-Y665 HydrophobicContact CD-CE1 3.76Å; K653-Y665 WeakPolarHBondContact CE-OH 3.46Å; K653-Y665 HydrophobicContact CG-CD1 3.99Å; K653-Y665 HydrophobicContact CG-CE1 3.65Å; R663-Y665 HydrophobicContact CB-CD1 4.35Å; R663-Y665 HydrophobicContact CB-CE1 4.12Å; Y665-Y685 PolarHBondContact N-O 3.07Å; Y665-Y685 PolarHBondContact O-N 3.15Å; Y665-I687 HydrophobicContact CD1-CB 4.47Å; Y665-I687 HydrophobicContact CD1-CD1 3.61Å; Y665-I687 HydrophobicContact CD1-CG1 3.94Å; Y665-I687 HydrophobicContact CD2-CD1 3.35Å; Y665-I687 HydrophobicContact CD2-CG1 4.36Å; Y665-I687 HydrophobicContact CE1-CB 4.47Å; Y665-I687 HydrophobicContact CE1-CD1 3.64Å; Y665-I687 HydrophobicContact CE1-CG1 4.23Å; Y665-I687 HydrophobicContact CE2-CD1 3.37Å; Y665-I687 HydrophobicContact CG-CD1 3.48Å; Y665-I687 VanDerWaalsContact CG-CD1 3.48Å; Y665-I687 HydrophobicContact CG-CG1 4.01Å
666	R	87.9	Confident	68.4	Low	85 Å²	85	75.3 Å²	75.3	32%	0.321	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	122.4	177.5	-64.3	-170.6	-66.4	-177.4	1	110	M651 G652 L654 I682 E684	M651-R666 HydrophobicContact CB-CB 4.15Å; M651-R666 PolarHBondContact N-O 2.62Å; G652-R666 PolarHBondContact O-N 3.09Å; L654-R666 HydrophobicContact CD1-CG 4.29Å; R666-I682 HydrophobicContact CB-CG2 4.08Å; R666-I682 HydrophobicContact CG-CG2 4.48Å; R666-E684 HydrophobicContact CG-CG 4.21Å
667	L	87.1	Confident	67.2	Low	0 Å²	0	76.8 Å²	76.8	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.7	175.4	-65.8	-179.3	0	0	0	109.7	A601 L602 I648 Q649 F650 Y669 I682 M683 Y685	A601-L667 HydrophobicContact CB-CD1 4.19Å; A601-L667 HydrophobicContact CB-CD2 3.84Å; L602-L667 HydrophobicContact CD2-CD1 3.76Å; L602-L667 HydrophobicContact CD2-CG 4.48Å; L602-L667 HydrophobicContact CG-CD1 4Å; I648-L667 HydrophobicContact CG2-CD1 4.42Å; Q649-L667 CarbonylContact O-C 3.55Å; Q649-L667 WeakPolarHBondContact O-CA 3.42Å; F650-L667 HydrophobicContact CB-CD2 3.93Å; F650-L667 HydrophobicContact CD2-CD2 3.82Å; F650-L667 HydrophobicContact CG-CD2 4.39Å; L667-Y669 HydrophobicContact CB-CE2 4.02Å; L667-I682 CarbonylContact O-C 3.58Å; L667-I682 WeakPolarHBondContact O-CA 2.89Å; L667-M683 PolarHBondContact N-O 2.97Å; L667-M683 PolarHBondContact O-N 3.43Å; L667-Y685 HydrophobicContact CB-CE2 4.26Å; L667-Y685 HydrophobicContact CD1-CD2 3.95Å; L667-Y685 HydrophobicContact CD1-CE2 3.67Å; L667-Y685 HydrophobicContact CG-CD2 4.21Å; L667-Y685 HydrophobicContact CG-CE2 4.2Å
668	E	84.6	Confident	66.5	Low	44 Å²	44	75 Å²	75	21%	0.206	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	127.1	172.7	-178.5	175.1	-161.3	0	0	109.5	I648 Q649 M651 S680	I648-E668 WeakPolarHBondContact CA-O 3.5Å; Q649-E668 HydrophobicContact CB-CB 4.38Å; Q649-E668 PolarHBondContact N-O 2.89Å; Q649-E668 PolarHBondContact O-N 2.93Å; M651-E668 HydrophobicContact CG-CB 3.98Å; E668-S680 WeakPolarHBondContact OE1-CB 3.16Å; E668-S680 PolarHBondContact OE1-OG 2.96Å
669	Y	81.5	Confident	66.3	Low	14 Å²	14	75.8 Å²	75.8	6%	0.055	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	126.8	175	-68.4	-103.1	0	0	0	109.3	I594 T598 I648 L667 E681 M683 Y685	I594-Y669 HydrophobicContact CG2-CE1 4.37Å; T598-Y669 HydrophobicContact CG2-CE1 3.67Å; T598-Y669 WeakPolarHBondContact CG2-OH 3.31Å; I648-Y669 HydrophobicContact CD1-CD1 4.2Å; I648-Y669 HydrophobicContact CD1-CE1 3.81Å; I648-Y669 HydrophobicContact CG1-CD1 4.06Å; I648-Y669 HydrophobicContact CG1-CE1 4.13Å; I648-Y669 HydrophobicContact CG2-CE1 4.32Å; L667-Y669 HydrophobicContact CB-CE2 4.02Å; Y669-E681 PolarHBondContact N-O 3.04Å; Y669-E681 PolarHBondContact O-N 3.26Å; Y669-M683 HydrophobicContact CD2-CB 4.3Å; Y669-M683 HydrophobicContact CD2-CG 3.9Å; Y669-M683 HydrophobicContact CE2-CB 3.79Å; Y669-M683 HydrophobicContact CE2-CG 3.68Å; Y669-Y685 PolarHBondContact OH-OH 3.49Å
670	D	70.1	Confident	66.3	Low	64 Å²	64	73.7 Å²	73.7	34%	0.342	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-63.9	148.4	178.5	-164.6	7.4	0	0	0	111.5	G647 F672 L673	G647-D670 WeakPolarHBondContact O-CB 3.23Å; G647-D670 PolarHBondContact O-N 2.93Å; D670-F672 PolarHBondContact O-N 3.34Å; D670-L673 HydrophobicContact CB-CD1 4.35Å; D670-L673 WeakPolarHBondContact O-CB 3.43Å; D670-L673 PolarHBondContact O-N 2.67Å
671	Q	57.9	Low	67	Low	90 Å²	90	73.1 Å²	73.1	42%	0.421	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-25.2	-167.6	-62.9	176.1	-5.9	0	0	113.5	D678	Q671-D678 PolarHBondContact NE2-O 2.89Å
672	F	53.7	Low	67.7	Low	125 Å²	125	71.5 Å²	71.5	55%	0.548	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-11.3	-177	-63.9	-73.8	0	0	0	114.4	F513 D670	F513-F672 HydrophobicContact CE2-CB 4.27Å; F513-F672 HydrophobicContact CZ-CB 3.65Å; F513-F672 HydrophobicContact CZ-CD2 4.33Å; F513-F672 HydrophobicContact CZ-CG 4.14Å; D670-F672 PolarHBondContact O-N 3.34Å
673	L	56.9	Low	68.2	Low	18 Å²	18	73.6 Å²	73.6	9%	0.094	38%	0.384	C	S	.	.	S	Bend	trans	-84.1	-17.8	-177.5	-75.4	162.4	0	0	0	113.1	L589 I594 G647 I648 D670	L589-L673 HydrophobicContact CB-CD2 4.25Å; L589-L673 HydrophobicContact CD1-CD2 3.4Å; L589-L673 VanDerWaalsContact CD1-CD2 3.4Å; L589-L673 HydrophobicContact CG-CD2 4.44Å; I594-L673 HydrophobicContact CD1-CD2 4.13Å; I594-L673 HydrophobicContact CG1-CD2 4.19Å; G647-L673 WeakPolarHBondContact O-CD1 3.49Å; I648-L673 HydrophobicContact CG1-CD1 4.07Å; D670-L673 HydrophobicContact CB-CD1 4.35Å; D670-L673 WeakPolarHBondContact O-CB 3.43Å; D670-L673 PolarHBondContact O-N 2.67Å
674	Q	51	Low	68.5	Low	90 Å²	90	72.9 Å²	72.9	42%	0.421	39%	0.385	S	S	.	.	S	Bend	trans	-131.8	157.2	-177.5	-64.8	-159.8	38.1	0	0	112.4	G676 E681	Q674-G676 PolarHBondContact O-N 2.73Å; Q674-E681 PolarHBondContact NE2-OE2 3.15Å; Q674-E681 PolarHBondContact OE1-OE2 3.26Å
675	N	46.2	Very low	68.8	Low	136 Å²	136	71.9 Å²	71.9	73%	0.727	38%	0.379	S	S	*	.	S	Bend	trans	-57.5	96.3	-172.2	-73	-31.7	0	0	0	113.7	Q588 S677	Q588-N675 PolarHBondContact NE2-OD1 3.24Å; N675-S677 PolarHBondContact O-N 2.9Å; N675-S677 VanDerWaalsContact O-N 3.09Å
676	G	48.5	Very low	68.9	Low	84 Å²	84	73.2 Å²	73.2	87%	0.866	39%	0.389	S	S	*	.	S	Bend	trans	66.6	16.5	145.8	0	0	0	0	0	119.1	Q674	Q674-G676 PolarHBondContact O-N 2.73Å
677	S	43.3	Very low	69	Low	70 Å²	70	69.2 Å²	69.2	49%	0.49	37%	0.374	S	S	.	.			trans	-99.1	129.2	170.4	53.1	0	0	0	0	111.2	N675 Q679	N675-S677 PolarHBondContact O-N 2.9Å; N675-S677 VanDerWaalsContact O-N 3.09Å; S677-Q679 PolarHBondContact O-N 3.4Å
678	D	51.3	Low	69	Low	153 Å²	153	70 Å²	70	82%	0.818	38%	0.378	S	S	*	.	S	Bend	trans	-66.6	17.9	-178.1	-69.9	-34	0	0	0	115.1	Q671	Q671-D678 PolarHBondContact NE2-O 2.89Å
679	Q	55.7	Low	69.1	Low	158 Å²	158	68.1 Å²	68.1	74%	0.738	37%	0.37	S	S	*	.	S	Bend	trans	-132.3	137.5	-174.9	-65.5	-175	-13.6	0	0	110.7	S677	S677-Q679 PolarHBondContact O-N 3.4Å
680	S	62	Low	69.4	Low	46 Å²	46	69 Å²	69	32%	0.322	38%	0.377	S	S	.	.			trans	-68	133.9	169.6	49.4	0	0	0	0	109.6	E668	E668-S680 WeakPolarHBondContact OE1-CB 3.16Å; E668-S680 PolarHBondContact OE1-OG 2.96Å
681	E	74.4	Confident	70.4	Confident	86 Å²	86	66 Å²	66	40%	0.402	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	126.9	-179.3	-167.8	-179.6	-156.1	0	0	109.6	Y669 Q674 M683	Y669-E681 PolarHBondContact N-O 3.04Å; Y669-E681 PolarHBondContact O-N 3.26Å; Q674-E681 PolarHBondContact NE2-OE2 3.15Å; Q674-E681 PolarHBondContact OE1-OE2 3.26Å; E681-M683 HydrophobicContact CG-CG 4.44Å; E681-M683 HydrophobicContact CG-SD 4.36Å
682	I	82	Confident	71.8	Confident	90 Å²	90	68.3 Å²	68.3	46%	0.462	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	115.1	174.7	-57.8	174.3	0	0	0	108.3	R666 L667	R666-I682 HydrophobicContact CB-CG2 4.08Å; R666-I682 HydrophobicContact CG-CG2 4.48Å; L667-I682 CarbonylContact O-C 3.58Å; L667-I682 WeakPolarHBondContact O-CA 2.89Å
683	M	84.8	Confident	73.3	Confident	45 Å²	45	67.7 Å²	67.7	22%	0.222	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	134.8	178.2	-66.3	-71.7	-100	0	0	110.9	L667 Y669 E681 Y685 P707	L667-M683 PolarHBondContact N-O 2.97Å; L667-M683 PolarHBondContact O-N 3.43Å; Y669-M683 HydrophobicContact CD2-CB 4.3Å; Y669-M683 HydrophobicContact CD2-CG 3.9Å; Y669-M683 HydrophobicContact CE2-CB 3.79Å; Y669-M683 HydrophobicContact CE2-CG 3.68Å; E681-M683 HydrophobicContact CG-CG 4.44Å; E681-M683 HydrophobicContact CG-SD 4.36Å; M683-Y685 HydrophobicContact CB-CE2 3.78Å; M683-P707 HydrophobicContact CE-CB 3.97Å; M683-P707 HydrophobicContact CE-CG 3.44Å; M683-P707 VanDerWaalsContact CE-CG 3.44Å; M683-P707 HydrophobicContact SD-CB 4.45Å; M683-P707 HydrophobicContact SD-CG 4.27Å
684	E	87.8	Confident	74.3	Confident	101 Å²	101	70 Å²	70	47%	0.472	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.4	-178.7	-56.2	-160.8	147	0	0	111.4	I664 R666	I664-E684 HydrophobicContact CG2-CB 3.84Å; I664-E684 HydrophobicContact CG2-CG 4.34Å; R666-E684 HydrophobicContact CG-CG 4.21Å
685	Y	90.4	Very high	75.3	Confident	10 Å²	10	69.8 Å²	69.8	4%	0.039	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.5	177.8	-67.2	-99.9	0	0	0	109.5	L602 I664 Y665 L667 Y669 M683 H706 P707	L602-Y685 HydrophobicContact CD1-CD1 3.72Å; L602-Y685 HydrophobicContact CD1-CE1 3.82Å; L602-Y685 HydrophobicContact CD1-CG 4.27Å; L602-Y685 HydrophobicContact CD2-CD1 3.87Å; L602-Y685 HydrophobicContact CD2-CD2 3.89Å; L602-Y685 HydrophobicContact CD2-CE1 4.49Å; L602-Y685 HydrophobicContact CD2-CG 3.54Å; L602-Y685 HydrophobicContact CG-CD1 4.44Å; I664-Y685 CarbonylContact C-O 3.49Å; I664-Y685 WeakPolarHBondContact CA-O 3.45Å; Y665-Y685 PolarHBondContact N-O 3.07Å; Y665-Y685 PolarHBondContact O-N 3.15Å; L667-Y685 HydrophobicContact CB-CE2 4.26Å; L667-Y685 HydrophobicContact CD1-CD2 3.95Å; L667-Y685 HydrophobicContact CD1-CE2 3.67Å; L667-Y685 HydrophobicContact CG-CD2 4.21Å; L667-Y685 HydrophobicContact CG-CE2 4.2Å; Y669-Y685 PolarHBondContact OH-OH 3.49Å; M683-Y685 HydrophobicContact CB-CE2 3.78Å; Y685-H706 HydrophobicContact CD1-CB 4.43Å; Y685-H706 AromaticContact CD1-CD2 3.9Å; Y685-H706 HydrophobicContact CE1-CB 4.24Å; Y685-H706 AromaticContact CE1-CD2 3.99Å; Y685-H706 AromaticContact CE1-CE1 3.77Å; Y685-H706 AromaticContact CE1-CG 3.74Å; Y685-H706 AromaticContact CE1-ND1 3.61Å; Y685-H706 AromaticContact CE1-NE2 3.97Å; Y685-P707 HydrophobicContact CE1-CG 4.13Å; Y685-P707 HydrophobicContact CE2-CG 4.42Å
686	S	89.3	Confident	76.8	Confident	28 Å²	28	68.9 Å²	68.9	20%	0.196	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	115.7	175	57.9	0	0	0	0	110.3	A704 K705	S686-A704 WeakPolarHBondContact O-CA 3.4Å; S686-K705 PolarHBondContact N-O 3.13Å; S686-K705 PolarHBondContact O-N 3.39Å; S686-K705 WeakPolarHBondContact OG-CB 3.37Å
687	I	89.4	Confident	78.4	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.01	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	108.5	174.9	-55.5	-163.5	0	0	0	108.5	R663 Y665 V690 I702 A704	R663-I687 PolarHBondContact N-O 2.88Å; R663-I687 PolarHBondContact O-N 3.43Å; Y665-I687 HydrophobicContact CD1-CB 4.47Å; Y665-I687 HydrophobicContact CD1-CD1 3.61Å; Y665-I687 HydrophobicContact CD1-CG1 3.94Å; Y665-I687 HydrophobicContact CD2-CD1 3.35Å; Y665-I687 HydrophobicContact CD2-CG1 4.36Å; Y665-I687 HydrophobicContact CE1-CB 4.47Å; Y665-I687 HydrophobicContact CE1-CD1 3.64Å; Y665-I687 HydrophobicContact CE1-CG1 4.23Å; Y665-I687 HydrophobicContact CE2-CD1 3.37Å; Y665-I687 HydrophobicContact CG-CD1 3.48Å; Y665-I687 VanDerWaalsContact CG-CD1 3.48Å; Y665-I687 HydrophobicContact CG-CG1 4.01Å; I687-V690 HydrophobicContact CG2-CG2 3.68Å; I687-I702 HydrophobicContact CD1-CD1 4.29Å; I687-A704 HydrophobicContact CG1-CB 4.37Å
688	D	87.7	Confident	80.4	Confident	16 Å²	16	67 Å²	67	9%	0.086	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-32.8	-176.3	-61.1	-46.4	0	0	0	112	M703 Y764 L768 Y772	D688-M703 PolarHBondContact N-O 3Å; D688-Y764 VanDerWaalsContact OD2-CE1 3.29Å; D688-Y764 WeakPolarHBondContact OD2-CE1 3.13Å; D688-Y764 PolarHBondContact OD2-OH 3.4Å; D688-L768 HydrophobicContact CB-CD1 3.9Å; D688-L768 HydrophobicContact CB-CD2 4Å; D688-Y772 PolarHBondContact O-OH 3.07Å
689	A	87.7	Confident	82.3	Confident	4 Å²	4	60.8 Å²	60.8	3%	0.033	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	138.3	177	0	0	0	0	0	112.1	L691 I702 M703 L768 F771	A689-L691 HydrophobicContact CB-CD1 4.35Å; A689-I702 WeakPolarHBondContact O-CA 2.98Å; A689-M703 HydrophobicContact CB-CB 4.13Å; A689-M703 HydrophobicContact CB-CG 4.29Å; A689-M703 HydrophobicContact CB-SD 4.09Å; A689-M703 PolarHBondContact O-N 3.41Å; A689-L768 HydrophobicContact CB-CD1 3.84Å; A689-F771 HydrophobicContact CB-CD1 3.96Å; A689-F771 HydrophobicContact CB-CE1 3.69Å; A689-F771 HydrophobicContact CB-CZ 4.14Å
690	V	88.2	Confident	84	Confident	34 Å²	34	53.5 Å²	53.5	21%	0.206	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	115.6	172.3	-179.5	0	0	0	0	108.2	T605 I687 E692 I702	T605-V690 HydrophobicContact CG2-CG1 4.49Å; I687-V690 HydrophobicContact CG2-CG2 3.68Å; V690-E692 HydrophobicContact CG1-CG 4.42Å; V690-E692 PolarHBondContact O-N 3.42Å; V690-I702 HydrophobicContact CG1-CG2 4.36Å; V690-I702 HydrophobicContact CG2-CG2 4.3Å
691	L	90.6	Very high	85.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	92.8	172.6	-73.4	67.8	0	0	0	107.4	A689 R697 S701 F771 Y790 I793	A689-L691 HydrophobicContact CB-CD1 4.35Å; L691-R697 PolarHBondContact O-NH2 3.45Å; L691-S701 WeakPolarHBondContact CA-O 3.25Å; L691-S701 WeakPolarHBondContact CB-O 3.29Å; L691-S701 PolarHBondContact N-O 2.91Å; L691-S701 PolarHBondContact O-N 3.23Å; L691-F771 HydrophobicContact CD1-CD2 4.42Å; L691-F771 HydrophobicContact CD1-CE2 4Å; L691-F771 HydrophobicContact CD1-CZ 4.46Å; L691-F771 HydrophobicContact CG-CE2 4.1Å; L691-Y790 HydrophobicContact CB-CE1 4.45Å; L691-Y790 HydrophobicContact CD2-CD1 3.37Å; L691-Y790 HydrophobicContact CD2-CE1 3.85Å; L691-Y790 HydrophobicContact CD2-CG 3.87Å; L691-Y790 HydrophobicContact CG-CD1 3.82Å; L691-Y790 HydrophobicContact CG-CE1 3.72Å; L691-I793 HydrophobicContact CD1-CD1 4.26Å; L691-I793 HydrophobicContact CD2-CB 4.37Å; L691-I793 HydrophobicContact CD2-CD1 4.07Å; L691-I793 HydrophobicContact CD2-CG2 4.1Å
692	E	86.6	Confident	86.4	Confident	139 Å²	139	47.2 Å²	47.2	65%	0.65	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-53.5	152.3	-176	-65.7	-173.6	172.7	0	0	113.2	V690 D694 R697	V690-E692 HydrophobicContact CG1-CG 4.42Å; V690-E692 PolarHBondContact O-N 3.42Å; E692-D694 PolarHBondContact O-N 3.08Å; E692-R697 PolarHBondContact O-NH2 3.41Å
693	F	85.2	Confident	86.9	Confident	112 Å²	112	43 Å²	43	49%	0.491	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	125.8	177.9	176.5	-92.1	0	0	0	111	M700	F693-M700 HydrophobicContact CB-CB 4.29Å; F693-M700 HydrophobicContact CB-CE 4.37Å
694	D	77.4	Confident	87.3	Confident	66 Å²	66	40.8 Å²	40.8	35%	0.353	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	131.5	171.1	171.5	16.1	0	0	0	109.4	E692 V696 R697 K698	E692-D694 PolarHBondContact O-N 3.08Å; D694-V696 PolarHBondContact O-N 2.93Å; D694-V696 PolarHBondContact OD1-N 3.27Å; D694-R697 HydrophobicContact CB-CB 3.84Å; D694-R697 PolarHBondContact O-N 3.45Å; D694-R697 PolarHBondContact OD2-N 3.48Å; D694-K698 WeakPolarHBondContact O-CA 3.32Å; D694-K698 PolarHBondContact O-N 3.49Å
695	S	73.4	Confident	87.4	Confident	86 Å²	86	39.4 Å²	39.4	60%	0.601	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-28	177.9	69.6	0	0	0	0	113.8	K698	S695-K698 WeakPolarHBondContact O-CG 3.15Å
696	V	76.2	Confident	87.4	Confident	117 Å²	117	40 Å²	40	71%	0.709	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78	-47.7	175.5	-178	0	0	0	0	109.9	D694	D694-V696 PolarHBondContact O-N 2.93Å; D694-V696 PolarHBondContact OD1-N 3.27Å
697	R	82.6	Confident	87.2	Confident	26 Å²	26	41.6 Å²	41.6	10%	0.098	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-28.7	179	-157.2	-175	54.9	-173.8	-9.3	113.7	L691 E692 D694 R699 S721 Y790 E794	L691-R697 PolarHBondContact O-NH2 3.45Å; E692-R697 PolarHBondContact O-NH2 3.41Å; D694-R697 HydrophobicContact CB-CB 3.84Å; D694-R697 PolarHBondContact O-N 3.45Å; D694-R697 PolarHBondContact OD2-N 3.48Å; R697-R699 VanDerWaalsContact C-N 3.26Å; R697-R699 HydrophobicContact CG-CG 3.76Å; R697-R699 PolarHBondContact NE-O 2.94Å; R697-R699 VanDerWaalsContact NE-O 3.08Å; R697-R699 PolarHBondContact NH2-O 3.39Å; R697-R699 PolarHBondContact O-N 3.37Å; R697-S721 WeakPolarHBondContact O-CB 3.43Å; R697-Y790 VanDerWaalsContact NH1-CD2 3.29Å; R697-E794 WeakPolarHBondContact CD-OE1 3.35Å; R697-E794 IonicContact CZ-OE1 3.05Å; R697-E794 IonicContact NE-OE1 2.71Å; R697-E794 PolarHBondContact NE-OE1 3.1Å; R697-E794 IonicContact NH1-OE1 3.41Å; R697-E794 PolarHBondContact NH1-OE1 3.11Å; R697-E794 IonicContact NH2-OE1 3.98Å
698	K	85.8	Confident	87	Confident	89 Å²	89	46.7 Å²	46.7	39%	0.387	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	33.1	-177.5	-53.6	179	-175.6	176.9	0	114.6	D694 S695 G717 A718 S721	D694-K698 WeakPolarHBondContact O-CA 3.32Å; D694-K698 PolarHBondContact O-N 3.49Å; S695-K698 WeakPolarHBondContact O-CG 3.15Å; K698-G717 WeakPolarHBondContact O-CA 3.35Å; K698-A718 HydrophobicContact CB-CB 4.43Å; K698-A718 PolarHBondContact O-N 3.4Å; K698-S721 PolarHBondContact O-OG 3.24Å
699	R	90.8	Very high	86.8	Confident	22 Å²	22	47.9 Å²	47.9	8%	0.083	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	158.5	176.6	61.5	-170.6	177.2	-127.7	0.7	111.5	R697 K716 S721 I722 I725 E794	R697-R699 VanDerWaalsContact C-N 3.26Å; R697-R699 HydrophobicContact CG-CG 3.76Å; R697-R699 PolarHBondContact NE-O 2.94Å; R697-R699 VanDerWaalsContact NE-O 3.08Å; R697-R699 PolarHBondContact NH2-O 3.39Å; R697-R699 PolarHBondContact O-N 3.37Å; R699-K716 CarbonylContact C-O 3.56Å; R699-K716 WeakPolarHBondContact CA-O 3.45Å; R699-K716 VanDerWaalsContact CB-O 3.25Å; R699-K716 WeakPolarHBondContact CB-O 3.29Å; R699-S721 PolarHBondContact NH1-O 3.39Å; R699-I722 HydrophobicContact CB-CD1 4.11Å; R699-I725 VanDerWaalsContact NH1-CG2 3.31Å; R699-E794 IonicContact CZ-OE2 3.47Å; R699-E794 VanDerWaalsContact NE-CD 3.31Å; R699-E794 IonicContact NE-OE1 3.27Å; R699-E794 IonicContact NE-OE2 3.76Å; R699-E794 PolarHBondContact NE-OE2 2.99Å; R699-E794 IonicContact NH2-OE2 2.65Å; R699-E794 PolarHBondContact NH2-OE2 2.84Å
700	M	91.9	Very high	87	Confident	5 Å²	5	49 Å²	49	3%	0.025	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	143.6	171.1	170.9	-173.5	-80.7	0	0	108.1	T605 E636 F693 S715 K716	T605-M700 HydrophobicContact CG2-CE 3.41Å; T605-M700 VanDerWaalsContact CG2-CE 3.41Å; T605-M700 HydrophobicContact CG2-SD 4.38Å; E636-M700 VanDerWaalsContact OE1-CE 3.23Å; E636-M700 WeakPolarHBondContact OE1-CE 3.45Å; F693-M700 HydrophobicContact CB-CB 4.29Å; F693-M700 HydrophobicContact CB-CE 4.37Å; M700-S715 WeakPolarHBondContact O-CA 3.09Å; M700-S715 PolarHBondContact O-OG 3.29Å; M700-K716 HydrophobicContact CB-CG 4.24Å; M700-K716 PolarHBondContact N-O 3.04Å; M700-K716 PolarHBondContact O-N 3.36Å; M700-K716 VanDerWaalsContact SD-CE 3.55Å
701	S	93.3	Very high	87.2	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	151.3	176.7	-46.5	0	0	0	0	111	L691 H714 S715 E794	L691-S701 WeakPolarHBondContact CA-O 3.25Å; L691-S701 WeakPolarHBondContact CB-O 3.29Å; L691-S701 PolarHBondContact N-O 2.91Å; L691-S701 PolarHBondContact O-N 3.23Å; S701-H714 CarbonylContact C-O 3.6Å; S701-H714 WeakPolarHBondContact CA-O 3.29Å; S701-S715 WeakPolarHBondContact OG-CB 2.84Å; S701-S715 PolarHBondContact OG-OG 3.27Å; S701-E794 PolarHBondContact OG-OE1 3.12Å
702	I	93.4	Very high	87.3	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	147.4	175.7	59.2	160.8	0	0	0	110	L602 C603 I687 A689 V690 A704 I713 H714	L602-I702 HydrophobicContact CB-CD1 3.77Å; L602-I702 WeakPolarHBondContact O-CD1 3.3Å; C603-I702 HydrophobicContact CB-CD1 4.02Å; C603-I702 HydrophobicContact CB-CG1 4.04Å; I687-I702 HydrophobicContact CD1-CD1 4.29Å; A689-I702 WeakPolarHBondContact O-CA 2.98Å; V690-I702 HydrophobicContact CG1-CG2 4.36Å; V690-I702 HydrophobicContact CG2-CG2 4.3Å; I702-A704 HydrophobicContact CD1-CB 4.29Å; I702-I713 WeakPolarHBondContact O-CA 3.36Å; I702-H714 HydrophobicContact CD1-CB 4.24Å; I702-H714 HydrophobicContact CG1-CB 3.82Å; I702-H714 PolarHBondContact N-O 3.23Å; I702-H714 PolarHBondContact O-N 3Å
703	M	93.3	Very high	87.7	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	115.1	167.6	-64.3	-179	66.3	0	0	107.3	D688 A689 I713 Y764 L767 L768 I793	D688-M703 PolarHBondContact N-O 3Å; A689-M703 HydrophobicContact CB-CB 4.13Å; A689-M703 HydrophobicContact CB-CG 4.29Å; A689-M703 HydrophobicContact CB-SD 4.09Å; A689-M703 PolarHBondContact O-N 3.41Å; M703-I713 HydrophobicContact CG-CG1 4.32Å; M703-Y764 VanDerWaalsContact C-OH 3.27Å; M703-Y764 HydrophobicContact CB-CE2 3.72Å; M703-Y764 HydrophobicContact CE-CD1 4.42Å; M703-Y764 HydrophobicContact CE-CD2 3.64Å; M703-Y764 HydrophobicContact CE-CE1 4.41Å; M703-Y764 HydrophobicContact CE-CE2 3.64Å; M703-Y764 HydrophobicContact CE-CG 4.07Å; M703-Y764 HydrophobicContact CG-CE2 4.41Å; M703-Y764 PolarHBondContact O-OH 3.01Å; M703-L767 HydrophobicContact CE-CB 4.11Å; M703-L768 HydrophobicContact CE-CB 4.4Å; M703-I793 HydrophobicContact CG-CG2 4.27Å; M703-I793 HydrophobicContact SD-CD1 3.96Å; M703-I793 HydrophobicContact SD-CG1 4.33Å; M703-I793 HydrophobicContact SD-CG2 4.17Å
704	A	92.1	Very high	88.1	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	136.4	-174.7	0	0	0	0	0	111	S686 I687 I702 H712 Y764	S686-A704 WeakPolarHBondContact O-CA 3.4Å; I687-A704 HydrophobicContact CG1-CB 4.37Å; I702-A704 HydrophobicContact CD1-CB 4.29Å; A704-H712 PolarHBondContact N-O 3.29Å; A704-H712 PolarHBondContact O-N 3.07Å; A704-H712 VanDerWaalsContact O-O 3.12Å; A704-Y764 PolarHBondContact N-OH 3.46Å
705	K	91.1	Very high	88.9	Confident	72 Å²	72	35.7 Å²	35.7	31%	0.313	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	123.8	166.9	171	-172.3	-175.5	-178.7	0	108.6	S686 T710 Y711	S686-K705 PolarHBondContact N-O 3.13Å; S686-K705 PolarHBondContact O-N 3.39Å; S686-K705 WeakPolarHBondContact OG-CB 3.37Å; K705-T710 WeakPolarHBondContact CA-O 3.45Å; K705-Y711 HydrophobicContact CB-CD1 4.04Å; K705-Y711 HydrophobicContact CB-CE1 4.18Å; K705-Y711 HydrophobicContact CD-CD1 4.5Å; K705-Y711 HydrophobicContact CD-CE1 3.82Å; K705-Y711 HydrophobicContact CG-CD1 4.22Å; K705-Y711 HydrophobicContact CG-CE1 4Å
706	H	89.7	Confident	89.8	Confident	23 Å²	23	32.2 Å²	32.2	11%	0.106	17%	0.174	C	C	.	.			trans	-81.6	156	-178.4	-81.1	-133.2	0	0	0	110.3	Y685 D708 G709 T710 H712 H714	Y685-H706 HydrophobicContact CD1-CB 4.43Å; Y685-H706 AromaticContact CD1-CD2 3.9Å; Y685-H706 HydrophobicContact CE1-CB 4.24Å; Y685-H706 AromaticContact CE1-CD2 3.99Å; Y685-H706 AromaticContact CE1-CE1 3.77Å; Y685-H706 AromaticContact CE1-CG 3.74Å; Y685-H706 AromaticContact CE1-ND1 3.61Å; Y685-H706 AromaticContact CE1-NE2 3.97Å; H706-D708 WeakPolarHBondContact CB-OD1 3.39Å; H706-D708 PolarHBondContact O-N 3.01Å; H706-G709 PolarHBondContact O-N 3.2Å; H706-T710 PolarHBondContact N-O 2.96Å; H706-H712 AromaticContact CD2-CD2 3.76Å; H706-H712 AromaticContact CG-CD2 3.77Å; H706-H714 AromaticContact CE1-NE2 3.71Å; H706-H714 AromaticContact NE2-CD2 4Å; H706-H714 AromaticContact NE2-NE2 3.09Å; H706-H714 PolarHBondContact NE2-NE2 3.41Å
707	P	84.8	Confident	90.5	Very high	61 Å²	61	26.8 Å²	26.8	40%	0.396	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-20.5	-179.2	23.9	-33.2	0	0	0	113.4	M683 Y685 G709	M683-P707 HydrophobicContact CE-CB 3.97Å; M683-P707 HydrophobicContact CE-CG 3.44Å; M683-P707 VanDerWaalsContact CE-CG 3.44Å; M683-P707 HydrophobicContact SD-CB 4.45Å; M683-P707 HydrophobicContact SD-CG 4.27Å; Y685-P707 HydrophobicContact CE1-CG 4.13Å; Y685-P707 HydrophobicContact CE2-CG 4.42Å; P707-G709 PolarHBondContact O-N 3.43Å
708	D	84.4	Confident	90.7	Very high	109 Å²	109	27 Å²	27	58%	0.583	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-3.6	172.4	66.3	-3.9	0	0	0	113.9	H706 T710	H706-D708 WeakPolarHBondContact CB-OD1 3.39Å; H706-D708 PolarHBondContact O-N 3.01Å; D708-T710 VanDerWaalsContact CG-OG1 3.25Å; D708-T710 WeakPolarHBondContact OD1-CB 3.35Å; D708-T710 PolarHBondContact OD1-N 3.29Å; D708-T710 PolarHBondContact OD1-OG1 2.78Å; D708-T710 PolarHBondContact OD2-OG1 3.19Å
709	G	84.8	Confident	90.6	Very high	40 Å²	40	26.3 Å²	26.3	41%	0.412	15%	0.147	S	C	.	.	S	Bend	trans	87.9	3.9	-179.7	0	0	0	0	0	114.7	H706 P707	H706-G709 PolarHBondContact O-N 3.2Å; P707-G709 PolarHBondContact O-N 3.43Å
710	T	91.8	Very high	90.3	Very high	29 Å²	29	28 Å²	28	18%	0.178	16%	0.162	C	C	.	.			trans	-86.3	154.6	177.1	65.8	0	0	0	0	112	K705 H706 D708 H712	K705-T710 WeakPolarHBondContact CA-O 3.45Å; H706-T710 PolarHBondContact N-O 2.96Å; D708-T710 VanDerWaalsContact CG-OG1 3.25Å; D708-T710 WeakPolarHBondContact OD1-CB 3.35Å; D708-T710 PolarHBondContact OD1-N 3.29Å; D708-T710 PolarHBondContact OD1-OG1 2.78Å; D708-T710 PolarHBondContact OD2-OG1 3.19Å; T710-H712 PolarHBondContact OG1-CD2 3.04Å; T710-H712 PolarHBondContact OG1-NE2 3.22Å
711	Y	92.9	Very high	90	Very high	37 Å²	37	28 Å²	28	15%	0.145	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	120.9	-179.7	-57.1	-94.3	0	0	0	109.2	K705 Q758 V759 Y764 Y765	K705-Y711 HydrophobicContact CB-CD1 4.04Å; K705-Y711 HydrophobicContact CB-CE1 4.18Å; K705-Y711 HydrophobicContact CD-CD1 4.5Å; K705-Y711 HydrophobicContact CD-CE1 3.82Å; K705-Y711 HydrophobicContact CG-CD1 4.22Å; K705-Y711 HydrophobicContact CG-CE1 4Å; Y711-Q758 WeakPolarHBondContact O-CA 3.24Å; Y711-V759 PolarHBondContact O-N 3.21Å; Y711-Y764 AromaticContact CD1-CD1 3.64Å; Y711-Y764 HydrophobicContact CD1-CD1 3.64Å; Y711-Y764 HydrophobicContact CD1-CD2 4.18Å; Y711-Y764 AromaticContact CD1-CE1 3.85Å; Y711-Y764 HydrophobicContact CD1-CE1 3.85Å; Y711-Y764 HydrophobicContact CD1-CE2 4.33Å; Y711-Y764 AromaticContact CD1-CG 3.81Å; Y711-Y764 HydrophobicContact CD1-CG 3.81Å; Y711-Y764 HydrophobicContact CE1-CD1 4.23Å; Y711-Y764 HydrophobicContact CE1-CE1 4.41Å; Y711-Y764 HydrophobicContact CG-CD1 4.43Å; Y711-Y764 HydrophobicContact CG-CD2 4.36Å; Y711-Y764 HydrophobicContact CG-CG 4.15Å; Y711-Y765 HydrophobicContact CE1-CE2 4.12Å
712	H	92.6	Very high	89.8	Confident	27 Å²	27	28 Å²	28	13%	0.125	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	142.1	-175.2	-73.6	-93.1	0	0	0	112.3	A704 H706 T710 H714 R757	A704-H712 PolarHBondContact N-O 3.29Å; A704-H712 PolarHBondContact O-N 3.07Å; A704-H712 VanDerWaalsContact O-O 3.12Å; H706-H712 AromaticContact CD2-CD2 3.76Å; H706-H712 AromaticContact CG-CD2 3.77Å; T710-H712 PolarHBondContact OG1-CD2 3.04Å; T710-H712 PolarHBondContact OG1-NE2 3.22Å; H712-H714 VanDerWaalsContact CB-NE2 3.25Å; H712-H714 WeakPolarHBondContact CB-NE2 3.49Å; H712-H714 AromaticContact CG-NE2 3.92Å; H712-R757 WeakPolarHBondContact CA-O 3.19Å
713	I	94.1	Very high	89.4	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	115.3	167.4	-56.7	179.3	0	0	0	107.1	I702 M703 S756 R757 V759 L767 I793 L797	I702-I713 WeakPolarHBondContact O-CA 3.36Å; M703-I713 HydrophobicContact CG-CG1 4.32Å; I713-S756 CarbonylContact O-C 3.54Å; I713-S756 WeakPolarHBondContact O-CA 3.43Å; I713-R757 PolarHBondContact N-O 3.16Å; I713-R757 PolarHBondContact O-N 2.83Å; I713-V759 HydrophobicContact CD1-CG2 3.62Å; I713-V759 HydrophobicContact CG1-CG2 3.91Å; I713-L767 HydrophobicContact CD1-CD1 4.39Å; I713-I793 HydrophobicContact CD1-CG2 4.04Å; I713-I793 WeakPolarHBondContact CD1-O 3.3Å; I713-I793 HydrophobicContact CG2-CG2 4.05Å; I713-L797 HydrophobicContact CG2-CD2 4.33Å
714	H	93.9	Very high	88.9	Confident	5 Å²	5	37.9 Å²	37.9	2%	0.023	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	135.4	177.2	-59.9	-66.2	0	0	0	109.4	T599 C603 S701 I702 H706 H712 S756	T599-H714 WeakPolarHBondContact CG2-ND1 3.19Å; C603-H714 HydrophobicContact CB-CB 4.31Å; S701-H714 CarbonylContact C-O 3.6Å; S701-H714 WeakPolarHBondContact CA-O 3.29Å; I702-H714 HydrophobicContact CD1-CB 4.24Å; I702-H714 HydrophobicContact CG1-CB 3.82Å; I702-H714 PolarHBondContact N-O 3.23Å; I702-H714 PolarHBondContact O-N 3Å; H706-H714 AromaticContact CE1-NE2 3.71Å; H706-H714 AromaticContact NE2-CD2 4Å; H706-H714 AromaticContact NE2-NE2 3.09Å; H706-H714 PolarHBondContact NE2-NE2 3.41Å; H712-H714 VanDerWaalsContact CB-NE2 3.25Å; H712-H714 WeakPolarHBondContact CB-NE2 3.49Å; H712-H714 AromaticContact CG-NE2 3.92Å; H714-S756 PolarHBondContact CE1-OG 2.92Å; H714-S756 WeakPolarHBondContact ND1-CB 3.48Å; H714-S756 PolarHBondContact ND1-OG 2.78Å
715	S	93.2	Very high	88.5	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.007	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	140.6	179.9	-172	0	0	0	0	111.1	M700 S701 A755	M700-S715 WeakPolarHBondContact O-CA 3.09Å; M700-S715 PolarHBondContact O-OG 3.29Å; S701-S715 WeakPolarHBondContact OG-CB 2.84Å; S701-S715 PolarHBondContact OG-OG 3.27Å; S715-A755 PolarHBondContact N-O 2.77Å; S715-A755 PolarHBondContact O-N 3.41Å; S715-A755 VanDerWaalsContact O-O 3.13Å
716	K	92.7	Very high	87.9	Confident	13 Å²	13	36.1 Å²	36.1	6%	0.057	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	141.5	173.4	71.2	-178.2	-178.7	-173.7	0	110.6	C603 E636 R699 M700 V753 Y754	C603-K716 VanDerWaalsContact O-CD 3.31Å; C603-K716 WeakPolarHBondContact O-CD 3.33Å; C603-K716 WeakPolarHBondContact O-CE 3.23Å; C603-K716 PolarHBondContact O-NZ 3.24Å; E636-K716 VanDerWaalsContact CG-NZ 3.27Å; E636-K716 VanDerWaalsContact OE1-CE 3.31Å; E636-K716 WeakPolarHBondContact OE1-CE 3.31Å; E636-K716 IonicContact OE1-NZ 3.6Å; E636-K716 PolarHBondContact OE1-NZ 3.23Å; E636-K716 IonicContact OE2-NZ 2.73Å; R699-K716 CarbonylContact C-O 3.56Å; R699-K716 WeakPolarHBondContact CA-O 3.45Å; R699-K716 VanDerWaalsContact CB-O 3.25Å; R699-K716 WeakPolarHBondContact CB-O 3.29Å; M700-K716 HydrophobicContact CB-CG 4.24Å; M700-K716 PolarHBondContact N-O 3.04Å; M700-K716 PolarHBondContact O-N 3.36Å; M700-K716 VanDerWaalsContact SD-CE 3.55Å; K716-V753 WeakPolarHBondContact CA-O 3.41Å; K716-Y754 HydrophobicContact CB-CD1 4Å; K716-Y754 HydrophobicContact CB-CD2 4.44Å; K716-Y754 HydrophobicContact CB-CE1 3.66Å; K716-Y754 HydrophobicContact CB-CE2 4.1Å; K716-Y754 HydrophobicContact CB-CG 4.37Å; K716-Y754 HydrophobicContact CD-CE1 4.21Å; K716-Y754 WeakPolarHBondContact CD-OH 3.39Å
717	G	90.5	Very high	87.1	Confident	4 Å²	4	37.3 Å²	37.3	4%	0.041	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.5	-172.9	179.9	0	0	0	0	0	114.5	K698 V753	K698-G717 WeakPolarHBondContact O-CA 3.35Å; G717-V753 PolarHBondContact N-O 3.28Å; G717-V753 VanDerWaalsContact N-O 3.13Å; G717-V753 PolarHBondContact O-N 3.18Å
718	A	86.7	Confident	85.9	Confident	31 Å²	31	42.3 Å²	42.3	26%	0.256	23%	0.233	S	C	.	.			trans	-67.9	151.8	173	0	0	0	0	0	111	K698 S720 S721 I722	K698-A718 HydrophobicContact CB-CB 4.43Å; K698-A718 PolarHBondContact O-N 3.4Å; A718-S720 VanDerWaalsContact C-N 3.26Å; A718-S720 PolarHBondContact O-N 2.84Å; A718-S721 PolarHBondContact N-OG 3.37Å; A718-S721 PolarHBondContact O-N 2.8Å; A718-S721 VanDerWaalsContact O-N 3.1Å; A718-S721 PolarHBondContact O-OG 3.47Å; A718-I722 WeakPolarHBondContact O-CG1 3.18Å; A718-I722 PolarHBondContact O-N 2.87Å
719	E	85	Confident	84.6	Confident	73 Å²	73	41.6 Å²	41.6	34%	0.341	24%	0.236	S	C	.	.	H	α-helix	trans	-51.6	-44.4	177.4	65.8	-141.6	-140.5	0	0	112.8	S721 I722 F723 V741 T751 V753	E719-S721 VanDerWaalsContact C-N 3.35Å; E719-S721 PolarHBondContact O-N 2.89Å; E719-I722 PolarHBondContact O-N 3.14Å; E719-F723 HydrophobicContact CB-CD2 4.47Å; E719-F723 HydrophobicContact CB-CE2 4.16Å; E719-F723 HydrophobicContact CB-CZ 4.24Å; E719-F723 WeakPolarHBondContact O-CB 3.48Å; E719-F723 WeakPolarHBondContact O-CD1 3.13Å; E719-F723 WeakPolarHBondContact O-CG 3.48Å; E719-F723 PolarHBondContact O-N 3.27Å; E719-V741 HydrophobicContact CB-CG1 4.31Å; E719-V741 HydrophobicContact CB-CG2 4.44Å; E719-V741 HydrophobicContact CG-CG1 4.36Å; E719-V741 WeakPolarHBondContact OE2-CG1 3.49Å; E719-T751 PolarHBondContact OE2-OG1 2.99Å; E719-V753 HydrophobicContact CB-CG2 4.06Å
720	S	83.3	Confident	83.5	Confident	57 Å²	57	40.3 Å²	40.3	40%	0.399	22%	0.22	S	C	.	.	H	α-helix	trans	-62.2	-38.6	-179.6	48.4	0	0	0	0	112.7	A718 E724	A718-S720 VanDerWaalsContact C-N 3.26Å; A718-S720 PolarHBondContact O-N 2.84Å; S720-E724 WeakPolarHBondContact O-CG 3.34Å
721	S	86.4	Confident	82.4	Confident	7 Å²	7	40.7 Å²	40.7	5%	0.049	23%	0.23	C	C	.	.	H	α-helix	trans	-83.4	-28.7	-177.7	60.6	0	0	0	0	113.2	R697 K698 R699 A718 E719	R697-S721 WeakPolarHBondContact O-CB 3.43Å; K698-S721 PolarHBondContact O-OG 3.24Å; R699-S721 PolarHBondContact NH1-O 3.39Å; A718-S721 PolarHBondContact N-OG 3.37Å; A718-S721 PolarHBondContact O-N 2.8Å; A718-S721 VanDerWaalsContact O-N 3.1Å; A718-S721 PolarHBondContact O-OG 3.47Å; E719-S721 VanDerWaalsContact C-N 3.35Å; E719-S721 PolarHBondContact O-N 2.89Å
722	I	88.2	Confident	81.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-84.6	-34.9	179.1	-61.3	-64	0	0	0	111.4	R699 A718 E719 E724 I725 S726 V753 A755 L799	R699-I722 HydrophobicContact CB-CD1 4.11Å; A718-I722 WeakPolarHBondContact O-CG1 3.18Å; A718-I722 PolarHBondContact O-N 2.87Å; E719-I722 PolarHBondContact O-N 3.14Å; I722-E724 VanDerWaalsContact C-N 3.27Å; I722-E724 PolarHBondContact O-N 3.06Å; I722-I725 HydrophobicContact CD1-CD1 4.07Å; I722-I725 VanDerWaalsContact O-CG1 3.3Å; I722-I725 WeakPolarHBondContact O-CG1 3.47Å; I722-I725 PolarHBondContact O-N 2.85Å; I722-S726 PolarHBondContact O-N 2.75Å; I722-S726 PolarHBondContact O-OG 2.79Å; I722-S726 VanDerWaalsContact O-OG 3.11Å; I722-V753 HydrophobicContact CB-CB 4.24Å; I722-V753 HydrophobicContact CB-CG1 4.31Å; I722-V753 HydrophobicContact CG1-CB 4.37Å; I722-V753 HydrophobicContact CG2-CB 4.22Å; I722-V753 HydrophobicContact CG2-CG1 3.8Å; I722-A755 HydrophobicContact CG2-CB 3.83Å; I722-L799 HydrophobicContact CG2-CD2 3.68Å
723	F	86	Confident	81.2	Confident	47 Å²	47	46.2 Å²	46.2	21%	0.206	26%	0.263	C	S	.	.	H	α-helix	trans	-66.2	-29	177.9	-71.4	-1.9	0	0	0	113.1	E719 S726 K734 A737 V753 L799	E719-F723 HydrophobicContact CB-CD2 4.47Å; E719-F723 HydrophobicContact CB-CE2 4.16Å; E719-F723 HydrophobicContact CB-CZ 4.24Å; E719-F723 WeakPolarHBondContact O-CB 3.48Å; E719-F723 WeakPolarHBondContact O-CD1 3.13Å; E719-F723 WeakPolarHBondContact O-CG 3.48Å; E719-F723 PolarHBondContact O-N 3.27Å; F723-S726 WeakPolarHBondContact CA-OG 3.35Å; F723-S726 PolarHBondContact O-OG 3.49Å; F723-K734 PolarHBondContact O-NZ 3.45Å; F723-A737 HydrophobicContact CE1-CB 4Å; F723-A737 HydrophobicContact CZ-CB 3.8Å; F723-V753 HydrophobicContact CE1-CG1 4.25Å; F723-V753 HydrophobicContact CE1-CG2 4.41Å; F723-L799 HydrophobicContact CD1-CD1 4.43Å; F723-L799 HydrophobicContact CD1-CD2 4.39Å; F723-L799 HydrophobicContact CE1-CD1 4.17Å; F723-L799 HydrophobicContact CE1-CD2 4.45Å
724	E	83.1	Confident	80.6	Confident	159 Å²	159	48.7 Å²	48.7	74%	0.743	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-33.9	175	-76.4	175.8	-174.5	0	0	113.4	S720 I722	S720-E724 WeakPolarHBondContact O-CG 3.34Å; I722-E724 VanDerWaalsContact C-N 3.27Å; I722-E724 PolarHBondContact O-N 3.06Å
725	I	83.4	Confident	80.2	Confident	28 Å²	28	55.2 Å²	55.2	14%	0.144	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-4.8	-174.5	59.4	172.4	0	0	0	114.2	R699 I722 E794 N796 L797	R699-I725 VanDerWaalsContact NH1-CG2 3.31Å; I722-I725 HydrophobicContact CD1-CD1 4.07Å; I722-I725 VanDerWaalsContact O-CG1 3.3Å; I722-I725 WeakPolarHBondContact O-CG1 3.47Å; I722-I725 PolarHBondContact O-N 2.85Å; I725-E794 HydrophobicContact CD1-CB 4.19Å; I725-N796 PolarHBondContact O-N 2.93Å; I725-L797 HydrophobicContact CD1-CD1 3.74Å; I725-L797 PolarHBondContact O-N 2.74Å
726	S	78.1	Confident	79.8	Confident	7 Å²	7	57 Å²	57	5%	0.049	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-84.3	144.2	-178.2	44.6	0	0	0	0	112.7	I722 F723 K734 L797	I722-S726 PolarHBondContact O-N 2.75Å; I722-S726 PolarHBondContact O-OG 2.79Å; I722-S726 VanDerWaalsContact O-OG 3.11Å; F723-S726 WeakPolarHBondContact CA-OG 3.35Å; F723-S726 PolarHBondContact O-OG 3.49Å; S726-K734 PolarHBondContact O-NZ 2.77Å; S726-K734 WeakPolarHBondContact OG-CE 3.49Å; S726-K734 PolarHBondContact OG-NZ 2.91Å; S726-K734 VanDerWaalsContact OG-NZ 3.1Å; S726-L797 VanDerWaalsContact CA-O 3.22Å; S726-L797 WeakPolarHBondContact CA-O 3.47Å
727	N	73.8	Confident	79.5	Confident	48 Å²	48	56.4 Å²	56.4	26%	0.257	31%	0.311	S	S	.	.			trans	-52.8	142.3	-174.3	-160.2	-13.1	0	0	0	113.1	S729 T730 N796 L797	N727-S729 PolarHBondContact ND2-OG 3.28Å; N727-S729 VanDerWaalsContact ND2-OG 3.15Å; N727-S729 PolarHBondContact O-N 2.9Å; N727-T730 PolarHBondContact O-N 3.17Å; N727-T730 PolarHBondContact O-OG1 2.87Å; N727-N796 VanDerWaalsContact CA-OD1 3.3Å; N727-N796 WeakPolarHBondContact CA-OD1 3.44Å; N727-N796 WeakPolarHBondContact CB-OD1 3.4Å; N727-N796 PolarHBondContact ND2-OD1 3.3Å; N727-N796 PolarHBondContact OD1-OD1 3.48Å; N727-N796 VanDerWaalsContact OD1-OD1 3.14Å; N727-L797 PolarHBondContact N-O 3.36Å; N727-L797 VanDerWaalsContact N-O 3.15Å
728	L	58.7	Low	79.2	Confident	166 Å²	166	58.8 Å²	58.8	87%	0.869	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-23.2	176.8	-92.8	93.2	0	0	0	113.1	T730	L728-T730 PolarHBondContact O-N 3.26Å
729	S	58	Low	79.2	Confident	95 Å²	95	63 Å²	63	66%	0.664	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-0.4	179.9	54.5	0	0	0	0	114.9	N727	N727-S729 PolarHBondContact ND2-OG 3.28Å; N727-S729 VanDerWaalsContact ND2-OG 3.15Å; N727-S729 PolarHBondContact O-N 2.9Å
730	T	61.9	Low	79.3	Confident	12 Å²	12	59.8 Å²	59.8	7%	0.074	33%	0.325	C	S	.	.			trans	-108.1	35.3	-174	59.9	0	0	0	0	113.3	N727 L728 D732 L733 K734	N727-T730 PolarHBondContact O-N 3.17Å; N727-T730 PolarHBondContact O-OG1 2.87Å; L728-T730 PolarHBondContact O-N 3.26Å; T730-D732 VanDerWaalsContact C-N 3.35Å; T730-D732 PolarHBondContact O-N 3.27Å; T730-L733 HydrophobicContact CG2-CD1 4.13Å; T730-L733 PolarHBondContact O-N 3.24Å; T730-K734 WeakPolarHBondContact O-CB 3.11Å; T730-K734 WeakPolarHBondContact O-CG 3.47Å; T730-K734 PolarHBondContact O-N 2.84Å; T730-K734 VanDerWaalsContact OG1-CE 3.27Å; T730-K734 WeakPolarHBondContact OG1-CE 3.39Å
731	G	69	Low	79.4	Confident	38 Å²	38	57.2 Å²	57.2	39%	0.392	31%	0.306	S	S	.	.	H	α-helix	trans	-52.3	-49.1	-177.8	0	0	0	0	0	113.6	K734 Q735	G731-K734 PolarHBondContact O-N 3.38Å; G731-Q735 PolarHBondContact O-N 3.49Å
732	D	78.3	Confident	79.1	Confident	133 Å²	133	60.3 Å²	60.3	71%	0.711	33%	0.325	S	S	*	.	H	α-helix	trans	-70.3	-43.3	-178.7	-58.8	-24.5	0	0	0	111.8	T730 K734 Q735 L736	T730-D732 VanDerWaalsContact C-N 3.35Å; T730-D732 PolarHBondContact O-N 3.27Å; D732-K734 VanDerWaalsContact C-N 3.3Å; D732-K734 PolarHBondContact O-N 3.14Å; D732-Q735 PolarHBondContact O-N 3.18Å; D732-L736 WeakPolarHBondContact O-CB 3.05Å; D732-L736 PolarHBondContact O-N 3.21Å
733	L	81.7	Confident	78.8	Confident	47 Å²	47	63.3 Å²	63.3	25%	0.246	34%	0.339	C	S	.	.	H	α-helix	trans	-63.1	-35	176.1	-67.5	174.8	0	0	0	111.9	L455 T730 A737	L455-L733 HydrophobicContact CB-CD2 4.22Å; T730-L733 HydrophobicContact CG2-CD1 4.13Å; T730-L733 PolarHBondContact O-N 3.24Å; L733-A737 WeakPolarHBondContact O-CB 3.23Å; L733-A737 PolarHBondContact O-N 2.99Å
734	K	81.8	Confident	78.7	Confident	52 Å²	52	61.1 Å²	61.1	23%	0.226	33%	0.329	C	S	.	.	H	α-helix	trans	-66.5	-39.5	174.5	-75.3	-174.9	-169	-158.2	0	111.8	F723 S726 T730 G731 D732 S738 L799	F723-K734 PolarHBondContact O-NZ 3.45Å; S726-K734 PolarHBondContact O-NZ 2.77Å; S726-K734 WeakPolarHBondContact OG-CE 3.49Å; S726-K734 PolarHBondContact OG-NZ 2.91Å; S726-K734 VanDerWaalsContact OG-NZ 3.1Å; T730-K734 WeakPolarHBondContact O-CB 3.11Å; T730-K734 WeakPolarHBondContact O-CG 3.47Å; T730-K734 PolarHBondContact O-N 2.84Å; T730-K734 VanDerWaalsContact OG1-CE 3.27Å; T730-K734 WeakPolarHBondContact OG1-CE 3.39Å; G731-K734 PolarHBondContact O-N 3.38Å; D732-K734 VanDerWaalsContact C-N 3.3Å; D732-K734 PolarHBondContact O-N 3.14Å; K734-S738 VanDerWaalsContact O-CB 3.32Å; K734-S738 WeakPolarHBondContact O-CB 3.4Å; K734-S738 PolarHBondContact O-N 3.19Å; K734-L799 HydrophobicContact CG-CD1 4.02Å
735	Q	83.5	Confident	78.2	Confident	141 Å²	141	55.2 Å²	55.2	66%	0.659	31%	0.308	S	S	*	.	H	α-helix	trans	-67.6	-46.6	176.5	-70	-178.8	22	0	0	111.7	G731 D732 A737 S738 K739	G731-Q735 PolarHBondContact O-N 3.49Å; D732-Q735 PolarHBondContact O-N 3.18Å; Q735-A737 VanDerWaalsContact C-N 3.34Å; Q735-A737 PolarHBondContact O-N 3.38Å; Q735-S738 WeakPolarHBondContact O-CB 3.32Å; Q735-S738 PolarHBondContact O-N 3.13Å; Q735-K739 PolarHBondContact O-N 3.24Å
736	L	86	Confident	77.5	Confident	39 Å²	39	59.1 Å²	59.1	20%	0.204	33%	0.328	C	S	.	.	H	α-helix	trans	-62.4	-42.2	176.4	-176.9	155.2	0	0	0	111.1	L455 D458 D732 S738 K739 Y740	L455-L736 HydrophobicContact CD2-CD2 3.35Å; D458-L736 HydrophobicContact CB-CD1 4.25Å; D458-L736 WeakPolarHBondContact OD1-CD1 3.4Å; D732-L736 WeakPolarHBondContact O-CB 3.05Å; D732-L736 PolarHBondContact O-N 3.21Å; L736-S738 PolarHBondContact O-N 3.38Å; L736-K739 WeakPolarHBondContact O-CB 3Å; L736-K739 PolarHBondContact O-N 3.49Å; L736-Y740 HydrophobicContact CD2-CD2 3.61Å; L736-Y740 HydrophobicContact CD2-CE2 3.42Å; L736-Y740 VanDerWaalsContact CD2-CE2 3.42Å; L736-Y740 HydrophobicContact CG-CD2 4.3Å; L736-Y740 HydrophobicContact CG-CE2 3.95Å; L736-Y740 WeakPolarHBondContact O-CD2 3.32Å; L736-Y740 PolarHBondContact O-N 3.03Å
737	A	85.9	Confident	77.1	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-60.7	-44.6	172.8	0	0	0	0	0	112.1	L455 F723 L733 Q735 K739 Y740 V741 L799 I802	L455-A737 HydrophobicContact CD1-CB 4.21Å; L455-A737 HydrophobicContact CD2-CB 3.84Å; F723-A737 HydrophobicContact CE1-CB 4Å; F723-A737 HydrophobicContact CZ-CB 3.8Å; L733-A737 WeakPolarHBondContact O-CB 3.23Å; L733-A737 PolarHBondContact O-N 2.99Å; Q735-A737 VanDerWaalsContact C-N 3.34Å; Q735-A737 PolarHBondContact O-N 3.38Å; A737-K739 VanDerWaalsContact C-N 3.33Å; A737-K739 PolarHBondContact O-N 3.34Å; A737-Y740 PolarHBondContact O-N 2.86Å; A737-V741 VanDerWaalsContact O-CB 3.32Å; A737-V741 WeakPolarHBondContact O-CB 3.05Å; A737-V741 VanDerWaalsContact O-CG2 3.24Å; A737-V741 WeakPolarHBondContact O-CG2 3.46Å; A737-V741 PolarHBondContact O-N 2.92Å; A737-L799 HydrophobicContact CB-CD1 4.24Å; A737-I802 HydrophobicContact CB-CD1 3.8Å; A737-I802 WeakPolarHBondContact O-CD1 3.11Å
738	S	84.8	Confident	77	Confident	55 Å²	55	60.7 Å²	60.7	39%	0.385	34%	0.338	S	S	.	.	H	α-helix	trans	-63	-37.9	176.6	-176.5	0	0	0	0	112.4	K734 Q735 L736 T742	K734-S738 VanDerWaalsContact O-CB 3.32Å; K734-S738 WeakPolarHBondContact O-CB 3.4Å; K734-S738 PolarHBondContact O-N 3.19Å; Q735-S738 WeakPolarHBondContact O-CB 3.32Å; Q735-S738 PolarHBondContact O-N 3.13Å; L736-S738 PolarHBondContact O-N 3.38Å; S738-T742 WeakPolarHBondContact O-CB 3.07Å; S738-T742 PolarHBondContact O-N 3.22Å; S738-T742 PolarHBondContact O-OG1 3.19Å
739	K	85.9	Confident	78	Confident	118 Å²	118	53.1 Å²	53.1	51%	0.513	30%	0.298	S	S	.	.	H	α-helix	trans	-60.4	-52.8	173.9	-176.1	-171	173.6	-164.1	0	111	Q735 L736 A737 T742 Q743	Q735-K739 PolarHBondContact O-N 3.24Å; L736-K739 WeakPolarHBondContact O-CB 3Å; L736-K739 PolarHBondContact O-N 3.49Å; A737-K739 VanDerWaalsContact C-N 3.33Å; A737-K739 PolarHBondContact O-N 3.34Å; K739-T742 PolarHBondContact O-N 2.96Å; K739-Q743 PolarHBondContact O-N 2.7Å
740	Y	87	Confident	79.2	Confident	7 Å²	7	51.2 Å²	51.2	3%	0.027	28%	0.276	C	S	.	.	H	α-helix	trans	-65.8	-41.2	-179.6	-74.9	-46.4	0	0	0	113.4	A453 L455 D458 V460 L736 A737 T742 Q743 F744	A453-Y740 HydrophobicContact CB-CD2 3.95Å; A453-Y740 HydrophobicContact CB-CE2 4.44Å; A453-Y740 HydrophobicContact CB-CG 4.08Å; L455-Y740 HydrophobicContact CD2-CD2 4.44Å; D458-Y740 VanDerWaalsContact OD1-CE2 3.23Å; D458-Y740 WeakPolarHBondContact OD1-CE2 3.34Å; D458-Y740 VanDerWaalsContact OD1-CZ 3.23Å; D458-Y740 PolarHBondContact OD1-OH 3.16Å; V460-Y740 HydrophobicContact CG2-CD1 3.9Å; V460-Y740 HydrophobicContact CG2-CE1 3.5Å; V460-Y740 VanDerWaalsContact CG2-CE1 3.5Å; L736-Y740 HydrophobicContact CD2-CD2 3.61Å; L736-Y740 HydrophobicContact CD2-CE2 3.42Å; L736-Y740 VanDerWaalsContact CD2-CE2 3.42Å; L736-Y740 HydrophobicContact CG-CD2 4.3Å; L736-Y740 HydrophobicContact CG-CE2 3.95Å; L736-Y740 WeakPolarHBondContact O-CD2 3.32Å; L736-Y740 PolarHBondContact O-N 3.03Å; A737-Y740 PolarHBondContact O-N 2.86Å; Y740-T742 VanDerWaalsContact C-N 3.3Å; Y740-T742 PolarHBondContact O-N 3.11Å; Y740-Q743 PolarHBondContact O-N 2.85Å; Y740-F744 WeakPolarHBondContact O-CB 3.37Å; Y740-F744 WeakPolarHBondContact O-CD1 3.34Å; Y740-F744 VanDerWaalsContact O-CG 3.32Å; Y740-F744 WeakPolarHBondContact O-CG 3.34Å; Y740-F744 PolarHBondContact O-N 3.42Å
741	V	85.3	Confident	80.4	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.012	28%	0.279	C	S	.	.	H	α-helix	trans	-55.9	-47.2	173	161.7	0	0	0	0	110.7	E719 A737 F744 A745 T751 V753 I802	E719-V741 HydrophobicContact CB-CG1 4.31Å; E719-V741 HydrophobicContact CB-CG2 4.44Å; E719-V741 HydrophobicContact CG-CG1 4.36Å; E719-V741 WeakPolarHBondContact OE2-CG1 3.49Å; A737-V741 VanDerWaalsContact O-CB 3.32Å; A737-V741 WeakPolarHBondContact O-CB 3.05Å; A737-V741 VanDerWaalsContact O-CG2 3.24Å; A737-V741 WeakPolarHBondContact O-CG2 3.46Å; A737-V741 PolarHBondContact O-N 2.92Å; V741-F744 PolarHBondContact O-N 3.15Å; V741-A745 VanDerWaalsContact O-CB 3.25Å; V741-A745 WeakPolarHBondContact O-CB 3.42Å; V741-A745 PolarHBondContact O-N 3.49Å; V741-T751 HydrophobicContact CG1-CG2 4.34Å; V741-V753 HydrophobicContact CG2-CG2 4.17Å; V741-I802 HydrophobicContact CG2-CD1 3.98Å; V741-I802 HydrophobicContact CG2-CG1 4.42Å; V741-I802 HydrophobicContact CG2-CG2 4Å
742	T	80.4	Confident	81.5	Confident	72 Å²	72	51.6 Å²	51.6	44%	0.442	27%	0.269	S	S	.	.	H	α-helix	trans	-63.6	-44.5	179.4	-55.6	0	0	0	0	111.3	S738 K739 Y740 A745 I746	S738-T742 WeakPolarHBondContact O-CB 3.07Å; S738-T742 PolarHBondContact O-N 3.22Å; S738-T742 PolarHBondContact O-OG1 3.19Å; K739-T742 PolarHBondContact O-N 2.96Å; Y740-T742 VanDerWaalsContact C-N 3.3Å; Y740-T742 PolarHBondContact O-N 3.11Å; T742-A745 PolarHBondContact O-N 2.92Å; T742-I746 HydrophobicContact CG2-CD1 3.94Å; T742-I746 HydrophobicContact CG2-CG1 4.49Å; T742-I746 VanDerWaalsContact O-CG1 3.25Å; T742-I746 WeakPolarHBondContact O-CG1 3.48Å; T742-I746 PolarHBondContact O-N 3.46Å
743	Q	81.5	Confident	82.2	Confident	63 Å²	63	45.2 Å²	45.2	29%	0.294	24%	0.235	S	C	.	.	H	α-helix	trans	-63.2	-42.3	177.7	-171.3	-178.5	8.4	0	0	112	K739 Y740 N747	K739-Q743 PolarHBondContact O-N 2.7Å; Y740-Q743 PolarHBondContact O-N 2.85Å; Q743-N747 VanDerWaalsContact O-CG 3.31Å; Q743-N747 PolarHBondContact O-N 2.97Å; Q743-N747 PolarHBondContact O-ND2 3.19Å; Q743-N747 VanDerWaalsContact O-ND2 3.14Å
744	F	84.2	Confident	82.7	Confident	1 Å²	1	43.2 Å²	43.2	0%	0.004	22%	0.224	C	C	.	.	H	α-helix	trans	-66.6	-42	176.7	-73.2	7.7	0	0	0	111.1	K451 A453 V460 Y740 V741 N747 G748 L749 T751 I802	K451-F744 HydrophobicContact CB-CE1 4.04Å; K451-F744 HydrophobicContact CB-CE2 3.95Å; K451-F744 HydrophobicContact CB-CZ 3.66Å; K451-F744 HydrophobicContact CD-CD1 4.14Å; K451-F744 HydrophobicContact CD-CE1 3.76Å; K451-F744 HydrophobicContact CD-CZ 4.27Å; A453-F744 HydrophobicContact CB-CE2 4.14Å; A453-F744 HydrophobicContact CB-CZ 3.88Å; V460-F744 HydrophobicContact CG1-CE1 3.96Å; V460-F744 HydrophobicContact CG1-CZ 3.79Å; V460-F744 HydrophobicContact CG2-CZ 4.39Å; Y740-F744 WeakPolarHBondContact O-CB 3.37Å; Y740-F744 WeakPolarHBondContact O-CD1 3.34Å; Y740-F744 VanDerWaalsContact O-CG 3.32Å; Y740-F744 WeakPolarHBondContact O-CG 3.34Å; Y740-F744 PolarHBondContact O-N 3.42Å; V741-F744 PolarHBondContact O-N 3.15Å; F744-N747 PolarHBondContact O-N 2.8Å; F744-G748 PolarHBondContact O-N 2.81Å; F744-L749 HydrophobicContact CB-CB 4.27Å; F744-L749 HydrophobicContact CB-CD1 4.27Å; F744-L749 HydrophobicContact CG-CD1 4.3Å; F744-L749 WeakPolarHBondContact O-CB 2.96Å; F744-L749 PolarHBondContact O-N 3.34Å; F744-T751 HydrophobicContact CB-CG2 3.57Å; F744-T751 HydrophobicContact CD2-CG2 4.37Å; F744-T751 HydrophobicContact CG-CG2 4.5Å; F744-I802 HydrophobicContact CD2-CG2 4.06Å; F744-I802 HydrophobicContact CE2-CG2 4.16Å
745	A	72.9	Confident	83.2	Confident	36 Å²	36	40.9 Å²	40.9	30%	0.298	22%	0.215	S	C	.	.	H	α-helix	trans	-65.2	-39.7	177.1	0	0	0	0	0	112.9	V741 T742 N747 G748	V741-A745 VanDerWaalsContact O-CB 3.25Å; V741-A745 WeakPolarHBondContact O-CB 3.42Å; V741-A745 PolarHBondContact O-N 3.49Å; T742-A745 PolarHBondContact O-N 2.92Å; A745-N747 VanDerWaalsContact C-N 3.28Å; A745-N747 PolarHBondContact O-N 3.36Å; A745-G748 PolarHBondContact O-N 3.23Å; A745-G748 VanDerWaalsContact O-N 3.1Å
746	I	68.4	Low	83.6	Confident	109 Å²	109	34.8 Å²	34.8	56%	0.559	19%	0.188	S	C	*	.	H	α-helix	trans	-60.8	-40	174.5	-72.6	166.5	0	0	0	110.8	T742 G748	T742-I746 HydrophobicContact CG2-CD1 3.94Å; T742-I746 HydrophobicContact CG2-CG1 4.49Å; T742-I746 VanDerWaalsContact O-CG1 3.25Å; T742-I746 WeakPolarHBondContact O-CG1 3.48Å; T742-I746 PolarHBondContact O-N 3.46Å; I746-G748 PolarHBondContact O-N 2.68Å
747	N	70.6	Confident	83.8	Confident	82 Å²	82	34.5 Å²	34.5	44%	0.439	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	1.5	177.5	-70	-25.5	0	0	0	114	Q743 F744 A745 L749	Q743-N747 VanDerWaalsContact O-CG 3.31Å; Q743-N747 PolarHBondContact O-N 2.97Å; Q743-N747 PolarHBondContact O-ND2 3.19Å; Q743-N747 VanDerWaalsContact O-ND2 3.14Å; F744-N747 PolarHBondContact O-N 2.8Å; A745-N747 VanDerWaalsContact C-N 3.28Å; A745-N747 PolarHBondContact O-N 3.36Å; N747-L749 HydrophobicContact CB-CG 4.43Å
748	G	70.5	Confident	84.1	Confident	7 Å²	7	40.5 Å²	40.5	7%	0.072	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	90	8.6	178	0	0	0	0	0	115	F744 A745 I746 T840 S844	F744-G748 PolarHBondContact O-N 2.81Å; A745-G748 PolarHBondContact O-N 3.23Å; A745-G748 VanDerWaalsContact O-N 3.1Å; I746-G748 PolarHBondContact O-N 2.68Å; G748-T840 WeakPolarHBondContact O-CG2 2.91Å; G748-S844 WeakPolarHBondContact CA-OG 3.41Å
749	L	81.3	Confident	84.4	Confident	7 Å²	7	38.2 Å²	38.2	4%	0.037	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-91.5	142.5	-175.3	-53.3	174.7	0	0	0	111.2	Y450 K451 F744 N747 E806	Y450-L749 HydrophobicContact CD1-CD1 3.95Å; Y450-L749 HydrophobicContact CD1-CD2 3.8Å; Y450-L749 HydrophobicContact CG-CD2 4.34Å; K451-L749 HydrophobicContact CB-CD1 4.22Å; K451-L749 HydrophobicContact CD-CD1 3.89Å; K451-L749 HydrophobicContact CG-CD1 4.02Å; F744-L749 HydrophobicContact CB-CB 4.27Å; F744-L749 HydrophobicContact CB-CD1 4.27Å; F744-L749 HydrophobicContact CG-CD1 4.3Å; F744-L749 WeakPolarHBondContact O-CB 2.96Å; F744-L749 PolarHBondContact O-N 3.34Å; N747-L749 HydrophobicContact CB-CG 4.43Å; L749-E806 HydrophobicContact CD2-CB 3.71Å; L749-E806 HydrophobicContact CD2-CG 4.11Å
750	R	82.6	Confident	84.7	Confident	55 Å²	55	38.6 Å²	38.6	21%	0.208	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	123.7	168.7	-60.6	-168.8	-168.1	175.6	0	109	M447 D635 G804 V805 D807	M447-R750 VanDerWaalsContact CE-CD 3.48Å; M447-R750 HydrophobicContact CE-CG 4.21Å; M447-R750 VanDerWaalsContact CE-CZ 3.44Å; D635-R750 IonicContact OD1-NH1 3.37Å; D635-R750 PolarHBondContact OD1-NH1 2.82Å; D635-R750 IonicContact OD2-NH1 3.51Å; R750-G804 WeakPolarHBondContact O-CA 3.22Å; R750-V805 HydrophobicContact CB-CB 4.46Å; R750-V805 PolarHBondContact N-O 3.03Å; R750-V805 PolarHBondContact O-N 2.89Å; R750-D807 IonicContact CZ-OD2 3.97Å; R750-D807 IonicContact NE-OD2 3.63Å; R750-D807 IonicContact NH2-OD2 2.67Å; R750-D807 PolarHBondContact NH2-OD2 2.88Å
751	T	88	Confident	84.9	Confident	23 Å²	23	40.9 Å²	40.9	14%	0.141	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	132.9	-177.4	47.9	0	0	0	0	111	E719 V741 F744 T803	E719-T751 PolarHBondContact OE2-OG1 2.99Å; V741-T751 HydrophobicContact CG1-CG2 4.34Å; F744-T751 HydrophobicContact CB-CG2 3.57Å; F744-T751 HydrophobicContact CD2-CG2 4.37Å; F744-T751 HydrophobicContact CG-CG2 4.5Å; T751-T803 VanDerWaalsContact CA-O 3.31Å; T751-T803 WeakPolarHBondContact CA-O 3.16Å
752	L	91.1	Very high	85.2	Confident	34 Å²	34	49.4 Å²	49.4	18%	0.178	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	135	166.8	-70	170.1	0	0	0	109.3	L639 Y754 I802 T803	L639-L752 HydrophobicContact CD1-CD1 3.77Å; L752-Y754 HydrophobicContact CB-CE2 4.33Å; L752-I802 WeakPolarHBondContact O-CA 3.43Å; L752-T803 PolarHBondContact N-O 2.87Å; L752-T803 PolarHBondContact O-N 3.09Å
753	V	92.1	Very high	85.8	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	128.7	179.7	-173.7	0	0	0	0	108.6	K716 G717 E719 I722 F723 V741 L799 I802	K716-V753 WeakPolarHBondContact CA-O 3.41Å; G717-V753 PolarHBondContact N-O 3.28Å; G717-V753 VanDerWaalsContact N-O 3.13Å; G717-V753 PolarHBondContact O-N 3.18Å; E719-V753 HydrophobicContact CB-CG2 4.06Å; I722-V753 HydrophobicContact CB-CB 4.24Å; I722-V753 HydrophobicContact CB-CG1 4.31Å; I722-V753 HydrophobicContact CG1-CB 4.37Å; I722-V753 HydrophobicContact CG2-CB 4.22Å; I722-V753 HydrophobicContact CG2-CG1 3.8Å; F723-V753 HydrophobicContact CE1-CG1 4.25Å; F723-V753 HydrophobicContact CE1-CG2 4.41Å; V741-V753 HydrophobicContact CG2-CG2 4.17Å; V753-L799 HydrophobicContact CG1-CD2 3.77Å; V753-I802 HydrophobicContact CG2-CG1 4.43Å
754	Y	93.2	Very high	86.3	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.016	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	134.6	176.1	-80	-102.6	0	0	0	110.2	L600 L639 K716 L752 V800 S801 T803	L600-Y754 HydrophobicContact CD2-CD2 4.41Å; L600-Y754 HydrophobicContact CD2-CE1 4.03Å; L600-Y754 HydrophobicContact CD2-CE2 3.61Å; L600-Y754 WeakPolarHBondContact CD2-OH 3.38Å; L600-Y754 HydrophobicContact CG-CE1 4.34Å; L639-Y754 WeakPolarHBondContact CD1-OH 3.28Å; K716-Y754 HydrophobicContact CB-CD1 4Å; K716-Y754 HydrophobicContact CB-CD2 4.44Å; K716-Y754 HydrophobicContact CB-CE1 3.66Å; K716-Y754 HydrophobicContact CB-CE2 4.1Å; K716-Y754 HydrophobicContact CB-CG 4.37Å; K716-Y754 HydrophobicContact CD-CE1 4.21Å; K716-Y754 WeakPolarHBondContact CD-OH 3.39Å; L752-Y754 HydrophobicContact CB-CE2 4.33Å; Y754-V800 PolarHBondContact O-N 3.04Å; Y754-S801 PolarHBondContact N-O 3.08Å; Y754-T803 HydrophobicContact CD2-CG2 4.34Å; Y754-T803 HydrophobicContact CE2-CG2 4.13Å
755	A	91.8	Very high	86.7	Confident	3 Å²	3	51.3 Å²	51.3	3%	0.025	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	142	174.6	0	0	0	0	0	110.2	S715 I722 L797 T798 L799	S715-A755 PolarHBondContact N-O 2.77Å; S715-A755 PolarHBondContact O-N 3.41Å; S715-A755 VanDerWaalsContact O-O 3.13Å; I722-A755 HydrophobicContact CG2-CB 3.83Å; A755-L797 HydrophobicContact CB-CB 3.7Å; A755-L797 HydrophobicContact CB-CD1 4.06Å; A755-T798 CarbonylContact C-O 3.43Å; A755-T798 WeakPolarHBondContact CA-O 3.08Å; A755-T798 VanDerWaalsContact CB-O 3.32Å; A755-T798 WeakPolarHBondContact CB-O 3.39Å; A755-L799 HydrophobicContact CB-CD2 4.31Å
756	S	92	Very high	87.6	Confident	13 Å²	13	55.2 Å²	55.2	9%	0.091	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	156.9	-178.7	-170	0	0	0	0	110.8	I713 H714 T798	I713-S756 CarbonylContact O-C 3.54Å; I713-S756 WeakPolarHBondContact O-CA 3.43Å; H714-S756 PolarHBondContact CE1-OG 2.92Å; H714-S756 WeakPolarHBondContact ND1-CB 3.48Å; H714-S756 PolarHBondContact ND1-OG 2.78Å; S756-T798 PolarHBondContact N-O 3.16Å; S756-T798 PolarHBondContact O-N 3.47Å; S756-T798 PolarHBondContact O-OG1 3.17Å
757	R	91.4	Very high	88.7	Confident	33 Å²	33	50.5 Å²	50.5	13%	0.125	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	128.4	170.9	-179.8	172.3	70.4	129.7	-7.8	109	H712 I713 V759 E763 I793 Y795 L797	H712-R757 WeakPolarHBondContact CA-O 3.19Å; I713-R757 PolarHBondContact N-O 3.16Å; I713-R757 PolarHBondContact O-N 2.83Å; R757-V759 HydrophobicContact CG-CG2 3.95Å; R757-E763 IonicContact CZ-OE1 3.58Å; R757-E763 IonicContact NH1-OE1 2.82Å; R757-E763 PolarHBondContact NH1-OE1 3.01Å; R757-E763 IonicContact NH2-OE1 3.51Å; R757-I793 PolarHBondContact NH2-O 3.29Å; R757-Y795 WeakPolarHBondContact CD-O 3.44Å; R757-Y795 PolarHBondContact NE-O 2.87Å; R757-Y795 VanDerWaalsContact NE-O 3.09Å; R757-L797 HydrophobicContact CB-CD2 3.39Å; R757-L797 HydrophobicContact CG-CD2 4.48Å
758	Q	91.7	Very high	89.6	Confident	127 Å²	127	47 Å²	47	59%	0.593	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	134.4	166.3	-170	176.6	-4.9	0	0	108.6	Y711	Y711-Q758 WeakPolarHBondContact O-CA 3.24Å
759	V	91.4	Very high	90.5	Very high	7 Å²	7	52 Å²	52	4%	0.042	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	146.4	-173.9	-179.2	0	0	0	0	109.7	Y711 I713 R757 E763	Y711-V759 PolarHBondContact O-N 3.21Å; I713-V759 HydrophobicContact CD1-CG2 3.62Å; I713-V759 HydrophobicContact CG1-CG2 3.91Å; R757-V759 HydrophobicContact CG-CG2 3.95Å; V759-E763 HydrophobicContact CG1-CB 3.63Å; V759-E763 HydrophobicContact CG1-CG 3.65Å
760	D	92.4	Very high	90.9	Very high	126 Å²	126	54.6 Å²	54.6	67%	0.674	26%	0.264	S	S	*	.			trans	-68.7	146.4	174.7	-76.4	-10.9	0	0	0	111.1	K762 E763 Y764	D760-K762 PolarHBondContact O-N 2.77Å; D760-K762 VanDerWaalsContact O-N 3.13Å; D760-E763 PolarHBondContact O-N 2.98Å; D760-E763 VanDerWaalsContact O-N 3.09Å; D760-Y764 WeakPolarHBondContact O-CB 3.33Å; D760-Y764 PolarHBondContact O-N 3.44Å
761	S	90.6	Very high	91.2	Very high	55 Å²	55	52.6 Å²	52.6	39%	0.385	26%	0.257	S	S	.	.	H	α-helix	trans	-53.3	-39.1	-178.2	60.5	0	0	0	0	113.5	Y764 Y765	S761-Y764 PolarHBondContact O-N 2.95Å; S761-Y765 WeakPolarHBondContact O-CD2 3.29Å; S761-Y765 PolarHBondContact O-N 2.96Å; S761-Y765 VanDerWaalsContact O-N 3.09Å
762	K	91.9	Very high	91.1	Very high	181 Å²	181	54.2 Å²	54.2	79%	0.787	26%	0.261	S	S	*	.	H	α-helix	trans	-64.4	-46.3	178.2	-67.8	-178.5	-179	176.6	0	112.5	D760 Y764 Q766	D760-K762 PolarHBondContact O-N 2.77Å; D760-K762 VanDerWaalsContact O-N 3.13Å; K762-Y764 VanDerWaalsContact C-N 3.35Å; K762-Q766 WeakPolarHBondContact O-CB 2.81Å; K762-Q766 PolarHBondContact O-N 3.11Å
763	E	92.2	Very high	90.9	Very high	75 Å²	75	58.5 Å²	58.5	35%	0.35	28%	0.28	S	S	.	.	H	α-helix	trans	-66.5	-40.6	177.3	-179.1	-174.8	164.8	0	0	110.2	R757 V759 D760 Q766 L767	R757-E763 IonicContact CZ-OE1 3.58Å; R757-E763 IonicContact NH1-OE1 2.82Å; R757-E763 PolarHBondContact NH1-OE1 3.01Å; R757-E763 IonicContact NH2-OE1 3.51Å; V759-E763 HydrophobicContact CG1-CB 3.63Å; V759-E763 HydrophobicContact CG1-CG 3.65Å; D760-E763 PolarHBondContact O-N 2.98Å; D760-E763 VanDerWaalsContact O-N 3.09Å; E763-Q766 PolarHBondContact O-N 3.28Å; E763-L767 HydrophobicContact CG-CD1 4Å; E763-L767 HydrophobicContact CG-CG 4.41Å; E763-L767 VanDerWaalsContact O-CG 3.31Å; E763-L767 WeakPolarHBondContact O-CG 3.22Å; E763-L767 PolarHBondContact O-N 3.1Å
764	Y	92.2	Very high	90.5	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-58.9	-51.7	179.8	-175.6	-89.6	0	0	0	112.6	D688 M703 A704 Y711 D760 S761 K762 L767 L768	D688-Y764 VanDerWaalsContact OD2-CE1 3.29Å; D688-Y764 WeakPolarHBondContact OD2-CE1 3.13Å; D688-Y764 PolarHBondContact OD2-OH 3.4Å; M703-Y764 VanDerWaalsContact C-OH 3.27Å; M703-Y764 HydrophobicContact CB-CE2 3.72Å; M703-Y764 HydrophobicContact CE-CD1 4.42Å; M703-Y764 HydrophobicContact CE-CD2 3.64Å; M703-Y764 HydrophobicContact CE-CE1 4.41Å; M703-Y764 HydrophobicContact CE-CE2 3.64Å; M703-Y764 HydrophobicContact CE-CG 4.07Å; M703-Y764 HydrophobicContact CG-CE2 4.41Å; M703-Y764 PolarHBondContact O-OH 3.01Å; A704-Y764 PolarHBondContact N-OH 3.46Å; Y711-Y764 AromaticContact CD1-CD1 3.64Å; Y711-Y764 HydrophobicContact CD1-CD1 3.64Å; Y711-Y764 HydrophobicContact CD1-CD2 4.18Å; Y711-Y764 AromaticContact CD1-CE1 3.85Å; Y711-Y764 HydrophobicContact CD1-CE1 3.85Å; Y711-Y764 HydrophobicContact CD1-CE2 4.33Å; Y711-Y764 AromaticContact CD1-CG 3.81Å; Y711-Y764 HydrophobicContact CD1-CG 3.81Å; Y711-Y764 HydrophobicContact CE1-CD1 4.23Å; Y711-Y764 HydrophobicContact CE1-CE1 4.41Å; Y711-Y764 HydrophobicContact CG-CD1 4.43Å; Y711-Y764 HydrophobicContact CG-CD2 4.36Å; Y711-Y764 HydrophobicContact CG-CG 4.15Å; D760-Y764 WeakPolarHBondContact O-CB 3.33Å; D760-Y764 PolarHBondContact O-N 3.44Å; S761-Y764 PolarHBondContact O-N 2.95Å; K762-Y764 VanDerWaalsContact C-N 3.35Å; Y764-L767 PolarHBondContact O-N 3.43Å; Y764-L768 WeakPolarHBondContact O-CB 3.29Å; Y764-L768 PolarHBondContact O-N 3.19Å
765	Y	91.6	Very high	89.8	Confident	101 Å²	101	60.5 Å²	60.5	40%	0.396	29%	0.291	S	S	.	.	H	α-helix	trans	-68.6	-34.4	179.5	-74.9	-65.2	0	0	0	112.7	Y711 S761 L768 D769	Y711-Y765 HydrophobicContact CE1-CE2 4.12Å; S761-Y765 WeakPolarHBondContact O-CD2 3.29Å; S761-Y765 PolarHBondContact O-N 2.96Å; S761-Y765 VanDerWaalsContact O-N 3.09Å; Y765-L768 HydrophobicContact CD1-CD2 4.19Å; Y765-L768 HydrophobicContact CE1-CD2 4.48Å; Y765-L768 PolarHBondContact O-N 3.06Å; Y765-D769 PolarHBondContact O-N 3.24Å
766	Q	92.5	Very high	89.2	Confident	117 Å²	117	63.6 Å²	63.6	55%	0.547	31%	0.312	S	S	.	.	H	α-helix	trans	-61.2	-45.8	173.8	-177.9	-179.1	-6.5	0	0	111.8	K762 E763 L768 D769 E770	K762-Q766 WeakPolarHBondContact O-CB 2.81Å; K762-Q766 PolarHBondContact O-N 3.11Å; E763-Q766 PolarHBondContact O-N 3.28Å; Q766-L768 VanDerWaalsContact C-N 3.3Å; Q766-L768 PolarHBondContact O-N 3.25Å; Q766-D769 PolarHBondContact O-N 3.31Å; Q766-E770 PolarHBondContact O-N 3.19Å; Q766-E770 VanDerWaalsContact O-N 3.13Å
767	L	91.9	Very high	88.7	Confident	11 Å²	11	65.2 Å²	65.2	6%	0.058	32%	0.32	C	S	.	.	H	α-helix	trans	-64.2	-37.2	177	-71	172.6	0	0	0	111.9	M703 I713 E763 Y764 F771 I789 K792 I793	M703-L767 HydrophobicContact CE-CB 4.11Å; I713-L767 HydrophobicContact CD1-CD1 4.39Å; E763-L767 HydrophobicContact CG-CD1 4Å; E763-L767 HydrophobicContact CG-CG 4.41Å; E763-L767 VanDerWaalsContact O-CG 3.31Å; E763-L767 WeakPolarHBondContact O-CG 3.22Å; E763-L767 PolarHBondContact O-N 3.1Å; Y764-L767 PolarHBondContact O-N 3.43Å; L767-F771 WeakPolarHBondContact O-CB 3.42Å; L767-F771 PolarHBondContact O-N 3.31Å; L767-I789 HydrophobicContact CD2-CD1 4.09Å; L767-K792 HydrophobicContact CD2-CB 3.92Å; L767-I793 HydrophobicContact CB-CG1 4.16Å; L767-I793 HydrophobicContact CD1-CG1 4.37Å; L767-I793 HydrophobicContact CD2-CG1 4.14Å; L767-I793 HydrophobicContact CG-CG1 4.46Å
768	L	89.7	Confident	87.9	Confident	9 Å²	9	72.1 Å²	72.1	5%	0.047	35%	0.351	C	S	.	.	H	α-helix	trans	-65.9	-44.6	178.7	-171.2	67.5	0	0	0	111.9	D688 A689 M703 Y764 Y765 Q766 F771 Y772	D688-L768 HydrophobicContact CB-CD1 3.9Å; D688-L768 HydrophobicContact CB-CD2 4Å; A689-L768 HydrophobicContact CB-CD1 3.84Å; M703-L768 HydrophobicContact CE-CB 4.4Å; Y764-L768 WeakPolarHBondContact O-CB 3.29Å; Y764-L768 PolarHBondContact O-N 3.19Å; Y765-L768 HydrophobicContact CD1-CD2 4.19Å; Y765-L768 HydrophobicContact CE1-CD2 4.48Å; Y765-L768 PolarHBondContact O-N 3.06Å; Q766-L768 VanDerWaalsContact C-N 3.3Å; Q766-L768 PolarHBondContact O-N 3.25Å; L768-F771 WeakPolarHBondContact O-CB 3.27Å; L768-F771 PolarHBondContact O-N 3.18Å; L768-Y772 HydrophobicContact CD1-CD2 4.33Å; L768-Y772 HydrophobicContact CD1-CE2 3.64Å; L768-Y772 HydrophobicContact CD2-CE2 3.93Å; L768-Y772 HydrophobicContact CG-CD2 3.96Å; L768-Y772 HydrophobicContact CG-CE2 3.46Å; L768-Y772 VanDerWaalsContact CG-CE2 3.46Å; L768-Y772 VanDerWaalsContact O-CD2 3.26Å; L768-Y772 WeakPolarHBondContact O-CD2 3.27Å; L768-Y772 PolarHBondContact O-N 3.34Å
769	D	88.4	Confident	87.4	Confident	111 Å²	111	68.7 Å²	68.7	59%	0.594	35%	0.35	S	S	*	.	H	α-helix	trans	-63.7	-44.6	176.9	-76	-14.6	0	0	0	111.7	Y765 Q766 F771 Y772 H773	Y765-D769 PolarHBondContact O-N 3.24Å; Q766-D769 PolarHBondContact O-N 3.31Å; D769-F771 VanDerWaalsContact C-N 3.29Å; D769-F771 PolarHBondContact O-N 3Å; D769-Y772 PolarHBondContact O-N 2.74Å; D769-H773 WeakPolarHBondContact O-CB 3.23Å; D769-H773 PolarHBondContact O-N 3.03Å
770	E	89.9	Confident	86.9	Confident	62 Å²	62	72.5 Å²	72.5	29%	0.29	38%	0.377	S	S	.	.	H	α-helix	trans	-61.7	-36.9	174.7	-74	-172.7	-155.1	0	0	111.9	Q766 H773 A774 I789 K792	Q766-E770 PolarHBondContact O-N 3.19Å; Q766-E770 VanDerWaalsContact O-N 3.13Å; E770-H773 PolarHBondContact O-N 3.47Å; E770-A774 WeakPolarHBondContact O-CB 3.36Å; E770-A774 PolarHBondContact O-N 2.92Å; E770-I789 HydrophobicContact CB-CD1 3.5Å; E770-I789 VanDerWaalsContact CB-CD1 3.5Å; E770-I789 HydrophobicContact CB-CG1 4.17Å; E770-I789 HydrophobicContact CG-CD1 4.47Å; E770-I789 WeakPolarHBondContact OE2-CD1 3.27Å; E770-K792 IonicContact OE1-NZ 3.42Å; E770-K792 PolarHBondContact OE1-NZ 2.9Å; E770-K792 IonicContact OE2-NZ 2.68Å; E770-K792 PolarHBondContact OE2-NZ 3.41Å
771	F	89.2	Confident	86.4	Confident	12 Å²	12	72.9 Å²	72.9	5%	0.053	37%	0.374	C	S	.	.	H	α-helix	trans	-67.3	-44.5	177	169.9	-97	0	0	0	112.4	A689 L691 L767 L768 D769 H773 A774 N775 I789 Y790 I793	A689-F771 HydrophobicContact CB-CD1 3.96Å; A689-F771 HydrophobicContact CB-CE1 3.69Å; A689-F771 HydrophobicContact CB-CZ 4.14Å; L691-F771 HydrophobicContact CD1-CD2 4.42Å; L691-F771 HydrophobicContact CD1-CE2 4Å; L691-F771 HydrophobicContact CD1-CZ 4.46Å; L691-F771 HydrophobicContact CG-CE2 4.1Å; L767-F771 WeakPolarHBondContact O-CB 3.42Å; L767-F771 PolarHBondContact O-N 3.31Å; L768-F771 WeakPolarHBondContact O-CB 3.27Å; L768-F771 PolarHBondContact O-N 3.18Å; D769-F771 VanDerWaalsContact C-N 3.29Å; D769-F771 PolarHBondContact O-N 3Å; F771-H773 VanDerWaalsContact C-N 3.33Å; F771-A774 PolarHBondContact O-N 2.96Å; F771-N775 WeakPolarHBondContact CE1-ND2 3.47Å; F771-N775 WeakPolarHBondContact CE2-ND2 3.46Å; F771-N775 WeakPolarHBondContact CZ-ND2 3.41Å; F771-N775 PolarHBondContact O-N 2.86Å; F771-N775 PolarHBondContact O-ND2 3.03Å; F771-I789 HydrophobicContact CB-CG1 4.11Å; F771-Y790 HydrophobicContact CD2-CE1 4.07Å; F771-Y790 AromaticContact CE2-CE1 3.81Å; F771-Y790 HydrophobicContact CE2-CE1 3.81Å; F771-I793 HydrophobicContact CB-CD1 4.35Å; F771-I793 HydrophobicContact CD2-CD1 4.37Å
772	Y	85.9	Confident	85.9	Confident	57 Å²	57	74 Å²	74	22%	0.224	37%	0.37	C	S	.	.	H	α-helix	trans	-65.4	-38.4	175.2	-71.5	-48.9	0	0	0	112	H661 D688 L768 D769 N775 S776	H661-Y772 HydrophobicContact CB-CE1 3.63Å; H661-Y772 WeakPolarHBondContact CB-OH 3.48Å; H661-Y772 AromaticContact CG-CE1 3.77Å; D688-Y772 PolarHBondContact O-OH 3.07Å; L768-Y772 HydrophobicContact CD1-CD2 4.33Å; L768-Y772 HydrophobicContact CD1-CE2 3.64Å; L768-Y772 HydrophobicContact CD2-CE2 3.93Å; L768-Y772 HydrophobicContact CG-CD2 3.96Å; L768-Y772 HydrophobicContact CG-CE2 3.46Å; L768-Y772 VanDerWaalsContact CG-CE2 3.46Å; L768-Y772 VanDerWaalsContact O-CD2 3.26Å; L768-Y772 WeakPolarHBondContact O-CD2 3.27Å; L768-Y772 PolarHBondContact O-N 3.34Å; D769-Y772 PolarHBondContact O-N 2.74Å; Y772-N775 PolarHBondContact O-N 3.01Å; Y772-S776 PolarHBondContact O-N 2.58Å
773	H	86.7	Confident	85.4	Confident	125 Å²	125	70.3 Å²	70.3	58%	0.579	36%	0.359	S	S	*	.	H	α-helix	trans	-60.1	-47.7	173.5	-172	57.4	0	0	0	111.5	D769 E770 F771 N775 S776	D769-H773 WeakPolarHBondContact O-CB 3.23Å; D769-H773 PolarHBondContact O-N 3.03Å; E770-H773 PolarHBondContact O-N 3.47Å; F771-H773 VanDerWaalsContact C-N 3.33Å; H773-N775 VanDerWaalsContact C-N 3.31Å; H773-N775 PolarHBondContact O-N 3.1Å; H773-S776 PolarHBondContact O-N 2.67Å; H773-S776 VanDerWaalsContact O-N 3.09Å; H773-S776 PolarHBondContact O-OG 3.01Å
774	A	84.2	Confident	85.1	Confident	4 Å²	4	71.4 Å²	71.4	3%	0.033	37%	0.367	C	S	.	.	H	α-helix	trans	-61.3	-37.3	176.1	0	0	0	0	0	112.9	E770 F771 S776 L777 A785 L786 I789	E770-A774 WeakPolarHBondContact O-CB 3.36Å; E770-A774 PolarHBondContact O-N 2.92Å; F771-A774 PolarHBondContact O-N 2.96Å; A774-S776 VanDerWaalsContact C-N 3.29Å; A774-S776 PolarHBondContact O-N 2.81Å; A774-L777 PolarHBondContact O-N 3.09Å; A774-A785 HydrophobicContact CB-CB 3.87Å; A774-L786 HydrophobicContact CB-CD2 3.86Å; A774-L786 HydrophobicContact CB-CG 4.26Å; A774-I789 HydrophobicContact CB-CG2 4.13Å
775	N	78.5	Confident	84.8	Confident	42 Å²	42	72.6 Å²	72.6	23%	0.225	38%	0.377	C	S	.	.	H	α-helix	trans	-71.5	-17.5	175.7	-87.2	-43.5	0	0	0	114.4	F771 Y772 H773 R782	F771-N775 WeakPolarHBondContact CE1-ND2 3.47Å; F771-N775 WeakPolarHBondContact CE2-ND2 3.46Å; F771-N775 WeakPolarHBondContact CZ-ND2 3.41Å; F771-N775 PolarHBondContact O-N 2.86Å; F771-N775 PolarHBondContact O-ND2 3.03Å; Y772-N775 PolarHBondContact O-N 3.01Å; H773-N775 VanDerWaalsContact C-N 3.31Å; H773-N775 PolarHBondContact O-N 3.1Å; N775-R782 PolarHBondContact O-NH1 3.27Å; N775-R782 PolarHBondContact OD1-NH2 2.83Å
776	S	78.9	Confident	84.6	Confident	67 Å²	67	68.4 Å²	68.4	47%	0.469	36%	0.362	S	S	.	.	H	α-helix	trans	-81.2	-16.7	175.9	74.5	0	0	0	0	113.4	Y772 H773 A774 F778	Y772-S776 PolarHBondContact O-N 2.58Å; H773-S776 PolarHBondContact O-N 2.67Å; H773-S776 VanDerWaalsContact O-N 3.09Å; H773-S776 PolarHBondContact O-OG 3.01Å; A774-S776 VanDerWaalsContact C-N 3.29Å; A774-S776 PolarHBondContact O-N 2.81Å; S776-F778 WeakPolarHBondContact O-CE2 3.24Å
777	L	80.8	Confident	84.3	Confident	48 Å²	48	69.8 Å²	69.8	25%	0.251	37%	0.366	S	S	.	.			trans	-75.9	160.9	178.3	-60.8	173.3	0	0	0	112.1	A774 R782 A785	A774-L777 PolarHBondContact O-N 3.09Å; L777-R782 HydrophobicContact CB-CB 4.03Å; L777-R782 HydrophobicContact CB-CG 4.49Å; L777-R782 WeakPolarHBondContact O-CB 3.11Å; L777-R782 WeakPolarHBondContact O-CD 3.42Å; L777-R782 VanDerWaalsContact O-CG 3.29Å; L777-R782 WeakPolarHBondContact O-CG 3.06Å; L777-R782 PolarHBondContact O-NH1 3.43Å; L777-A785 HydrophobicContact CD1-CB 3.74Å
778	F	76.2	Confident	84.2	Confident	177 Å²	177	76.6 Å²	76.6	78%	0.776	40%	0.395	S	S	*	.			trans	-119.8	158.4	-179.5	-61.8	-84.2	0	0	0	112.1	S776	S776-F778 WeakPolarHBondContact O-CE2 3.24Å
779	G	80.2	Confident	84.3	Confident	55 Å²	55	76.4 Å²	76.4	57%	0.567	39%	0.394	S	S	*	.	H	α-helix	trans	69.3	-148.2	172.6	0	0	0	0	0	114.8	E781 R782	G779-E781 VanDerWaalsContact C-N 3.34Å; G779-R782 WeakPolarHBondContact O-CB 3.28Å; G779-R782 PolarHBondContact O-N 2.86Å
780	S	81.6	Confident	84.5	Confident	87 Å²	87	73.1 Å²	73.1	61%	0.608	37%	0.374	S	S	*	.	H	α-helix	trans	-65.7	-35	-179.7	49.2	0	0	0	0	113	R782 N783 D784	S780-R782 VanDerWaalsContact C-N 3.28Å; S780-R782 PolarHBondContact O-N 2.82Å; S780-N783 PolarHBondContact O-N 3.02Å; S780-N783 VanDerWaalsContact O-N 3.11Å; S780-D784 PolarHBondContact O-N 3.26Å
781	E	80.9	Confident	84.4	Confident	134 Å²	134	73.6 Å²	73.6	63%	0.626	38%	0.384	S	S	*	.	H	α-helix	trans	-60.6	-38.5	179.4	-65.4	-178.3	172.2	0	0	111.9	G779 D784 A785	G779-E781 VanDerWaalsContact C-N 3.34Å; E781-D784 PolarHBondContact O-N 3.32Å; E781-A785 VanDerWaalsContact O-CB 3.26Å; E781-A785 WeakPolarHBondContact O-CB 3.47Å; E781-A785 PolarHBondContact O-N 3.34Å
782	R	81.5	Confident	84.5	Confident	80 Å²	80	78 Å²	78	30%	0.302	40%	0.403	S	S	.	.	H	α-helix	trans	-56.9	-50.8	172.2	-174.6	-159.8	172.7	94.2	4.3	111.6	N775 L777 G779 S780 D784 A785 L786	N775-R782 PolarHBondContact O-NH1 3.27Å; N775-R782 PolarHBondContact OD1-NH2 2.83Å; L777-R782 HydrophobicContact CB-CB 4.03Å; L777-R782 HydrophobicContact CB-CG 4.49Å; L777-R782 WeakPolarHBondContact O-CB 3.11Å; L777-R782 WeakPolarHBondContact O-CD 3.42Å; L777-R782 VanDerWaalsContact O-CG 3.29Å; L777-R782 WeakPolarHBondContact O-CG 3.06Å; L777-R782 PolarHBondContact O-NH1 3.43Å; G779-R782 WeakPolarHBondContact O-CB 3.28Å; G779-R782 PolarHBondContact O-N 2.86Å; S780-R782 VanDerWaalsContact C-N 3.28Å; S780-R782 PolarHBondContact O-N 2.82Å; R782-D784 VanDerWaalsContact C-N 3.32Å; R782-D784 PolarHBondContact O-N 3.15Å; R782-A785 PolarHBondContact O-N 3.22Å; R782-L786 HydrophobicContact CG-CD1 3.84Å; R782-L786 HydrophobicContact CG-CG 4.34Å; R782-L786 VanDerWaalsContact O-CB 3.3Å; R782-L786 WeakPolarHBondContact O-CB 3.22Å; R782-L786 VanDerWaalsContact O-CG 3.25Å; R782-L786 WeakPolarHBondContact O-CG 3.32Å; R782-L786 PolarHBondContact O-N 2.8Å
783	N	80.2	Confident	84.8	Confident	103 Å²	103	75.3 Å²	75.3	55%	0.551	39%	0.392	S	S	*	.	H	α-helix	trans	-64.4	-39.7	-176.1	-67.9	-20.5	0	0	0	111.3	S780 K787	S780-N783 PolarHBondContact O-N 3.02Å; S780-N783 VanDerWaalsContact O-N 3.11Å; N783-K787 WeakPolarHBondContact O-CB 3.45Å; N783-K787 PolarHBondContact O-N 3.28Å
784	D	86.1	Confident	84.9	Confident	97 Å²	97	69.3 Å²	69.3	52%	0.519	37%	0.365	S	S	.	.	H	α-helix	trans	-69.3	-41.5	177.1	-72.3	-22.8	0	0	0	112.3	S780 E781 R782 K787 K788	S780-D784 PolarHBondContact O-N 3.26Å; E781-D784 PolarHBondContact O-N 3.32Å; R782-D784 VanDerWaalsContact C-N 3.32Å; R782-D784 PolarHBondContact O-N 3.15Å; D784-K787 PolarHBondContact O-N 3.01Å; D784-K788 WeakPolarHBondContact O-CG 3.39Å; D784-K788 PolarHBondContact O-N 2.85Å; D784-K788 VanDerWaalsContact O-N 3.16Å
785	A	87	Confident	85.1	Confident	26 Å²	26	76.9 Å²	76.9	22%	0.215	39%	0.393	C	S	.	.	H	α-helix	trans	-63.7	-45.4	174.7	0	0	0	0	0	111.5	A774 L777 E781 R782 K787 K788 I789	A774-A785 HydrophobicContact CB-CB 3.87Å; L777-A785 HydrophobicContact CD1-CB 3.74Å; E781-A785 VanDerWaalsContact O-CB 3.26Å; E781-A785 WeakPolarHBondContact O-CB 3.47Å; E781-A785 PolarHBondContact O-N 3.34Å; R782-A785 PolarHBondContact O-N 3.22Å; A785-K787 VanDerWaalsContact C-N 3.33Å; A785-K787 PolarHBondContact O-N 3.28Å; A785-K788 PolarHBondContact O-N 3.09Å; A785-I789 WeakPolarHBondContact O-CG2 3.17Å; A785-I789 PolarHBondContact O-N 3.02Å
786	L	86.7	Confident	85.5	Confident	13 Å²	13	77.4 Å²	77.4	7%	0.068	40%	0.396	C	S	.	.	H	α-helix	trans	-59.5	-42.7	175.8	-75.6	175.4	0	0	0	111.7	A774 R782 K788 I789 Y790	A774-L786 HydrophobicContact CB-CD2 3.86Å; A774-L786 HydrophobicContact CB-CG 4.26Å; R782-L786 HydrophobicContact CG-CD1 3.84Å; R782-L786 HydrophobicContact CG-CG 4.34Å; R782-L786 VanDerWaalsContact O-CB 3.3Å; R782-L786 WeakPolarHBondContact O-CB 3.22Å; R782-L786 VanDerWaalsContact O-CG 3.25Å; R782-L786 WeakPolarHBondContact O-CG 3.32Å; R782-L786 PolarHBondContact O-N 2.8Å; L786-K788 VanDerWaalsContact C-N 3.33Å; L786-K788 PolarHBondContact O-N 2.82Å; L786-I789 HydrophobicContact CD2-CG2 4.4Å; L786-I789 VanDerWaalsContact O-CG2 3.23Å; L786-I789 WeakPolarHBondContact O-CG2 3.46Å; L786-I789 PolarHBondContact O-N 3.48Å; L786-Y790 HydrophobicContact CB-CE1 4.33Å; L786-Y790 HydrophobicContact CB-CE2 4.42Å; L786-Y790 HydrophobicContact CD2-CE1 3.94Å; L786-Y790 WeakPolarHBondContact O-CB 3.44Å; L786-Y790 WeakPolarHBondContact O-CD1 3.27Å; L786-Y790 PolarHBondContact O-N 3.01Å
787	K	86.4	Confident	86	Confident	145 Å²	145	74.2 Å²	74.2	63%	0.63	37%	0.374	S	S	*	.	H	α-helix	trans	-62.2	-39.4	177.6	-170.6	176.6	-179.4	-178.8	0	112.8	N783 D784 A785 S791	N783-K787 WeakPolarHBondContact O-CB 3.45Å; N783-K787 PolarHBondContact O-N 3.28Å; D784-K787 PolarHBondContact O-N 3.01Å; A785-K787 VanDerWaalsContact C-N 3.33Å; A785-K787 PolarHBondContact O-N 3.28Å; K787-S791 PolarHBondContact O-N 3.43Å; K787-S791 PolarHBondContact O-OG 2.86Å
788	K	89.4	Confident	86.4	Confident	155 Å²	155	75.2 Å²	75.2	67%	0.674	38%	0.382	S	S	*	.	H	α-helix	trans	-66.2	-48.1	176.6	-72.6	175.7	-176.4	175.3	0	111.5	D784 A785 L786 S791 K792	D784-K788 WeakPolarHBondContact O-CG 3.39Å; D784-K788 PolarHBondContact O-N 2.85Å; D784-K788 VanDerWaalsContact O-N 3.16Å; A785-K788 PolarHBondContact O-N 3.09Å; L786-K788 VanDerWaalsContact C-N 3.33Å; L786-K788 PolarHBondContact O-N 2.82Å; K788-S791 PolarHBondContact O-N 2.94Å; K788-K792 PolarHBondContact O-N 3.03Å
789	I	92	Very high	87	Confident	5 Å²	5	67 Å²	67	3%	0.026	35%	0.346	C	S	.	.	H	α-helix	trans	-68.7	-37.5	-178.5	-170.2	57.2	0	0	0	112.2	L767 E770 F771 A774 A785 L786 S791 K792 I793	L767-I789 HydrophobicContact CD2-CD1 4.09Å; E770-I789 HydrophobicContact CB-CD1 3.5Å; E770-I789 VanDerWaalsContact CB-CD1 3.5Å; E770-I789 HydrophobicContact CB-CG1 4.17Å; E770-I789 HydrophobicContact CG-CD1 4.47Å; E770-I789 WeakPolarHBondContact OE2-CD1 3.27Å; F771-I789 HydrophobicContact CB-CG1 4.11Å; A774-I789 HydrophobicContact CB-CG2 4.13Å; A785-I789 WeakPolarHBondContact O-CG2 3.17Å; A785-I789 PolarHBondContact O-N 3.02Å; L786-I789 HydrophobicContact CD2-CG2 4.4Å; L786-I789 VanDerWaalsContact O-CG2 3.23Å; L786-I789 WeakPolarHBondContact O-CG2 3.46Å; L786-I789 PolarHBondContact O-N 3.48Å; I789-S791 VanDerWaalsContact C-N 3.27Å; I789-S791 PolarHBondContact O-N 3.34Å; I789-K792 HydrophobicContact CD1-CB 4.38Å; I789-K792 HydrophobicContact CD1-CD 4.2Å; I789-K792 WeakPolarHBondContact O-CB 3.43Å; I789-K792 PolarHBondContact O-N 2.71Å; I789-I793 HydrophobicContact CD1-CD1 4.45Å; I789-I793 HydrophobicContact CD1-CG1 4.38Å; I789-I793 HydrophobicContact CG1-CD1 3.89Å; I789-I793 HydrophobicContact CG1-CG1 4.3Å; I789-I793 WeakPolarHBondContact O-CG1 2.95Å; I789-I793 PolarHBondContact O-N 3.06Å
790	Y	91.6	Very high	87.4	Confident	42 Å²	42	65.4 Å²	65.4	17%	0.165	33%	0.326	C	S	.	.	H	α-helix	trans	-57.6	-42.7	175.2	-68.6	-2.7	0	0	0	111.5	L691 R697 F771 L786 K792 I793 E794	L691-Y790 HydrophobicContact CB-CE1 4.45Å; L691-Y790 HydrophobicContact CD2-CD1 3.37Å; L691-Y790 HydrophobicContact CD2-CE1 3.85Å; L691-Y790 HydrophobicContact CD2-CG 3.87Å; L691-Y790 HydrophobicContact CG-CD1 3.82Å; L691-Y790 HydrophobicContact CG-CE1 3.72Å; R697-Y790 VanDerWaalsContact NH1-CD2 3.29Å; F771-Y790 HydrophobicContact CD2-CE1 4.07Å; F771-Y790 AromaticContact CE2-CE1 3.81Å; F771-Y790 HydrophobicContact CE2-CE1 3.81Å; L786-Y790 HydrophobicContact CB-CE1 4.33Å; L786-Y790 HydrophobicContact CB-CE2 4.42Å; L786-Y790 HydrophobicContact CD2-CE1 3.94Å; L786-Y790 WeakPolarHBondContact O-CB 3.44Å; L786-Y790 WeakPolarHBondContact O-CD1 3.27Å; L786-Y790 PolarHBondContact O-N 3.01Å; Y790-K792 VanDerWaalsContact C-N 3.29Å; Y790-K792 PolarHBondContact O-N 3.19Å; Y790-I793 PolarHBondContact O-N 3.31Å; Y790-E794 WeakPolarHBondContact O-CB 3.41Å; Y790-E794 VanDerWaalsContact O-CG 3.29Å; Y790-E794 WeakPolarHBondContact O-CG 3.24Å; Y790-E794 PolarHBondContact O-N 3.4Å
791	S	88.5	Confident	87.9	Confident	71 Å²	71	61.3 Å²	61.3	50%	0.497	30%	0.297	S	S	.	.	H	α-helix	trans	-64.5	-32.4	178.2	-55.2	0	0	0	0	112.7	K787 K788 I789	K787-S791 PolarHBondContact O-N 3.43Å; K787-S791 PolarHBondContact O-OG 2.86Å; K788-S791 PolarHBondContact O-N 2.94Å; I789-S791 VanDerWaalsContact C-N 3.27Å; I789-S791 PolarHBondContact O-N 3.34Å
792	K	90.8	Very high	88.4	Confident	105 Å²	105	54.9 Å²	54.9	46%	0.457	27%	0.267	S	S	.	.	H	α-helix	trans	-73.4	-44.3	174.9	-69.1	-176.4	179	-178.5	0	112.2	L767 E770 K788 I789 Y790 E794 Y795	L767-K792 HydrophobicContact CD2-CB 3.92Å; E770-K792 IonicContact OE1-NZ 3.42Å; E770-K792 PolarHBondContact OE1-NZ 2.9Å; E770-K792 IonicContact OE2-NZ 2.68Å; E770-K792 PolarHBondContact OE2-NZ 3.41Å; K788-K792 PolarHBondContact O-N 3.03Å; I789-K792 HydrophobicContact CD1-CB 4.38Å; I789-K792 HydrophobicContact CD1-CD 4.2Å; I789-K792 WeakPolarHBondContact O-CB 3.43Å; I789-K792 PolarHBondContact O-N 2.71Å; Y790-K792 VanDerWaalsContact C-N 3.29Å; Y790-K792 PolarHBondContact O-N 3.19Å; K792-E794 VanDerWaalsContact C-N 3.34Å; K792-E794 PolarHBondContact O-N 3.48Å; K792-Y795 WeakPolarHBondContact O-CB 3.43Å; K792-Y795 PolarHBondContact O-N 3Å
793	I	92	Very high	88.9	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-44.7	-179.4	-70.1	171.3	0	0	0	110.6	L691 M703 I713 R757 L767 F771 I789 Y790 Y795	L691-I793 HydrophobicContact CD1-CD1 4.26Å; L691-I793 HydrophobicContact CD2-CB 4.37Å; L691-I793 HydrophobicContact CD2-CD1 4.07Å; L691-I793 HydrophobicContact CD2-CG2 4.1Å; M703-I793 HydrophobicContact CG-CG2 4.27Å; M703-I793 HydrophobicContact SD-CD1 3.96Å; M703-I793 HydrophobicContact SD-CG1 4.33Å; M703-I793 HydrophobicContact SD-CG2 4.17Å; I713-I793 HydrophobicContact CD1-CG2 4.04Å; I713-I793 WeakPolarHBondContact CD1-O 3.3Å; I713-I793 HydrophobicContact CG2-CG2 4.05Å; R757-I793 PolarHBondContact NH2-O 3.29Å; L767-I793 HydrophobicContact CB-CG1 4.16Å; L767-I793 HydrophobicContact CD1-CG1 4.37Å; L767-I793 HydrophobicContact CD2-CG1 4.14Å; L767-I793 HydrophobicContact CG-CG1 4.46Å; F771-I793 HydrophobicContact CB-CD1 4.35Å; F771-I793 HydrophobicContact CD2-CD1 4.37Å; I789-I793 HydrophobicContact CD1-CD1 4.45Å; I789-I793 HydrophobicContact CD1-CG1 4.38Å; I789-I793 HydrophobicContact CG1-CD1 3.89Å; I789-I793 HydrophobicContact CG1-CG1 4.3Å; I789-I793 WeakPolarHBondContact O-CG1 2.95Å; I789-I793 PolarHBondContact O-N 3.06Å; Y790-I793 PolarHBondContact O-N 3.31Å; I793-Y795 VanDerWaalsContact C-N 3.28Å; I793-Y795 PolarHBondContact O-N 2.97Å
794	E	90	Very high	89.3	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	7	-173.7	-62.4	165.9	168.5	0	0	113.6	R697 R699 S701 I725 Y790 K792	R697-E794 WeakPolarHBondContact CD-OE1 3.35Å; R697-E794 IonicContact CZ-OE1 3.05Å; R697-E794 IonicContact NE-OE1 2.71Å; R697-E794 PolarHBondContact NE-OE1 3.1Å; R697-E794 IonicContact NH1-OE1 3.41Å; R697-E794 PolarHBondContact NH1-OE1 3.11Å; R697-E794 IonicContact NH2-OE1 3.98Å; R699-E794 IonicContact CZ-OE2 3.47Å; R699-E794 VanDerWaalsContact NE-CD 3.31Å; R699-E794 IonicContact NE-OE1 3.27Å; R699-E794 IonicContact NE-OE2 3.76Å; R699-E794 PolarHBondContact NE-OE2 2.99Å; R699-E794 IonicContact NH2-OE2 2.65Å; R699-E794 PolarHBondContact NH2-OE2 2.84Å; S701-E794 PolarHBondContact OG-OE1 3.12Å; I725-E794 HydrophobicContact CD1-CB 4.19Å; Y790-E794 WeakPolarHBondContact O-CB 3.41Å; Y790-E794 VanDerWaalsContact O-CG 3.29Å; Y790-E794 WeakPolarHBondContact O-CG 3.24Å; Y790-E794 PolarHBondContact O-N 3.4Å; K792-E794 VanDerWaalsContact C-N 3.34Å; K792-E794 PolarHBondContact O-N 3.48Å
795	Y	87.3	Confident	89.4	Confident	162 Å²	162	41.6 Å²	41.6	64%	0.635	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.4	134.9	-179.3	-177.7	-107.9	0	0	0	111.7	R757 K792 I793	R757-Y795 WeakPolarHBondContact CD-O 3.44Å; R757-Y795 PolarHBondContact NE-O 2.87Å; R757-Y795 VanDerWaalsContact NE-O 3.09Å; K792-Y795 WeakPolarHBondContact O-CB 3.43Å; K792-Y795 PolarHBondContact O-N 3Å; I793-Y795 VanDerWaalsContact C-N 3.28Å; I793-Y795 PolarHBondContact O-N 2.97Å
796	N	87.4	Confident	89.3	Confident	54 Å²	54	43.5 Å²	43.5	29%	0.289	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.4	42.4	167.4	-155.2	29.7	0	0	0	116.5	I725 N727	I725-N796 PolarHBondContact O-N 2.93Å; N727-N796 VanDerWaalsContact CA-OD1 3.3Å; N727-N796 WeakPolarHBondContact CA-OD1 3.44Å; N727-N796 WeakPolarHBondContact CB-OD1 3.4Å; N727-N796 PolarHBondContact ND2-OD1 3.3Å; N727-N796 PolarHBondContact OD1-OD1 3.48Å; N727-N796 VanDerWaalsContact OD1-OD1 3.14Å
797	L	88.5	Confident	89	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-75	151	177.4	-56.2	178.9	0	0	0	112.4	I713 I725 S726 N727 A755 R757	I713-L797 HydrophobicContact CG2-CD2 4.33Å; I725-L797 HydrophobicContact CD1-CD1 3.74Å; I725-L797 PolarHBondContact O-N 2.74Å; S726-L797 VanDerWaalsContact CA-O 3.22Å; S726-L797 WeakPolarHBondContact CA-O 3.47Å; N727-L797 PolarHBondContact N-O 3.36Å; N727-L797 VanDerWaalsContact N-O 3.15Å; A755-L797 HydrophobicContact CB-CB 3.7Å; A755-L797 HydrophobicContact CB-CD1 4.06Å; R757-L797 HydrophobicContact CB-CD2 3.39Å; R757-L797 HydrophobicContact CG-CD2 4.48Å
798	T	89.3	Confident	88.8	Confident	69 Å²	69	39.7 Å²	39.7	42%	0.423	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	139.8	171.7	59	0	0	0	0	110.5	A755 S756	A755-T798 CarbonylContact C-O 3.43Å; A755-T798 WeakPolarHBondContact CA-O 3.08Å; A755-T798 VanDerWaalsContact CB-O 3.32Å; A755-T798 WeakPolarHBondContact CB-O 3.39Å; S756-T798 PolarHBondContact N-O 3.16Å; S756-T798 PolarHBondContact O-N 3.47Å; S756-T798 PolarHBondContact O-OG1 3.17Å
799	L	90	Very high	88.7	Confident	4 Å²	4	34.1 Å²	34.1	2%	0.021	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	134.8	179.8	-59	175.4	0	0	0	110.1	L455 I722 F723 K734 A737 V753 A755	L455-L799 HydrophobicContact CD1-CB 3.48Å; L455-L799 VanDerWaalsContact CD1-CB 3.48Å; L455-L799 HydrophobicContact CD1-CD1 4.36Å; I722-L799 HydrophobicContact CG2-CD2 3.68Å; F723-L799 HydrophobicContact CD1-CD1 4.43Å; F723-L799 HydrophobicContact CD1-CD2 4.39Å; F723-L799 HydrophobicContact CE1-CD1 4.17Å; F723-L799 HydrophobicContact CE1-CD2 4.45Å; K734-L799 HydrophobicContact CG-CD1 4.02Å; A737-L799 HydrophobicContact CB-CD1 4.24Å; V753-L799 HydrophobicContact CG1-CD2 3.77Å; A755-L799 HydrophobicContact CB-CD2 4.31Å
800	V	88.8	Confident	88.5	Confident	22 Å²	22	34.5 Å²	34.5	13%	0.133	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	-61.7	-176.6	179.3	0	0	0	0	110.7	L455 Y754	L455-V800 PolarHBondContact N-O 2.97Å; Y754-V800 PolarHBondContact O-N 3.04Å
801	S	91.1	Very high	88.2	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	162.4	-173.3	62.5	0	0	0	0	111.9	A453 Y754	A453-S801 CarbonylContact O-C 3.45Å; A453-S801 VanDerWaalsContact O-CA 3.26Å; A453-S801 WeakPolarHBondContact O-CA 3.25Å; A453-S801 WeakPolarHBondContact O-CB 3.4Å; Y754-S801 PolarHBondContact N-O 3.08Å
802	I	92	Very high	88.1	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	129.3	172.9	-59	161.2	0	0	0	107.6	I452 A453 L455 A737 V741 F744 L752 V753	I452-I802 CarbonylContact C-O 3.47Å; I452-I802 WeakPolarHBondContact CA-O 3.17Å; A453-I802 HydrophobicContact CB-CB 4.27Å; A453-I802 PolarHBondContact N-O 3.01Å; A453-I802 PolarHBondContact O-N 3.28Å; L455-I802 HydrophobicContact CD1-CG1 4.5Å; L455-I802 HydrophobicContact CD2-CD1 3.75Å; L455-I802 HydrophobicContact CD2-CG1 4.32Å; A737-I802 HydrophobicContact CB-CD1 3.8Å; A737-I802 WeakPolarHBondContact O-CD1 3.11Å; V741-I802 HydrophobicContact CG2-CD1 3.98Å; V741-I802 HydrophobicContact CG2-CG1 4.42Å; V741-I802 HydrophobicContact CG2-CG2 4Å; F744-I802 HydrophobicContact CD2-CG2 4.06Å; F744-I802 HydrophobicContact CE2-CG2 4.16Å; L752-I802 WeakPolarHBondContact O-CA 3.43Å; V753-I802 HydrophobicContact CG2-CG1 4.43Å
803	T	92.3	Very high	88.1	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	141.3	173.2	59.7	0	0	0	0	110.8	L449 I452 L600 L639 T751 L752 Y754	L449-T803 HydrophobicContact CD1-CG2 4.05Å; I452-T803 HydrophobicContact CG1-CG2 4.34Å; L600-T803 HydrophobicContact CD1-CG2 4.19Å; L600-T803 HydrophobicContact CD2-CG2 3.73Å; L639-T803 HydrophobicContact CD2-CG2 3.89Å; T751-T803 VanDerWaalsContact CA-O 3.31Å; T751-T803 WeakPolarHBondContact CA-O 3.16Å; L752-T803 PolarHBondContact N-O 2.87Å; L752-T803 PolarHBondContact O-N 3.09Å; Y754-T803 HydrophobicContact CD2-CG2 4.34Å; Y754-T803 HydrophobicContact CE2-CG2 4.13Å
804	G	89	Confident	88	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	103.8	171	0	0	0	0	0	109.1	Y450 K451 R750	Y450-G804 PolarHBondContact N-O 3.01Å; K451-G804 PolarHBondContact N-O 3.47Å; K451-G804 PolarHBondContact O-N 2.94Å; R750-G804 WeakPolarHBondContact O-CA 3.22Å
805	V	87.8	Confident	88	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	121.8	177.9	-171.7	0	0	0	0	108.9	M447 N448 L449 A638 L639 R750	M447-V805 HydrophobicContact CB-CG1 3.94Å; M447-V805 HydrophobicContact CE-CB 4.43Å; M447-V805 HydrophobicContact CE-CG1 3.73Å; N448-V805 CarbonylContact O-C 3.55Å; N448-V805 WeakPolarHBondContact O-CA 3.37Å; N448-V805 WeakPolarHBondContact O-CG1 3.16Å; L449-V805 HydrophobicContact CD1-CG2 4.31Å; A638-V805 HydrophobicContact CB-CG1 3.96Å; L639-V805 HydrophobicContact CD2-CG2 3.92Å; L639-V805 HydrophobicContact CG-CG2 4.31Å; R750-V805 HydrophobicContact CB-CB 4.46Å; R750-V805 PolarHBondContact N-O 3.03Å; R750-V805 PolarHBondContact O-N 2.89Å
806	E	83.7	Confident	88.2	Confident	65 Å²	65	31.6 Å²	31.6	30%	0.304	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	132.6	176.5	-171.5	-177	-165	0	0	110.5	M447 N448 Y450 L749	M447-E806 WeakPolarHBondContact CA-O 3.24Å; N448-E806 PolarHBondContact N-O 3.04Å; N448-E806 PolarHBondContact O-N 3.45Å; Y450-E806 HydrophobicContact CG-CB 4.43Å; L749-E806 HydrophobicContact CD2-CB 3.71Å; L749-E806 HydrophobicContact CD2-CG 4.11Å
807	D	81.9	Confident	88.4	Confident	9 Å²	9	29.2 Å²	29.2	5%	0.048	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	94.9	166.8	-171	-7.9	0	0	0	107.9	K438 T443 M447 R750 L809 V841	K438-D807 IonicContact NZ-OD2 3.12Å; T443-D807 VanDerWaalsContact CB-OD1 3.22Å; T443-D807 WeakPolarHBondContact CB-OD1 3.48Å; T443-D807 WeakPolarHBondContact CG2-OD1 3.4Å; T443-D807 PolarHBondContact OG1-OD1 2.75Å; M447-D807 HydrophobicContact CE-CB 3.96Å; M447-D807 HydrophobicContact SD-CB 3.62Å; R750-D807 IonicContact CZ-OD2 3.97Å; R750-D807 IonicContact NE-OD2 3.63Å; R750-D807 IonicContact NH2-OD2 2.67Å; R750-D807 PolarHBondContact NH2-OD2 2.88Å; D807-L809 PolarHBondContact O-N 2.73Å; D807-V841 HydrophobicContact CB-CG2 4.4Å
808	K	82.1	Confident	88.4	Confident	69 Å²	69	34.6 Å²	34.6	30%	0.3	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	124.5	-165.2	-169.9	179.5	174.9	-174.8	0	111.2	T443 L444 E446	T443-K808 CarbonylContact C-O 3.2Å; T443-K808 WeakPolarHBondContact CA-O 3.38Å; L444-K808 HydrophobicContact CD1-CD 3.97Å; L444-K808 HydrophobicContact CD1-CG 4.13Å; L444-K808 PolarHBondContact N-O 2.95Å; E446-K808 HydrophobicContact CB-CB 4.48Å; E446-K808 WeakPolarHBondContact O-CB 3.3Å; E446-K808 PolarHBondContact O-N 3.24Å; E446-K808 VanDerWaalsContact O-N 3.11Å; E446-K808 IonicContact OE2-NZ 2.77Å
809	L	86.6	Confident	88.4	Confident	38 Å²	38	32.2 Å²	32.2	20%	0.199	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	153	174.4	-65.1	175.1	0	0	0	111.5	L442 T443 D807 V841 A845	L442-L809 WeakPolarHBondContact O-CA 3.48Å; T443-L809 HydrophobicContact CG2-CD2 4.18Å; D807-L809 PolarHBondContact O-N 2.73Å; L809-V841 HydrophobicContact CD2-CG1 4Å; L809-A845 HydrophobicContact CD1-CB 4.33Å; L809-A845 HydrophobicContact CD2-CB 4.18Å
810	Q	86.9	Confident	88.4	Confident	13 Å²	13	32 Å²	32	6%	0.061	17%	0.165	C	C	.	.	P	Polyproline II helix	trans	-64.1	148	165.9	-61.2	-160.7	9.1	0	0	110.4	G440 T441 L442 L444 G812 V813	G440-Q810 PolarHBondContact O-NE2 2.88Å; T441-Q810 PolarHBondContact O-NE2 3.01Å; T441-Q810 VanDerWaalsContact O-NE2 3.09Å; L442-Q810 PolarHBondContact O-N 2.83Å; L444-Q810 HydrophobicContact CD2-CB 4.43Å; L444-Q810 HydrophobicContact CD2-CG 3.77Å; L444-Q810 HydrophobicContact CG-CB 4.5Å; L444-Q810 HydrophobicContact CG-CG 3.97Å; Q810-G812 PolarHBondContact O-N 3.24Å; Q810-V813 HydrophobicContact CB-CG2 3.6Å; Q810-V813 WeakPolarHBondContact O-CG2 3.36Å; Q810-V813 PolarHBondContact O-N 3.33Å
811	P	86.2	Confident	88.2	Confident	62 Å²	62	34.5 Å²	34.5	40%	0.403	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	135.1	179.3	25.8	-35.1	0	0	0	110.9	V813 K1069	P811-V813 VanDerWaalsContact C-N 3.32Å; P811-V813 PolarHBondContact O-N 2.81Å; P811-K1069 WeakPolarHBondContact O-CB 3.44Å
812	G	86.4	Confident	87.9	Confident	36 Å²	36	38.5 Å²	38.5	37%	0.371	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.5	4.6	176.2	0	0	0	0	0	116	Q810 H814 E815 C816	Q810-G812 PolarHBondContact O-N 3.24Å; G812-H814 PolarHBondContact O-N 3.4Å; G812-E815 PolarHBondContact O-N 3.05Å; G812-C816 WeakPolarHBondContact O-CB 3.48Å; G812-C816 PolarHBondContact O-N 3.28Å
813	V	91.2	Very high	87.6	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-59.4	-45.4	179.3	168.9	0	0	0	0	112.2	L442 Q810 P811 C816 L817 A845 F1068	L442-V813 HydrophobicContact CB-CG1 4.49Å; L442-V813 HydrophobicContact CD2-CG1 3.75Å; Q810-V813 HydrophobicContact CB-CG2 3.6Å; Q810-V813 WeakPolarHBondContact O-CG2 3.36Å; Q810-V813 PolarHBondContact O-N 3.33Å; P811-V813 VanDerWaalsContact C-N 3.32Å; P811-V813 PolarHBondContact O-N 2.81Å; V813-C816 PolarHBondContact O-N 3.13Å; V813-L817 HydrophobicContact CG1-CD1 3.91Å; V813-L817 HydrophobicContact CG1-CG 4.37Å; V813-L817 WeakPolarHBondContact O-CB 3.28Å; V813-L817 WeakPolarHBondContact O-CG 3.29Å; V813-L817 PolarHBondContact O-N 3.47Å; V813-A845 HydrophobicContact CG1-CB 3.97Å; V813-F1068 HydrophobicContact CB-CD1 4.3Å; V813-F1068 HydrophobicContact CG1-CD1 4.32Å; V813-F1068 HydrophobicContact CG1-CE1 4.38Å; V813-F1068 HydrophobicContact CG2-CB 3.98Å; V813-F1068 HydrophobicContact CG2-CD1 3.78Å; V813-F1068 HydrophobicContact CG2-CG 4.07Å
814	H	89.6	Confident	87.1	Confident	102 Å²	102	39 Å²	39	47%	0.472	20%	0.198	S	C	.	.	H	α-helix	trans	-60.4	-49.3	-178.9	-175.9	99.2	0	0	0	112.2	G812 L817 K818 A845 G846	G812-H814 PolarHBondContact O-N 3.4Å; H814-L817 PolarHBondContact O-N 3.12Å; H814-K818 WeakPolarHBondContact O-CB 3.5Å; H814-K818 PolarHBondContact O-N 2.88Å; H814-K818 VanDerWaalsContact O-N 3.08Å; H814-A845 WeakPolarHBondContact CA-O 3.48Å; H814-G846 WeakPolarHBondContact ND1-CA 3.19Å; H814-G846 PolarHBondContact ND1-N 2.96Å
815	E	89.7	Confident	87	Confident	119 Å²	119	39.1 Å²	39.1	56%	0.556	20%	0.199	S	C	*	.	H	α-helix	trans	-63.3	-45	177.7	-170.4	-174	170.4	0	0	111.5	G812 L817 K818 N819	G812-E815 PolarHBondContact O-N 3.05Å; E815-L817 PolarHBondContact O-N 2.81Å; E815-K818 WeakPolarHBondContact O-CB 3.46Å; E815-K818 PolarHBondContact O-N 2.71Å; E815-N819 WeakPolarHBondContact O-CB 3.24Å; E815-N819 VanDerWaalsContact O-CG 3.27Å; E815-N819 PolarHBondContact O-N 3.25Å; E815-N819 PolarHBondContact O-ND2 3.47Å
816	C	92.3	Very high	87	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-57.7	-49.6	177.4	-176.5	0	0	0	0	111.6	G812 V813 K818 N819 L820 F1068	G812-C816 WeakPolarHBondContact O-CB 3.48Å; G812-C816 PolarHBondContact O-N 3.28Å; V813-C816 PolarHBondContact O-N 3.13Å; C816-K818 VanDerWaalsContact C-N 3.33Å; C816-K818 PolarHBondContact O-N 3.3Å; C816-N819 PolarHBondContact O-N 3.22Å; C816-L820 WeakPolarHBondContact O-CB 3.04Å; C816-L820 VanDerWaalsContact O-CG 3.24Å; C816-L820 WeakPolarHBondContact O-CG 3.34Å; C816-L820 PolarHBondContact O-N 2.81Å; C816-F1068 HydrophobicContact CB-CD1 4.21Å; C816-F1068 HydrophobicContact CB-CE1 4.06Å
817	L	90.9	Very high	87.4	Confident	4 Å²	4	37 Å²	37	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-64.5	-36.2	179.7	-73.9	178.4	0	0	0	112.7	L442 V813 H814 E815 R821 V827 A845 H847 F1068	L442-L817 HydrophobicContact CD2-CD1 4.25Å; V813-L817 HydrophobicContact CG1-CD1 3.91Å; V813-L817 HydrophobicContact CG1-CG 4.37Å; V813-L817 WeakPolarHBondContact O-CB 3.28Å; V813-L817 WeakPolarHBondContact O-CG 3.29Å; V813-L817 PolarHBondContact O-N 3.47Å; H814-L817 PolarHBondContact O-N 3.12Å; E815-L817 PolarHBondContact O-N 2.81Å; L817-R821 WeakPolarHBondContact O-CB 3.07Å; L817-R821 PolarHBondContact O-N 3Å; L817-R821 VanDerWaalsContact O-N 3.07Å; L817-V827 HydrophobicContact CD2-CB 4.32Å; L817-V827 HydrophobicContact CD2-CG1 3.83Å; L817-V827 HydrophobicContact CD2-CG2 4.01Å; L817-A845 HydrophobicContact CD1-CB 3.89Å; L817-A845 WeakPolarHBondContact CD1-O 3.39Å; L817-H847 HydrophobicContact CD1-CB 4.24Å; L817-F1068 HydrophobicContact CD2-CE1 4.08Å; L817-F1068 HydrophobicContact CD2-CZ 3.85Å; L817-F1068 HydrophobicContact CG-CE1 4.09Å; L817-F1068 HydrophobicContact CG-CZ 4.32Å
818	K	87.8	Confident	88	Confident	113 Å²	113	36.8 Å²	36.8	49%	0.491	19%	0.188	S	C	.	.	H	α-helix	trans	-61.8	-50	172	-176.6	-177.1	175.9	-174.7	0	111	H814 E815 C816 L820 R821 D822	H814-K818 WeakPolarHBondContact O-CB 3.5Å; H814-K818 PolarHBondContact O-N 2.88Å; H814-K818 VanDerWaalsContact O-N 3.08Å; E815-K818 WeakPolarHBondContact O-CB 3.46Å; E815-K818 PolarHBondContact O-N 2.71Å; C816-K818 VanDerWaalsContact C-N 3.33Å; C816-K818 PolarHBondContact O-N 3.3Å; K818-L820 PolarHBondContact O-N 3.33Å; K818-R821 WeakPolarHBondContact O-CB 3.33Å; K818-R821 PolarHBondContact O-N 3.23Å; K818-R821 VanDerWaalsContact O-N 3.15Å; K818-D822 PolarHBondContact O-N 2.88Å
819	N	89.3	Confident	88.6	Confident	19 Å²	19	33.5 Å²	33.5	10%	0.102	17%	0.174	C	C	.	.	H	α-helix	trans	-63.9	-39.2	-179.6	-69.8	-23.4	0	0	0	112.4	E815 C816 R821 D822 A823 Q1072 L1076 P1155	E815-N819 WeakPolarHBondContact O-CB 3.24Å; E815-N819 VanDerWaalsContact O-CG 3.27Å; E815-N819 PolarHBondContact O-N 3.25Å; E815-N819 PolarHBondContact O-ND2 3.47Å; C816-N819 PolarHBondContact O-N 3.22Å; N819-R821 PolarHBondContact O-N 3.41Å; N819-D822 PolarHBondContact O-N 2.96Å; N819-A823 WeakPolarHBondContact O-CB 3.23Å; N819-A823 PolarHBondContact O-N 3.2Å; N819-Q1072 HydrophobicContact CB-CG 4.41Å; N819-Q1072 PolarHBondContact ND2-NE2 2.96Å; N819-Q1072 PolarHBondContact ND2-OE1 3.36Å; N819-L1076 HydrophobicContact CB-CD1 4.38Å; N819-P1155 HydrophobicContact CB-CB 4.26Å; N819-P1155 HydrophobicContact CB-CG 3.73Å; N819-P1155 WeakPolarHBondContact O-CB 3.42Å
820	L	90.5	Very high	88.9	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-64.1	-39.1	174.1	-68.1	173	0	0	0	112	L434 C816 K818 D822 A823 G824 I825 V827 L1071 L1075	L434-L820 HydrophobicContact CD2-CD1 3.78Å; C816-L820 WeakPolarHBondContact O-CB 3.04Å; C816-L820 VanDerWaalsContact O-CG 3.24Å; C816-L820 WeakPolarHBondContact O-CG 3.34Å; C816-L820 PolarHBondContact O-N 2.81Å; K818-L820 PolarHBondContact O-N 3.33Å; L820-D822 VanDerWaalsContact C-N 3.35Å; L820-A823 WeakPolarHBondContact O-CB 3.44Å; L820-A823 PolarHBondContact O-N 3.43Å; L820-G824 PolarHBondContact O-N 3.15Å; L820-I825 HydrophobicContact CB-CB 4.47Å; L820-I825 HydrophobicContact CD2-CD1 3.7Å; L820-I825 WeakPolarHBondContact O-CB 3.27Å; L820-I825 PolarHBondContact O-N 3.29Å; L820-V827 HydrophobicContact CB-CG2 4.38Å; L820-L1071 HydrophobicContact CD1-CD2 4.11Å; L820-L1075 HydrophobicContact CD2-CD1 3.85Å
821	R	85.7	Confident	89	Confident	73 Å²	73	31.1 Å²	31.1	28%	0.275	16%	0.162	S	C	.	.	H	α-helix	trans	-63.7	-41	174	-173.4	-170.7	-66.1	136.1	-1.4	111.2	L817 K818 N819 G824 G846 H847	L817-R821 WeakPolarHBondContact O-CB 3.07Å; L817-R821 PolarHBondContact O-N 3Å; L817-R821 VanDerWaalsContact O-N 3.07Å; K818-R821 WeakPolarHBondContact O-CB 3.33Å; K818-R821 PolarHBondContact O-N 3.23Å; K818-R821 VanDerWaalsContact O-N 3.15Å; N819-R821 PolarHBondContact O-N 3.41Å; R821-G824 VanDerWaalsContact O-CA 3.23Å; R821-G824 WeakPolarHBondContact O-CA 3.27Å; R821-G824 PolarHBondContact O-N 2.83Å; R821-G846 PolarHBondContact NH2-O 3.22Å; R821-H847 PolarHBondContact NH2-O 3.22Å
822	D	83.8	Confident	88.6	Confident	84 Å²	84	30.2 Å²	30.2	45%	0.449	16%	0.164	S	C	.	.	H	α-helix	trans	-69.1	-33.8	177.9	-71.5	-20.7	0	0	0	112.6	K818 N819 L820 G824 P1155	K818-D822 PolarHBondContact O-N 2.88Å; N819-D822 PolarHBondContact O-N 2.96Å; L820-D822 VanDerWaalsContact C-N 3.35Å; D822-G824 PolarHBondContact O-N 2.78Å; D822-G824 VanDerWaalsContact O-N 3.15Å; D822-P1155 HydrophobicContact CB-CB 4.21Å
823	A	86.2	Confident	88.1	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-11.3	165.7	0	0	0	0	0	113.4	N819 L820 I825 L1076 P1155 Y1158	N819-A823 WeakPolarHBondContact O-CB 3.23Å; N819-A823 PolarHBondContact O-N 3.2Å; L820-A823 WeakPolarHBondContact O-CB 3.44Å; L820-A823 PolarHBondContact O-N 3.43Å; A823-I825 HydrophobicContact CB-CD1 4.32Å; A823-I825 HydrophobicContact CB-CG1 4.35Å; A823-L1076 HydrophobicContact CB-CD2 3.58Å; A823-P1155 VanDerWaalsContact CA-O 3.22Å; A823-P1155 WeakPolarHBondContact CA-O 3.49Å; A823-P1155 HydrophobicContact CB-CB 4.17Å; A823-P1155 VanDerWaalsContact CB-O 3.28Å; A823-P1155 WeakPolarHBondContact CB-O 3.29Å; A823-Y1158 HydrophobicContact CB-CD1 4.16Å; A823-Y1158 HydrophobicContact CB-CG 4.26Å
824	G	81.2	Confident	87.1	Confident	10 Å²	10	35.2 Å²	35.2	10%	0.103	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	16.7	179.6	0	0	0	0	0	113.5	L820 R821 D822 K1162	L820-G824 PolarHBondContact O-N 3.15Å; R821-G824 VanDerWaalsContact O-CA 3.23Å; R821-G824 WeakPolarHBondContact O-CA 3.27Å; R821-G824 PolarHBondContact O-N 2.83Å; D822-G824 PolarHBondContact O-N 2.78Å; D822-G824 VanDerWaalsContact O-N 3.15Å; G824-K1162 PolarHBondContact O-NZ 3.1Å
825	I	87.8	Confident	86.7	Confident	4 Å²	4	31.7 Å²	31.7	2%	0.021	16%	0.162	C	C	.	.			trans	-76.9	127.2	173	-59.5	169.9	0	0	0	107.5	V431 L434 L820 A823 L1075 Y1158	V431-I825 HydrophobicContact CG1-CG2 4.31Å; L434-I825 HydrophobicContact CB-CG2 3.86Å; L820-I825 HydrophobicContact CB-CB 4.47Å; L820-I825 HydrophobicContact CD2-CD1 3.7Å; L820-I825 WeakPolarHBondContact O-CB 3.27Å; L820-I825 PolarHBondContact O-N 3.29Å; A823-I825 HydrophobicContact CB-CD1 4.32Å; A823-I825 HydrophobicContact CB-CG1 4.35Å; I825-L1075 HydrophobicContact CD1-CD1 4.21Å; I825-Y1158 HydrophobicContact CD1-CD1 4.17Å; I825-Y1158 HydrophobicContact CD1-CE1 3.77Å; I825-Y1158 HydrophobicContact CG1-CD1 4.24Å; I825-Y1158 HydrophobicContact CG1-CE1 3.9Å
826	Q	88	Confident	85.9	Confident	16 Å²	16	32.9 Å²	32.9	8%	0.075	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	114.1	177.2	-67.3	-167.7	-55.2	0	0	109.1	N432 Y433 L434 P959 L994	N432-Q826 PolarHBondContact O-N 3.4Å; Y433-Q826 WeakPolarHBondContact CA-O 3.34Å; Y433-Q826 HydrophobicContact CD1-CB 3.8Å; Y433-Q826 HydrophobicContact CE1-CB 3.9Å; Y433-Q826 HydrophobicContact CE1-CG 4.38Å; Y433-Q826 PolarHBondContact OH-OE1 3.22Å; L434-Q826 PolarHBondContact N-O 3.18Å; Q826-P959 HydrophobicContact CG-CB 4.25Å; Q826-P959 VanDerWaalsContact NE2-CB 3.35Å; Q826-L994 PolarHBondContact NE2-O 3.36Å
827	V	91.7	Very high	85	Confident	6 Å²	6	34.3 Å²	34.3	4%	0.036	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	128.5	178.5	-172.1	0	0	0	0	109.4	L434 L817 L820 H847	L434-V827 HydrophobicContact CB-CG2 4.39Å; L434-V827 HydrophobicContact CD2-CG1 4.36Å; L434-V827 HydrophobicContact CD2-CG2 4.19Å; L434-V827 CarbonylContact O-C 3.49Å; L434-V827 WeakPolarHBondContact O-CA 3.32Å; L817-V827 HydrophobicContact CD2-CB 4.32Å; L817-V827 HydrophobicContact CD2-CG1 3.83Å; L817-V827 HydrophobicContact CD2-CG2 4.01Å; L820-V827 HydrophobicContact CB-CG2 4.38Å; V827-H847 PolarHBondContact O-NE2 3.49Å
828	W	94.4	Very high	84.6	Confident	3 Å²	3	34.2 Å²	34.2	1%	0.011	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	127.6	174.5	-71.7	29.9	0	0	0	107.8	Y433 L434 F435 S436 C991 V997 V1010 V1014	Y433-W828 HydrophobicContact CD1-CZ2 4.46Å; Y433-W828 AromaticContact CD1-NE1 3.76Å; Y433-W828 HydrophobicContact CE1-CZ2 4.18Å; Y433-W828 AromaticContact CE1-NE1 3.89Å; L434-W828 PolarHBondContact O-N 3.12Å; F435-W828 CarbonylContact C-O 3.46Å; F435-W828 WeakPolarHBondContact CA-O 2.98Å; F435-W828 HydrophobicContact CD1-CB 3.74Å; F435-W828 HydrophobicContact CD1-CE3 4.41Å; F435-W828 HydrophobicContact CD1-CG 4.35Å; F435-W828 HydrophobicContact CE1-CB 4Å; F435-W828 AromaticContact CE1-CD2 3.92Å; F435-W828 HydrophobicContact CE1-CD2 3.92Å; F435-W828 AromaticContact CE1-CE3 3.66Å; F435-W828 HydrophobicContact CE1-CE3 3.66Å; F435-W828 HydrophobicContact CE1-CG 4.12Å; F435-W828 HydrophobicContact CE1-CZ3 4.38Å; S436-W828 PolarHBondContact N-O 2.6Å; W828-C991 HydrophobicContact CH2-CB 3.75Å; W828-C991 HydrophobicContact CZ2-CB 3.86Å; W828-V997 CarbonylContact C-O 3.54Å; W828-V997 VanDerWaalsContact CA-O 3.25Å; W828-V997 WeakPolarHBondContact CA-O 3.33Å; W828-V997 HydrophobicContact CD2-CB 3.6Å; W828-V997 HydrophobicContact CD2-CG1 4.25Å; W828-V997 HydrophobicContact CD2-CG2 3.87Å; W828-V997 VanDerWaalsContact CE2-CG2 3.5Å; W828-V997 HydrophobicContact CE3-CB 3.92Å; W828-V997 HydrophobicContact CE3-CG1 4.04Å; W828-V997 HydrophobicContact CE3-CG2 4.31Å; W828-V997 HydrophobicContact CG-CB 3.86Å; W828-V997 HydrophobicContact CG-CG2 4.38Å; W828-V997 HydrophobicContact CH2-CG2 4.19Å; W828-V997 HydrophobicContact CZ2-CB 4.35Å; W828-V997 HydrophobicContact CZ2-CG2 3.69Å; W828-V997 HydrophobicContact CZ3-CB 4.44Å; W828-V997 HydrophobicContact CZ3-CG1 4.32Å; W828-V997 HydrophobicContact CZ3-CG2 4.46Å; W828-V1010 HydrophobicContact CE3-CG1 4.06Å; W828-V1010 HydrophobicContact CZ3-CG1 4.04Å; W828-V1014 HydrophobicContact CE3-CG2 4.41Å; W828-V1014 HydrophobicContact CH2-CG2 3.66Å; W828-V1014 HydrophobicContact CZ2-CG2 4.32Å; W828-V1014 HydrophobicContact CZ3-CG2 3.73Å
829	V	94.3	Very high	84.5	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.006	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	122.6	178.9	177.5	0	0	0	0	108.7	S436 K438 L442 V997 L998 C999	S436-V829 CarbonylContact O-C 3.48Å; S436-V829 WeakPolarHBondContact O-CA 3.49Å; K438-V829 HydrophobicContact CB-CG1 4.17Å; L442-V829 HydrophobicContact CD1-CG1 4.36Å; L442-V829 HydrophobicContact CD1-CG2 4.11Å; V829-V997 PolarHBondContact N-O 3.12Å; V829-L998 HydrophobicContact CB-CD1 3.61Å; V829-L998 HydrophobicContact CG1-CD1 3.62Å; V829-L998 WeakPolarHBondContact O-CA 3.41Å; V829-C999 PolarHBondContact O-N 3.28Å
830	L	93.2	Very high	84	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	105.6	-177.8	-56.6	-172.1	0	0	0	108.8	F435 S436 C999 L1002 K1007 V1010 V1011 M1039	F435-L830 HydrophobicContact CB-CD1 4.08Å; F435-L830 HydrophobicContact CB-CG 4.49Å; F435-L830 HydrophobicContact CD1-CD1 3.77Å; F435-L830 HydrophobicContact CD1-CD2 4.44Å; F435-L830 HydrophobicContact CD1-CG 4.16Å; F435-L830 HydrophobicContact CG-CD1 4.21Å; S436-L830 PolarHBondContact O-N 3.41Å; L830-C999 HydrophobicContact CD2-CB 3.63Å; L830-C999 VanDerWaalsContact CD2-SG 3.55Å; L830-L1002 HydrophobicContact CB-CD1 3.91Å; L830-L1002 HydrophobicContact CD2-CD1 3.98Å; L830-L1002 HydrophobicContact CG-CD1 4.4Å; L830-K1007 HydrophobicContact CB-CG 4.25Å; L830-K1007 HydrophobicContact CD1-CB 4.41Å; L830-K1007 VanDerWaalsContact O-CE 3.3Å; L830-K1007 WeakPolarHBondContact O-CE 3.38Å; L830-V1010 HydrophobicContact CD1-CB 4.18Å; L830-V1010 HydrophobicContact CD1-CG1 4.18Å; L830-V1010 HydrophobicContact CD2-CB 4.46Å; L830-V1010 HydrophobicContact CD2-CG1 3.95Å; L830-V1011 HydrophobicContact CD1-CG2 4.47Å; L830-M1039 HydrophobicContact CB-SD 4.44Å; L830-M1039 HydrophobicContact CD1-SD 3.8Å
831	T	88.6	Confident	83.7	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.161	C	C	.	.			trans	-126.8	148.3	-174.3	-176	0	0	0	0	113	D833 A838 L998 C999 C1000 R1001 L1002	T831-D833 HydrophobicContact CG2-CB 4.15Å; T831-D833 WeakPolarHBondContact OG1-CB 3.45Å; T831-D833 PolarHBondContact OG1-N 3.29Å; T831-D833 VanDerWaalsContact OG1-N 3.08Å; T831-A838 HydrophobicContact CG2-CB 3.6Å; T831-L998 HydrophobicContact CG2-CD1 4.47Å; T831-C999 PolarHBondContact N-O 3.33Å; T831-C1000 CarbonylContact O-C 3.56Å; T831-R1001 PolarHBondContact O-N 2.86Å; T831-R1001 VanDerWaalsContact O-N 3.07Å; T831-L1002 PolarHBondContact O-N 3.42Å
832	G	78.2	Confident	83.8	Confident	44 Å²	44	27 Å²	27	45%	0.454	15%	0.149	S	C	.	.	S	Bend	trans	-75.8	-12.6	167.9	0	0	0	0	0	113.2	R1001	G832-R1001 WeakPolarHBondContact O-CA 3.41Å
833	D	74.9	Confident	83.8	Confident	43 Å²	43	28.9 Å²	28.9	23%	0.23	15%	0.15	C	C	.	.	S	Bend	trans	-69.3	165.8	-175.3	-80.5	-2.5	0	0	0	113.7	K438 T831 R1001	K438-D833 HydrophobicContact CD-CB 4.46Å; K438-D833 WeakPolarHBondContact CD-OD2 3.41Å; K438-D833 WeakPolarHBondContact CE-OD2 3.36Å; K438-D833 IonicContact NZ-OD2 2.76Å; K438-D833 PolarHBondContact NZ-OD2 3.47Å; T831-D833 HydrophobicContact CG2-CB 4.15Å; T831-D833 WeakPolarHBondContact OG1-CB 3.45Å; T831-D833 PolarHBondContact OG1-N 3.29Å; T831-D833 VanDerWaalsContact OG1-N 3.08Å; D833-R1001 WeakPolarHBondContact O-CG 3.37Å; D833-R1001 PolarHBondContact O-N 3.41Å
834	K	71.4	Confident	83.6	Confident	99 Å²	99	31 Å²	31	43%	0.43	16%	0.164	S	C	.	.			trans	-62.6	154.7	171.3	-65.3	177.4	-177.6	171.3	0	110.6	E836 T837 A838	K834-E836 PolarHBondContact O-N 3.45Å; K834-T837 PolarHBondContact O-OG1 3.03Å; K834-T837 VanDerWaalsContact O-OG1 3.05Å; K834-A838 VanDerWaalsContact O-CB 3.25Å; K834-A838 WeakPolarHBondContact O-CB 3.5Å; K834-A838 PolarHBondContact O-N 3.45Å; K834-A838 VanDerWaalsContact O-N 3.07Å
835	E	80.9	Confident	83.8	Confident	28 Å²	28	30.5 Å²	30.5	13%	0.131	16%	0.159	C	C	.	.	H	α-helix	trans	-57.9	-48.3	-178.4	178	175.1	-175.3	0	0	112.9	A838 I839 H856 T858 V969 C1000	E835-A838 PolarHBondContact O-N 3.21Å; E835-I839 HydrophobicContact CG-CD1 3.73Å; E835-I839 HydrophobicContact CG-CG1 4.44Å; E835-I839 VanDerWaalsContact O-CG1 3.32Å; E835-I839 WeakPolarHBondContact O-CG1 3.3Å; E835-I839 PolarHBondContact O-N 3.39Å; E835-H856 IonicContact OE1-CE1 2.74Å; E835-H856 IonicContact OE1-CG 3.74Å; E835-H856 IonicContact OE1-ND1 2.72Å; E835-H856 PolarHBondContact OE1-ND1 3.47Å; E835-T858 WeakPolarHBondContact OE1-CG2 3.48Å; E835-T858 PolarHBondContact OE1-OG1 2.83Å; E835-T858 VanDerWaalsContact OE2-CB 3.26Å; E835-T858 WeakPolarHBondContact OE2-CB 3.4Å; E835-T858 VanDerWaalsContact OE2-CG2 3.3Å; E835-T858 WeakPolarHBondContact OE2-CG2 3.37Å; E835-T858 PolarHBondContact OE2-OG1 2.87Å; E835-V969 HydrophobicContact CG-CG1 3.84Å; E835-C1000 HydrophobicContact CB-CB 4.4Å
836	E	73.8	Confident	83.6	Confident	144 Å²	144	30.7 Å²	30.7	67%	0.673	16%	0.162	S	C	*	.	H	α-helix	trans	-56.3	-54.8	-179.5	-66.7	154.7	-160.5	0	0	111.2	K834 A838 I839 T840	K834-E836 PolarHBondContact O-N 3.45Å; E836-A838 VanDerWaalsContact C-N 3.25Å; E836-A838 PolarHBondContact O-N 3.46Å; E836-I839 PolarHBondContact O-N 3.31Å; E836-T840 WeakPolarHBondContact O-CB 3.48Å; E836-T840 PolarHBondContact O-N 2.96Å; E836-T840 PolarHBondContact O-OG1 3.12Å
837	T	72.7	Confident	83.5	Confident	30 Å²	30	30 Å²	30	18%	0.184	16%	0.159	C	C	.	.	H	α-helix	trans	-64.4	-30.9	-179.1	59.2	0	0	0	0	112.6	K438 K834 V841	K438-T837 PolarHBondContact NZ-O 2.86Å; K834-T837 PolarHBondContact O-OG1 3.03Å; K834-T837 VanDerWaalsContact O-OG1 3.05Å; T837-V841 WeakPolarHBondContact O-CG2 3.4Å; T837-V841 PolarHBondContact O-N 2.99Å; T837-V841 VanDerWaalsContact O-N 3.15Å
838	A	82.8	Confident	83.2	Confident	1 Å²	1	30 Å²	30	1%	0.008	16%	0.159	C	C	.	.	H	α-helix	trans	-72.7	-38.5	177.3	0	0	0	0	0	112.5	T831 K834 E835 E836 S842 L998	T831-A838 HydrophobicContact CG2-CB 3.6Å; K834-A838 VanDerWaalsContact O-CB 3.25Å; K834-A838 WeakPolarHBondContact O-CB 3.5Å; K834-A838 PolarHBondContact O-N 3.45Å; K834-A838 VanDerWaalsContact O-N 3.07Å; E835-A838 PolarHBondContact O-N 3.21Å; E836-A838 VanDerWaalsContact C-N 3.25Å; E836-A838 PolarHBondContact O-N 3.46Å; A838-S842 VanDerWaalsContact O-CB 3.27Å; A838-S842 WeakPolarHBondContact O-CB 3.27Å; A838-S842 PolarHBondContact O-N 3.32Å; A838-S842 PolarHBondContact O-OG 3.06Å; A838-L998 HydrophobicContact CB-CD1 4.15Å; A838-L998 HydrophobicContact CB-CD2 3.93Å; A838-L998 HydrophobicContact CB-CG 4.38Å
839	I	84.8	Confident	82.5	Confident	20 Å²	20	31.9 Å²	31.9	10%	0.103	17%	0.171	C	C	.	.	H	α-helix	trans	-67.1	-46.3	174.6	-68.7	167.6	0	0	0	110.1	E835 E836 V841 S842 R843 F848 L854 V969 L998	E835-I839 HydrophobicContact CG-CD1 3.73Å; E835-I839 HydrophobicContact CG-CG1 4.44Å; E835-I839 VanDerWaalsContact O-CG1 3.32Å; E835-I839 WeakPolarHBondContact O-CG1 3.3Å; E835-I839 PolarHBondContact O-N 3.39Å; E836-I839 PolarHBondContact O-N 3.31Å; I839-V841 PolarHBondContact O-N 3.41Å; I839-S842 WeakPolarHBondContact O-CB 3.24Å; I839-S842 PolarHBondContact O-N 3.21Å; I839-R843 PolarHBondContact O-N 3.32Å; I839-F848 HydrophobicContact CG1-CE2 4.47Å; I839-L854 HydrophobicContact CG2-CD1 4.26Å; I839-V969 HydrophobicContact CD1-CG1 4.41Å; I839-V969 HydrophobicContact CD1-CG2 4.38Å; I839-V969 HydrophobicContact CG1-CG2 4.32Å; I839-L998 HydrophobicContact CG1-CD2 3.85Å
840	T	80.3	Confident	81.4	Confident	26 Å²	26	38 Å²	38	16%	0.16	21%	0.21	C	C	.	.	H	α-helix	trans	-53.9	-53.6	177.8	-61.9	0	0	0	0	111	G748 E836 S842 R843 S844	G748-T840 WeakPolarHBondContact O-CG2 2.91Å; E836-T840 WeakPolarHBondContact O-CB 3.48Å; E836-T840 PolarHBondContact O-N 2.96Å; E836-T840 PolarHBondContact O-OG1 3.12Å; T840-S842 PolarHBondContact O-N 3.37Å; T840-R843 PolarHBondContact O-N 3.47Å; T840-S844 PolarHBondContact O-N 3.29Å; T840-S844 VanDerWaalsContact O-N 3.1Å; T840-S844 PolarHBondContact O-OG 3.46Å
841	V	83.2	Confident	80.5	Confident	6 Å²	6	44.2 Å²	44.2	4%	0.036	24%	0.243	C	C	.	.	H	α-helix	trans	-67.3	-34.6	178.1	172	0	0	0	0	112.5	K438 T443 D807 L809 T837 I839 R843 S844 A845	K438-V841 HydrophobicContact CD-CB 4.27Å; K438-V841 HydrophobicContact CD-CG1 4.28Å; K438-V841 HydrophobicContact CG-CB 4.36Å; K438-V841 HydrophobicContact CG-CG1 3.85Å; T443-V841 HydrophobicContact CG2-CG1 3.81Å; T443-V841 HydrophobicContact CG2-CG2 4.39Å; D807-V841 HydrophobicContact CB-CG2 4.4Å; L809-V841 HydrophobicContact CD2-CG1 4Å; T837-V841 WeakPolarHBondContact O-CG2 3.4Å; T837-V841 PolarHBondContact O-N 2.99Å; T837-V841 VanDerWaalsContact O-N 3.15Å; I839-V841 PolarHBondContact O-N 3.41Å; V841-R843 VanDerWaalsContact C-N 3.3Å; V841-R843 PolarHBondContact O-N 3.36Å; V841-S844 PolarHBondContact O-N 3.02Å; V841-A845 WeakPolarHBondContact O-CB 3.2Å; V841-A845 PolarHBondContact O-N 3.35Å
842	S	87.7	Confident	80	Confident	2 Å²	2	45 Å²	45	1%	0.014	25%	0.247	C	C	.	.	H	α-helix	trans	-64.2	-32.8	174.7	-69	0	0	0	0	113.1	A838 I839 T840 G846 H847 F848	A838-S842 VanDerWaalsContact O-CB 3.27Å; A838-S842 WeakPolarHBondContact O-CB 3.27Å; A838-S842 PolarHBondContact O-N 3.32Å; A838-S842 PolarHBondContact O-OG 3.06Å; I839-S842 WeakPolarHBondContact O-CB 3.24Å; I839-S842 PolarHBondContact O-N 3.21Å; T840-S842 PolarHBondContact O-N 3.37Å; S842-G846 PolarHBondContact O-N 2.87Å; S842-H847 WeakPolarHBondContact O-CA 3.45Å; S842-H847 WeakPolarHBondContact O-CB 3.43Å; S842-H847 PolarHBondContact O-N 3.44Å; S842-H847 PolarHBondContact OG-ND1 2.87Å; S842-F848 PolarHBondContact O-N 3.45Å
843	R	84.3	Confident	80.2	Confident	124 Å²	124	47.1 Å²	47.1	47%	0.468	25%	0.248	S	C	.	.	H	α-helix	trans	-71.2	-49.7	173.8	-74.4	179.2	174.7	170.9	-1.2	110.8	I839 T840 V841 A845 G846 F848	I839-R843 PolarHBondContact O-N 3.32Å; T840-R843 PolarHBondContact O-N 3.47Å; V841-R843 VanDerWaalsContact C-N 3.3Å; V841-R843 PolarHBondContact O-N 3.36Å; R843-A845 VanDerWaalsContact C-N 3.31Å; R843-A845 PolarHBondContact O-N 2.99Å; R843-G846 PolarHBondContact O-N 3.38Å; R843-F848 HydrophobicContact CG-CB 4.28Å
844	S	82.5	Confident	80.6	Confident	44 Å²	44	47 Å²	47	31%	0.308	25%	0.247	S	C	.	.	H	α-helix	trans	-59.2	-41.7	177.9	-53	0	0	0	0	112.2	G748 T840 V841 G846	G748-S844 WeakPolarHBondContact CA-OG 3.41Å; T840-S844 PolarHBondContact O-N 3.29Å; T840-S844 VanDerWaalsContact O-N 3.1Å; T840-S844 PolarHBondContact O-OG 3.46Å; V841-S844 PolarHBondContact O-N 3.02Å; S844-G846 PolarHBondContact O-N 2.9Å
845	A	85.4	Confident	81.3	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-5.8	178.1	0	0	0	0	0	113.7	L809 V813 H814 L817 V841 R843 H847	L809-A845 HydrophobicContact CD1-CB 4.33Å; L809-A845 HydrophobicContact CD2-CB 4.18Å; V813-A845 HydrophobicContact CG1-CB 3.97Å; H814-A845 WeakPolarHBondContact CA-O 3.48Å; L817-A845 HydrophobicContact CD1-CB 3.89Å; L817-A845 WeakPolarHBondContact CD1-O 3.39Å; V841-A845 WeakPolarHBondContact O-CB 3.2Å; V841-A845 PolarHBondContact O-N 3.35Å; R843-A845 VanDerWaalsContact C-N 3.31Å; R843-A845 PolarHBondContact O-N 2.99Å; A845-H847 PolarHBondContact O-N 3.48Å
846	G	81.8	Confident	81.7	Confident	8 Å²	8	45 Å²	45	8%	0.082	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	9.7	-175.5	0	0	0	0	0	114.3	H814 R821 S842 R843 S844 F848	H814-G846 WeakPolarHBondContact ND1-CA 3.19Å; H814-G846 PolarHBondContact ND1-N 2.96Å; R821-G846 PolarHBondContact NH2-O 3.22Å; S842-G846 PolarHBondContact O-N 2.87Å; R843-G846 PolarHBondContact O-N 3.38Å; S844-G846 PolarHBondContact O-N 2.9Å; G846-F848 VanDerWaalsContact C-N 3.33Å
847	H	86.8	Confident	82.4	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.009	21%	0.208	C	C	.	.	S	Bend	trans	-62.9	-41.1	173	172	-129	0	0	0	110.9	L817 R821 V827 S842 A845 T996	L817-H847 HydrophobicContact CD1-CB 4.24Å; R821-H847 PolarHBondContact NH2-O 3.22Å; V827-H847 PolarHBondContact O-NE2 3.49Å; S842-H847 WeakPolarHBondContact O-CA 3.45Å; S842-H847 WeakPolarHBondContact O-CB 3.43Å; S842-H847 PolarHBondContact O-N 3.44Å; S842-H847 PolarHBondContact OG-ND1 2.87Å; A845-H847 PolarHBondContact O-N 3.48Å; H847-T996 WeakPolarHBondContact NE2-CB 3.14Å
848	F	86.2	Confident	82.9	Confident	5 Å²	5	37.3 Å²	37.3	2%	0.022	20%	0.204	C	C	.	.	S	Bend	trans	-102.2	121.7	165.4	-61.3	-27.1	0	0	0	109.6	I839 S842 R843 G846 M852 L854 A967 V969 L998	I839-F848 HydrophobicContact CG1-CE2 4.47Å; S842-F848 PolarHBondContact O-N 3.45Å; R843-F848 HydrophobicContact CG-CB 4.28Å; G846-F848 VanDerWaalsContact C-N 3.33Å; F848-M852 HydrophobicContact CD1-SD 4.39Å; F848-L854 HydrophobicContact CD1-CD2 4.28Å; F848-L854 HydrophobicContact CD2-CD2 3.87Å; F848-L854 HydrophobicContact CE1-CD2 4.4Å; F848-L854 HydrophobicContact CE2-CD2 3.96Å; F848-L854 HydrophobicContact CG-CD2 4.02Å; F848-L854 HydrophobicContact CZ-CD2 4.2Å; F848-A967 HydrophobicContact CD1-CB 3.68Å; F848-A967 HydrophobicContact CE1-CB 3.38Å; F848-A967 HydrophobicContact CZ-CB 4.1Å; F848-V969 HydrophobicContact CE2-CG2 4.43Å; F848-V969 HydrophobicContact CZ-CG2 4.28Å; F848-L998 HydrophobicContact CE1-CB 4.42Å; F848-L998 HydrophobicContact CE2-CB 4.34Å; F848-L998 HydrophobicContact CE2-CD2 3.81Å; F848-L998 HydrophobicContact CZ-CB 3.58Å; F848-L998 HydrophobicContact CZ-CD2 3.92Å; F848-L998 HydrophobicContact CZ-CG 4.36Å
849	T	78.8	Confident	82.8	Confident	43 Å²	43	42.1 Å²	42.1	26%	0.264	23%	0.229	S	C	.	.			trans	-75	149.4	168.2	57.6	0	0	0	0	109.5	N851 M852	T849-N851 PolarHBondContact O-N 3.38Å; T849-M852 HydrophobicContact CG2-CE 3.92Å; T849-M852 WeakPolarHBondContact O-CB 3.33Å; T849-M852 WeakPolarHBondContact O-CG 3.18Å; T849-M852 PolarHBondContact O-N 3.27Å; T849-M852 WeakPolarHBondContact OG1-CE 3.42Å; T849-M852 WeakPolarHBondContact OG1-CG 3.18Å
850	P	71.5	Confident	82.6	Confident	128 Å²	128	41.4 Å²	41.4	83%	0.831	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-30	-179.7	19.8	-32.2	0	0	0	113.1	M852	P850-M852 VanDerWaalsContact C-N 3.32Å; P850-M852 PolarHBondContact O-N 2.86Å
851	N	74.2	Confident	82.6	Confident	131 Å²	131	48.3 Å²	48.3	70%	0.701	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	9.8	179.4	-55.8	1.6	0	0	0	114	T849	T849-N851 PolarHBondContact O-N 3.38Å
852	M	77.8	Confident	82.7	Confident	16 Å²	16	52.6 Å²	52.6	8%	0.079	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-83.5	133.4	177.7	-59.4	-153.8	175.4	0	0	112	F848 T849 P850 P965 A967	F848-M852 HydrophobicContact CD1-SD 4.39Å; T849-M852 HydrophobicContact CG2-CE 3.92Å; T849-M852 WeakPolarHBondContact O-CB 3.33Å; T849-M852 WeakPolarHBondContact O-CG 3.18Å; T849-M852 PolarHBondContact O-N 3.27Å; T849-M852 WeakPolarHBondContact OG1-CE 3.42Å; T849-M852 WeakPolarHBondContact OG1-CG 3.18Å; P850-M852 VanDerWaalsContact C-N 3.32Å; P850-M852 PolarHBondContact O-N 2.86Å; M852-P965 VanDerWaalsContact CA-O 3.29Å; M852-P965 WeakPolarHBondContact CA-O 3.15Å; M852-P965 HydrophobicContact CB-CB 4.47Å; M852-P965 HydrophobicContact CB-CG 4.41Å; M852-P965 HydrophobicContact CE-CB 3.85Å; M852-P965 HydrophobicContact CG-CB 3.7Å; M852-P965 HydrophobicContact CG-CG 3.78Å; M852-P965 HydrophobicContact SD-CB 4.01Å; M852-A967 HydrophobicContact SD-CB 4.24Å
853	N	82.1	Confident	82.7	Confident	89 Å²	89	55.9 Å²	55.9	48%	0.476	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	121.6	168.5	-69.2	-18.2	0	0	0	109.8	P965 M966 A967	N853-P965 PolarHBondContact N-O 2.72Å; N853-P965 VanDerWaalsContact N-O 3.11Å; N853-M966 HydrophobicContact CB-CG 4.4Å; N853-M966 WeakPolarHBondContact O-CA 3.12Å; N853-A967 PolarHBondContact O-N 2.91Å
854	L	84.4	Confident	82.7	Confident	41 Å²	41	53 Å²	53	22%	0.215	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	125.3	178.8	-56.2	-177.4	0	0	0	110.4	I839 F848 A967	I839-L854 HydrophobicContact CG2-CD1 4.26Å; F848-L854 HydrophobicContact CD1-CD2 4.28Å; F848-L854 HydrophobicContact CD2-CD2 3.87Å; F848-L854 HydrophobicContact CE1-CD2 4.4Å; F848-L854 HydrophobicContact CE2-CD2 3.96Å; F848-L854 HydrophobicContact CG-CD2 4.02Å; F848-L854 HydrophobicContact CZ-CD2 4.2Å; L854-A967 HydrophobicContact CD2-CB 3.79Å
855	V	85.5	Confident	82.9	Confident	18 Å²	18	53.5 Å²	53.5	11%	0.109	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	119.3	173.7	177.8	0	0	0	0	108.2	Y873 A967 L968 V969	V855-Y873 HydrophobicContact CG1-CD1 3.78Å; V855-Y873 HydrophobicContact CG1-CD2 3.81Å; V855-Y873 HydrophobicContact CG1-CE1 3.76Å; V855-Y873 HydrophobicContact CG1-CE2 3.79Å; V855-Y873 HydrophobicContact CG1-CG 3.83Å; V855-A967 PolarHBondContact N-O 3.3Å; V855-L968 HydrophobicContact CB-CD1 4.27Å; V855-L968 HydrophobicContact CG1-CD1 4Å; V855-L968 CarbonylContact O-C 3.53Å; V855-L968 WeakPolarHBondContact O-CA 3.33Å; V855-V969 PolarHBondContact O-N 3.35Å
856	H	88.4	Confident	83	Confident	66 Å²	66	53.5 Å²	53.5	31%	0.306	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	114.7	-178.1	-65.1	-98.9	0	0	0	111.6	E835	E835-H856 IonicContact OE1-CE1 2.74Å; E835-H856 IonicContact OE1-CG 3.74Å; E835-H856 IonicContact OE1-ND1 2.72Å; E835-H856 PolarHBondContact OE1-ND1 3.47Å
857	L	88.2	Confident	83.2	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	54.2	168.7	-68.4	-177.7	0	0	0	110.1	F866 K869 L870 Y873 L968 V969 I970 S974 L990	L857-F866 HydrophobicContact CB-CE2 4.25Å; L857-F866 HydrophobicContact CD1-CE2 4.05Å; L857-F866 HydrophobicContact CD1-CZ 4.32Å; L857-K869 HydrophobicContact CD2-CB 3.88Å; L857-L870 HydrophobicContact CD1-CD1 4.43Å; L857-Y873 HydrophobicContact CD2-CD2 3.83Å; L857-Y873 HydrophobicContact CD2-CE2 3.75Å; L857-L968 HydrophobicContact CB-CD1 4.12Å; L857-L968 HydrophobicContact CD1-CD1 3.68Å; L857-L968 HydrophobicContact CG-CD1 3.73Å; L857-V969 PolarHBondContact N-O 3.35Å; L857-I970 HydrophobicContact CB-CB 4.42Å; L857-I970 HydrophobicContact CB-CD1 4.5Å; L857-I970 HydrophobicContact CB-CG1 4.26Å; L857-S974 VanDerWaalsContact O-CB 3.24Å; L857-S974 WeakPolarHBondContact O-CB 3.33Å; L857-S974 PolarHBondContact O-OG 3.38Å; L857-L990 HydrophobicContact CD1-CD2 4.14Å
858	T	83.8	Confident	83.2	Confident	14 Å²	14	57 Å²	57	9%	0.086	30%	0.3	C	S	.	.			trans	-112.1	159.4	-177.4	62.6	0	0	0	0	112.4	E835 C860 V969 D971	E835-T858 WeakPolarHBondContact OE1-CG2 3.48Å; E835-T858 PolarHBondContact OE1-OG1 2.83Å; E835-T858 VanDerWaalsContact OE2-CB 3.26Å; E835-T858 WeakPolarHBondContact OE2-CB 3.4Å; E835-T858 VanDerWaalsContact OE2-CG2 3.3Å; E835-T858 WeakPolarHBondContact OE2-CG2 3.37Å; E835-T858 PolarHBondContact OE2-OG1 2.87Å; T858-C860 VanDerWaalsContact C-N 3.3Å; T858-C860 PolarHBondContact O-N 3.35Å; T858-V969 HydrophobicContact CG2-CG1 4.05Å; T858-D971 HydrophobicContact CG2-CB 4.13Å
859	N	81	Confident	83.2	Confident	102 Å²	102	59.9 Å²	59.9	55%	0.545	31%	0.313	S	S	.	.			trans	55.8	32.3	176.3	-61.6	-42.2	0	0	0	115.5	K861 D971	N859-K861 PolarHBondContact O-N 3.03Å; N859-D971 PolarHBondContact N-OD2 3.36Å
860	C	81.6	Confident	83.5	Confident	5 Å²	5	57.9 Å²	57.9	3%	0.034	30%	0.3	C	S	.	.			trans	-76	118.6	173.7	-61.1	0	0	0	0	110.1	T858 F866 S974 Y977	T858-C860 VanDerWaalsContact C-N 3.3Å; T858-C860 PolarHBondContact O-N 3.35Å; C860-F866 HydrophobicContact CB-CB 4.03Å; C860-F866 HydrophobicContact CB-CD2 4.38Å; C860-S974 WeakPolarHBondContact CB-OG 3.31Å; C860-S974 PolarHBondContact N-OG 3.39Å; C860-Y977 WeakPolarHBondContact O-CE2 3.43Å
861	K	80.1	Confident	84.2	Confident	171 Å²	171	52.1 Å²	52.1	74%	0.743	26%	0.262	S	S	*	.			trans	-76.3	-41.5	177.7	-64.2	-177.1	-178.5	178.7	0	112.1	N859 Y977	N859-K861 PolarHBondContact O-N 3.03Å; K861-Y977 PolarHBondContact O-OH 3.01Å
862	D	84.9	Confident	84.7	Confident	96 Å²	96	48.5 Å²	48.5	51%	0.513	24%	0.243	S	C	.	.	S	Bend	trans	-121.2	151	-171.4	-51.2	-39.5	0	0	0	112.4	S864 N865 F866	D862-S864 VanDerWaalsContact C-N 3.31Å; D862-S864 PolarHBondContact O-N 3.4Å; D862-N865 PolarHBondContact O-N 2.69Å; D862-F866 PolarHBondContact O-N 3.02Å
863	F	86.6	Confident	84.9	Confident	71 Å²	71	51.1 Å²	51.1	31%	0.311	25%	0.252	S	S	.	.	H	α-helix	trans	-55.2	-41.9	175.9	176.9	-91.5	0	0	0	113.1	F866 A867 Y977 D980 T982 L983	F863-F866 PolarHBondContact O-N 2.78Å; F863-A867 WeakPolarHBondContact O-CB 3.41Å; F863-A867 PolarHBondContact O-N 3.48Å; F863-Y977 HydrophobicContact CB-CD1 4.07Å; F863-Y977 HydrophobicContact CB-CE1 4.39Å; F863-Y977 HydrophobicContact CD2-CD1 4.19Å; F863-D980 HydrophobicContact CE2-CB 3.91Å; F863-D980 WeakPolarHBondContact CE2-OD2 3.44Å; F863-T982 WeakPolarHBondContact CZ-OG1 3.26Å; F863-L983 HydrophobicContact CD2-CD1 4.09Å; F863-L983 HydrophobicContact CE1-CD1 4.24Å; F863-L983 HydrophobicContact CE2-CD1 3.41Å; F863-L983 VanDerWaalsContact CE2-CD1 3.41Å; F863-L983 HydrophobicContact CE2-CG 3.95Å; F863-L983 HydrophobicContact CZ-CD1 3.5Å; F863-L983 VanDerWaalsContact CZ-CD1 3.5Å; F863-L983 HydrophobicContact CZ-CG 3.74Å
864	S	84.9	Confident	84.8	Confident	63 Å²	63	47.7 Å²	47.7	44%	0.441	23%	0.234	S	C	.	.	H	α-helix	trans	-67.3	-37.1	-178.6	58.6	0	0	0	0	112.9	D862 A867 Y868	D862-S864 VanDerWaalsContact C-N 3.31Å; D862-S864 PolarHBondContact O-N 3.4Å; S864-A867 PolarHBondContact O-N 3.33Å; S864-Y868 WeakPolarHBondContact O-CB 3.46Å; S864-Y868 PolarHBondContact O-N 3.05Å
865	N	86.7	Confident	84.4	Confident	54 Å²	54	49.6 Å²	49.6	29%	0.289	24%	0.241	S	C	.	.	H	α-helix	trans	-67.7	-43.1	176.8	-168.6	3.8	0	0	0	110.6	D862 Y868 K869	D862-N865 PolarHBondContact O-N 2.69Å; N865-Y868 PolarHBondContact O-N 2.86Å; N865-K869 PolarHBondContact O-N 3.46Å
866	F	87.6	Confident	84.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60	-48.5	173.6	179.5	-96.2	0	0	0	111.7	L857 C860 D862 F863 Y868 K869 L870 I970 Y977 A978 L983 F987	L857-F866 HydrophobicContact CB-CE2 4.25Å; L857-F866 HydrophobicContact CD1-CE2 4.05Å; L857-F866 HydrophobicContact CD1-CZ 4.32Å; C860-F866 HydrophobicContact CB-CB 4.03Å; C860-F866 HydrophobicContact CB-CD2 4.38Å; D862-F866 PolarHBondContact O-N 3.02Å; F863-F866 PolarHBondContact O-N 2.78Å; F866-Y868 PolarHBondContact O-N 2.94Å; F866-K869 PolarHBondContact O-N 3.37Å; F866-L870 HydrophobicContact CE1-CD2 4.12Å; F866-L870 WeakPolarHBondContact O-CB 3.39Å; F866-L870 PolarHBondContact O-N 3.42Å; F866-I970 HydrophobicContact CE2-CD1 4.19Å; F866-I970 HydrophobicContact CZ-CD1 4.46Å; F866-Y977 HydrophobicContact CB-CD2 4.33Å; F866-A978 HydrophobicContact CE1-CB 3.85Å; F866-A978 HydrophobicContact CE2-CB 4.37Å; F866-A978 HydrophobicContact CZ-CB 3.48Å; F866-A978 VanDerWaalsContact CZ-CB 3.48Å; F866-L983 HydrophobicContact CD1-CD1 3.75Å; F866-L983 HydrophobicContact CE1-CD1 4.08Å; F866-F987 HydrophobicContact CZ-CD2 4.42Å
867	A	86.9	Confident	83.3	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-57.8	-47	177.2	0	0	0	0	0	112	F863 S864 L870 F871 I940 L983	F863-A867 WeakPolarHBondContact O-CB 3.41Å; F863-A867 PolarHBondContact O-N 3.48Å; S864-A867 PolarHBondContact O-N 3.33Å; A867-L870 PolarHBondContact O-N 3.47Å; A867-F871 HydrophobicContact CB-CD2 4.44Å; A867-F871 HydrophobicContact CB-CE2 4.42Å; A867-F871 WeakPolarHBondContact O-CD2 3.32Å; A867-F871 PolarHBondContact O-N 3.22Å; A867-I940 HydrophobicContact CB-CD1 4.36Å; A867-L983 HydrophobicContact CB-CD1 3.96Å; A867-L983 HydrophobicContact CB-CD2 4.07Å
868	Y	85.3	Confident	82.6	Confident	84 Å²	84	54.3 Å²	54.3	33%	0.329	26%	0.263	S	S	.	.	H	α-helix	trans	-59.2	-48.3	178.1	178	-96.5	0	0	0	112.2	S864 N865 F866 L870 F871 N872 K936 F939	S864-Y868 WeakPolarHBondContact O-CB 3.46Å; S864-Y868 PolarHBondContact O-N 3.05Å; N865-Y868 PolarHBondContact O-N 2.86Å; F866-Y868 PolarHBondContact O-N 2.94Å; Y868-L870 PolarHBondContact O-N 2.66Å; Y868-F871 PolarHBondContact O-N 2.71Å; Y868-N872 VanDerWaalsContact O-CB 3.29Å; Y868-N872 WeakPolarHBondContact O-CB 3.31Å; Y868-N872 PolarHBondContact O-N 3.05Å; Y868-K936 HydrophobicContact CD2-CG 4.43Å; Y868-F939 AromaticContact CD2-CD1 3.77Å; Y868-F939 HydrophobicContact CD2-CD1 3.77Å; Y868-F939 HydrophobicContact CD2-CE1 4.19Å; Y868-F939 AromaticContact CE2-CD1 3.92Å; Y868-F939 HydrophobicContact CE2-CD1 3.92Å; Y868-F939 HydrophobicContact CE2-CE1 4.26Å; Y868-F939 HydrophobicContact CE2-CG 4.39Å
869	K	86.1	Confident	82.1	Confident	65 Å²	65	56.9 Å²	56.9	28%	0.283	28%	0.277	S	S	.	.	H	α-helix	trans	-58.9	-47.9	175.8	-74.3	-172.1	177.9	-171.7	0	111.3	L857 N865 F866 F871 N872 Y873	L857-K869 HydrophobicContact CD2-CB 3.88Å; N865-K869 PolarHBondContact O-N 3.46Å; F866-K869 PolarHBondContact O-N 3.37Å; K869-F871 PolarHBondContact O-N 2.9Å; K869-N872 PolarHBondContact O-N 2.9Å; K869-Y873 HydrophobicContact CB-CE2 4.38Å; K869-Y873 WeakPolarHBondContact O-CD2 3.23Å; K869-Y873 PolarHBondContact O-N 3.07Å
870	L	86.9	Confident	81.6	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-57.8	-48.5	179.8	178	62.7	0	0	0	112.1	L857 F866 A867 Y868 Y873 L874 L983 F987 L990	L857-L870 HydrophobicContact CD1-CD1 4.43Å; F866-L870 HydrophobicContact CE1-CD2 4.12Å; F866-L870 WeakPolarHBondContact O-CB 3.39Å; F866-L870 PolarHBondContact O-N 3.42Å; A867-L870 PolarHBondContact O-N 3.47Å; Y868-L870 PolarHBondContact O-N 2.66Å; L870-Y873 PolarHBondContact O-N 3.41Å; L870-L874 PolarHBondContact O-N 3.14Å; L870-L874 VanDerWaalsContact O-N 3.08Å; L870-L983 HydrophobicContact CD2-CD2 4.38Å; L870-F987 HydrophobicContact CD1-CD2 4.47Å; L870-F987 HydrophobicContact CD2-CB 4.32Å; L870-L990 HydrophobicContact CD1-CB 4.2Å; L870-L990 HydrophobicContact CD1-CD2 3.63Å
871	F	85.4	Confident	80.8	Confident	8 Å²	8	60.8 Å²	60.8	4%	0.035	29%	0.286	C	S	.	.	H	α-helix	trans	-67.4	-41	179.4	-76.4	-62.5	0	0	0	112.4	A867 Y868 K869 Y873 L874 E875 F939 Y944 V947 L983 T986	A867-F871 HydrophobicContact CB-CD2 4.44Å; A867-F871 HydrophobicContact CB-CE2 4.42Å; A867-F871 WeakPolarHBondContact O-CD2 3.32Å; A867-F871 PolarHBondContact O-N 3.22Å; Y868-F871 PolarHBondContact O-N 2.71Å; K869-F871 PolarHBondContact O-N 2.9Å; F871-Y873 VanDerWaalsContact C-N 3.34Å; F871-Y873 PolarHBondContact O-N 3.15Å; F871-L874 PolarHBondContact O-N 3.36Å; F871-E875 WeakPolarHBondContact O-CB 3.46Å; F871-E875 PolarHBondContact O-N 2.73Å; F871-F939 HydrophobicContact CB-CE1 3.82Å; F871-F939 HydrophobicContact CB-CZ 4.48Å; F871-Y944 HydrophobicContact CE2-CD2 4.31Å; F871-Y944 AromaticContact CE2-CE2 3.99Å; F871-Y944 HydrophobicContact CE2-CE2 3.99Å; F871-Y944 HydrophobicContact CZ-CD1 4.36Å; F871-Y944 HydrophobicContact CZ-CD2 4.32Å; F871-Y944 HydrophobicContact CZ-CE1 4.26Å; F871-Y944 HydrophobicContact CZ-CE2 4.21Å; F871-Y944 HydrophobicContact CZ-CG 4.38Å; F871-V947 HydrophobicContact CE1-CG2 4.23Å; F871-L983 HydrophobicContact CE2-CD2 4.03Å; F871-L983 HydrophobicContact CZ-CD2 4.31Å; F871-T986 HydrophobicContact CE1-CG2 3.84Å; F871-T986 HydrophobicContact CZ-CG2 4.18Å
872	N	85	Confident	80.4	Confident	55 Å²	55	58 Å²	58	29%	0.294	28%	0.276	S	S	.	.	H	α-helix	trans	-59.6	-44.2	175.9	-173.4	21.2	0	0	0	111.4	Y868 K869 L874 E875 N876	Y868-N872 VanDerWaalsContact O-CB 3.29Å; Y868-N872 WeakPolarHBondContact O-CB 3.31Å; Y868-N872 PolarHBondContact O-N 3.05Å; K869-N872 PolarHBondContact O-N 2.9Å; N872-L874 PolarHBondContact O-N 3.26Å; N872-E875 PolarHBondContact O-N 3.44Å; N872-N876 WeakPolarHBondContact O-CB 3.04Å; N872-N876 VanDerWaalsContact O-CG 3.23Å; N872-N876 PolarHBondContact O-N 3.01Å; N872-N876 PolarHBondContact O-ND2 2.99Å; N872-N876 PolarHBondContact OD1-ND2 3.14Å
873	Y	81.8	Confident	79.7	Confident	71 Å²	71	59.9 Å²	59.9	28%	0.278	28%	0.279	S	S	.	.	H	α-helix	trans	-62.9	-44.1	175	-75.4	-59.5	0	0	0	112.4	V855 L857 K869 L870 F871 E875 N876 L877	V855-Y873 HydrophobicContact CG1-CD1 3.78Å; V855-Y873 HydrophobicContact CG1-CD2 3.81Å; V855-Y873 HydrophobicContact CG1-CE1 3.76Å; V855-Y873 HydrophobicContact CG1-CE2 3.79Å; V855-Y873 HydrophobicContact CG1-CG 3.83Å; L857-Y873 HydrophobicContact CD2-CD2 3.83Å; L857-Y873 HydrophobicContact CD2-CE2 3.75Å; K869-Y873 HydrophobicContact CB-CE2 4.38Å; K869-Y873 WeakPolarHBondContact O-CD2 3.23Å; K869-Y873 PolarHBondContact O-N 3.07Å; L870-Y873 PolarHBondContact O-N 3.41Å; F871-Y873 VanDerWaalsContact C-N 3.34Å; F871-Y873 PolarHBondContact O-N 3.15Å; Y873-E875 VanDerWaalsContact C-N 3.32Å; Y873-E875 PolarHBondContact O-N 3.04Å; Y873-N876 PolarHBondContact O-N 3.31Å; Y873-L877 VanDerWaalsContact O-CG 3.27Å; Y873-L877 WeakPolarHBondContact O-CG 3.24Å; Y873-L877 PolarHBondContact O-N 3.19Å
874	L	78.8	Confident	78.6	Confident	17 Å²	17	60.1 Å²	60.1	9%	0.089	28%	0.28	C	S	.	.	H	α-helix	trans	-61.9	-39.1	176.6	-77.8	173	0	0	0	112.5	L870 F871 N872 L877 K878 L990	L870-L874 PolarHBondContact O-N 3.14Å; L870-L874 VanDerWaalsContact O-N 3.08Å; F871-L874 PolarHBondContact O-N 3.36Å; N872-L874 PolarHBondContact O-N 3.26Å; L874-L877 PolarHBondContact O-N 3.3Å; L874-K878 WeakPolarHBondContact O-CG 3.23Å; L874-K878 PolarHBondContact O-N 3.24Å; L874-L990 HydrophobicContact CD2-CB 3.93Å; L874-L990 HydrophobicContact CD2-CD1 3.92Å; L874-L990 HydrophobicContact CG-CB 4.44Å; L874-L990 HydrophobicContact CG-CD1 4.37Å
875	E	77.9	Confident	77.7	Confident	80 Å²	80	65.6 Å²	65.6	37%	0.374	29%	0.291	S	S	.	.	H	α-helix	trans	-67.2	-44.2	176	-170.7	170.5	-166.6	0	0	111.5	F871 N872 Y873 L877 K878 N879 F939	F871-E875 WeakPolarHBondContact O-CB 3.46Å; F871-E875 PolarHBondContact O-N 2.73Å; N872-E875 PolarHBondContact O-N 3.44Å; Y873-E875 VanDerWaalsContact C-N 3.32Å; Y873-E875 PolarHBondContact O-N 3.04Å; E875-L877 VanDerWaalsContact C-N 3.31Å; E875-L877 PolarHBondContact O-N 2.97Å; E875-K878 WeakPolarHBondContact O-CB 3.3Å; E875-K878 PolarHBondContact O-N 2.92Å; E875-K878 VanDerWaalsContact O-N 3.09Å; E875-N879 WeakPolarHBondContact O-CB 3.42Å; E875-N879 VanDerWaalsContact O-CG 3.29Å; E875-N879 PolarHBondContact O-N 3.43Å; E875-F939 WeakPolarHBondContact OE2-CE2 3.38Å; E875-F939 WeakPolarHBondContact OE2-CZ 3.49Å
876	N	78.5	Confident	77.1	Confident	58 Å²	58	67.1 Å²	67.1	31%	0.31	30%	0.299	S	S	.	.	H	α-helix	trans	-57.1	-45.3	173	-71.6	-28.7	0	0	0	111.1	N872 Y873 K878 N879 F880	N872-N876 WeakPolarHBondContact O-CB 3.04Å; N872-N876 VanDerWaalsContact O-CG 3.23Å; N872-N876 PolarHBondContact O-N 3.01Å; N872-N876 PolarHBondContact O-ND2 2.99Å; N872-N876 PolarHBondContact OD1-ND2 3.14Å; Y873-N876 PolarHBondContact O-N 3.31Å; N876-K878 VanDerWaalsContact C-N 3.34Å; N876-K878 PolarHBondContact O-N 3.25Å; N876-N879 PolarHBondContact O-N 2.74Å; N876-F880 HydrophobicContact CB-CD2 4.39Å; N876-F880 HydrophobicContact CB-CE2 4.31Å; N876-F880 WeakPolarHBondContact O-CB 3.15Å; N876-F880 WeakPolarHBondContact O-CD2 3.33Å; N876-F880 PolarHBondContact O-N 3.19Å
877	L	72.2	Confident	76.2	Confident	20 Å²	20	71.2 Å²	71.2	11%	0.105	32%	0.321	C	S	.	.	H	α-helix	trans	-61.9	-38	175.6	-70.6	-177.9	0	0	0	113.2	Y873 L874 E875 R881 M966 L990	Y873-L877 VanDerWaalsContact O-CG 3.27Å; Y873-L877 WeakPolarHBondContact O-CG 3.24Å; Y873-L877 PolarHBondContact O-N 3.19Å; L874-L877 PolarHBondContact O-N 3.3Å; E875-L877 VanDerWaalsContact C-N 3.31Å; E875-L877 PolarHBondContact O-N 2.97Å; L877-R881 VanDerWaalsContact O-CG 3.28Å; L877-R881 WeakPolarHBondContact O-CG 3.47Å; L877-R881 PolarHBondContact O-N 3.24Å; L877-R881 VanDerWaalsContact O-N 3.1Å; L877-M966 HydrophobicContact CD1-CE 4.5Å; L877-M966 HydrophobicContact CD2-CE 3.34Å; L877-M966 HydrophobicContact CD2-SD 3.36Å; L877-M966 WeakPolarHBondContact CD2-SD 3.34Å; L877-L990 HydrophobicContact CD1-CD1 3.48Å; L877-L990 VanDerWaalsContact CD1-CD1 3.48Å
878	K	72.6	Confident	75.1	Confident	106 Å²	106	78.2 Å²	78.2	46%	0.461	35%	0.351	S	S	.	.	H	α-helix	trans	-65.2	-48.1	173.8	-74.6	177	179.8	-175.3	0	110.6	L874 E875 N876 F880 R881 E882	L874-K878 WeakPolarHBondContact O-CG 3.23Å; L874-K878 PolarHBondContact O-N 3.24Å; E875-K878 WeakPolarHBondContact O-CB 3.3Å; E875-K878 PolarHBondContact O-N 2.92Å; E875-K878 VanDerWaalsContact O-N 3.09Å; N876-K878 VanDerWaalsContact C-N 3.34Å; N876-K878 PolarHBondContact O-N 3.25Å; K878-F880 PolarHBondContact O-N 3.3Å; K878-R881 WeakPolarHBondContact O-CB 3.47Å; K878-R881 PolarHBondContact O-N 3.42Å; K878-R881 VanDerWaalsContact O-N 3.1Å; K878-E882 PolarHBondContact O-N 2.79Å
879	N	74.3	Confident	74.5	Confident	68 Å²	68	81 Å²	81	36%	0.364	37%	0.365	S	S	.	.	H	α-helix	trans	-60.3	-44.4	178.2	-70	-16.5	0	0	0	111.8	E875 N876 R881 E882 K883	E875-N879 WeakPolarHBondContact O-CB 3.42Å; E875-N879 VanDerWaalsContact O-CG 3.29Å; E875-N879 PolarHBondContact O-N 3.43Å; N876-N879 PolarHBondContact O-N 2.74Å; N879-R881 VanDerWaalsContact C-N 3.32Å; N879-R881 PolarHBondContact O-N 3.2Å; N879-E882 PolarHBondContact O-N 3.05Å; N879-K883 WeakPolarHBondContact O-CB 3.32Å; N879-K883 WeakPolarHBondContact O-CG 3.47Å; N879-K883 PolarHBondContact O-N 3.13Å
880	F	69.2	Low	73.7	Confident	112 Å²	112	84.8 Å²	84.8	49%	0.491	38%	0.381	S	S	.	.	H	α-helix	trans	-59.8	-41	174.2	-81.7	-63.9	0	0	0	111.9	N876 K878 K884 F920	N876-F880 HydrophobicContact CB-CD2 4.39Å; N876-F880 HydrophobicContact CB-CE2 4.31Å; N876-F880 WeakPolarHBondContact O-CB 3.15Å; N876-F880 WeakPolarHBondContact O-CD2 3.33Å; N876-F880 PolarHBondContact O-N 3.19Å; K878-F880 PolarHBondContact O-N 3.3Å; F880-K884 VanDerWaalsContact O-CB 3.31Å; F880-K884 WeakPolarHBondContact O-CB 3.41Å; F880-K884 PolarHBondContact O-N 2.74Å; F880-F920 HydrophobicContact CZ-CZ 4.39Å
881	R	65.6	Low	72.3	Confident	77 Å²	77	89.3 Å²	89.3	29%	0.291	40%	0.404	S	S	.	.	H	α-helix	trans	-67.6	-41.7	176.7	-77.6	176.3	-177.4	167.1	11.4	113.1	L877 K878 N879 K884 R885 H993	L877-R881 VanDerWaalsContact O-CG 3.28Å; L877-R881 WeakPolarHBondContact O-CG 3.47Å; L877-R881 PolarHBondContact O-N 3.24Å; L877-R881 VanDerWaalsContact O-N 3.1Å; K878-R881 WeakPolarHBondContact O-CB 3.47Å; K878-R881 PolarHBondContact O-N 3.42Å; K878-R881 VanDerWaalsContact O-N 3.1Å; N879-R881 VanDerWaalsContact C-N 3.32Å; N879-R881 PolarHBondContact O-N 3.2Å; R881-K884 PolarHBondContact O-N 2.78Å; R881-R885 VanDerWaalsContact O-CB 3.3Å; R881-R885 WeakPolarHBondContact O-CB 3.37Å; R881-R885 WeakPolarHBondContact O-CG 3.44Å; R881-R885 PolarHBondContact O-N 2.87Å; R881-H993 VanDerWaalsContact CZ-CD2 3.48Å; R881-H993 PolarHBondContact NH1-CD2 3.45Å; R881-H993 PolarHBondContact NH1-CE1 3.5Å; R881-H993 PolarHBondContact NH1-NE2 3.4Å; R881-H993 PolarHBondContact NH2-CD2 2.85Å; R881-H993 PolarHBondContact NH2-NE2 3.18Å
882	E	70.3	Confident	71.4	Confident	112 Å²	112	95.4 Å²	95.4	52%	0.523	43%	0.43	S	S	.	.	H	α-helix	trans	-65.7	-45.9	177.6	-74.1	-173.6	176	0	0	110.9	K878 N879 K884 R885 N886	K878-E882 PolarHBondContact O-N 2.79Å; N879-E882 PolarHBondContact O-N 3.05Å; E882-K884 PolarHBondContact O-N 3.11Å; E882-R885 PolarHBondContact O-N 3.41Å; E882-N886 VanDerWaalsContact O-CB 3.29Å; E882-N886 WeakPolarHBondContact O-CB 3.29Å; E882-N886 PolarHBondContact O-N 3.1Å; E882-N886 PolarHBondContact O-ND2 3.37Å
883	K	71	Confident	70.5	Confident	135 Å²	135	98.9 Å²	98.9	59%	0.587	44%	0.444	S	S	*	.	H	α-helix	trans	-54.1	-49.7	171.1	-74.6	-178.8	-180	-177	0	111	N879 R885 N886 L887	N879-K883 WeakPolarHBondContact O-CB 3.32Å; N879-K883 WeakPolarHBondContact O-CG 3.47Å; N879-K883 PolarHBondContact O-N 3.13Å; K883-R885 PolarHBondContact O-N 2.6Å; K883-N886 PolarHBondContact O-N 3.06Å; K883-L887 WeakPolarHBondContact O-CB 3.33Å; K883-L887 PolarHBondContact O-N 2.67Å
884	K	64.5	Low	69.1	Low	77 Å²	77	103.3 Å²	103.3	34%	0.335	47%	0.465	S	S	.	.	H	α-helix	trans	-67.2	-35.4	180	-160.8	163.3	-166.4	154.6	0	113.1	F880 R881 E882 K888 E964	F880-K884 VanDerWaalsContact O-CB 3.31Å; F880-K884 WeakPolarHBondContact O-CB 3.41Å; F880-K884 PolarHBondContact O-N 2.74Å; R881-K884 PolarHBondContact O-N 2.78Å; E882-K884 PolarHBondContact O-N 3.11Å; K884-K888 WeakPolarHBondContact O-CB 3.44Å; K884-K888 WeakPolarHBondContact O-CG 3.38Å; K884-K888 PolarHBondContact O-N 3.39Å; K884-E964 IonicContact NZ-OE1 3.08Å; K884-E964 PolarHBondContact NZ-OE1 2.81Å
885	R	65.7	Low	67.7	Low	178 Å²	178	108.4 Å²	108.4	67%	0.672	49%	0.487	S	S	*	.	H	α-helix	trans	-67.2	-43.5	172.9	-83.3	177.4	166.4	172.6	-2.9	111.2	R881 E882 K883 K888 K889	R881-R885 VanDerWaalsContact O-CB 3.3Å; R881-R885 WeakPolarHBondContact O-CB 3.37Å; R881-R885 WeakPolarHBondContact O-CG 3.44Å; R881-R885 PolarHBondContact O-N 2.87Å; E882-R885 PolarHBondContact O-N 3.41Å; K883-R885 PolarHBondContact O-N 2.6Å; R885-K888 PolarHBondContact O-N 3.14Å; R885-K889 WeakPolarHBondContact O-CB 2.93Å; R885-K889 WeakPolarHBondContact O-CG 3.35Å; R885-K889 PolarHBondContact O-N 3.06Å
886	N	73.8	Confident	66.6	Low	85 Å²	85	109.9 Å²	109.9	46%	0.455	49%	0.494	S	S	.	.	H	α-helix	trans	-66.2	-39.4	176.7	-70.8	-15.5	0	0	0	110.8	E882 K883 K889 K890	E882-N886 VanDerWaalsContact O-CB 3.29Å; E882-N886 WeakPolarHBondContact O-CB 3.29Å; E882-N886 PolarHBondContact O-N 3.1Å; E882-N886 PolarHBondContact O-ND2 3.37Å; K883-N886 PolarHBondContact O-N 3.06Å; N886-K889 PolarHBondContact O-N 2.85Å; N886-K890 WeakPolarHBondContact O-CB 3.46Å; N886-K890 WeakPolarHBondContact O-CG 3.31Å; N886-K890 PolarHBondContact O-N 2.81Å
887	L	67.4	Low	65.2	Low	87 Å²	87	115.1 Å²	115.1	46%	0.455	51%	0.514	S	S	.	.	H	α-helix	trans	-62.8	-46.5	173.4	-137.6	109.5	0	0	0	111.1	K883 K889 K890 M891	K883-L887 WeakPolarHBondContact O-CB 3.33Å; K883-L887 PolarHBondContact O-N 2.67Å; L887-K889 PolarHBondContact O-N 3.4Å; L887-K890 PolarHBondContact O-N 2.99Å; L887-M891 WeakPolarHBondContact O-CB 3.4Å; L887-M891 WeakPolarHBondContact O-CG 3.22Å; L887-M891 PolarHBondContact O-N 3.05Å
888	K	65.4	Low	64.1	Low	148 Å²	148	115.7 Å²	115.7	64%	0.643	52%	0.52	S	S	*	.	H	α-helix	trans	-62.5	-39.5	174.8	-82.3	-173	177.5	-178	0	113	K884 R885 K892	K884-K888 WeakPolarHBondContact O-CB 3.44Å; K884-K888 WeakPolarHBondContact O-CG 3.38Å; K884-K888 PolarHBondContact O-N 3.39Å; R885-K888 PolarHBondContact O-N 3.14Å; K888-K892 VanDerWaalsContact O-CB 3.32Å; K888-K892 WeakPolarHBondContact O-CB 3.24Å; K888-K892 PolarHBondContact O-N 3.05Å
889	K	72.6	Confident	62.7	Low	141 Å²	141	116.6 Å²	116.6	61%	0.613	53%	0.528	S	S	*	.	H	α-helix	trans	-65.3	-46.4	175	-78.7	-178.6	177.8	-177.5	0	111.1	R885 N886 L887 K892 Q893	R885-K889 WeakPolarHBondContact O-CB 2.93Å; R885-K889 WeakPolarHBondContact O-CG 3.35Å; R885-K889 PolarHBondContact O-N 3.06Å; N886-K889 PolarHBondContact O-N 2.85Å; L887-K889 PolarHBondContact O-N 3.4Å; K889-K892 PolarHBondContact O-N 2.95Å; K889-Q893 WeakPolarHBondContact O-CG 3.34Å; K889-Q893 PolarHBondContact O-N 3.13Å
890	K	68.6	Low	61.1	Low	145 Å²	145	120 Å²	120	63%	0.63	55%	0.547	S	S	*	.	H	α-helix	trans	-59.6	-47	175.4	-79.2	-174.4	176.7	-173.8	0	111.2	N886 L887 K892 Q893 F894	N886-K890 WeakPolarHBondContact O-CB 3.46Å; N886-K890 WeakPolarHBondContact O-CG 3.31Å; N886-K890 PolarHBondContact O-N 2.81Å; L887-K890 PolarHBondContact O-N 2.99Å; K890-K892 VanDerWaalsContact C-N 3.35Å; K890-K892 PolarHBondContact O-N 3.4Å; K890-Q893 PolarHBondContact O-N 2.77Å; K890-F894 WeakPolarHBondContact O-CB 3.05Å; K890-F894 PolarHBondContact O-N 3.49Å
891	M	58.7	Low	60	Low	96 Å²	96	120.2 Å²	120.2	47%	0.473	56%	0.557	S	S	.	*	H	α-helix	trans	-60.9	-43.2	175.1	-75.3	-169.1	84.4	0	0	111.7	L887 Q893 F894 F895	L887-M891 WeakPolarHBondContact O-CB 3.4Å; L887-M891 WeakPolarHBondContact O-CG 3.22Å; L887-M891 PolarHBondContact O-N 3.05Å; M891-Q893 VanDerWaalsContact C-N 3.35Å; M891-Q893 PolarHBondContact O-N 3.48Å; M891-F894 PolarHBondContact O-N 3.41Å; M891-F895 HydrophobicContact CE-CE2 4.05Å; M891-F895 WeakPolarHBondContact O-CB 3.37Å; M891-F895 WeakPolarHBondContact O-CD2 3.37Å; M891-F895 PolarHBondContact O-N 3.2Å
892	K	66.3	Low	58.8	Low	136 Å²	136	122.9 Å²	122.9	59%	0.591	58%	0.575	S	S	*	*	H	α-helix	trans	-63.4	-41.2	178.3	-157.6	-175	179.5	-145.9	0	111.8	K888 K889 K890 E896	K888-K892 VanDerWaalsContact O-CB 3.32Å; K888-K892 WeakPolarHBondContact O-CB 3.24Å; K888-K892 PolarHBondContact O-N 3.05Å; K889-K892 PolarHBondContact O-N 2.95Å; K890-K892 VanDerWaalsContact C-N 3.35Å; K890-K892 PolarHBondContact O-N 3.4Å; K892-E896 WeakPolarHBondContact CE-OE1 3.45Å; K892-E896 IonicContact NZ-OE1 3.36Å; K892-E896 WeakPolarHBondContact O-CB 3.32Å; K892-E896 WeakPolarHBondContact O-CG 3.26Å; K892-E896 PolarHBondContact O-N 2.84Å
893	Q	64.9	Low	57.3	Low	127 Å²	127	126.5 Å²	126.5	59%	0.593	59%	0.593	S	S	*	*	H	α-helix	trans	-66.5	-37	173.4	-75.8	177.9	-18.9	0	0	112.6	K889 K890 M891 E896 K897	K889-Q893 WeakPolarHBondContact O-CG 3.34Å; K889-Q893 PolarHBondContact O-N 3.13Å; K890-Q893 PolarHBondContact O-N 2.77Å; M891-Q893 VanDerWaalsContact C-N 3.35Å; M891-Q893 PolarHBondContact O-N 3.48Å; Q893-E896 PolarHBondContact O-N 3.46Å; Q893-K897 WeakPolarHBondContact O-CB 3.48Å; Q893-K897 PolarHBondContact O-N 3.36Å
894	F	52.2	Low	55.5	Low	164 Å²	164	128.2 Å²	128.2	72%	0.719	60%	0.604	S	S	*	*	H	α-helix	trans	-66.3	-45.5	176.7	-130	-88.5	0	0	0	110.8	K890 M891 K897 S898	K890-F894 WeakPolarHBondContact O-CB 3.05Å; K890-F894 PolarHBondContact O-N 3.49Å; M891-F894 PolarHBondContact O-N 3.41Å; F894-K897 PolarHBondContact O-N 2.85Å; F894-S898 WeakPolarHBondContact O-CB 3.26Å; F894-S898 PolarHBondContact O-N 3.48Å; F894-S898 PolarHBondContact O-OG 3.08Å
895	F	49.9	Very low	54.1	Low	125 Å²	125	133.7 Å²	133.7	55%	0.548	63%	0.629	S	S	.	*	H	α-helix	trans	-65.4	-38.1	175.2	-89.1	-76.8	0	0	0	112.6	M891 S898 I899	M891-F895 HydrophobicContact CE-CE2 4.05Å; M891-F895 WeakPolarHBondContact O-CB 3.37Å; M891-F895 WeakPolarHBondContact O-CD2 3.37Å; M891-F895 PolarHBondContact O-N 3.2Å; F895-S898 WeakPolarHBondContact CA-OG 3.36Å; F895-S898 PolarHBondContact O-OG 2.94Å; F895-I899 WeakPolarHBondContact O-CB 3.4Å; F895-I899 VanDerWaalsContact O-CD1 3.27Å; F895-I899 WeakPolarHBondContact O-CD1 3.2Å; F895-I899 WeakPolarHBondContact O-CG1 3.41Å; F895-I899 PolarHBondContact O-N 3.5Å; F895-I899 VanDerWaalsContact O-N 3.16Å
896	E	54.1	Low	52.5	Low	110 Å²	110	130.9 Å²	130.9	51%	0.514	63%	0.631	S	S	.	*	H	α-helix	trans	-69.1	-31.9	175.1	-77.5	170.7	-171.8	0	0	112.3	K892 Q893	K892-E896 WeakPolarHBondContact CE-OE1 3.45Å; K892-E896 IonicContact NZ-OE1 3.36Å; K892-E896 WeakPolarHBondContact O-CB 3.32Å; K892-E896 WeakPolarHBondContact O-CG 3.26Å; K892-E896 PolarHBondContact O-N 2.84Å; Q893-E896 PolarHBondContact O-N 3.46Å
897	K	50.9	Low	50.4	Low	168 Å²	168	133.9 Å²	133.9	73%	0.73	65%	0.647	S	S	*	*	H	α-helix	trans	-80.3	-34.8	174.8	-88.4	-174.2	173	-175.1	0	113.8	Q893 F894 N900	Q893-K897 WeakPolarHBondContact O-CB 3.48Å; Q893-K897 PolarHBondContact O-N 3.36Å; F894-K897 PolarHBondContact O-N 2.85Å; K897-N900 PolarHBondContact O-N 3.39Å
898	S	47.2	Very low	48.8	Very low	33 Å²	33	137 Å²	137	23%	0.231	67%	0.665	C	S	.	*	H	α-helix	trans	-76.2	-27.2	-179.4	60.3	0	0	0	0	112.5	F894 F895 N900 V901 I902	F894-S898 WeakPolarHBondContact O-CB 3.26Å; F894-S898 PolarHBondContact O-N 3.48Å; F894-S898 PolarHBondContact O-OG 3.08Å; F895-S898 WeakPolarHBondContact CA-OG 3.36Å; F895-S898 PolarHBondContact O-OG 2.94Å; S898-N900 PolarHBondContact O-N 3.5Å; S898-V901 PolarHBondContact O-N 3.43Å; S898-I902 WeakPolarHBondContact O-CB 3.33Å; S898-I902 WeakPolarHBondContact O-CD1 3.38Å; S898-I902 WeakPolarHBondContact O-CG1 3.44Å; S898-I902 PolarHBondContact O-N 3.05Å; S898-I902 VanDerWaalsContact O-N 3.11Å
899	I	43.4	Very low	47.3	Very low	124 Å²	124	142.2 Å²	142.2	64%	0.636	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-23.8	173.5	-71.7	167.5	0	0	0	112.6	F895	F895-I899 WeakPolarHBondContact O-CB 3.4Å; F895-I899 VanDerWaalsContact O-CD1 3.27Å; F895-I899 WeakPolarHBondContact O-CD1 3.2Å; F895-I899 WeakPolarHBondContact O-CG1 3.41Å; F895-I899 PolarHBondContact O-N 3.5Å; F895-I899 VanDerWaalsContact O-N 3.16Å
900	N	41.5	Very low	45.3	Very low	140 Å²	140	142.3 Å²	142.3	75%	0.749	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-2.4	176.1	-75.3	-3.3	0	0	0	114.6	K897 S898	K897-N900 PolarHBondContact O-N 3.39Å; S898-N900 PolarHBondContact O-N 3.5Å
901	V	45.9	Very low	43.3	Very low	116 Å²	116	141.8 Å²	141.8	70%	0.703	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.6	-17.3	-177.6	179.8	0	0	0	0	112.2	S898 E903	S898-V901 PolarHBondContact O-N 3.43Å; V901-E903 VanDerWaalsContact C-N 3.27Å; V901-E903 PolarHBondContact O-N 3.2Å
902	I	39.9	Very low	41.9	Very low	133 Å²	133	143.1 Å²	143.1	68%	0.682	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	44.1	-177.5	-58.1	165.6	0	0	0	111.3	S898	S898-I902 WeakPolarHBondContact O-CB 3.33Å; S898-I902 WeakPolarHBondContact O-CD1 3.38Å; S898-I902 WeakPolarHBondContact O-CG1 3.44Å; S898-I902 PolarHBondContact O-N 3.05Å; S898-I902 VanDerWaalsContact O-N 3.11Å
903	E	38.7	Very low	40	Very low	189 Å²	189	141.6 Å²	141.6	88%	0.883	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	7.8	167.8	-135.8	175.3	-156.1	0	0	112.6	V901	V901-E903 VanDerWaalsContact C-N 3.27Å; V901-E903 PolarHBondContact O-N 3.2Å
904	M	34	Very low	38.3	Very low	170 Å²	170	142.5 Å²	142.5	84%	0.837	69%	0.692	S	S	*	*	S	Bend	trans	-137	122.8	170.7	-72.8	-162.9	176.4	0	0	112
905	K	35.6	Very low	37	Very low	193 Å²	193	141.8 Å²	141.8	84%	0.839	70%	0.696	S	S	*	*			trans	74.2	102.5	163.8	-67.5	-178.3	175.6	179.8	0	118.9
906	T	31.3	Very low	36.1	Very low	119 Å²	119	145.4 Å²	145.4	73%	0.73	71%	0.707	S	S	*	*				43.6	124.9	127.5	55.1	0	0	0	0	120.8
907	N	30.3	Very low	34.8	Very low	147 Å²	147	148.4 Å²	148.4	79%	0.786	72%	0.721	S	S	*	*			trans	45.5	95.7	136.5	-65.1	-5.2	0	0	0	117.6
908	N	34.4	Very low	33.7	Very low	154 Å²	154	147.6 Å²	147.6	82%	0.824	73%	0.725	S	S	*	*			trans	-178.3	111	130.3	-88.5	-18	0	0	0	109.4	I910	N908-I910 PolarHBondContact O-N 3.39Å
909	R	32.9	Very low	32.6	Very low	256 Å²	256	153.4 Å²	153.4	97%	0.966	75%	0.753	S	S	*	*			trans	-81.9	101.4	171.9	-81.6	-175.4	176.9	173.1	2.2	109	K911	R909-K911 PolarHBondContact O-N 2.87Å
910	I	29.6	Very low	32	Very low	144 Å²	144	155.4 Å²	155.4	74%	0.738	76%	0.757	S	S	*	*			trans	-74.2	112.3	168.3	-61.1	169.9	0	0	0	107.9	N908 I912	N908-I910 PolarHBondContact O-N 3.39Å; I910-I912 HydrophobicContact CG2-CG1 3.91Å; I910-I912 PolarHBondContact O-N 2.9Å
911	K	28.3	Very low	31.5	Very low	133 Å²	133	154.1 Å²	154.1	58%	0.578	75%	0.754	S	S	*	*			trans	-72.6	117	162	-85.4	-176.7	-177.8	-179.9	0	107.4	N534 R909	N534-K911 WeakPolarHBondContact OD1-CD 3.49Å; N534-K911 WeakPolarHBondContact OD1-CE 3.1Å; N534-K911 PolarHBondContact OD1-NZ 3.28Å; R909-K911 PolarHBondContact O-N 2.87Å
912	I	27.8	Very low	30.6	Very low	125 Å²	125	154.1 Å²	154.1	64%	0.641	75%	0.751	S	S	*	*			trans	-98.5	97.6	170.7	-60	175.3	0	0	0	106.3	I910 F914	I910-I912 HydrophobicContact CG2-CG1 3.91Å; I910-I912 PolarHBondContact O-N 2.9Å; I912-F914 HydrophobicContact CG2-CD2 4.29Å; I912-F914 HydrophobicContact CG2-CE2 4.05Å; I912-F914 PolarHBondContact O-N 2.72Å
913	D	27.8	Very low	30.3	Very low	103 Å²	103	156.3 Å²	156.3	55%	0.551	76%	0.758	S	S	*	*			trans	-74.8	118.3	170.3	-78.4	-22.4	0	0	0	109.7	N915	D913-N915 PolarHBondContact O-N 3.27Å
914	F	29	Very low	30	Very low	147 Å²	147	156.8 Å²	156.8	65%	0.645	76%	0.757	S	S	*	*			trans	-85.1	83.1	171.9	-85	-84.9	0	0	0	109.4	I912 Y916	I912-F914 HydrophobicContact CG2-CD2 4.29Å; I912-F914 HydrophobicContact CG2-CE2 4.05Å; I912-F914 PolarHBondContact O-N 2.72Å; F914-Y916 PolarHBondContact O-N 3.36Å
915	N	24.7	Very low	29.9	Very low	149 Å²	149	157.6 Å²	157.6	80%	0.797	75%	0.752	S	S	*	*			trans	-75.2	96.7	162.5	-86	-16.1	0	0	0	109.3	D913 Q917	D913-N915 PolarHBondContact O-N 3.27Å; N915-Q917 PolarHBondContact O-N 2.76Å
916	Y	29.9	Very low	29.8	Very low	200 Å²	200	155 Å²	155	78%	0.784	75%	0.747	S	S	*	*			trans	-85.9	93.3	161.2	-112.6	-93.9	0	0	0	107.5	F914	F914-Y916 PolarHBondContact O-N 3.36Å
917	Q	26.9	Very low	29.9	Very low	173 Å²	173	159.6 Å²	159.6	81%	0.808	75%	0.752	S	S	*	*			trans	-63.2	144.7	166.8	-86.1	174.2	-35.6	0	0	110.4	N915 D919	N915-Q917 PolarHBondContact O-N 2.76Å; Q917-D919 PolarHBondContact O-N 3.02Å
918	N	27.6	Very low	30	Very low	151 Å²	151	159.9 Å²	159.9	81%	0.807	75%	0.754	S	S	*	*			trans	-58.8	97.8	179.3	-70	-42.6	0	0	0	112.2
919	D	25.8	Very low	29.9	Very low	155 Å²	155	160 Å²	160	83%	0.829	75%	0.754	S	S	*	*			trans	-99.1	67.7	156.1	-77.8	-20.8	0	0	0	108.9	Q917	Q917-D919 PolarHBondContact O-N 3.02Å
920	F	30.5	Very low	30	Very low	166 Å²	166	155.9 Å²	155.9	73%	0.728	75%	0.751	S	S	*	*			trans	-105.4	102	157.3	-87.6	-78.6	0	0	0	107.7	F880 D922	F880-F920 HydrophobicContact CZ-CZ 4.39Å; F920-D922 PolarHBondContact O-N 3.38Å
921	V	29.8	Very low	30.4	Very low	113 Å²	113	156.9 Å²	156.9	69%	0.685	75%	0.753	S	S	*	*			trans	-40.9	126.5	177.8	177.4	0	0	0	0	111.6	E923	V921-E923 PolarHBondContact O-N 2.98Å
922	D	27.6	Very low	31.2	Very low	117 Å²	117	154.6 Å²	154.6	63%	0.626	75%	0.747	S	S	*	*			trans	-40.9	120.2	168.5	-73.2	-48	0	0	0	112.1	F920 K924 Y925	F920-D922 PolarHBondContact O-N 3.38Å; D922-K924 PolarHBondContact O-N 3.28Å; D922-Y925 HydrophobicContact CB-CD2 4.29Å; D922-Y925 PolarHBondContact O-N 3.04Å; D922-Y925 VanDerWaalsContact O-N 3.13Å
923	E	33.5	Very low	32.1	Very low	178 Å²	178	154.5 Å²	154.5	83%	0.832	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-57.1	-9.2	171.8	-82.4	-172.2	141.5	0	0	113.3	V921 Y925	V921-E923 PolarHBondContact O-N 2.98Å; E923-Y925 VanDerWaalsContact C-N 3.33Å; E923-Y925 PolarHBondContact O-N 3.16Å
924	K	32.9	Very low	33	Very low	199 Å²	199	155 Å²	155	87%	0.865	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-71.3	-16.7	173.6	-93.7	178.1	175.3	173.9	0	115	D922	D922-K924 PolarHBondContact O-N 3.28Å
925	Y	31.5	Very low	34.2	Very low	187 Å²	187	152.8 Å²	152.8	73%	0.733	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-91.3	-3	176	-76.5	-78.8	0	0	0	114.8	D922 E923	D922-Y925 HydrophobicContact CB-CD2 4.29Å; D922-Y925 PolarHBondContact O-N 3.04Å; D922-Y925 VanDerWaalsContact O-N 3.13Å; E923-Y925 VanDerWaalsContact C-N 3.33Å; E923-Y925 PolarHBondContact O-N 3.16Å
926	L	32.9	Very low	35.3	Very low	139 Å²	139	150.4 Å²	150.4	73%	0.728	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	1.8	-172.2	-105.7	148.3	0	0	0	115.6
927	Y	33.6	Very low	36.3	Very low	215 Å²	215	147.4 Å²	147.4	84%	0.843	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	-1.4	179.8	-115	-87.8	0	0	0	115.8
928	N	32.9	Very low	37.3	Very low	154 Å²	154	143.2 Å²	143.2	82%	0.824	70%	0.704	S	S	*	*	S	Bend	trans	-110.3	9	-173.1	-101.2	-1.5	0	0	0	117
929	N	33.2	Very low	38.7	Very low	155 Å²	155	138.5 Å²	138.5	83%	0.829	68%	0.676	S	S	*	*			trans	-110.4	85.8	173.5	-88.6	-23.7	0	0	0	112	H931	N929-H931 PolarHBondContact O-N 3.16Å
930	N	34.4	Very low	39.9	Very low	170 Å²	170	132.2 Å²	132.2	91%	0.909	64%	0.642	S	S	*	*			trans	-83.2	31.9	174.3	-112.6	-10	0	0	0	113.4
931	H	38.1	Very low	41.1	Very low	165 Å²	165	127.2 Å²	127.2	76%	0.764	63%	0.628	S	S	*	*			trans	-115.4	119.5	176.3	-90.5	-60.5	0	0	0	112.8	N929	N929-H931 PolarHBondContact O-N 3.16Å
932	N	44.2	Very low	42.4	Very low	85 Å²	85	130 Å²	130	46%	0.455	63%	0.626	S	S	.	*			trans	88.7	84.6	159.6	-60.9	-12.4	0	0	0	119.2	N934 N935	N932-N934 PolarHBondContact O-N 2.98Å; N932-N935 HydrophobicContact CB-CB 4.04Å; N932-N935 PolarHBondContact O-N 2.94Å
933	N	47.7	Very low	43.8	Very low	124 Å²	124	125.3 Å²	125.3	66%	0.663	60%	0.603	S	S	*	*	H	α-helix	trans	-53.5	-29.2	153.9	-84.6	-20.6	0	0	0	112.8	N935 K936 Q937	N933-N935 PolarHBondContact O-N 3.09Å; N933-K936 PolarHBondContact O-N 3.1Å; N933-Q937 PolarHBondContact O-N 3.06Å
934	N	47.1	Very low	44.7	Very low	114 Å²	114	120.7 Å²	120.7	61%	0.61	58%	0.578	S	S	*	*	H	α-helix	trans	-64.9	-37.9	177.8	-68.5	-6.6	0	0	0	112.6	N932 K936 Q937 L938	N932-N934 PolarHBondContact O-N 2.98Å; N934-K936 PolarHBondContact O-N 3.27Å; N934-Q937 PolarHBondContact O-N 3.23Å; N934-L938 VanDerWaalsContact O-CB 3.32Å; N934-L938 WeakPolarHBondContact O-CB 3.47Å; N934-L938 PolarHBondContact O-N 3.08Å
935	N	53.1	Low	45.5	Very low	100 Å²	100	119.4 Å²	119.4	54%	0.535	57%	0.572	S	S	.	*	H	α-helix	trans	-69.2	-35.7	179.7	-74.7	-8.2	0	0	0	111.8	N932 N933 L938 F939	N932-N935 HydrophobicContact CB-CB 4.04Å; N932-N935 PolarHBondContact O-N 2.94Å; N933-N935 PolarHBondContact O-N 3.09Å; N935-L938 PolarHBondContact O-N 3.41Å; N935-F939 WeakPolarHBondContact O-CB 3.49Å; N935-F939 PolarHBondContact O-N 2.89Å
936	K	48.7	Very low	46.3	Very low	99 Å²	99	116 Å²	116	43%	0.43	57%	0.567	S	S	.	*	H	α-helix	trans	-63.5	-48.1	174.7	-72.7	-179.1	179.7	173.3	0	111.3	Y868 N933 N934 L938 F939 I940	Y868-K936 HydrophobicContact CD2-CG 4.43Å; N933-K936 PolarHBondContact O-N 3.1Å; N934-K936 PolarHBondContact O-N 3.27Å; K936-L938 VanDerWaalsContact C-N 3.34Å; K936-L938 PolarHBondContact O-N 2.97Å; K936-F939 PolarHBondContact O-N 3.36Å; K936-I940 WeakPolarHBondContact O-CB 3.03Å; K936-I940 WeakPolarHBondContact O-CD1 3.14Å; K936-I940 WeakPolarHBondContact O-CG1 3.32Å; K936-I940 PolarHBondContact O-N 2.97Å
937	Q	49.7	Very low	47.1	Very low	136 Å²	136	112.3 Å²	112.3	64%	0.636	55%	0.55	S	S	*	.	H	α-helix	trans	-63.7	-39.4	177.3	-73.2	-175	-7	0	0	112.1	N933 N934 I940 S941	N933-Q937 PolarHBondContact O-N 3.06Å; N934-Q937 PolarHBondContact O-N 3.23Å; Q937-I940 PolarHBondContact O-N 3.3Å; Q937-S941 WeakPolarHBondContact O-CB 3.38Å; Q937-S941 PolarHBondContact O-N 3.27Å; Q937-S941 PolarHBondContact O-OG 3.06Å
938	L	49	Very low	47.5	Very low	85 Å²	85	110.3 Å²	110.3	45%	0.445	55%	0.548	S	S	.	.	H	α-helix	trans	-68.8	-40	-180	-148	138.7	0	0	0	111.7	N934 N935 K936 S941 R942	N934-L938 VanDerWaalsContact O-CB 3.32Å; N934-L938 WeakPolarHBondContact O-CB 3.47Å; N934-L938 PolarHBondContact O-N 3.08Å; N935-L938 PolarHBondContact O-N 3.41Å; K936-L938 VanDerWaalsContact C-N 3.34Å; K936-L938 PolarHBondContact O-N 2.97Å; L938-S941 WeakPolarHBondContact CA-OG 3.34Å; L938-S941 PolarHBondContact O-N 3.21Å; L938-S941 PolarHBondContact O-OG 3.27Å; L938-R942 HydrophobicContact CD2-CG 4.43Å; L938-R942 WeakPolarHBondContact O-CG 3.42Å; L938-R942 PolarHBondContact O-N 3.17Å
939	F	55.7	Low	47.8	Very low	52 Å²	52	110 Å²	110	23%	0.228	55%	0.546	C	S	.	.	H	α-helix	trans	-62.2	-45	172	179.2	-97.3	0	0	0	112.4	Y868 F871 E875 N935 K936 S941 R942 S943	Y868-F939 AromaticContact CD2-CD1 3.77Å; Y868-F939 HydrophobicContact CD2-CD1 3.77Å; Y868-F939 HydrophobicContact CD2-CE1 4.19Å; Y868-F939 AromaticContact CE2-CD1 3.92Å; Y868-F939 HydrophobicContact CE2-CD1 3.92Å; Y868-F939 HydrophobicContact CE2-CE1 4.26Å; Y868-F939 HydrophobicContact CE2-CG 4.39Å; F871-F939 HydrophobicContact CB-CE1 3.82Å; F871-F939 HydrophobicContact CB-CZ 4.48Å; E875-F939 WeakPolarHBondContact OE2-CE2 3.38Å; E875-F939 WeakPolarHBondContact OE2-CZ 3.49Å; N935-F939 WeakPolarHBondContact O-CB 3.49Å; N935-F939 PolarHBondContact O-N 2.89Å; K936-F939 PolarHBondContact O-N 3.36Å; F939-S941 PolarHBondContact O-N 3.08Å; F939-R942 PolarHBondContact O-N 2.79Å; F939-S943 VanDerWaalsContact O-CB 3.3Å; F939-S943 WeakPolarHBondContact O-CB 3.49Å; F939-S943 PolarHBondContact O-N 3.24Å; F939-S943 PolarHBondContact O-OG 3.15Å
940	I	52.8	Low	47.9	Very low	24 Å²	24	113.9 Å²	113.9	12%	0.123	55%	0.55	C	S	.	.	H	α-helix	trans	-59.2	-48.9	175.8	-70.5	166.4	0	0	0	109.6	A867 K936 Q937 R942 S943 Y944	A867-I940 HydrophobicContact CB-CD1 4.36Å; K936-I940 WeakPolarHBondContact O-CB 3.03Å; K936-I940 WeakPolarHBondContact O-CD1 3.14Å; K936-I940 WeakPolarHBondContact O-CG1 3.32Å; K936-I940 PolarHBondContact O-N 2.97Å; Q937-I940 PolarHBondContact O-N 3.3Å; I940-R942 PolarHBondContact O-N 3.21Å; I940-S943 PolarHBondContact O-N 2.84Å; I940-Y944 HydrophobicContact CG2-CD2 3.51Å; I940-Y944 HydrophobicContact CG2-CE2 3.35Å; I940-Y944 WeakPolarHBondContact O-CD2 3.43Å; I940-Y944 PolarHBondContact O-N 3.33Å
941	S	55.4	Low	48	Very low	61 Å²	61	109 Å²	109	43%	0.427	53%	0.527	S	S	.	.	H	α-helix	trans	-63.4	-39.6	-179.7	73.7	0	0	0	0	113.8	Q937 L938 F939 K945	Q937-S941 WeakPolarHBondContact O-CB 3.38Å; Q937-S941 PolarHBondContact O-N 3.27Å; Q937-S941 PolarHBondContact O-OG 3.06Å; L938-S941 WeakPolarHBondContact CA-OG 3.34Å; L938-S941 PolarHBondContact O-N 3.21Å; L938-S941 PolarHBondContact O-OG 3.27Å; F939-S941 PolarHBondContact O-N 3.08Å; S941-K945 PolarHBondContact O-N 2.98Å
942	R	56.2	Low	47.7	Very low	171 Å²	171	112.8 Å²	112.8	65%	0.645	54%	0.535	S	S	*	.	H	α-helix	trans	-67.1	-40.6	174.8	-77.1	-177.6	177	176.2	1	111.5	L938 F939 I940 K945 N946	L938-R942 HydrophobicContact CD2-CG 4.43Å; L938-R942 WeakPolarHBondContact O-CG 3.42Å; L938-R942 PolarHBondContact O-N 3.17Å; F939-R942 PolarHBondContact O-N 2.79Å; I940-R942 PolarHBondContact O-N 3.21Å; R942-K945 PolarHBondContact O-N 3.24Å; R942-N946 PolarHBondContact O-N 2.9Å
943	S	56.6	Low	47.5	Very low	19 Å²	19	112.4 Å²	112.4	13%	0.133	53%	0.528	C	S	.	.	H	α-helix	trans	-66.9	-38.6	178.1	-64.1	0	0	0	0	111.9	F939 I940 K945 N946 V947	F939-S943 VanDerWaalsContact O-CB 3.3Å; F939-S943 WeakPolarHBondContact O-CB 3.49Å; F939-S943 PolarHBondContact O-N 3.24Å; F939-S943 PolarHBondContact O-OG 3.15Å; I940-S943 PolarHBondContact O-N 2.84Å; S943-K945 VanDerWaalsContact C-N 3.32Å; S943-K945 PolarHBondContact O-N 2.72Å; S943-N946 PolarHBondContact O-N 2.98Å; S943-V947 WeakPolarHBondContact O-CG2 3.38Å
944	Y	53.7	Low	46.7	Very low	80 Å²	80	117.7 Å²	117.7	31%	0.314	54%	0.538	S	S	.	.	H	α-helix	trans	-58.9	-40.3	173.8	-91.2	-71.4	0	0	0	112.5	F871 I940 N946 L983	F871-Y944 HydrophobicContact CE2-CD2 4.31Å; F871-Y944 AromaticContact CE2-CE2 3.99Å; F871-Y944 HydrophobicContact CE2-CE2 3.99Å; F871-Y944 HydrophobicContact CZ-CD1 4.36Å; F871-Y944 HydrophobicContact CZ-CD2 4.32Å; F871-Y944 HydrophobicContact CZ-CE1 4.26Å; F871-Y944 HydrophobicContact CZ-CE2 4.21Å; F871-Y944 HydrophobicContact CZ-CG 4.38Å; I940-Y944 HydrophobicContact CG2-CD2 3.51Å; I940-Y944 HydrophobicContact CG2-CE2 3.35Å; I940-Y944 WeakPolarHBondContact O-CD2 3.43Å; I940-Y944 PolarHBondContact O-N 3.33Å; Y944-N946 VanDerWaalsContact C-N 3.34Å; Y944-N946 PolarHBondContact O-N 3.2Å; Y944-L983 WeakPolarHBondContact OH-CD2 3.21Å
945	K	49.3	Very low	46.4	Very low	172 Å²	172	117.8 Å²	117.8	75%	0.748	54%	0.535	S	S	*	.	H	α-helix	trans	-67.8	-28.5	178.7	-76.4	-175.4	176	-177.4	0	113.9	S941 R942 S943	S941-K945 PolarHBondContact O-N 2.98Å; R942-K945 PolarHBondContact O-N 3.24Å; S943-K945 VanDerWaalsContact C-N 3.32Å; S943-K945 PolarHBondContact O-N 2.72Å
946	N	47.6	Very low	45.5	Very low	117 Å²	117	115.6 Å²	115.6	63%	0.626	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	1.2	-176.8	-73.5	-11.5	0	0	0	114.5	R942 S943 Y944	R942-N946 PolarHBondContact O-N 2.9Å; S943-N946 PolarHBondContact O-N 2.98Å; Y944-N946 VanDerWaalsContact C-N 3.34Å; Y944-N946 PolarHBondContact O-N 3.2Å
947	V	50.2	Low	45.1	Very low	60 Å²	60	119.1 Å²	119.1	36%	0.364	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-7.5	-176.9	173.2	0	0	0	0	112.8	F871 S943 D949 T986	F871-V947 HydrophobicContact CE1-CG2 4.23Å; S943-V947 WeakPolarHBondContact O-CG2 3.38Å; V947-D949 PolarHBondContact O-N 2.85Å; V947-T986 HydrophobicContact CG1-CG2 3.92Å; V947-T986 HydrophobicContact CG2-CG2 4.2Å
948	E	41.6	Very low	44.8	Very low	174 Å²	174	119.2 Å²	119.2	81%	0.813	54%	0.537	S	S	*	.			trans	-71.5	-10	179.7	-70.2	-169.9	158.3	0	0	115	R950	E948-R950 PolarHBondContact O-N 3.02Å
949	D	39.3	Very low	44.4	Very low	146 Å²	146	117.9 Å²	117.9	78%	0.781	53%	0.533	S	S	*	.	S	Bend	trans	-70.8	100.7	172.5	-88.8	-20	0	0	0	111.1	V947 P951	V947-D949 PolarHBondContact O-N 2.85Å; D949-P951 WeakPolarHBondContact O-CD 3.46Å; D949-P951 VanDerWaalsContact O-N 3.1Å
950	R	35.2	Very low	43.7	Very low	238 Å²	238	116.3 Å²	116.3	90%	0.898	53%	0.532	S	S	*	.			trans	-58.4	108	177.6	-61.5	-174.6	-171.7	-170.4	3.1	111	E948 R952	E948-R950 PolarHBondContact O-N 3.02Å; R950-R952 PolarHBondContact O-N 3.26Å
951	P	36	Very low	42.8	Very low	67 Å²	67	118.5 Å²	118.5	44%	0.435	55%	0.549	S	S	.	.			trans	-70.9	116.7	170.1	29.8	-32.1	0	0	0	108.8	D949 Y953	D949-P951 WeakPolarHBondContact O-CD 3.46Å; D949-P951 VanDerWaalsContact O-N 3.1Å; P951-Y953 VanDerWaalsContact C-N 3.26Å; P951-Y953 HydrophobicContact CB-CD2 4.02Å; P951-Y953 HydrophobicContact CB-CE2 3.82Å; P951-Y953 HydrophobicContact CG-CD2 3.77Å; P951-Y953 HydrophobicContact CG-CE2 3.33Å; P951-Y953 PolarHBondContact O-N 3.13Å
952	R	31.8	Very low	41.9	Very low	245 Å²	245	117.1 Å²	117.1	93%	0.925	54%	0.54	S	S	*	.			trans	-66.9	90.7	162.1	-82	-172.5	-108.1	177.4	-4.7	107.9	R950 R954	R950-R952 PolarHBondContact O-N 3.26Å; R952-R954 VanDerWaalsContact C-N 3.26Å; R952-R954 PolarHBondContact O-N 3.13Å
953	Y	40.2	Very low	41.4	Very low	77 Å²	77	111.7 Å²	111.7	30%	0.302	54%	0.538	S	S	.	.			trans	-66.9	85.5	171.3	-81.5	-82.9	0	0	0	109.7	P951 H955 N989 L992 H993	P951-Y953 VanDerWaalsContact C-N 3.26Å; P951-Y953 HydrophobicContact CB-CD2 4.02Å; P951-Y953 HydrophobicContact CB-CE2 3.82Å; P951-Y953 HydrophobicContact CG-CD2 3.77Å; P951-Y953 HydrophobicContact CG-CE2 3.33Å; P951-Y953 PolarHBondContact O-N 3.13Å; Y953-H955 PolarHBondContact O-N 2.81Å; Y953-N989 PolarHBondContact OH-OD1 3.42Å; Y953-L992 HydrophobicContact CD2-CD1 4.43Å; Y953-L992 HydrophobicContact CE1-CB 4.31Å; Y953-L992 HydrophobicContact CE1-CD1 4.31Å; Y953-L992 HydrophobicContact CE2-CD1 3.97Å; Y953-H993 AromaticContact CE1-NE2 3.64Å; Y953-H993 AromaticContact CZ-NE2 3.77Å; Y953-H993 PolarHBondContact OH-CE1 3.29Å; Y953-H993 PolarHBondContact OH-NE2 3.14Å
954	R	32.4	Very low	41.3	Very low	234 Å²	234	115.6 Å²	115.6	88%	0.883	55%	0.553	S	S	*	*			trans	-65.4	117	150.9	-85.9	-177.9	172.1	170.6	-1.6	105	R952 S956	R952-R954 VanDerWaalsContact C-N 3.26Å; R952-R954 PolarHBondContact O-N 3.13Å; R954-S956 VanDerWaalsContact C-N 3.35Å; R954-S956 PolarHBondContact O-N 2.92Å
955	H	39.2	Very low	42	Very low	116 Å²	116	113.5 Å²	113.5	54%	0.537	55%	0.55	S	S	.	.			trans	-38.6	106.6	170.5	-86	-70	0	0	0	108	Y953 K957 H1163	Y953-H955 PolarHBondContact O-N 2.81Å; H955-K957 PolarHBondContact O-N 3.44Å; H955-K957 VanDerWaalsContact O-N 3.1Å; H955-H1163 AromaticContact CD2-NE2 3.71Å; H955-H1163 AromaticContact CE1-CE1 3.79Å; H955-H1163 AromaticContact CE1-NE2 3.52Å; H955-H1163 AromaticContact NE2-CE1 3.28Å; H955-H1163 PolarHBondContact NE2-CE1 2.86Å; H955-H1163 VanDerWaalsContact NE2-CE1 3.28Å; H955-H1163 AromaticContact NE2-NE2 3.13Å; H955-H1163 PolarHBondContact NE2-NE2 3.49Å; H955-H1163 VanDerWaalsContact NE2-NE2 3.13Å
956	S	34.5	Very low	43.4	Very low	54 Å²	54	106.5 Å²	106.5	38%	0.378	52%	0.52	S	S	.	.			trans	-52.4	127.9	167.4	163.6	0	0	0	0	104.5	R954 R958 S961	R954-S956 VanDerWaalsContact C-N 3.35Å; R954-S956 PolarHBondContact O-N 2.92Å; S956-R958 WeakPolarHBondContact CB-O 3.43Å; S956-R958 CarbonylContact O-C 3.52Å; S956-R958 PolarHBondContact O-N 2.87Å; S956-R958 PolarHBondContact OG-N 3.23Å; S956-R958 PolarHBondContact OG-O 3.18Å; S956-S961 WeakPolarHBondContact OG-CB 3.08Å; S956-S961 PolarHBondContact OG-OG 2.86Å; S956-S961 VanDerWaalsContact OG-OG 3.07Å
957	K	40.2	Very low	45.3	Very low	173 Å²	173	100.9 Å²	100.9	75%	0.752	49%	0.49	S	S	*	.	S	Bend	trans	-59.7	8.6	177.6	-75.1	-176	177.8	-178.3	0	112.2	H955 R1159	H955-K957 PolarHBondContact O-N 3.44Å; H955-K957 VanDerWaalsContact O-N 3.1Å; K957-R1159 PolarHBondContact O-NH1 2.89Å; K957-R1159 PolarHBondContact O-NH2 3.01Å
958	R	43.3	Very low	47.2	Very low	138 Å²	138	98 Å²	98	52%	0.521	47%	0.473	S	S	.	.	S	Bend	trans	-147.8	118.1	165.7	-46.7	174.4	174.5	-165.7	-19.2	106.9	S956 G960 S961	S956-R958 WeakPolarHBondContact CB-O 3.43Å; S956-R958 CarbonylContact O-C 3.52Å; S956-R958 PolarHBondContact O-N 2.87Å; S956-R958 PolarHBondContact OG-N 3.23Å; S956-R958 PolarHBondContact OG-O 3.18Å; R958-G960 PolarHBondContact O-N 2.72Å; R958-S961 WeakPolarHBondContact O-CB 3.37Å; R958-S961 PolarHBondContact O-N 3.48Å
959	P	40.5	Very low	49.6	Very low	57 Å²	57	89.8 Å²	89.8	37%	0.37	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	126.2	151.7	22.4	-27.5	0	0	0	106.6	Q826	Q826-P959 HydrophobicContact CG-CB 4.25Å; Q826-P959 VanDerWaalsContact NE2-CB 3.35Å
960	G	41.4	Very low	52.2	Low	20 Å²	20	82.8 Å²	82.8	21%	0.206	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	21.8	-167.9	0	0	0	0	0	116.9	R958 S962	R958-G960 PolarHBondContact O-N 2.72Å; G960-S962 CarbonylContact O-C 3.25Å; G960-S962 PolarHBondContact O-N 2.92Å
961	S	34.6	Very low	54.8	Low	69 Å²	69	71.6 Å²	71.6	48%	0.483	36%	0.355	S	S	.	.			trans	-75.3	4.3	175.9	122.5	0	0	0	0	116.1	S956 R958 G963	S956-S961 WeakPolarHBondContact OG-CB 3.08Å; S956-S961 PolarHBondContact OG-OG 2.86Å; S956-S961 VanDerWaalsContact OG-OG 3.07Å; R958-S961 WeakPolarHBondContact O-CB 3.37Å; R958-S961 PolarHBondContact O-N 3.48Å; S961-G963 PolarHBondContact O-N 2.64Å
962	S	35.5	Very low	57.1	Low	32 Å²	32	68.6 Å²	68.6	22%	0.224	34%	0.336	C	S	.	.	S	Bend	trans	-73	99.4	147.9	20	0	0	0	0	104.8	G960 E964	G960-S962 CarbonylContact O-C 3.25Å; G960-S962 PolarHBondContact O-N 2.92Å; S962-E964 CarbonylContact O-C 3.6Å; S962-E964 PolarHBondContact O-N 2.95Å
963	G	46.6	Very low	59.7	Low	58 Å²	58	64.4 Å²	64.4	60%	0.598	32%	0.324	S	S	*	.	S	Bend	trans	-59.5	23.2	-163.2	0	0	0	0	0	119.5	S961	S961-G963 PolarHBondContact O-N 2.64Å
964	E	55	Low	62	Low	100 Å²	100	60.8 Å²	60.8	47%	0.467	31%	0.31	S	S	.	.	S	Bend	trans	-121	132.7	157.7	-72.3	121.6	-114.1	0	0	108.7	K884 S962 M966	K884-E964 IonicContact NZ-OE1 3.08Å; K884-E964 PolarHBondContact NZ-OE1 2.81Å; S962-E964 CarbonylContact O-C 3.6Å; S962-E964 PolarHBondContact O-N 2.95Å; E964-M966 PolarHBondContact O-N 3.07Å
965	P	67.9	Low	64.8	Low	37 Å²	37	49.7 Å²	49.7	24%	0.24	27%	0.268	C	S	.	.			trans	-68.3	129.1	177.8	29.6	-32.9	0	0	0	110	M852 N853 T995	M852-P965 VanDerWaalsContact CA-O 3.29Å; M852-P965 WeakPolarHBondContact CA-O 3.15Å; M852-P965 HydrophobicContact CB-CB 4.47Å; M852-P965 HydrophobicContact CB-CG 4.41Å; M852-P965 HydrophobicContact CE-CB 3.85Å; M852-P965 HydrophobicContact CG-CB 3.7Å; M852-P965 HydrophobicContact CG-CG 3.78Å; M852-P965 HydrophobicContact SD-CB 4.01Å; N853-P965 PolarHBondContact N-O 2.72Å; N853-P965 VanDerWaalsContact N-O 3.11Å; P965-T995 HydrophobicContact CB-CG2 4.29Å
966	M	78.7	Confident	67.1	Low	24 Å²	24	53.3 Å²	53.3	12%	0.118	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	133.8	177.9	-65.4	178.8	-57.6	0	0	109.1	N853 L877 E964 L994 T995	N853-M966 HydrophobicContact CB-CG 4.4Å; N853-M966 WeakPolarHBondContact O-CA 3.12Å; L877-M966 HydrophobicContact CD1-CE 4.5Å; L877-M966 HydrophobicContact CD2-CE 3.34Å; L877-M966 HydrophobicContact CD2-SD 3.36Å; L877-M966 WeakPolarHBondContact CD2-SD 3.34Å; E964-M966 PolarHBondContact O-N 3.07Å; M966-L994 HydrophobicContact CB-CD2 3.83Å; M966-T995 PolarHBondContact N-OG1 3.32Å; M966-T995 PolarHBondContact O-N 3.45Å; M966-T995 PolarHBondContact O-OG1 3.23Å
967	A	86.6	Confident	69.7	Low	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	153	177.7	0	0	0	0	0	111.2	F848 M852 N853 L854 V855 T996	F848-A967 HydrophobicContact CD1-CB 3.68Å; F848-A967 HydrophobicContact CE1-CB 3.38Å; F848-A967 HydrophobicContact CZ-CB 4.1Å; M852-A967 HydrophobicContact SD-CB 4.24Å; N853-A967 PolarHBondContact O-N 2.91Å; L854-A967 HydrophobicContact CD2-CB 3.79Å; V855-A967 PolarHBondContact N-O 3.3Å; A967-T996 VanDerWaalsContact CA-O 3.3Å; A967-T996 WeakPolarHBondContact CA-O 3.48Å; A967-T996 WeakPolarHBondContact CB-OG1 3.43Å
968	L	91.2	Very high	71.9	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	136.5	176.8	169.8	70.6	0	0	0	110.7	V855 L857 F987 L990 L994 T996 V997 L998	V855-L968 HydrophobicContact CB-CD1 4.27Å; V855-L968 HydrophobicContact CG1-CD1 4Å; V855-L968 CarbonylContact O-C 3.53Å; V855-L968 WeakPolarHBondContact O-CA 3.33Å; L857-L968 HydrophobicContact CB-CD1 4.12Å; L857-L968 HydrophobicContact CD1-CD1 3.68Å; L857-L968 HydrophobicContact CG-CD1 3.73Å; L968-F987 HydrophobicContact CD2-CE2 3.93Å; L968-F987 HydrophobicContact CD2-CZ 4.32Å; L968-L990 HydrophobicContact CD2-CD2 4.5Å; L968-L994 HydrophobicContact CB-CD1 3.39Å; L968-L994 HydrophobicContact CB-CD2 4.39Å; L968-L994 HydrophobicContact CB-CG 4.42Å; L968-L994 HydrophobicContact CD2-CD1 3.81Å; L968-L994 HydrophobicContact CG-CD1 4.15Å; L968-T996 PolarHBondContact N-O 3.31Å; L968-T996 VanDerWaalsContact N-O 3.16Å; L968-V997 HydrophobicContact CB-CG1 4.29Å; L968-V997 HydrophobicContact CB-CG2 4.33Å; L968-V997 HydrophobicContact CD2-CG1 4.07Å; L968-V997 HydrophobicContact CG-CG1 4.29Å; L968-V997 CarbonylContact O-C 3.48Å; L968-V997 WeakPolarHBondContact O-CA 3.3Å; L968-L998 PolarHBondContact O-N 3.21Å
969	V	92.5	Very high	73.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	122.3	170.6	-173.7	0	0	0	0	108.3	E835 I839 F848 V855 L857 T858 L998	E835-V969 HydrophobicContact CG-CG1 3.84Å; I839-V969 HydrophobicContact CD1-CG1 4.41Å; I839-V969 HydrophobicContact CD1-CG2 4.38Å; I839-V969 HydrophobicContact CG1-CG2 4.32Å; F848-V969 HydrophobicContact CE2-CG2 4.43Å; F848-V969 HydrophobicContact CZ-CG2 4.28Å; V855-V969 PolarHBondContact O-N 3.35Å; L857-V969 PolarHBondContact N-O 3.35Å; T858-V969 HydrophobicContact CG2-CG1 4.05Å; V969-L998 CarbonylContact C-O 3.54Å; V969-L998 VanDerWaalsContact CA-O 3.31Å; V969-L998 WeakPolarHBondContact CA-O 3.44Å; V969-L998 HydrophobicContact CG1-CD2 4.33Å; V969-L998 HydrophobicContact CG2-CB 4.46Å; V969-L998 HydrophobicContact CG2-CD2 4.33Å
970	I	92.7	Very high	76.1	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	139.7	-179.9	-172	166.1	0	0	0	110.5	L857 F866 L975 A978 F987 L998 C999 C1000	L857-I970 HydrophobicContact CB-CB 4.42Å; L857-I970 HydrophobicContact CB-CD1 4.5Å; L857-I970 HydrophobicContact CB-CG1 4.26Å; F866-I970 HydrophobicContact CE2-CD1 4.19Å; F866-I970 HydrophobicContact CZ-CD1 4.46Å; I970-L975 HydrophobicContact CD1-CB 4.22Å; I970-L975 HydrophobicContact CD1-CD1 4.13Å; I970-L975 HydrophobicContact CG1-CB 4.34Å; I970-A978 HydrophobicContact CD1-CB 4.2Å; I970-F987 HydrophobicContact CD1-CE2 3.75Å; I970-F987 HydrophobicContact CD1-CZ 3.98Å; I970-L998 PolarHBondContact N-O 3.18Å; I970-C999 HydrophobicContact CG2-CB 4.05Å; I970-C999 WeakPolarHBondContact CG2-SG 3.49Å; I970-C999 CarbonylContact O-C 3.53Å; I970-C999 VanDerWaalsContact O-CA 3.27Å; I970-C999 WeakPolarHBondContact O-CA 3.31Å; I970-C1000 PolarHBondContact O-N 2.52Å
971	D	89.4	Confident	78.1	Confident	3 Å²	3	45.3 Å²	45.3	2%	0.016	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	157	177.2	69.5	-13.3	0	0	0	112	T858 N859 K973 S974 L975 C1000	T858-D971 HydrophobicContact CG2-CB 4.13Å; N859-D971 PolarHBondContact N-OD2 3.36Å; D971-K973 PolarHBondContact O-N 3.34Å; D971-K973 VanDerWaalsContact O-N 3.12Å; D971-S974 PolarHBondContact O-N 3.12Å; D971-S974 VanDerWaalsContact O-N 3.13Å; D971-S974 WeakPolarHBondContact OD1-CB 3.38Å; D971-S974 PolarHBondContact OD1-N 3.41Å; D971-S974 PolarHBondContact OD1-OG 3.2Å; D971-L975 WeakPolarHBondContact O-CB 3.42Å; D971-L975 PolarHBondContact O-N 2.92Å; D971-C1000 CarbonylContact C-O 3.55Å; D971-C1000 WeakPolarHBondContact CA-O 3.46Å
972	G	84.3	Confident	80.4	Confident	3 Å²	3	45.6 Å²	45.6	3%	0.031	24%	0.241	C	C	.	.	H	α-helix	trans	-58.1	-26.6	-178.7	0	0	0	0	0	114.6	C1000 Q1006	G972-C1000 PolarHBondContact N-O 3.4Å; G972-Q1006 PolarHBondContact O-NE2 2.95Å
973	K	86.3	Confident	82.8	Confident	158 Å²	158	44.1 Å²	44.1	69%	0.687	23%	0.23	S	C	*	.	H	α-helix	trans	-70.7	-50	174	-68.4	-175.9	-179.3	-179.1	0	111.6	D971 L975 R976	D971-K973 PolarHBondContact O-N 3.34Å; D971-K973 VanDerWaalsContact O-N 3.12Å; K973-L975 VanDerWaalsContact C-N 3.33Å; K973-L975 PolarHBondContact O-N 3.15Å; K973-R976 WeakPolarHBondContact O-CB 3.33Å; K973-R976 PolarHBondContact O-N 2.93Å
974	S	89.8	Confident	84.7	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-70.1	-31.6	179	-51.9	0	0	0	0	112	L857 C860 D971 R976 Y977 A978	L857-S974 VanDerWaalsContact O-CB 3.24Å; L857-S974 WeakPolarHBondContact O-CB 3.33Å; L857-S974 PolarHBondContact O-OG 3.38Å; C860-S974 WeakPolarHBondContact CB-OG 3.31Å; C860-S974 PolarHBondContact N-OG 3.39Å; D971-S974 PolarHBondContact O-N 3.12Å; D971-S974 VanDerWaalsContact O-N 3.13Å; D971-S974 WeakPolarHBondContact OD1-CB 3.38Å; D971-S974 PolarHBondContact OD1-N 3.41Å; D971-S974 PolarHBondContact OD1-OG 3.2Å; S974-R976 PolarHBondContact O-N 3.15Å; S974-Y977 WeakPolarHBondContact O-CB 3.46Å; S974-Y977 PolarHBondContact O-N 2.88Å; S974-A978 PolarHBondContact O-N 3.34Å
975	L	90	Very high	86.1	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-58.3	-35.2	175.4	-178.4	68.6	0	0	0	112.2	I970 D971 K973 Y977 A978 L979 F987 L1002 V1010	I970-L975 HydrophobicContact CD1-CB 4.22Å; I970-L975 HydrophobicContact CD1-CD1 4.13Å; I970-L975 HydrophobicContact CG1-CB 4.34Å; D971-L975 WeakPolarHBondContact O-CB 3.42Å; D971-L975 PolarHBondContact O-N 2.92Å; K973-L975 VanDerWaalsContact C-N 3.33Å; K973-L975 PolarHBondContact O-N 3.15Å; L975-Y977 PolarHBondContact O-N 3.41Å; L975-A978 HydrophobicContact CD1-CB 4.33Å; L975-A978 WeakPolarHBondContact O-CB 3.22Å; L975-A978 PolarHBondContact O-N 3.37Å; L975-L979 HydrophobicContact CD1-CG 4.49Å; L975-L979 HydrophobicContact CG-CD1 4.24Å; L975-L979 HydrophobicContact CG-CG 4.35Å; L975-L979 WeakPolarHBondContact O-CG 3.35Å; L975-L979 PolarHBondContact O-N 2.82Å; L975-F987 HydrophobicContact CD1-CZ 4.48Å; L975-L1002 HydrophobicContact CD2-CD2 3.5Å; L975-V1010 HydrophobicContact CD1-CG2 4.16Å; L975-V1010 HydrophobicContact CD2-CG2 3.43Å; L975-V1010 VanDerWaalsContact CD2-CG2 3.43Å; L975-V1010 HydrophobicContact CG-CG2 4.4Å
976	R	87.6	Confident	86.9	Confident	192 Å²	192	43.6 Å²	43.6	73%	0.725	21%	0.205	S	C	*	.	H	α-helix	trans	-57.1	-38.5	175.9	-173.2	179.3	176.9	179	-0.5	111.9	K973 S974	K973-R976 WeakPolarHBondContact O-CB 3.33Å; K973-R976 PolarHBondContact O-N 2.93Å; S974-R976 PolarHBondContact O-N 3.15Å
977	Y	89.4	Confident	87.4	Confident	66 Å²	66	42.6 Å²	42.6	26%	0.259	20%	0.2	S	C	.	.	H	α-helix	trans	-74.4	-32.9	175.6	-55.4	-53.8	0	0	0	112.4	C860 K861 F863 F866 S974 L975 L979 D980	C860-Y977 WeakPolarHBondContact O-CE2 3.43Å; K861-Y977 PolarHBondContact O-OH 3.01Å; F863-Y977 HydrophobicContact CB-CD1 4.07Å; F863-Y977 HydrophobicContact CB-CE1 4.39Å; F863-Y977 HydrophobicContact CD2-CD1 4.19Å; F866-Y977 HydrophobicContact CB-CD2 4.33Å; S974-Y977 WeakPolarHBondContact O-CB 3.46Å; S974-Y977 PolarHBondContact O-N 2.88Å; L975-Y977 PolarHBondContact O-N 3.41Å; Y977-L979 VanDerWaalsContact C-N 3.27Å; Y977-L979 PolarHBondContact O-N 3.25Å; Y977-D980 WeakPolarHBondContact O-CB 3.49Å; Y977-D980 PolarHBondContact O-N 3.1Å
978	A	87.4	Confident	87.3	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.7	-29.6	175.4	0	0	0	0	0	113.3	F866 I970 S974 L975 D980 R984 F987	F866-A978 HydrophobicContact CE1-CB 3.85Å; F866-A978 HydrophobicContact CE2-CB 4.37Å; F866-A978 HydrophobicContact CZ-CB 3.48Å; F866-A978 VanDerWaalsContact CZ-CB 3.48Å; I970-A978 HydrophobicContact CD1-CB 4.2Å; S974-A978 PolarHBondContact O-N 3.34Å; L975-A978 HydrophobicContact CD1-CB 4.33Å; L975-A978 WeakPolarHBondContact O-CB 3.22Å; L975-A978 PolarHBondContact O-N 3.37Å; A978-D980 VanDerWaalsContact C-N 3.32Å; A978-R984 WeakPolarHBondContact O-CA 3.26Å; A978-F987 HydrophobicContact CB-CB 4.46Å; A978-F987 HydrophobicContact CB-CD1 4.07Å; A978-F987 HydrophobicContact CB-CD2 3.94Å; A978-F987 HydrophobicContact CB-CE1 4.28Å; A978-F987 HydrophobicContact CB-CE2 4.16Å; A978-F987 HydrophobicContact CB-CG 3.89Å; A978-F987 HydrophobicContact CB-CZ 4.32Å
979	L	85.4	Confident	86.8	Confident	50 Å²	50	44 Å²	44	26%	0.262	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-13	179.2	-70	173.2	0	0	0	113.7	L975 Y977 L1013	L975-L979 HydrophobicContact CD1-CG 4.49Å; L975-L979 HydrophobicContact CG-CD1 4.24Å; L975-L979 HydrophobicContact CG-CG 4.35Å; L975-L979 WeakPolarHBondContact O-CG 3.35Å; L975-L979 PolarHBondContact O-N 2.82Å; Y977-L979 VanDerWaalsContact C-N 3.27Å; Y977-L979 PolarHBondContact O-N 3.25Å; L979-L1013 HydrophobicContact CD2-CB 4.1Å; L979-L1013 HydrophobicContact CD2-CD1 4.04Å; L979-L1013 HydrophobicContact CD2-CD2 3.76Å; L979-L1013 HydrophobicContact CD2-CG 4.16Å
980	D	85.5	Confident	86.4	Confident	58 Å²	58	44 Å²	44	31%	0.31	21%	0.208	S	C	.	.	S	Bend	trans	-57.1	130	176	-172.7	-45.5	0	0	0	110.3	F863 Y977 A978 T982 L983 R984	F863-D980 HydrophobicContact CE2-CB 3.91Å; F863-D980 WeakPolarHBondContact CE2-OD2 3.44Å; Y977-D980 WeakPolarHBondContact O-CB 3.49Å; Y977-D980 PolarHBondContact O-N 3.1Å; A978-D980 VanDerWaalsContact C-N 3.32Å; D980-T982 PolarHBondContact O-N 2.87Å; D980-T982 PolarHBondContact OD1-N 3.41Å; D980-T982 PolarHBondContact OD1-OG1 3.25Å; D980-L983 PolarHBondContact O-N 3.39Å; D980-R984 WeakPolarHBondContact O-CB 3.43Å; D980-R984 PolarHBondContact O-N 2.82Å
981	P	83.2	Confident	86	Confident	100 Å²	100	44 Å²	44	65%	0.649	21%	0.208	S	C	*	.	H	α-helix	trans	-46.3	-31.8	179.9	-29.9	34.4	0	0	0	115.2
982	T	84.1	Confident	85.4	Confident	76 Å²	76	46 Å²	46	47%	0.466	22%	0.218	S	C	.	.	H	α-helix	trans	-71.4	-38.8	-179.1	57.5	0	0	0	0	113.7	F863 D980	F863-T982 WeakPolarHBondContact CZ-OG1 3.26Å; D980-T982 PolarHBondContact O-N 2.87Å; D980-T982 PolarHBondContact OD1-N 3.41Å; D980-T982 PolarHBondContact OD1-OG1 3.25Å
983	L	86.3	Confident	84.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-101	-15	-178.2	-68.2	177.4	0	0	0	113.4	F863 F866 A867 L870 F871 Y944 D980 K985 T986 F987	F863-L983 HydrophobicContact CD2-CD1 4.09Å; F863-L983 HydrophobicContact CE1-CD1 4.24Å; F863-L983 HydrophobicContact CE2-CD1 3.41Å; F863-L983 VanDerWaalsContact CE2-CD1 3.41Å; F863-L983 HydrophobicContact CE2-CG 3.95Å; F863-L983 HydrophobicContact CZ-CD1 3.5Å; F863-L983 VanDerWaalsContact CZ-CD1 3.5Å; F863-L983 HydrophobicContact CZ-CG 3.74Å; F866-L983 HydrophobicContact CD1-CD1 3.75Å; F866-L983 HydrophobicContact CE1-CD1 4.08Å; A867-L983 HydrophobicContact CB-CD1 3.96Å; A867-L983 HydrophobicContact CB-CD2 4.07Å; L870-L983 HydrophobicContact CD2-CD2 4.38Å; F871-L983 HydrophobicContact CE2-CD2 4.03Å; F871-L983 HydrophobicContact CZ-CD2 4.31Å; Y944-L983 WeakPolarHBondContact OH-CD2 3.21Å; D980-L983 PolarHBondContact O-N 3.39Å; L983-K985 VanDerWaalsContact C-N 3.31Å; L983-K985 PolarHBondContact O-N 3.35Å; L983-T986 WeakPolarHBondContact CA-OG1 3.02Å; L983-T986 PolarHBondContact O-N 3.44Å; L983-T986 VanDerWaalsContact O-N 3.12Å; L983-T986 PolarHBondContact O-OG1 3.1Å; L983-F987 WeakPolarHBondContact O-CB 3.38Å; L983-F987 PolarHBondContact O-N 3.13Å
984	R	86.4	Confident	84.4	Confident	64 Å²	64	39.7 Å²	39.7	24%	0.242	19%	0.19	C	C	.	.	H	α-helix	trans	-50.4	-46.7	-176.6	-166.9	-178	65.8	174.1	2.6	113.3	A978 D980 F987 L988 L1013 E1020	A978-R984 WeakPolarHBondContact O-CA 3.26Å; D980-R984 WeakPolarHBondContact O-CB 3.43Å; D980-R984 PolarHBondContact O-N 2.82Å; R984-F987 PolarHBondContact O-N 3.49Å; R984-L988 HydrophobicContact CG-CD1 4.24Å; R984-L988 WeakPolarHBondContact O-CB 3.27Å; R984-L988 VanDerWaalsContact O-CG 3.28Å; R984-L988 WeakPolarHBondContact O-CG 3.4Å; R984-L988 PolarHBondContact O-N 3.42Å; R984-L1013 HydrophobicContact CG-CD1 3.36Å; R984-E1020 IonicContact CZ-OE1 2.71Å; R984-E1020 IonicContact NH2-OE1 3.67Å; R984-E1020 PolarHBondContact NH2-OE1 2.91Å; R984-E1020 IonicContact NH2-OE2 3.91Å; R984-E1020 PolarHBondContact NH2-OE2 3.44Å; R984-E1020 VanDerWaalsContact NH2-OE2 3.17Å
985	K	83.9	Confident	83.8	Confident	116 Å²	116	40.8 Å²	40.8	50%	0.504	20%	0.197	S	C	.	.	H	α-helix	trans	-67	-42.1	-179.3	-71.6	-179	177.2	175.7	0	112.3	L983 L988 N989 E1020 F1021	L983-K985 VanDerWaalsContact C-N 3.31Å; L983-K985 PolarHBondContact O-N 3.35Å; K985-L988 PolarHBondContact O-N 3.07Å; K985-N989 WeakPolarHBondContact O-CB 3.2Å; K985-N989 PolarHBondContact O-N 3.39Å; K985-E1020 WeakPolarHBondContact CE-OE2 3.42Å; K985-E1020 IonicContact NZ-OE2 3.96Å; K985-F1021 HydrophobicContact CB-CZ 4.41Å
986	T	84.8	Confident	83.6	Confident	5 Å²	5	40.9 Å²	40.9	3%	0.031	20%	0.197	C	C	.	.	H	α-helix	trans	-67	-38.9	177	36.2	0	0	0	0	112	F871 V947 L983 N989 L990	F871-T986 HydrophobicContact CE1-CG2 3.84Å; F871-T986 HydrophobicContact CZ-CG2 4.18Å; V947-T986 HydrophobicContact CG1-CG2 3.92Å; V947-T986 HydrophobicContact CG2-CG2 4.2Å; L983-T986 WeakPolarHBondContact CA-OG1 3.02Å; L983-T986 PolarHBondContact O-N 3.44Å; L983-T986 VanDerWaalsContact O-N 3.12Å; L983-T986 PolarHBondContact O-OG1 3.1Å; T986-N989 WeakPolarHBondContact O-CB 3.25Å; T986-N989 PolarHBondContact O-N 2.97Å; T986-L990 PolarHBondContact O-N 3.47Å
987	F	88.7	Confident	83.8	Confident	3 Å²	3	31.8 Å²	31.8	1%	0.013	16%	0.163	C	C	.	.	H	α-helix	trans	-64.1	-47.4	174.7	176.5	-107.2	0	0	0	111.8	F866 L870 L968 I970 L975 A978 L983 R984 N989 L990 C991 L1013	F866-F987 HydrophobicContact CZ-CD2 4.42Å; L870-F987 HydrophobicContact CD1-CD2 4.47Å; L870-F987 HydrophobicContact CD2-CB 4.32Å; L968-F987 HydrophobicContact CD2-CE2 3.93Å; L968-F987 HydrophobicContact CD2-CZ 4.32Å; I970-F987 HydrophobicContact CD1-CE2 3.75Å; I970-F987 HydrophobicContact CD1-CZ 3.98Å; L975-F987 HydrophobicContact CD1-CZ 4.48Å; A978-F987 HydrophobicContact CB-CB 4.46Å; A978-F987 HydrophobicContact CB-CD1 4.07Å; A978-F987 HydrophobicContact CB-CD2 3.94Å; A978-F987 HydrophobicContact CB-CE1 4.28Å; A978-F987 HydrophobicContact CB-CE2 4.16Å; A978-F987 HydrophobicContact CB-CG 3.89Å; A978-F987 HydrophobicContact CB-CZ 4.32Å; L983-F987 WeakPolarHBondContact O-CB 3.38Å; L983-F987 PolarHBondContact O-N 3.13Å; R984-F987 PolarHBondContact O-N 3.49Å; F987-N989 VanDerWaalsContact C-N 3.27Å; F987-N989 PolarHBondContact O-N 3.41Å; F987-L990 WeakPolarHBondContact O-CB 3.44Å; F987-L990 PolarHBondContact O-N 2.73Å; F987-C991 PolarHBondContact O-N 2.7Å; F987-C991 PolarHBondContact O-SG 3.32Å; F987-C991 VanDerWaalsContact O-SG 3.36Å; F987-L1013 HydrophobicContact CD1-CD2 3.97Å; F987-L1013 HydrophobicContact CE1-CD2 3.75Å
988	L	85.3	Confident	84	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.5	-37.9	175.1	-75.5	169.2	0	0	0	112.6	R984 K985 C991 L992 L1013 F1018 F1021	R984-L988 HydrophobicContact CG-CD1 4.24Å; R984-L988 WeakPolarHBondContact O-CB 3.27Å; R984-L988 VanDerWaalsContact O-CG 3.28Å; R984-L988 WeakPolarHBondContact O-CG 3.4Å; R984-L988 PolarHBondContact O-N 3.42Å; K985-L988 PolarHBondContact O-N 3.07Å; L988-C991 PolarHBondContact O-N 3.31Å; L988-L992 WeakPolarHBondContact O-CG 3.43Å; L988-L992 PolarHBondContact O-N 3.06Å; L988-L1013 HydrophobicContact CD1-CD1 4.1Å; L988-L1013 HydrophobicContact CD2-CD1 4.28Å; L988-L1013 HydrophobicContact CD2-CD2 4.39Å; L988-L1013 HydrophobicContact CD2-CG 3.97Å; L988-L1013 HydrophobicContact CG-CD1 4.26Å; L988-L1013 HydrophobicContact CG-CG 4.46Å; L988-F1018 HydrophobicContact CB-CD1 4.49Å; L988-F1018 HydrophobicContact CB-CE1 3.87Å; L988-F1018 HydrophobicContact CB-CZ 4.5Å; L988-F1018 HydrophobicContact CD2-CD1 4.28Å; L988-F1018 HydrophobicContact CD2-CE1 3.74Å; L988-F1018 HydrophobicContact CD2-CE2 4.16Å; L988-F1018 HydrophobicContact CD2-CZ 3.7Å; L988-F1018 HydrophobicContact CG-CE1 4.37Å; L988-F1021 HydrophobicContact CB-CE2 3.89Å; L988-F1021 HydrophobicContact CB-CZ 4.45Å; L988-F1021 HydrophobicContact CD1-CE2 4.28Å
989	N	80.9	Confident	84.3	Confident	29 Å²	29	28.7 Å²	28.7	16%	0.155	15%	0.151	C	C	.	.	H	α-helix	trans	-62.3	-41.2	174	-176.3	-10.6	0	0	0	111.8	Y953 K985 T986 F987 L992 H993	Y953-N989 PolarHBondContact OH-OD1 3.42Å; K985-N989 WeakPolarHBondContact O-CB 3.2Å; K985-N989 PolarHBondContact O-N 3.39Å; T986-N989 WeakPolarHBondContact O-CB 3.25Å; T986-N989 PolarHBondContact O-N 2.97Å; F987-N989 VanDerWaalsContact C-N 3.27Å; F987-N989 PolarHBondContact O-N 3.41Å; N989-L992 PolarHBondContact O-N 2.98Å; N989-H993 PolarHBondContact O-ND1 3.47Å; N989-H993 PolarHBondContact OD1-CE1 3.22Å; N989-H993 PolarHBondContact OD1-ND1 3.02Å
990	L	83.5	Confident	84.5	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-59.7	-48.9	171.3	-179.6	67.6	0	0	0	110.8	L857 L870 L874 L877 L968 T986 F987 L992 H993 L994	L857-L990 HydrophobicContact CD1-CD2 4.14Å; L870-L990 HydrophobicContact CD1-CB 4.2Å; L870-L990 HydrophobicContact CD1-CD2 3.63Å; L874-L990 HydrophobicContact CD2-CB 3.93Å; L874-L990 HydrophobicContact CD2-CD1 3.92Å; L874-L990 HydrophobicContact CG-CB 4.44Å; L874-L990 HydrophobicContact CG-CD1 4.37Å; L877-L990 HydrophobicContact CD1-CD1 3.48Å; L877-L990 VanDerWaalsContact CD1-CD1 3.48Å; L968-L990 HydrophobicContact CD2-CD2 4.5Å; T986-L990 PolarHBondContact O-N 3.47Å; F987-L990 WeakPolarHBondContact O-CB 3.44Å; F987-L990 PolarHBondContact O-N 2.73Å; L990-L992 VanDerWaalsContact C-N 3.3Å; L990-L992 PolarHBondContact O-N 3.32Å; L990-H993 WeakPolarHBondContact O-CB 3.32Å; L990-H993 PolarHBondContact O-N 3.04Å; L990-L994 HydrophobicContact CD1-CD1 4.43Å; L990-L994 HydrophobicContact CD2-CD1 4.4Å; L990-L994 HydrophobicContact CG-CD1 3.85Å; L990-L994 WeakPolarHBondContact O-CG 3.37Å; L990-L994 PolarHBondContact O-N 3.39Å
991	C	84.7	Confident	84.4	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-58.6	-34.9	-179.8	-66.4	0	0	0	0	113.8	W828 F987 L988 H993 L994 F1018	W828-C991 HydrophobicContact CH2-CB 3.75Å; W828-C991 HydrophobicContact CZ2-CB 3.86Å; F987-C991 PolarHBondContact O-N 2.7Å; F987-C991 PolarHBondContact O-SG 3.32Å; F987-C991 VanDerWaalsContact O-SG 3.36Å; L988-C991 PolarHBondContact O-N 3.31Å; C991-H993 PolarHBondContact O-N 3.12Å; C991-L994 PolarHBondContact O-N 3.48Å; C991-F1018 HydrophobicContact CB-CZ 4.37Å
992	L	76.1	Confident	84.4	Confident	43 Å²	43	24.6 Å²	24.6	23%	0.225	12%	0.116	C	C	.	.	H	α-helix	trans	-63.9	-21	175.4	-74.4	168.3	0	0	0	113.9	Y953 L988 N989 L990 F1018	Y953-L992 HydrophobicContact CD2-CD1 4.43Å; Y953-L992 HydrophobicContact CE1-CB 4.31Å; Y953-L992 HydrophobicContact CE1-CD1 4.31Å; Y953-L992 HydrophobicContact CE2-CD1 3.97Å; L988-L992 WeakPolarHBondContact O-CG 3.43Å; L988-L992 PolarHBondContact O-N 3.06Å; N989-L992 PolarHBondContact O-N 2.98Å; L990-L992 VanDerWaalsContact C-N 3.3Å; L990-L992 PolarHBondContact O-N 3.32Å; L992-F1018 HydrophobicContact CD1-CD1 4.05Å; L992-F1018 HydrophobicContact CD1-CE1 3.73Å; L992-F1018 HydrophobicContact CD2-CD1 3.85Å; L992-F1018 HydrophobicContact CD2-CE1 3.47Å; L992-F1018 VanDerWaalsContact CD2-CE1 3.47Å; L992-F1018 HydrophobicContact CD2-CZ 3.81Å; L992-F1018 HydrophobicContact CG-CD1 4.02Å; L992-F1018 HydrophobicContact CG-CE1 3.33Å; L992-F1018 HydrophobicContact CG-CZ 3.89Å
993	H	73.7	Confident	84.2	Confident	28 Å²	28	24.4 Å²	24.4	13%	0.13	12%	0.115	C	C	.	.	H	α-helix	trans	-96.4	-18.7	-177	-64.5	133.1	0	0	0	113.8	R881 Y953 N989 L990 C991	R881-H993 VanDerWaalsContact CZ-CD2 3.48Å; R881-H993 PolarHBondContact NH1-CD2 3.45Å; R881-H993 PolarHBondContact NH1-CE1 3.5Å; R881-H993 PolarHBondContact NH1-NE2 3.4Å; R881-H993 PolarHBondContact NH2-CD2 2.85Å; R881-H993 PolarHBondContact NH2-NE2 3.18Å; Y953-H993 AromaticContact CE1-NE2 3.64Å; Y953-H993 AromaticContact CZ-NE2 3.77Å; Y953-H993 PolarHBondContact OH-CE1 3.29Å; Y953-H993 PolarHBondContact OH-NE2 3.14Å; N989-H993 PolarHBondContact O-ND1 3.47Å; N989-H993 PolarHBondContact OD1-CE1 3.22Å; N989-H993 PolarHBondContact OD1-ND1 3.02Å; L990-H993 WeakPolarHBondContact O-CB 3.32Å; L990-H993 PolarHBondContact O-N 3.04Å; C991-H993 PolarHBondContact O-N 3.12Å
994	L	76.5	Confident	83.8	Confident	1 Å²	1	26.9 Å²	26.9	1%	0.005	13%	0.131	C	C	.	.			trans	-82.2	152.5	179	-64.4	160.4	0	0	0	110.3	Q826 M966 L968 L990 C991	Q826-L994 PolarHBondContact NE2-O 3.36Å; M966-L994 HydrophobicContact CB-CD2 3.83Å; L968-L994 HydrophobicContact CB-CD1 3.39Å; L968-L994 HydrophobicContact CB-CD2 4.39Å; L968-L994 HydrophobicContact CB-CG 4.42Å; L968-L994 HydrophobicContact CD2-CD1 3.81Å; L968-L994 HydrophobicContact CG-CD1 4.15Å; L990-L994 HydrophobicContact CD1-CD1 4.43Å; L990-L994 HydrophobicContact CD2-CD1 4.4Å; L990-L994 HydrophobicContact CG-CD1 3.85Å; L990-L994 WeakPolarHBondContact O-CG 3.37Å; L990-L994 PolarHBondContact O-N 3.39Å; C991-L994 PolarHBondContact O-N 3.48Å
995	T	76	Confident	83.6	Confident	23 Å²	23	29.8 Å²	29.8	14%	0.141	15%	0.15	C	C	.	.	S	Bend	trans	-81.2	-42.9	176.1	44.4	0	0	0	0	111.6	P965 M966	P965-T995 HydrophobicContact CB-CG2 4.29Å; M966-T995 PolarHBondContact N-OG1 3.32Å; M966-T995 PolarHBondContact O-N 3.45Å; M966-T995 PolarHBondContact O-OG1 3.23Å
996	T	86.9	Confident	83.8	Confident	4 Å²	4	26.2 Å²	26.2	3%	0.025	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	154.1	-172.7	45.8	0	0	0	0	110.2	H847 A967 L968	H847-T996 WeakPolarHBondContact NE2-CB 3.14Å; A967-T996 VanDerWaalsContact CA-O 3.3Å; A967-T996 WeakPolarHBondContact CA-O 3.48Å; A967-T996 WeakPolarHBondContact CB-OG1 3.43Å; L968-T996 PolarHBondContact N-O 3.31Å; L968-T996 VanDerWaalsContact N-O 3.16Å
997	V	91.6	Very high	83.9	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	135.6	-179.1	-177.7	0	0	0	0	109.1	W828 V829 L968	W828-V997 CarbonylContact C-O 3.54Å; W828-V997 VanDerWaalsContact CA-O 3.25Å; W828-V997 WeakPolarHBondContact CA-O 3.33Å; W828-V997 HydrophobicContact CD2-CB 3.6Å; W828-V997 HydrophobicContact CD2-CG1 4.25Å; W828-V997 HydrophobicContact CD2-CG2 3.87Å; W828-V997 VanDerWaalsContact CE2-CG2 3.5Å; W828-V997 HydrophobicContact CE3-CB 3.92Å; W828-V997 HydrophobicContact CE3-CG1 4.04Å; W828-V997 HydrophobicContact CE3-CG2 4.31Å; W828-V997 HydrophobicContact CG-CB 3.86Å; W828-V997 HydrophobicContact CG-CG2 4.38Å; W828-V997 HydrophobicContact CH2-CG2 4.19Å; W828-V997 HydrophobicContact CZ2-CB 4.35Å; W828-V997 HydrophobicContact CZ2-CG2 3.69Å; W828-V997 HydrophobicContact CZ3-CB 4.44Å; W828-V997 HydrophobicContact CZ3-CG1 4.32Å; W828-V997 HydrophobicContact CZ3-CG2 4.46Å; V829-V997 PolarHBondContact N-O 3.12Å; L968-V997 HydrophobicContact CB-CG1 4.29Å; L968-V997 HydrophobicContact CB-CG2 4.33Å; L968-V997 HydrophobicContact CD2-CG1 4.07Å; L968-V997 HydrophobicContact CG-CG1 4.29Å; L968-V997 CarbonylContact O-C 3.48Å; L968-V997 WeakPolarHBondContact O-CA 3.3Å
998	L	93.8	Very high	83.9	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.8	174.4	177.2	66.8	0	0	0	108.7	V829 T831 A838 I839 F848 L968 V969 I970	V829-L998 HydrophobicContact CB-CD1 3.61Å; V829-L998 HydrophobicContact CG1-CD1 3.62Å; V829-L998 WeakPolarHBondContact O-CA 3.41Å; T831-L998 HydrophobicContact CG2-CD1 4.47Å; A838-L998 HydrophobicContact CB-CD1 4.15Å; A838-L998 HydrophobicContact CB-CD2 3.93Å; A838-L998 HydrophobicContact CB-CG 4.38Å; I839-L998 HydrophobicContact CG1-CD2 3.85Å; F848-L998 HydrophobicContact CE1-CB 4.42Å; F848-L998 HydrophobicContact CE2-CB 4.34Å; F848-L998 HydrophobicContact CE2-CD2 3.81Å; F848-L998 HydrophobicContact CZ-CB 3.58Å; F848-L998 HydrophobicContact CZ-CD2 3.92Å; F848-L998 HydrophobicContact CZ-CG 4.36Å; L968-L998 PolarHBondContact O-N 3.21Å; V969-L998 CarbonylContact C-O 3.54Å; V969-L998 VanDerWaalsContact CA-O 3.31Å; V969-L998 WeakPolarHBondContact CA-O 3.44Å; V969-L998 HydrophobicContact CG1-CD2 4.33Å; V969-L998 HydrophobicContact CG2-CB 4.46Å; V969-L998 HydrophobicContact CG2-CD2 4.33Å; I970-L998 PolarHBondContact N-O 3.18Å
999	C	92.8	Very high	84.1	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.007	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	123.9	174	-55.8	0	0	0	0	109.4	V829 L830 T831 I970 L1002	V829-C999 PolarHBondContact O-N 3.28Å; L830-C999 HydrophobicContact CD2-CB 3.63Å; L830-C999 VanDerWaalsContact CD2-SG 3.55Å; T831-C999 PolarHBondContact N-O 3.33Å; I970-C999 HydrophobicContact CG2-CB 4.05Å; I970-C999 WeakPolarHBondContact CG2-SG 3.49Å; I970-C999 CarbonylContact O-C 3.53Å; I970-C999 VanDerWaalsContact O-CA 3.27Å; I970-C999 WeakPolarHBondContact O-CA 3.31Å; C999-L1002 HydrophobicContact CB-CD1 3.38Å; C999-L1002 HydrophobicContact CB-CD2 4.17Å; C999-L1002 HydrophobicContact CB-CG 3.87Å
1000	C	89.2	Confident	84.6	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	158.7	-174.8	-51.5	0	0	0	0	111.2	T831 E835 I970 D971 G972 L1002	T831-C1000 CarbonylContact O-C 3.56Å; E835-C1000 HydrophobicContact CB-CB 4.4Å; I970-C1000 PolarHBondContact O-N 2.52Å; D971-C1000 CarbonylContact C-O 3.55Å; D971-C1000 WeakPolarHBondContact CA-O 3.46Å; G972-C1000 PolarHBondContact N-O 3.4Å; C1000-L1002 PolarHBondContact O-N 2.75Å
1001	R	83.7	Confident	85	Confident	112 Å²	112	27.2 Å²	27.2	42%	0.423	15%	0.145	S	C	.	.	S	Bend	trans	51.1	39.9	179.8	-59.5	-177.7	174.7	149.6	-0.2	113.5	T831 G832 D833	T831-R1001 PolarHBondContact O-N 2.86Å; T831-R1001 VanDerWaalsContact O-N 3.07Å; G832-R1001 WeakPolarHBondContact O-CA 3.41Å; D833-R1001 WeakPolarHBondContact O-CG 3.37Å; D833-R1001 PolarHBondContact O-N 3.41Å
1002	L	83.4	Confident	85.3	Confident	10 Å²	10	31.9 Å²	31.9	5%	0.052	17%	0.166	C	C	.	.			trans	-85	138.5	177.3	-64.3	-173.3	0	0	0	111.9	L830 T831 L975 C999 C1000 Q1006 K1007 V1010	L830-L1002 HydrophobicContact CB-CD1 3.91Å; L830-L1002 HydrophobicContact CD2-CD1 3.98Å; L830-L1002 HydrophobicContact CG-CD1 4.4Å; T831-L1002 PolarHBondContact O-N 3.42Å; L975-L1002 HydrophobicContact CD2-CD2 3.5Å; C999-L1002 HydrophobicContact CB-CD1 3.38Å; C999-L1002 HydrophobicContact CB-CD2 4.17Å; C999-L1002 HydrophobicContact CB-CG 3.87Å; C1000-L1002 PolarHBondContact O-N 2.75Å; L1002-Q1006 HydrophobicContact CB-CB 4.47Å; L1002-Q1006 HydrophobicContact CD2-CB 4.24Å; L1002-K1007 HydrophobicContact CB-CG 3.94Å; L1002-K1007 HydrophobicContact CD1-CG 4.07Å; L1002-V1010 HydrophobicContact CD1-CG2 4.47Å
1003	T	80.6	Confident	85.9	Confident	72 Å²	72	30.1 Å²	30.1	44%	0.442	16%	0.157	S	C	.	.			trans	-78.3	157.3	164.3	58.2	0	0	0	0	111	L1005 Q1006 K1007	T1003-L1005 VanDerWaalsContact C-N 3.27Å; T1003-L1005 PolarHBondContact O-N 3.35Å; T1003-Q1006 WeakPolarHBondContact O-CA 3.41Å; T1003-Q1006 WeakPolarHBondContact O-CB 3.45Å; T1003-Q1006 PolarHBondContact O-N 3.26Å; T1003-Q1006 WeakPolarHBondContact OG1-CB 3.39Å; T1003-Q1006 VanDerWaalsContact OG1-CD 3.23Å; T1003-Q1006 WeakPolarHBondContact OG1-CG 3.47Å; T1003-Q1006 PolarHBondContact OG1-N 2.92Å; T1003-Q1006 PolarHBondContact OG1-OE1 3.42Å; T1003-K1007 PolarHBondContact O-N 3.08Å
1004	P	78.2	Confident	86.6	Confident	52 Å²	52	28.8 Å²	28.8	34%	0.338	15%	0.151	S	C	.	.	H	α-helix	trans	-50.5	-43.3	177.1	-31.7	37.9	0	0	0	114	K1007 A1008 N1035	P1004-K1007 WeakPolarHBondContact O-CB 3.29Å; P1004-K1007 PolarHBondContact O-N 3.06Å; P1004-A1008 PolarHBondContact O-N 3.29Å; P1004-N1035 WeakPolarHBondContact CB-O 3.4Å; P1004-N1035 HydrophobicContact CG-CB 4.19Å
1005	L	82	Confident	87.1	Confident	124 Å²	124	33.8 Å²	33.8	65%	0.649	17%	0.17	S	C	*	.	H	α-helix	trans	-68.5	-35.2	177.8	-172.2	67	0	0	0	112.6	T1003 A1008 S1009	T1003-L1005 VanDerWaalsContact C-N 3.27Å; T1003-L1005 PolarHBondContact O-N 3.35Å; L1005-A1008 PolarHBondContact O-N 2.9Å; L1005-S1009 WeakPolarHBondContact O-CB 3.34Å; L1005-S1009 PolarHBondContact O-N 3.39Å; L1005-S1009 PolarHBondContact O-OG 3.49Å
1006	Q	86.9	Confident	87.4	Confident	42 Å²	42	35 Å²	35	20%	0.196	18%	0.179	C	C	.	.	H	α-helix	trans	-67.6	-38.3	173.9	-75	171.6	-29.3	0	0	111.6	G972 L1002 T1003 A1008 S1009 V1010	G972-Q1006 PolarHBondContact O-NE2 2.95Å; L1002-Q1006 HydrophobicContact CB-CB 4.47Å; L1002-Q1006 HydrophobicContact CD2-CB 4.24Å; T1003-Q1006 WeakPolarHBondContact O-CA 3.41Å; T1003-Q1006 WeakPolarHBondContact O-CB 3.45Å; T1003-Q1006 PolarHBondContact O-N 3.26Å; T1003-Q1006 WeakPolarHBondContact OG1-CB 3.39Å; T1003-Q1006 VanDerWaalsContact OG1-CD 3.23Å; T1003-Q1006 WeakPolarHBondContact OG1-CG 3.47Å; T1003-Q1006 PolarHBondContact OG1-N 2.92Å; T1003-Q1006 PolarHBondContact OG1-OE1 3.42Å; Q1006-A1008 VanDerWaalsContact C-N 3.33Å; Q1006-A1008 PolarHBondContact O-N 3.27Å; Q1006-S1009 WeakPolarHBondContact O-CB 3.21Å; Q1006-S1009 PolarHBondContact O-N 3.4Å; Q1006-S1009 VanDerWaalsContact O-N 3.13Å; Q1006-V1010 WeakPolarHBondContact O-CG2 3.37Å; Q1006-V1010 PolarHBondContact O-N 3.23Å
1007	K	88.3	Confident	86.9	Confident	10 Å²	10	34.9 Å²	34.9	4%	0.043	18%	0.178	C	C	.	.	H	α-helix	trans	-55.2	-49.9	172.3	-66.9	-178.3	169.7	-177.1	0	110.5	D437 L830 L1002 T1003 P1004 S1009 V1010 V1011 D1036 M1039	D437-K1007 IonicContact OD1-NZ 3.89Å; D437-K1007 PolarHBondContact OD1-NZ 2.94Å; L830-K1007 HydrophobicContact CB-CG 4.25Å; L830-K1007 HydrophobicContact CD1-CB 4.41Å; L830-K1007 VanDerWaalsContact O-CE 3.3Å; L830-K1007 WeakPolarHBondContact O-CE 3.38Å; L1002-K1007 HydrophobicContact CB-CG 3.94Å; L1002-K1007 HydrophobicContact CD1-CG 4.07Å; T1003-K1007 PolarHBondContact O-N 3.08Å; P1004-K1007 WeakPolarHBondContact O-CB 3.29Å; P1004-K1007 PolarHBondContact O-N 3.06Å; K1007-S1009 VanDerWaalsContact C-N 3.32Å; K1007-S1009 PolarHBondContact O-N 3.42Å; K1007-V1010 PolarHBondContact O-N 3.07Å; K1007-V1011 PolarHBondContact O-N 3.38Å; K1007-D1036 IonicContact NZ-OD1 3.78Å; K1007-D1036 PolarHBondContact NZ-OD1 3.38Å; K1007-M1039 HydrophobicContact CB-CB 4.1Å; K1007-M1039 HydrophobicContact CB-CG 4.36Å; K1007-M1039 HydrophobicContact CB-SD 4.38Å
1008	A	87.5	Confident	86.2	Confident	10 Å²	10	34.9 Å²	34.9	8%	0.083	18%	0.178	C	C	.	.	H	α-helix	trans	-60.5	-39.7	175.6	0	0	0	0	0	112.8	P1004 L1005 Q1006 V1010 V1011 Q1012 A1038 Q1042	P1004-A1008 PolarHBondContact O-N 3.29Å; L1005-A1008 PolarHBondContact O-N 2.9Å; Q1006-A1008 VanDerWaalsContact C-N 3.33Å; Q1006-A1008 PolarHBondContact O-N 3.27Å; A1008-V1010 VanDerWaalsContact C-N 3.34Å; A1008-V1010 PolarHBondContact O-N 3.3Å; A1008-V1011 PolarHBondContact O-N 2.79Å; A1008-Q1012 PolarHBondContact O-N 2.87Å; A1008-A1038 HydrophobicContact CB-CB 3.99Å; A1008-A1038 WeakPolarHBondContact CB-O 3.19Å; A1008-Q1042 HydrophobicContact CB-CB 4.26Å
1009	S	90.2	Very high	85.2	Confident	37 Å²	37	37.6 Å²	37.6	26%	0.259	20%	0.197	S	C	.	.	H	α-helix	trans	-63.2	-36.6	177.5	-59.5	0	0	0	0	112.6	L1005 Q1006 K1007 Q1012 L1013	L1005-S1009 WeakPolarHBondContact O-CB 3.34Å; L1005-S1009 PolarHBondContact O-N 3.39Å; L1005-S1009 PolarHBondContact O-OG 3.49Å; Q1006-S1009 WeakPolarHBondContact O-CB 3.21Å; Q1006-S1009 PolarHBondContact O-N 3.4Å; Q1006-S1009 VanDerWaalsContact O-N 3.13Å; K1007-S1009 VanDerWaalsContact C-N 3.32Å; K1007-S1009 PolarHBondContact O-N 3.42Å; S1009-Q1012 PolarHBondContact O-N 3.2Å; S1009-L1013 VanDerWaalsContact O-CB 3.24Å; S1009-L1013 WeakPolarHBondContact O-CB 3.38Å; S1009-L1013 PolarHBondContact O-N 3.36Å
1010	V	92.1	Very high	84.1	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.012	22%	0.218	C	C	.	.	H	α-helix	trans	-65.3	-43	174.3	176.2	0	0	0	0	111.2	F435 W828 L830 L975 L1002 Q1006 K1007 A1008 Q1012 L1013 V1014	F435-V1010 HydrophobicContact CE1-CG1 4.06Å; W828-V1010 HydrophobicContact CE3-CG1 4.06Å; W828-V1010 HydrophobicContact CZ3-CG1 4.04Å; L830-V1010 HydrophobicContact CD1-CB 4.18Å; L830-V1010 HydrophobicContact CD1-CG1 4.18Å; L830-V1010 HydrophobicContact CD2-CB 4.46Å; L830-V1010 HydrophobicContact CD2-CG1 3.95Å; L975-V1010 HydrophobicContact CD1-CG2 4.16Å; L975-V1010 HydrophobicContact CD2-CG2 3.43Å; L975-V1010 VanDerWaalsContact CD2-CG2 3.43Å; L975-V1010 HydrophobicContact CG-CG2 4.4Å; L1002-V1010 HydrophobicContact CD1-CG2 4.47Å; Q1006-V1010 WeakPolarHBondContact O-CG2 3.37Å; Q1006-V1010 PolarHBondContact O-N 3.23Å; K1007-V1010 PolarHBondContact O-N 3.07Å; A1008-V1010 VanDerWaalsContact C-N 3.34Å; A1008-V1010 PolarHBondContact O-N 3.3Å; V1010-Q1012 VanDerWaalsContact C-N 3.35Å; V1010-Q1012 PolarHBondContact O-N 3.23Å; V1010-L1013 WeakPolarHBondContact O-CB 3.2Å; V1010-L1013 PolarHBondContact O-N 3.19Å; V1010-V1014 PolarHBondContact O-N 3.47Å; V1010-V1014 VanDerWaalsContact O-N 3.07Å
1011	V	91.4	Very high	82.8	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.4	-46.1	175.6	179.2	0	0	0	0	110.4	F435 L830 K1007 A1008 L1013 V1014 R1015 M1039 Q1042 A1043	F435-V1011 HydrophobicContact CB-CG2 4.31Å; F435-V1011 HydrophobicContact CD1-CG2 4.39Å; F435-V1011 HydrophobicContact CD2-CB 4.36Å; F435-V1011 HydrophobicContact CD2-CG1 4.2Å; F435-V1011 HydrophobicContact CD2-CG2 3.67Å; F435-V1011 HydrophobicContact CE2-CB 4.25Å; F435-V1011 HydrophobicContact CE2-CG1 4.08Å; F435-V1011 HydrophobicContact CE2-CG2 4.02Å; F435-V1011 HydrophobicContact CG-CG2 3.87Å; L830-V1011 HydrophobicContact CD1-CG2 4.47Å; K1007-V1011 PolarHBondContact O-N 3.38Å; A1008-V1011 PolarHBondContact O-N 2.79Å; V1011-L1013 VanDerWaalsContact C-N 3.33Å; V1011-L1013 PolarHBondContact O-N 2.87Å; V1011-V1014 PolarHBondContact O-N 2.9Å; V1011-R1015 WeakPolarHBondContact O-CB 3.35Å; V1011-R1015 PolarHBondContact O-N 3.15Å; V1011-M1039 HydrophobicContact CG2-CG 3.59Å; V1011-Q1042 HydrophobicContact CB-CG 4.35Å; V1011-Q1042 HydrophobicContact CG1-CB 4.39Å; V1011-Q1042 HydrophobicContact CG1-CG 4.31Å; V1011-A1043 HydrophobicContact CG1-CB 3.96Å
1012	Q	90	Very high	81.8	Confident	97 Å²	97	43 Å²	43	45%	0.453	25%	0.245	S	C	.	.	H	α-helix	trans	-61.9	-40.6	176.3	-172.7	171.4	-3.4	0	0	112.1	A1008 S1009 V1010 R1015 S1016 Q1042	A1008-Q1012 PolarHBondContact O-N 2.87Å; S1009-Q1012 PolarHBondContact O-N 3.2Å; V1010-Q1012 VanDerWaalsContact C-N 3.35Å; V1010-Q1012 PolarHBondContact O-N 3.23Å; Q1012-R1015 PolarHBondContact O-N 3.34Å; Q1012-S1016 WeakPolarHBondContact O-CB 3.19Å; Q1012-S1016 PolarHBondContact O-N 3.47Å; Q1012-S1016 PolarHBondContact O-OG 2.92Å; Q1012-Q1042 HydrophobicContact CB-CG 4.05Å
1013	L	89.9	Confident	80.9	Confident	7 Å²	7	44.4 Å²	44.4	4%	0.037	25%	0.254	C	S	.	.	H	α-helix	trans	-58.8	-46.5	177.6	174.7	70.3	0	0	0	111.4	L979 R984 F987 L988 S1009 V1010 V1011 G1017	L979-L1013 HydrophobicContact CD2-CB 4.1Å; L979-L1013 HydrophobicContact CD2-CD1 4.04Å; L979-L1013 HydrophobicContact CD2-CD2 3.76Å; L979-L1013 HydrophobicContact CD2-CG 4.16Å; R984-L1013 HydrophobicContact CG-CD1 3.36Å; F987-L1013 HydrophobicContact CD1-CD2 3.97Å; F987-L1013 HydrophobicContact CE1-CD2 3.75Å; L988-L1013 HydrophobicContact CD1-CD1 4.1Å; L988-L1013 HydrophobicContact CD2-CD1 4.28Å; L988-L1013 HydrophobicContact CD2-CD2 4.39Å; L988-L1013 HydrophobicContact CD2-CG 3.97Å; L988-L1013 HydrophobicContact CG-CD1 4.26Å; L988-L1013 HydrophobicContact CG-CG 4.46Å; S1009-L1013 VanDerWaalsContact O-CB 3.24Å; S1009-L1013 WeakPolarHBondContact O-CB 3.38Å; S1009-L1013 PolarHBondContact O-N 3.36Å; V1010-L1013 WeakPolarHBondContact O-CB 3.2Å; V1010-L1013 PolarHBondContact O-N 3.19Å; V1011-L1013 VanDerWaalsContact C-N 3.33Å; V1011-L1013 PolarHBondContact O-N 2.87Å; L1013-G1017 WeakPolarHBondContact O-CA 3.4Å; L1013-G1017 PolarHBondContact O-N 3.19Å
1014	V	88.8	Confident	80.6	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-69.4	-45	178.6	165.8	0	0	0	0	111.1	Y433 F435 W828 V1010 V1011 F1018 P1025 T1027	Y433-V1014 HydrophobicContact CD1-CG1 4.3Å; Y433-V1014 HydrophobicContact CD2-CG1 4.03Å; Y433-V1014 HydrophobicContact CE2-CG1 4.39Å; Y433-V1014 HydrophobicContact CG-CG1 3.99Å; F435-V1014 HydrophobicContact CE1-CG2 4.2Å; F435-V1014 HydrophobicContact CE2-CB 4.47Å; F435-V1014 HydrophobicContact CE2-CG1 4.4Å; F435-V1014 HydrophobicContact CZ-CB 3.7Å; F435-V1014 HydrophobicContact CZ-CG1 3.84Å; F435-V1014 HydrophobicContact CZ-CG2 3.72Å; W828-V1014 HydrophobicContact CE3-CG2 4.41Å; W828-V1014 HydrophobicContact CH2-CG2 3.66Å; W828-V1014 HydrophobicContact CZ2-CG2 4.32Å; W828-V1014 HydrophobicContact CZ3-CG2 3.73Å; V1010-V1014 PolarHBondContact O-N 3.47Å; V1010-V1014 VanDerWaalsContact O-N 3.07Å; V1011-V1014 PolarHBondContact O-N 2.9Å; V1014-F1018 HydrophobicContact CB-CD2 4.26Å; V1014-F1018 HydrophobicContact CB-CE2 4.19Å; V1014-F1018 HydrophobicContact CG1-CD2 3.71Å; V1014-F1018 HydrophobicContact CG1-CE2 3.75Å; V1014-F1018 HydrophobicContact CG2-CE2 4.05Å; V1014-F1018 WeakPolarHBondContact O-CB 3.27Å; V1014-F1018 VanDerWaalsContact O-CD2 3.22Å; V1014-F1018 WeakPolarHBondContact O-CD2 3.48Å; V1014-F1018 PolarHBondContact O-N 3.08Å; V1014-P1025 HydrophobicContact CG1-CG 4.32Å; V1014-T1027 HydrophobicContact CG1-CG2 3.79Å
1015	R	85.1	Confident	80.8	Confident	106 Å²	106	43.5 Å²	43.5	40%	0.4	25%	0.247	S	C	.	.	H	α-helix	trans	-64.1	-48.2	-178.1	-179.6	178	162.5	-179.7	-0.2	112.7	V1011 Q1012 T1027 Q1042	V1011-R1015 WeakPolarHBondContact O-CB 3.35Å; V1011-R1015 PolarHBondContact O-N 3.15Å; Q1012-R1015 PolarHBondContact O-N 3.34Å; R1015-T1027 HydrophobicContact CB-CG2 4.23Å; R1015-Q1042 PolarHBondContact NH1-O 3.15Å
1016	S	82.5	Confident	81.2	Confident	49 Å²	49	38 Å²	38	34%	0.343	22%	0.218	S	C	.	.	H	α-helix	trans	-86.9	-40.4	-178.6	64	0	0	0	0	112.5	Q1012 F1018 S1019	Q1012-S1016 WeakPolarHBondContact O-CB 3.19Å; Q1012-S1016 PolarHBondContact O-N 3.47Å; Q1012-S1016 PolarHBondContact O-OG 2.92Å; S1016-F1018 PolarHBondContact O-N 3.39Å; S1016-S1019 VanDerWaalsContact O-CB 3.31Å; S1016-S1019 WeakPolarHBondContact O-CB 2.98Å; S1016-S1019 PolarHBondContact O-N 2.8Å; S1016-S1019 VanDerWaalsContact O-N 3.15Å; S1016-S1019 PolarHBondContact O-OG 3.4Å
1017	G	76	Confident	81.5	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-69.1	-34.8	-173.6	0	0	0	0	0	113.7	L1013 S1019 E1020 F1021	L1013-G1017 WeakPolarHBondContact O-CA 3.4Å; L1013-G1017 PolarHBondContact O-N 3.19Å; G1017-S1019 VanDerWaalsContact C-N 3.28Å; G1017-S1019 PolarHBondContact O-N 2.94Å; G1017-E1020 PolarHBondContact O-N 3.21Å; G1017-F1021 WeakPolarHBondContact O-CD2 3.37Å
1018	F	77.8	Confident	81.8	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.009	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-72.6	-21.4	174	-70.8	-47.6	0	0	0	113.6	Y433 L988 C991 L992 V1014 S1016 E1020 F1021 G1022 V1023 P1025	Y433-F1018 HydrophobicContact CE1-CE2 4.36Å; Y433-F1018 HydrophobicContact CE2-CD2 4.41Å; Y433-F1018 HydrophobicContact CE2-CE2 4.34Å; Y433-F1018 AromaticContact CZ-CE2 3.92Å; L988-F1018 HydrophobicContact CB-CD1 4.49Å; L988-F1018 HydrophobicContact CB-CE1 3.87Å; L988-F1018 HydrophobicContact CB-CZ 4.5Å; L988-F1018 HydrophobicContact CD2-CD1 4.28Å; L988-F1018 HydrophobicContact CD2-CE1 3.74Å; L988-F1018 HydrophobicContact CD2-CE2 4.16Å; L988-F1018 HydrophobicContact CD2-CZ 3.7Å; L988-F1018 HydrophobicContact CG-CE1 4.37Å; C991-F1018 HydrophobicContact CB-CZ 4.37Å; L992-F1018 HydrophobicContact CD1-CD1 4.05Å; L992-F1018 HydrophobicContact CD1-CE1 3.73Å; L992-F1018 HydrophobicContact CD2-CD1 3.85Å; L992-F1018 HydrophobicContact CD2-CE1 3.47Å; L992-F1018 VanDerWaalsContact CD2-CE1 3.47Å; L992-F1018 HydrophobicContact CD2-CZ 3.81Å; L992-F1018 HydrophobicContact CG-CD1 4.02Å; L992-F1018 HydrophobicContact CG-CE1 3.33Å; L992-F1018 HydrophobicContact CG-CZ 3.89Å; V1014-F1018 HydrophobicContact CB-CD2 4.26Å; V1014-F1018 HydrophobicContact CB-CE2 4.19Å; V1014-F1018 HydrophobicContact CG1-CD2 3.71Å; V1014-F1018 HydrophobicContact CG1-CE2 3.75Å; V1014-F1018 HydrophobicContact CG2-CE2 4.05Å; V1014-F1018 WeakPolarHBondContact O-CB 3.27Å; V1014-F1018 VanDerWaalsContact O-CD2 3.22Å; V1014-F1018 WeakPolarHBondContact O-CD2 3.48Å; V1014-F1018 PolarHBondContact O-N 3.08Å; S1016-F1018 PolarHBondContact O-N 3.39Å; F1018-E1020 PolarHBondContact O-N 2.9Å; F1018-F1021 HydrophobicContact CD1-CD2 4.11Å; F1018-F1021 CarbonylContact O-C 3.6Å; F1018-F1021 WeakPolarHBondContact O-CA 3.31Å; F1018-F1021 WeakPolarHBondContact O-CB 3.28Å; F1018-F1021 PolarHBondContact O-N 3.49Å; F1018-G1022 PolarHBondContact O-N 3.4Å; F1018-V1023 CarbonylContact C-O 3.35Å; F1018-V1023 WeakPolarHBondContact CB-O 3.38Å; F1018-V1023 PolarHBondContact O-N 3.35Å; F1018-P1025 HydrophobicContact CB-CG 4.04Å; F1018-P1025 HydrophobicContact CD2-CG 4.01Å; F1018-P1025 HydrophobicContact CG-CG 4.48Å
1019	S	72.5	Confident	82.2	Confident	56 Å²	56	35 Å²	35	39%	0.392	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-61.3	-30.6	175	79.8	0	0	0	0	111.8	S1016 G1017 F1021 G1022 V1023	S1016-S1019 VanDerWaalsContact O-CB 3.31Å; S1016-S1019 WeakPolarHBondContact O-CB 2.98Å; S1016-S1019 PolarHBondContact O-N 2.8Å; S1016-S1019 VanDerWaalsContact O-N 3.15Å; S1016-S1019 PolarHBondContact O-OG 3.4Å; G1017-S1019 VanDerWaalsContact C-N 3.28Å; G1017-S1019 PolarHBondContact O-N 2.94Å; S1019-F1021 PolarHBondContact O-N 3.43Å; S1019-G1022 WeakPolarHBondContact O-CA 3.44Å; S1019-G1022 PolarHBondContact O-N 3.35Å; S1019-V1023 WeakPolarHBondContact CA-O 3.47Å; S1019-V1023 PolarHBondContact N-O 3.5Å; S1019-V1023 VanDerWaalsContact N-O 3.12Å
1020	E	69.1	Low	82.4	Confident	98 Å²	98	33.3 Å²	33.3	46%	0.458	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-66.5	-23.8	174.2	-59.5	-174.6	175	0	0	112.7	R984 K985 G1017 F1018 G1022	R984-E1020 IonicContact CZ-OE1 2.71Å; R984-E1020 IonicContact NH2-OE1 3.67Å; R984-E1020 PolarHBondContact NH2-OE1 2.91Å; R984-E1020 IonicContact NH2-OE2 3.91Å; R984-E1020 PolarHBondContact NH2-OE2 3.44Å; R984-E1020 VanDerWaalsContact NH2-OE2 3.17Å; K985-E1020 WeakPolarHBondContact CE-OE2 3.42Å; K985-E1020 IonicContact NZ-OE2 3.96Å; G1017-E1020 PolarHBondContact O-N 3.21Å; F1018-E1020 PolarHBondContact O-N 2.9Å; E1020-G1022 VanDerWaalsContact C-N 3.29Å
1021	F	63.8	Low	82.3	Confident	60 Å²	60	33.2 Å²	33.2	26%	0.263	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-88.9	7.4	172.2	-64.6	-86.8	0	0	0	112.7	K985 L988 G1017 F1018 S1019 V1023	K985-F1021 HydrophobicContact CB-CZ 4.41Å; L988-F1021 HydrophobicContact CB-CE2 3.89Å; L988-F1021 HydrophobicContact CB-CZ 4.45Å; L988-F1021 HydrophobicContact CD1-CE2 4.28Å; G1017-F1021 WeakPolarHBondContact O-CD2 3.37Å; F1018-F1021 HydrophobicContact CD1-CD2 4.11Å; F1018-F1021 CarbonylContact O-C 3.6Å; F1018-F1021 WeakPolarHBondContact O-CA 3.31Å; F1018-F1021 WeakPolarHBondContact O-CB 3.28Å; F1018-F1021 PolarHBondContact O-N 3.49Å; S1019-F1021 PolarHBondContact O-N 3.43Å; F1021-V1023 VanDerWaalsContact C-N 3.34Å
1022	G	62.1	Low	81.9	Confident	69 Å²	69	33.3 Å²	33.3	71%	0.711	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.5	12.2	-179.5	0	0	0	0	0	114.4	F1018 S1019 E1020	F1018-G1022 PolarHBondContact O-N 3.4Å; S1019-G1022 WeakPolarHBondContact O-CA 3.44Å; S1019-G1022 PolarHBondContact O-N 3.35Å; E1020-G1022 VanDerWaalsContact C-N 3.29Å
1023	V	63.5	Low	80.9	Confident	39 Å²	39	28.9 Å²	28.9	24%	0.236	17%	0.171	C	C	.	.			trans	-121.4	116.7	179.8	-174.6	0	0	0	0	108.7	F1018 S1019 F1021 P1025	F1018-V1023 CarbonylContact C-O 3.35Å; F1018-V1023 WeakPolarHBondContact CB-O 3.38Å; F1018-V1023 PolarHBondContact O-N 3.35Å; S1019-V1023 WeakPolarHBondContact CA-O 3.47Å; S1019-V1023 PolarHBondContact N-O 3.5Å; S1019-V1023 VanDerWaalsContact N-O 3.12Å; F1021-V1023 VanDerWaalsContact C-N 3.34Å; V1023-P1025 WeakPolarHBondContact O-CD 3.43Å
1024	T	74.4	Confident	79.7	Confident	101 Å²	101	29.1 Å²	29.1	62%	0.62	18%	0.175	S	C	*	.			trans	-97.7	88.6	170.4	53	0	0	0	0	108.6
1025	P	84.2	Confident	78.9	Confident	5 Å²	5	31.9 Å²	31.9	3%	0.032	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-71.1	147.4	178.6	30.7	-34.9	0	0	0	110.6	N432 Y433 V1014 F1018 V1023	N432-P1025 HydrophobicContact CB-CB 3.94Å; Y433-P1025 HydrophobicContact CD2-CB 3.63Å; Y433-P1025 HydrophobicContact CD2-CG 4.13Å; Y433-P1025 HydrophobicContact CE2-CB 3.67Å; Y433-P1025 HydrophobicContact CE2-CG 4.05Å; V1014-P1025 HydrophobicContact CG1-CG 4.32Å; F1018-P1025 HydrophobicContact CB-CG 4.04Å; F1018-P1025 HydrophobicContact CD2-CG 4.01Å; F1018-P1025 HydrophobicContact CG-CG 4.48Å; V1023-P1025 WeakPolarHBondContact O-CD 3.43Å
1026	I	89.2	Confident	78.7	Confident	8 Å²	8	27 Å²	27	4%	0.041	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	121	171.5	-67.7	152.2	0	0	0	107.9	T317 E427 Q430 V431 N432 Y433 N1044	T317-I1026 HydrophobicContact CG2-CD1 3.84Å; T317-I1026 HydrophobicContact CG2-CG1 3.82Å; E427-I1026 WeakPolarHBondContact OE2-CD1 3.22Å; E427-I1026 WeakPolarHBondContact OE2-CG1 3.46Å; Q430-I1026 HydrophobicContact CB-CD1 3.29Å; Q430-I1026 HydrophobicContact CG-CD1 4.21Å; V431-I1026 HydrophobicContact CG2-CG2 4.44Å; N432-I1026 PolarHBondContact N-O 3.44Å; Y433-I1026 PolarHBondContact N-O 2.98Å; I1026-N1044 HydrophobicContact CG2-CB 4.19Å
1027	T	93	Very high	78.5	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	126.2	-178	58.1	0	0	0	0	110.1	Y433 F435 V1014 R1015 N1044 I1045	Y433-T1027 WeakPolarHBondContact O-CA 3.2Å; F435-T1027 HydrophobicContact CE2-CG2 3.76Å; F435-T1027 HydrophobicContact CZ-CG2 4.48Å; V1014-T1027 HydrophobicContact CG1-CG2 3.79Å; R1015-T1027 HydrophobicContact CB-CG2 4.23Å; T1027-N1044 PolarHBondContact N-OD1 3.23Å; T1027-N1044 WeakPolarHBondContact O-CB 3.25Å; T1027-N1044 PolarHBondContact O-N 3.38Å; T1027-N1044 PolarHBondContact OG1-N 3.17Å; T1027-N1044 PolarHBondContact OG1-OD1 3.39Å; T1027-N1044 VanDerWaalsContact OG1-OD1 3.09Å; T1027-I1045 PolarHBondContact O-N 3.29Å
1028	A	94.7	Very high	78.7	Confident	0 Å²	0	27 Å²	27	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	146.3	166.2	0	0	0	0	0	109.7	V431 Y433 L434 F435 I1045	V431-A1028 HydrophobicContact CB-CB 4.46Å; V431-A1028 HydrophobicContact CG1-CB 3.59Å; V431-A1028 HydrophobicContact CG2-CB 3.95Å; Y433-A1028 PolarHBondContact O-N 3.06Å; L434-A1028 CarbonylContact C-O 3.52Å; L434-A1028 WeakPolarHBondContact CA-O 3.39Å; L434-A1028 HydrophobicContact CD1-CB 3.93Å; F435-A1028 WeakPolarHBondContact CD2-O 3.42Å; F435-A1028 PolarHBondContact N-O 3.34Å; A1028-I1045 CarbonylContact C-O 3.52Å; A1028-I1045 VanDerWaalsContact CA-O 3.28Å; A1028-I1045 WeakPolarHBondContact CA-O 3.42Å; A1028-I1045 HydrophobicContact CB-CB 4.32Å
1029	A	95.2	Very high	79.2	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	143.5	171.5	0	0	0	0	0	110.2	F435 M1039 L1040 A1043 I1045 I1047	F435-A1029 HydrophobicContact CB-CB 4.23Å; F435-A1029 CarbonylContact O-C 3.58Å; F435-A1029 VanDerWaalsContact O-CA 3.24Å; F435-A1029 WeakPolarHBondContact O-CA 3.3Å; A1029-M1039 HydrophobicContact CB-CE 4.24Å; A1029-M1039 HydrophobicContact CB-CG 3.86Å; A1029-M1039 HydrophobicContact CB-SD 4.32Å; A1029-L1040 HydrophobicContact CB-CD2 3.99Å; A1029-L1040 WeakPolarHBondContact O-CD2 3.33Å; A1029-A1043 HydrophobicContact CB-CB 3.59Å; A1029-I1045 PolarHBondContact N-O 3.29Å; A1029-I1047 PolarHBondContact O-N 3.44Å
1030	I	94.9	Very high	79.9	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	133.1	176.9	-173.5	168.2	0	0	0	111.1	L434 F435 D437 M1039 I1047 V1049 I1065 F1068 L1071	L434-I1030 HydrophobicContact CD1-CB 4.5Å; L434-I1030 HydrophobicContact CD1-CG2 4.06Å; L434-I1030 HydrophobicContact CG-CG2 4.45Å; F435-I1030 PolarHBondContact O-N 3.12Å; D437-I1030 PolarHBondContact N-O 3.02Å; I1030-M1039 VanDerWaalsContact O-CE 3.31Å; I1030-M1039 WeakPolarHBondContact O-CE 3.42Å; I1030-I1047 VanDerWaalsContact CA-O 3.23Å; I1030-I1047 WeakPolarHBondContact CA-O 3.26Å; I1030-I1047 HydrophobicContact CB-CB 4.26Å; I1030-I1047 HydrophobicContact CD1-CG2 4.08Å; I1030-I1047 HydrophobicContact CG1-CB 4.26Å; I1030-I1047 HydrophobicContact CG1-CG2 4.19Å; I1030-V1049 HydrophobicContact CD1-CG2 3.61Å; I1030-V1049 HydrophobicContact CG1-CG2 3.65Å; I1030-I1065 HydrophobicContact CD1-CD1 3.88Å; I1030-F1068 HydrophobicContact CD1-CD2 3.83Å; I1030-F1068 HydrophobicContact CD1-CE2 4.03Å; I1030-F1068 HydrophobicContact CG2-CE2 4.13Å; I1030-L1071 HydrophobicContact CD1-CD1 4.43Å; I1030-L1071 HydrophobicContact CD1-CD2 3.93Å
1031	G	89.6	Confident	80.7	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	156.4	-171.7	0	0	0	0	0	111	T441 D1036 I1047 G1048 V1049	T441-G1031 VanDerWaalsContact CG2-C 3.48Å; T441-G1031 VanDerWaalsContact CG2-CA 3.41Å; G1031-D1036 VanDerWaalsContact CA-OD2 3.24Å; G1031-D1036 WeakPolarHBondContact CA-OD2 3.15Å; G1031-I1047 PolarHBondContact N-O 3.49Å; G1031-I1047 VanDerWaalsContact N-O 3.16Å; G1031-G1048 CarbonylContact O-C 3.59Å; G1031-G1048 VanDerWaalsContact O-CA 3.29Å; G1031-G1048 WeakPolarHBondContact O-CA 3.45Å; G1031-V1049 PolarHBondContact O-N 3.2Å
1032	D	83.7	Confident	81.8	Confident	3 Å²	3	21.1 Å²	21.1	2%	0.016	14%	0.141	C	C	.	.	S	Bend	trans	-117.7	-33	179.7	75.6	-44.1	0	0	0	112.8	T439 G440 T441 D1036 V1049 A1057	T439-D1032 VanDerWaalsContact O-OD1 3.13Å; G440-D1032 WeakPolarHBondContact CA-OD2 3.36Å; T441-D1032 HydrophobicContact CG2-CB 3.96Å; D1032-D1036 PolarHBondContact N-OD2 2.85Å; D1032-V1049 HydrophobicContact CB-CB 4.02Å; D1032-A1057 WeakPolarHBondContact O-CB 3.44Å
1033	G	69.9	Low	83.2	Confident	3 Å²	3	17.9 Å²	17.9	3%	0.031	11%	0.108	C	C	.	.	S	Bend	trans	-98.8	171.3	-175.9	0	0	0	0	0	115.7	N1035 D1036	G1033-N1035 PolarHBondContact O-N 3.32Å; G1033-D1036 PolarHBondContact O-N 3.5Å; G1033-D1036 VanDerWaalsContact O-N 3.16Å
1034	G	64.2	Low	84.5	Confident	12 Å²	12	17.3 Å²	17.3	12%	0.124	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-61.3	-30	176.8	0	0	0	0	0	113.6	I195 D1036 V1037	I195-G1034 CarbonylContact O-C 3.59Å; I195-G1034 WeakPolarHBondContact O-CA 3.37Å; G1034-D1036 PolarHBondContact O-N 3.11Å; G1034-D1036 VanDerWaalsContact O-N 3.11Å; G1034-V1037 WeakPolarHBondContact O-CB 3.39Å; G1034-V1037 WeakPolarHBondContact O-CG2 3.44Å; G1034-V1037 PolarHBondContact O-N 3.09Å; G1034-V1037 VanDerWaalsContact O-N 3.11Å
1035	N	72.6	Confident	85.4	Confident	59 Å²	59	12.5 Å²	12.5	32%	0.316	7%	0.074	S	C	.	.	G	3₁₀ helix	trans	-59.4	-22.6	175	-73.4	-26.2	0	0	0	114.2	D196 P1004 G1033	D196-N1035 PolarHBondContact O-ND2 2.95Å; P1004-N1035 WeakPolarHBondContact CB-O 3.4Å; P1004-N1035 HydrophobicContact CG-CB 4.19Å; G1033-N1035 PolarHBondContact O-N 3.32Å
1036	D	80.8	Confident	85.7	Confident	2 Å²	2	12.3 Å²	12.3	1%	0.011	7%	0.072	C	C	.	.	G	3₁₀ helix	trans	-96.1	-9.7	-178.6	-64.2	-36.6	0	0	0	113.1	D437 K1007 G1031 D1032 G1033 G1034 A1038 M1039 L1040	D437-D1036 VanDerWaalsContact CB-OD2 3.28Å; D437-D1036 WeakPolarHBondContact CB-OD2 3.15Å; K1007-D1036 IonicContact NZ-OD1 3.78Å; K1007-D1036 PolarHBondContact NZ-OD1 3.38Å; G1031-D1036 VanDerWaalsContact CA-OD2 3.24Å; G1031-D1036 WeakPolarHBondContact CA-OD2 3.15Å; D1032-D1036 PolarHBondContact N-OD2 2.85Å; G1033-D1036 PolarHBondContact O-N 3.5Å; G1033-D1036 VanDerWaalsContact O-N 3.16Å; G1034-D1036 PolarHBondContact O-N 3.11Å; G1034-D1036 VanDerWaalsContact O-N 3.11Å; D1036-A1038 VanDerWaalsContact C-N 3.27Å; D1036-A1038 PolarHBondContact O-N 3.28Å; D1036-M1039 HydrophobicContact CB-CE 3.92Å; D1036-M1039 CarbonylContact O-C 3.49Å; D1036-M1039 WeakPolarHBondContact O-CA 3.1Å; D1036-M1039 VanDerWaalsContact O-CB 3.28Å; D1036-M1039 WeakPolarHBondContact O-CB 3.49Å; D1036-M1039 PolarHBondContact O-N 3.33Å; D1036-L1040 HydrophobicContact CB-CD1 4.5Å; D1036-L1040 HydrophobicContact CB-CG 4.46Å; D1036-L1040 VanDerWaalsContact O-CG 3.32Å; D1036-L1040 WeakPolarHBondContact O-CG 2.88Å; D1036-L1040 PolarHBondContact O-N 3.37Å
1037	V	77.8	Confident	86	Confident	18 Å²	18	11.9 Å²	11.9	11%	0.109	7%	0.07	C	C	.	.	H	α-helix	trans	-55.9	-43	-176.4	170.8	0	0	0	0	111.4	G1034 M1039 L1040 L1041 E1056 A1060	G1034-V1037 WeakPolarHBondContact O-CB 3.39Å; G1034-V1037 WeakPolarHBondContact O-CG2 3.44Å; G1034-V1037 PolarHBondContact O-N 3.09Å; G1034-V1037 VanDerWaalsContact O-N 3.11Å; V1037-M1039 VanDerWaalsContact C-N 3.33Å; V1037-M1039 PolarHBondContact O-N 3.36Å; V1037-L1040 PolarHBondContact O-N 2.98Å; V1037-L1041 HydrophobicContact CG1-CD1 3.53Å; V1037-L1041 HydrophobicContact CG1-CG 4.26Å; V1037-L1041 WeakPolarHBondContact O-CB 3.45Å; V1037-L1041 VanDerWaalsContact O-CG 3.23Å; V1037-L1041 WeakPolarHBondContact O-CG 3.45Å; V1037-L1041 PolarHBondContact O-N 3.23Å; V1037-E1056 HydrophobicContact CG2-CB 4.39Å; V1037-A1060 HydrophobicContact CB-CB 4.44Å; V1037-A1060 HydrophobicContact CG1-CB 3.71Å; V1037-A1060 HydrophobicContact CG2-CB 4.15Å
1038	A	80.1	Confident	85.8	Confident	32 Å²	32	11.9 Å²	11.9	26%	0.264	7%	0.07	S	C	.	.	H	α-helix	trans	-62.1	-39.6	176.2	0	0	0	0	0	112.3	A1008 D1036 Q1042	A1008-A1038 HydrophobicContact CB-CB 3.99Å; A1008-A1038 WeakPolarHBondContact CB-O 3.19Å; D1036-A1038 VanDerWaalsContact C-N 3.27Å; D1036-A1038 PolarHBondContact O-N 3.28Å; A1038-Q1042 WeakPolarHBondContact O-CB 3.4Å; A1038-Q1042 PolarHBondContact O-N 3.42Å
1039	M	87.9	Confident	85.6	Confident	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-66	-46.1	176.4	-176.4	-173.5	59.1	0	0	111.4	F435 L830 K1007 V1011 A1029 I1030 D1036 V1037 Q1042 A1043	F435-M1039 HydrophobicContact CB-SD 4.09Å; L830-M1039 HydrophobicContact CB-SD 4.44Å; L830-M1039 HydrophobicContact CD1-SD 3.8Å; K1007-M1039 HydrophobicContact CB-CB 4.1Å; K1007-M1039 HydrophobicContact CB-CG 4.36Å; K1007-M1039 HydrophobicContact CB-SD 4.38Å; V1011-M1039 HydrophobicContact CG2-CG 3.59Å; A1029-M1039 HydrophobicContact CB-CE 4.24Å; A1029-M1039 HydrophobicContact CB-CG 3.86Å; A1029-M1039 HydrophobicContact CB-SD 4.32Å; I1030-M1039 VanDerWaalsContact O-CE 3.31Å; I1030-M1039 WeakPolarHBondContact O-CE 3.42Å; D1036-M1039 HydrophobicContact CB-CE 3.92Å; D1036-M1039 CarbonylContact O-C 3.49Å; D1036-M1039 WeakPolarHBondContact O-CA 3.1Å; D1036-M1039 VanDerWaalsContact O-CB 3.28Å; D1036-M1039 WeakPolarHBondContact O-CB 3.49Å; D1036-M1039 PolarHBondContact O-N 3.33Å; V1037-M1039 VanDerWaalsContact C-N 3.33Å; V1037-M1039 PolarHBondContact O-N 3.36Å; M1039-Q1042 PolarHBondContact O-N 2.95Å; M1039-A1043 PolarHBondContact O-N 2.99Å
1040	L	88.4	Confident	85	Confident	1 Å²	1	13.1 Å²	13.1	1%	0.005	8%	0.075	C	C	.	.	H	α-helix	trans	-63.3	-43.7	-179.6	-65.8	176.8	0	0	0	112.4	A1029 D1036 V1037 Q1042 I1047 A1057	A1029-L1040 HydrophobicContact CB-CD2 3.99Å; A1029-L1040 WeakPolarHBondContact O-CD2 3.33Å; D1036-L1040 HydrophobicContact CB-CD1 4.5Å; D1036-L1040 HydrophobicContact CB-CG 4.46Å; D1036-L1040 VanDerWaalsContact O-CG 3.32Å; D1036-L1040 WeakPolarHBondContact O-CG 2.88Å; D1036-L1040 PolarHBondContact O-N 3.37Å; V1037-L1040 PolarHBondContact O-N 2.98Å; L1040-Q1042 VanDerWaalsContact C-N 3.32Å; L1040-Q1042 PolarHBondContact O-N 2.89Å; L1040-I1047 WeakPolarHBondContact CD2-O 3.36Å; L1040-A1057 HydrophobicContact CD1-CB 3.78Å
1041	L	85.2	Confident	83.8	Confident	40 Å²	40	14 Å²	14	21%	0.209	8%	0.084	C	C	.	.	H	α-helix	trans	-70.1	-30.3	-179.8	-68.7	168.7	0	0	0	112.3	N309 V1037 A1060	N309-L1041 HydrophobicContact CB-CD1 4.05Å; V1037-L1041 HydrophobicContact CG1-CD1 3.53Å; V1037-L1041 HydrophobicContact CG1-CG 4.26Å; V1037-L1041 WeakPolarHBondContact O-CB 3.45Å; V1037-L1041 VanDerWaalsContact O-CG 3.23Å; V1037-L1041 WeakPolarHBondContact O-CG 3.45Å; V1037-L1041 PolarHBondContact O-N 3.23Å; L1041-A1060 HydrophobicContact CD2-CB 4.38Å; L1041-A1060 HydrophobicContact CG-CB 4.45Å
1042	Q	87.7	Confident	82.4	Confident	52 Å²	52	20.4 Å²	20.4	24%	0.243	11%	0.112	C	C	.	.	H	α-helix	trans	-77.4	-30.2	179.4	-168	61.4	15.2	0	0	113.1	A1008 V1011 Q1012 R1015 A1038 M1039 L1040	A1008-Q1042 HydrophobicContact CB-CB 4.26Å; V1011-Q1042 HydrophobicContact CB-CG 4.35Å; V1011-Q1042 HydrophobicContact CG1-CB 4.39Å; V1011-Q1042 HydrophobicContact CG1-CG 4.31Å; Q1012-Q1042 HydrophobicContact CB-CG 4.05Å; R1015-Q1042 PolarHBondContact NH1-O 3.15Å; A1038-Q1042 WeakPolarHBondContact O-CB 3.4Å; A1038-Q1042 PolarHBondContact O-N 3.42Å; M1039-Q1042 PolarHBondContact O-N 2.95Å; L1040-Q1042 VanDerWaalsContact C-N 3.32Å; L1040-Q1042 PolarHBondContact O-N 2.89Å
1043	A	90.3	Very high	80.9	Confident	0 Å²	0	21 Å²	21	0%	0	12%	0.115	C	C	.	.	S	Bend	trans	-66.1	155.5	176.6	0	0	0	0	0	112.3	K314 V1011 A1029 M1039 I1045	K314-A1043 PolarHBondContact NZ-O 3.09Å; V1011-A1043 HydrophobicContact CG1-CB 3.96Å; A1029-A1043 HydrophobicContact CB-CB 3.59Å; M1039-A1043 PolarHBondContact O-N 2.99Å; A1043-I1045 WeakPolarHBondContact CB-O 3.21Å; A1043-I1045 PolarHBondContact O-N 3.35Å
1044	N	90.6	Very high	80.3	Confident	28 Å²	28	21.3 Å²	21.3	15%	0.15	12%	0.118	C	C	.	.	S	Bend	trans	-59.9	-42.3	170.9	-67.6	99.1	0	0	0	110.1	K314 I1026 T1027	K314-N1044 WeakPolarHBondContact CD-O 3.49Å; K314-N1044 PolarHBondContact NZ-O 3.11Å; I1026-N1044 HydrophobicContact CG2-CB 4.19Å; T1027-N1044 PolarHBondContact N-OD1 3.23Å; T1027-N1044 WeakPolarHBondContact O-CB 3.25Å; T1027-N1044 PolarHBondContact O-N 3.38Å; T1027-N1044 PolarHBondContact OG1-N 3.17Å; T1027-N1044 PolarHBondContact OG1-OD1 3.39Å; T1027-N1044 VanDerWaalsContact OG1-OD1 3.09Å
1045	I	92.7	Very high	80.4	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	122.4	176.1	-50.2	176	0	0	0	108.8	E427 L428 V431 T1027 A1028 A1029 A1043 I1047 Y1063	E427-I1045 VanDerWaalsContact C-CD1 3.47Å; E427-I1045 HydrophobicContact CB-CD1 3.65Å; E427-I1045 HydrophobicContact CB-CG1 4.13Å; L428-I1045 HydrophobicContact CD2-CD1 3.93Å; L428-I1045 HydrophobicContact CD2-CG2 3.97Å; L428-I1045 HydrophobicContact CG-CD1 4.32Å; V431-I1045 HydrophobicContact CG2-CD1 3.86Å; T1027-I1045 PolarHBondContact O-N 3.29Å; A1028-I1045 CarbonylContact C-O 3.52Å; A1028-I1045 VanDerWaalsContact CA-O 3.28Å; A1028-I1045 WeakPolarHBondContact CA-O 3.42Å; A1028-I1045 HydrophobicContact CB-CB 4.32Å; A1029-I1045 PolarHBondContact N-O 3.29Å; A1043-I1045 WeakPolarHBondContact CB-O 3.21Å; A1043-I1045 PolarHBondContact O-N 3.35Å; I1045-I1047 HydrophobicContact CG2-CG1 4.16Å; I1045-Y1063 HydrophobicContact CG2-CD2 3.91Å; I1045-Y1063 HydrophobicContact CG2-CE2 4.11Å
1046	G	91.8	Very high	80.2	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.2	169.1	0	0	0	0	0	111	D1062 Y1063	G1046-D1062 PolarHBondContact N-OD2 3.13Å; G1046-D1062 WeakPolarHBondContact O-CA 3.3Å; G1046-D1062 WeakPolarHBondContact O-CB 3.49Å; G1046-D1062 PolarHBondContact O-N 3.01Å; G1046-Y1063 PolarHBondContact O-N 3.19Å; G1046-Y1063 VanDerWaalsContact O-N 3.12Å
1047	I	94.4	Very high	79.8	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	118.9	176.6	-55.9	176.5	0	0	0	108.4	A1029 I1030 G1031 L1040 I1045 Y1063 I1065 L1071 L1074	A1029-I1047 PolarHBondContact O-N 3.44Å; I1030-I1047 VanDerWaalsContact CA-O 3.23Å; I1030-I1047 WeakPolarHBondContact CA-O 3.26Å; I1030-I1047 HydrophobicContact CB-CB 4.26Å; I1030-I1047 HydrophobicContact CD1-CG2 4.08Å; I1030-I1047 HydrophobicContact CG1-CB 4.26Å; I1030-I1047 HydrophobicContact CG1-CG2 4.19Å; G1031-I1047 PolarHBondContact N-O 3.49Å; G1031-I1047 VanDerWaalsContact N-O 3.16Å; L1040-I1047 WeakPolarHBondContact CD2-O 3.36Å; I1045-I1047 HydrophobicContact CG2-CG1 4.16Å; I1047-Y1063 CarbonylContact C-O 3.56Å; I1047-Y1063 WeakPolarHBondContact CA-O 3.3Å; I1047-I1065 HydrophobicContact CG2-CD1 3.96Å; I1047-I1065 HydrophobicContact CG2-CG1 3.99Å; I1047-I1065 HydrophobicContact CG2-CG2 4.39Å; I1047-L1071 HydrophobicContact CD1-CD1 3.41Å; I1047-L1071 VanDerWaalsContact CD1-CD1 3.41Å; I1047-L1071 HydrophobicContact CG2-CD1 4.49Å; I1047-L1074 HydrophobicContact CD1-CD2 4.32Å
1048	G	90.4	Very high	79.8	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	133.6	176.1	0	0	0	0	0	110	G1031 S1061 Y1063 A1064 I1065	G1031-G1048 CarbonylContact O-C 3.59Å; G1031-G1048 VanDerWaalsContact O-CA 3.29Å; G1031-G1048 WeakPolarHBondContact O-CA 3.45Å; G1048-S1061 PolarHBondContact N-OG 3.33Å; G1048-Y1063 PolarHBondContact N-O 3.45Å; G1048-A1064 CarbonylContact O-C 3.53Å; G1048-A1064 WeakPolarHBondContact O-CA 3.45Å; G1048-I1065 PolarHBondContact O-N 2.99Å
1049	V	89.9	Confident	79.3	Confident	0 Å²	0	31 Å²	31	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	140.4	164.6	-177.6	0	0	0	0	107.9	T441 I1030 G1031 D1032 G1051 V1058 I1065	T441-V1049 HydrophobicContact CG2-CB 4.5Å; T441-V1049 HydrophobicContact CG2-CG2 4.18Å; I1030-V1049 HydrophobicContact CD1-CG2 3.61Å; I1030-V1049 HydrophobicContact CG1-CG2 3.65Å; G1031-V1049 PolarHBondContact O-N 3.2Å; D1032-V1049 HydrophobicContact CB-CB 4.02Å; V1049-G1051 PolarHBondContact O-N 3.4Å; V1049-V1058 WeakPolarHBondContact O-CG2 3.46Å; V1049-I1065 WeakPolarHBondContact CA-O 3.36Å; V1049-I1065 HydrophobicContact CG2-CD1 4.47Å; V1049-I1065 HydrophobicContact CG2-CG1 4.16Å
1050	Y	83.1	Confident	78.5	Confident	26 Å²	26	32.4 Å²	32.4	10%	0.102	16%	0.155	C	C	.	.			trans	-69.8	97	172	-71.2	-90.6	0	0	0	109.3	L415 N416 V1058 A1064 I1065	L415-Y1050 HydrophobicContact CD1-CD1 3.84Å; L415-Y1050 HydrophobicContact CD1-CD2 4.26Å; L415-Y1050 HydrophobicContact CD1-CE1 4.43Å; L415-Y1050 HydrophobicContact CD1-CG 3.73Å; L415-Y1050 HydrophobicContact CD2-CE1 4.43Å; N416-Y1050 PolarHBondContact O-OH 2.96Å; Y1050-V1058 HydrophobicContact CD1-CG1 4.11Å; Y1050-V1058 HydrophobicContact CD1-CG2 3.84Å; Y1050-V1058 HydrophobicContact CD2-CG2 4.44Å; Y1050-V1058 HydrophobicContact CE1-CG1 3.62Å; Y1050-V1058 HydrophobicContact CE1-CG2 4.19Å; Y1050-V1058 HydrophobicContact CG-CG2 4Å; Y1050-A1064 HydrophobicContact CE2-CB 3.9Å; Y1050-I1065 WeakPolarHBondContact CD2-O 3.43Å; Y1050-I1065 PolarHBondContact N-O 3.47Å; Y1050-I1065 VanDerWaalsContact N-O 3.1Å
1051	G	68.4	Low	78.3	Confident	18 Å²	18	32.4 Å²	32.4	19%	0.186	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-78.4	153.5	174.3	0	0	0	0	0	112.1	V1049 E1053	V1049-G1051 PolarHBondContact O-N 3.4Å; G1051-E1053 PolarHBondContact O-N 3.41Å
1052	K	61.2	Low	78.5	Confident	134 Å²	134	31 Å²	31	58%	0.583	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-29.5	159.8	-64.1	-176.2	-174.5	177.1	0	110.6	N199 E446 G1054	N199-K1052 WeakPolarHBondContact ND2-CB 3Å; N199-K1052 PolarHBondContact OD1-O 2.97Å; E446-K1052 IonicContact OE1-NZ 3.72Å; E446-K1052 PolarHBondContact OE1-NZ 3.35Å; K1052-G1054 VanDerWaalsContact C-N 3.25Å; K1052-G1054 PolarHBondContact O-N 3.15Å
1053	E	52.5	Low	78.7	Confident	16 Å²	16	28.5 Å²	28.5	8%	0.075	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-12.7	179.7	-75	-152.3	-178	0	0	115.6	V193 G197 N199 N445 G1051	V193-E1053 CarbonylContact C-O 3.46Å; V193-E1053 WeakPolarHBondContact CA-O 3.46Å; V193-E1053 WeakPolarHBondContact CB-O 3.38Å; V193-E1053 WeakPolarHBondContact CG1-O 3.23Å; G197-E1053 VanDerWaalsContact CA-OE2 3.32Å; G197-E1053 WeakPolarHBondContact CA-OE2 3.48Å; G197-E1053 VanDerWaalsContact O-CA 3.24Å; G197-E1053 WeakPolarHBondContact O-CA 3.35Å; G197-E1053 WeakPolarHBondContact O-CB 3.41Å; G197-E1053 WeakPolarHBondContact O-CG 3.32Å; N199-E1053 HydrophobicContact CB-CG 4.48Å; N199-E1053 WeakPolarHBondContact ND2-CG 3.25Å; N199-E1053 PolarHBondContact ND2-N 3.48Å; N199-E1053 VanDerWaalsContact OD1-CA 3.29Å; N199-E1053 WeakPolarHBondContact OD1-CA 3.49Å; N445-E1053 PolarHBondContact ND2-OE1 3Å; G1051-E1053 PolarHBondContact O-N 3.41Å
1054	G	56.4	Low	78.7	Confident	10 Å²	10	28.5 Å²	28.5	10%	0.103	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	138.7	175.6	178.8	0	0	0	0	0	112.3	K1052	K1052-G1054 VanDerWaalsContact C-N 3.25Å; K1052-G1054 PolarHBondContact O-N 3.15Å
1055	K	67.3	Low	78.8	Confident	126 Å²	126	27.1 Å²	27.1	55%	0.548	13%	0.129	S	C	.	.	S	Bend	trans	-111.6	16.6	179.2	-64.3	-173.4	-179.7	-177.1	0	112.7	R1059	K1055-R1059 WeakPolarHBondContact O-CB 3.47Å; K1055-R1059 WeakPolarHBondContact O-CG 3.49Å; K1055-R1059 PolarHBondContact O-N 3.27Å
1056	E	67.3	Low	78.6	Confident	31 Å²	31	27.2 Å²	27.2	15%	0.145	13%	0.129	C	C	.	.	H	α-helix	trans	-70.6	-48.6	-176.2	-71.5	-154.7	179.8	0	0	113	N194 L304 V1037 V1058 R1059 A1060	N194-E1056 WeakPolarHBondContact CA-OE1 3.43Å; N194-E1056 HydrophobicContact CB-CG 4.15Å; N194-E1056 VanDerWaalsContact CB-OE1 3.24Å; N194-E1056 WeakPolarHBondContact CB-OE1 3.29Å; N194-E1056 WeakPolarHBondContact O-CB 3.26Å; N194-E1056 WeakPolarHBondContact O-CG 3.3Å; N194-E1056 VanDerWaalsContact O-OE1 3.11Å; L304-E1056 WeakPolarHBondContact CD1-OE1 3.43Å; V1037-E1056 HydrophobicContact CG2-CB 4.39Å; E1056-V1058 VanDerWaalsContact C-N 3.26Å; E1056-V1058 PolarHBondContact O-N 3.33Å; E1056-R1059 PolarHBondContact O-N 2.93Å; E1056-A1060 PolarHBondContact O-N 3.49Å
1057	A	73.2	Confident	78.5	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-55.9	-44.7	173.5	0	0	0	0	0	111.2	D1032 L1040 R1059 A1060 S1061	D1032-A1057 WeakPolarHBondContact O-CB 3.44Å; L1040-A1057 HydrophobicContact CD1-CB 3.78Å; A1057-R1059 VanDerWaalsContact C-N 3.28Å; A1057-R1059 PolarHBondContact O-N 3.36Å; A1057-A1060 PolarHBondContact O-N 3Å; A1057-S1061 WeakPolarHBondContact O-CB 3.5Å; A1057-S1061 PolarHBondContact O-N 3.18Å; A1057-S1061 PolarHBondContact O-OG 2.92Å
1058	V	77.9	Confident	78.4	Confident	8 Å²	8	27.9 Å²	27.9	5%	0.048	13%	0.132	C	C	.	.	H	α-helix	trans	-61.1	-31.7	176.9	166.4	0	0	0	0	113.5	N420 V1049 Y1050 E1056 S1061 A1064	N420-V1058 PolarHBondContact ND2-O 3.16Å; V1049-V1058 WeakPolarHBondContact O-CG2 3.46Å; Y1050-V1058 HydrophobicContact CD1-CG1 4.11Å; Y1050-V1058 HydrophobicContact CD1-CG2 3.84Å; Y1050-V1058 HydrophobicContact CD2-CG2 4.44Å; Y1050-V1058 HydrophobicContact CE1-CG1 3.62Å; Y1050-V1058 HydrophobicContact CE1-CG2 4.19Å; Y1050-V1058 HydrophobicContact CG-CG2 4Å; E1056-V1058 VanDerWaalsContact C-N 3.26Å; E1056-V1058 PolarHBondContact O-N 3.33Å; V1058-S1061 PolarHBondContact O-OG 3.48Å; V1058-A1064 HydrophobicContact CB-CB 4.18Å; V1058-A1064 HydrophobicContact CG1-CB 3.63Å; V1058-A1064 HydrophobicContact CG2-CB 4.11Å
1059	R	69.1	Low	78.5	Confident	160 Å²	160	31.7 Å²	31.7	60%	0.604	15%	0.149	S	C	*	.	H	α-helix	trans	-80.7	-35.5	177.3	-75.8	175	71.5	-179.2	2.5	112	K1055 E1056 A1057	K1055-R1059 WeakPolarHBondContact O-CB 3.47Å; K1055-R1059 WeakPolarHBondContact O-CG 3.49Å; K1055-R1059 PolarHBondContact O-N 3.27Å; E1056-R1059 PolarHBondContact O-N 2.93Å; A1057-R1059 VanDerWaalsContact C-N 3.28Å; A1057-R1059 PolarHBondContact O-N 3.36Å
1060	A	71	Confident	78.7	Confident	30 Å²	30	32.1 Å²	32.1	25%	0.248	15%	0.151	C	C	.	.	H	α-helix	trans	-83.4	-21	179.8	0	0	0	0	0	113.5	V1037 L1041 E1056 A1057	V1037-A1060 HydrophobicContact CB-CB 4.44Å; V1037-A1060 HydrophobicContact CG1-CB 3.71Å; V1037-A1060 HydrophobicContact CG2-CB 4.15Å; L1041-A1060 HydrophobicContact CD2-CB 4.38Å; L1041-A1060 HydrophobicContact CG-CB 4.45Å; E1056-A1060 PolarHBondContact O-N 3.49Å; A1057-A1060 PolarHBondContact O-N 3Å
1061	S	84.8	Confident	79.2	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.014	15%	0.146	C	C	.	.	S	Bend	trans	-75.1	157.6	-178	67.6	0	0	0	0	113.2	N420 G1048 A1057 V1058 Y1063	N420-S1061 WeakPolarHBondContact CB-O 3.33Å; N420-S1061 PolarHBondContact ND2-O 2.96Å; G1048-S1061 PolarHBondContact N-OG 3.33Å; A1057-S1061 WeakPolarHBondContact O-CB 3.5Å; A1057-S1061 PolarHBondContact O-N 3.18Å; A1057-S1061 PolarHBondContact O-OG 2.92Å; V1058-S1061 PolarHBondContact O-OG 3.48Å; S1061-Y1063 WeakPolarHBondContact CB-O 3.46Å; S1061-Y1063 PolarHBondContact OG-O 3.35Å
1062	D	88.3	Confident	80.4	Confident	9 Å²	9	31.2 Å²	31.2	5%	0.048	14%	0.143	C	C	.	.	S	Bend	trans	-77.2	-37.4	172.8	-63.2	-58.2	0	0	0	111.3	K314 N420 T421 L424 G1046	K314-D1062 IonicContact NZ-OD1 2.73Å; K314-D1062 IonicContact NZ-OD2 3.99Å; K314-D1062 PolarHBondContact NZ-OD2 2.91Å; N420-D1062 PolarHBondContact N-O 2.89Å; T421-D1062 WeakPolarHBondContact CB-OD1 3.38Å; T421-D1062 PolarHBondContact N-O 3.21Å; T421-D1062 VanDerWaalsContact N-O 3.11Å; T421-D1062 PolarHBondContact OG1-OD1 2.98Å; L424-D1062 HydrophobicContact CD1-CB 4.03Å; L424-D1062 VanDerWaalsContact CD1-CG 3.48Å; G1046-D1062 PolarHBondContact N-OD2 3.13Å; G1046-D1062 WeakPolarHBondContact O-CA 3.3Å; G1046-D1062 WeakPolarHBondContact O-CB 3.49Å; G1046-D1062 PolarHBondContact O-N 3.01Å
1063	Y	91.5	Very high	82	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	150.1	173.2	-62.3	-85.9	0	0	0	110.1	I402 K418 S419 T421 L424 V425 L428 I1045 G1046 I1047 G1048 S1061	I402-Y1063 HydrophobicContact CD1-CE1 4.33Å; K418-Y1063 CarbonylContact O-C 3.47Å; K418-Y1063 WeakPolarHBondContact O-CA 3.46Å; S419-Y1063 WeakPolarHBondContact OG-CE1 3.44Å; T421-Y1063 PolarHBondContact O-OH 3.13Å; L424-Y1063 VanDerWaalsContact C-OH 3.31Å; L424-Y1063 HydrophobicContact CB-CE2 4.38Å; V425-Y1063 WeakPolarHBondContact CA-OH 3.32Å; V425-Y1063 HydrophobicContact CG2-CE1 4.28Å; V425-Y1063 WeakPolarHBondContact CG2-OH 3.48Å; V425-Y1063 PolarHBondContact N-OH 3.47Å; L428-Y1063 HydrophobicContact CD1-CD2 4.42Å; L428-Y1063 HydrophobicContact CD1-CE1 4.07Å; L428-Y1063 HydrophobicContact CD1-CE2 3.91Å; L428-Y1063 HydrophobicContact CD2-CD2 4.09Å; L428-Y1063 HydrophobicContact CD2-CE2 3.98Å; L428-Y1063 HydrophobicContact CG-CE2 4.02Å; I1045-Y1063 HydrophobicContact CG2-CD2 3.91Å; I1045-Y1063 HydrophobicContact CG2-CE2 4.11Å; G1046-Y1063 PolarHBondContact O-N 3.19Å; G1046-Y1063 VanDerWaalsContact O-N 3.12Å; I1047-Y1063 CarbonylContact C-O 3.56Å; I1047-Y1063 WeakPolarHBondContact CA-O 3.3Å; G1048-Y1063 PolarHBondContact N-O 3.45Å; S1061-Y1063 WeakPolarHBondContact CB-O 3.46Å; S1061-Y1063 PolarHBondContact OG-O 3.35Å
1064	A	90.3	Very high	84	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	123.2	174.5	0	0	0	0	0	110.6	T417 K418 G1048 Y1050 V1058	T417-A1064 CarbonylContact C-O 3.57Å; T417-A1064 WeakPolarHBondContact CA-O 3.43Å; T417-A1064 WeakPolarHBondContact CG2-O 3.33Å; K418-A1064 HydrophobicContact CB-CB 4.28Å; K418-A1064 PolarHBondContact N-O 2.9Å; K418-A1064 PolarHBondContact O-N 3.16Å; G1048-A1064 CarbonylContact O-C 3.53Å; G1048-A1064 WeakPolarHBondContact O-CA 3.45Å; Y1050-A1064 HydrophobicContact CE2-CB 3.9Å; V1058-A1064 HydrophobicContact CB-CB 4.18Å; V1058-A1064 HydrophobicContact CG1-CB 3.63Å; V1058-A1064 HydrophobicContact CG2-CB 4.11Å
1065	I	92.9	Very high	85.8	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	142.6	-176.8	60.9	176.6	0	0	0	111	T417 I1030 I1047 G1048 V1049 Y1050 Q1067 H1070 L1071 L1074	T417-I1065 HydrophobicContact CG2-CG2 3.89Å; I1030-I1065 HydrophobicContact CD1-CD1 3.88Å; I1047-I1065 HydrophobicContact CG2-CD1 3.96Å; I1047-I1065 HydrophobicContact CG2-CG1 3.99Å; I1047-I1065 HydrophobicContact CG2-CG2 4.39Å; G1048-I1065 PolarHBondContact O-N 2.99Å; V1049-I1065 WeakPolarHBondContact CA-O 3.36Å; V1049-I1065 HydrophobicContact CG2-CD1 4.47Å; V1049-I1065 HydrophobicContact CG2-CG1 4.16Å; Y1050-I1065 WeakPolarHBondContact CD2-O 3.43Å; Y1050-I1065 PolarHBondContact N-O 3.47Å; Y1050-I1065 VanDerWaalsContact N-O 3.1Å; I1065-Q1067 WeakPolarHBondContact CD1-O 3.44Å; I1065-Q1067 PolarHBondContact O-N 2.77Å; I1065-H1070 HydrophobicContact CB-CB 4.3Å; I1065-L1071 HydrophobicContact CD1-CB 3.9Å; I1065-L1071 HydrophobicContact CD1-CD1 4.46Å; I1065-L1074 HydrophobicContact CG2-CD2 3.84Å
1066	P	88.9	Confident	87	Confident	1 Å²	1	19.2 Å²	19.2	1%	0.006	9%	0.087	C	C	.	.	S	Bend	trans	-61.5	-40.7	-179.9	-26.2	34.1	0	0	0	115	D410 L415 T417	D410-P1066 HydrophobicContact CB-CB 3.57Å; D410-P1066 HydrophobicContact CB-CG 4.15Å; L415-P1066 HydrophobicContact CB-CB 4.31Å; L415-P1066 HydrophobicContact CB-CG 4.1Å; L415-P1066 VanDerWaalsContact O-CG 3.23Å; L415-P1066 WeakPolarHBondContact O-CG 3.35Å; T417-P1066 WeakPolarHBondContact OG1-CD 3.35Å
1067	Q	90.5	Very high	88.3	Confident	14 Å²	14	17.7 Å²	17.7	7%	0.065	8%	0.08	C	C	.	.	S	Bend	trans	-144.2	157	-173.9	-66.5	179.8	-1.4	0	0	109.3	D410 I1065 K1069 H1070	D410-Q1067 PolarHBondContact OD1-NE2 2.85Å; D410-Q1067 PolarHBondContact OD2-NE2 2.97Å; I1065-Q1067 WeakPolarHBondContact CD1-O 3.44Å; I1065-Q1067 PolarHBondContact O-N 2.77Å; Q1067-K1069 VanDerWaalsContact C-N 3.32Å; Q1067-K1069 HydrophobicContact CB-CG 4.28Å; Q1067-K1069 PolarHBondContact O-N 3.26Å; Q1067-K1069 VanDerWaalsContact OE1-NZ 3.15Å; Q1067-H1070 PolarHBondContact N-ND1 3.33Å; Q1067-H1070 WeakPolarHBondContact O-CB 3.32Å; Q1067-H1070 PolarHBondContact O-N 3.04Å
1068	F	92.4	Very high	89.3	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-36.3	-178.8	-169.9	-88.6	0	0	0	113.3	L442 V813 C816 L817 I1030 H1070 L1071	L442-F1068 HydrophobicContact CD2-CD1 4.41Å; L442-F1068 HydrophobicContact CD2-CD2 3.95Å; L442-F1068 HydrophobicContact CD2-CE1 4.05Å; L442-F1068 HydrophobicContact CD2-CE2 3.54Å; L442-F1068 HydrophobicContact CD2-CG 4.37Å; L442-F1068 HydrophobicContact CD2-CZ 3.6Å; V813-F1068 HydrophobicContact CB-CD1 4.3Å; V813-F1068 HydrophobicContact CG1-CD1 4.32Å; V813-F1068 HydrophobicContact CG1-CE1 4.38Å; V813-F1068 HydrophobicContact CG2-CB 3.98Å; V813-F1068 HydrophobicContact CG2-CD1 3.78Å; V813-F1068 HydrophobicContact CG2-CG 4.07Å; C816-F1068 HydrophobicContact CB-CD1 4.21Å; C816-F1068 HydrophobicContact CB-CE1 4.06Å; L817-F1068 HydrophobicContact CD2-CE1 4.08Å; L817-F1068 HydrophobicContact CD2-CZ 3.85Å; L817-F1068 HydrophobicContact CG-CE1 4.09Å; L817-F1068 HydrophobicContact CG-CZ 4.32Å; I1030-F1068 HydrophobicContact CD1-CD2 3.83Å; I1030-F1068 HydrophobicContact CD1-CE2 4.03Å; I1030-F1068 HydrophobicContact CG2-CE2 4.13Å; F1068-H1070 PolarHBondContact O-N 3.11Å; F1068-H1070 VanDerWaalsContact O-N 3.11Å; F1068-L1071 HydrophobicContact CE2-CD2 4.06Å; F1068-L1071 HydrophobicContact CZ-CD2 4Å; F1068-L1071 WeakPolarHBondContact O-CB 3.31Å; F1068-L1071 PolarHBondContact O-N 3.47Å
1069	K	91.3	Very high	90	Very high	81 Å²	81	18.1 Å²	18.1	35%	0.352	8%	0.081	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-32.2	179.3	70.8	-174.5	-172.3	-169	0	113.8	P811 Q1067 L1071 Q1072	P811-K1069 WeakPolarHBondContact O-CB 3.44Å; Q1067-K1069 VanDerWaalsContact C-N 3.32Å; Q1067-K1069 HydrophobicContact CB-CG 4.28Å; Q1067-K1069 PolarHBondContact O-N 3.26Å; Q1067-K1069 VanDerWaalsContact OE1-NZ 3.15Å; K1069-L1071 PolarHBondContact O-N 2.92Å; K1069-Q1072 PolarHBondContact O-N 3.07Å
1070	H	93.5	Very high	91.1	Very high	9 Å²	9	10.6 Å²	10.6	4%	0.042	5%	0.053	C	C	.	.	H	α-helix	trans	-67.2	-18.9	-179.6	-60.1	141.5	0	0	0	112.3	N407 L408 I1065 Q1067 F1068 Q1072 R1073 L1074	N407-H1070 PolarHBondContact O-CD2 3.17Å; L408-H1070 HydrophobicContact CD2-CB 3.74Å; L408-H1070 WeakPolarHBondContact CD2-O 3.41Å; I1065-H1070 HydrophobicContact CB-CB 4.3Å; Q1067-H1070 PolarHBondContact N-ND1 3.33Å; Q1067-H1070 WeakPolarHBondContact O-CB 3.32Å; Q1067-H1070 PolarHBondContact O-N 3.04Å; F1068-H1070 PolarHBondContact O-N 3.11Å; F1068-H1070 VanDerWaalsContact O-N 3.11Å; H1070-Q1072 PolarHBondContact O-N 2.68Å; H1070-R1073 PolarHBondContact O-N 3.09Å; H1070-L1074 WeakPolarHBondContact O-CB 3.49Å; H1070-L1074 PolarHBondContact O-N 3.36Å
1071	L	94.3	Very high	92.1	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-59.2	-36.3	174.9	-174.8	62.8	0	0	0	112.3	L434 L820 I1030 I1047 I1065 F1068 K1069 L1074 L1075	L434-L1071 HydrophobicContact CD1-CD2 4.33Å; L434-L1071 HydrophobicContact CD2-CD2 3.61Å; L820-L1071 HydrophobicContact CD1-CD2 4.11Å; I1030-L1071 HydrophobicContact CD1-CD1 4.43Å; I1030-L1071 HydrophobicContact CD1-CD2 3.93Å; I1047-L1071 HydrophobicContact CD1-CD1 3.41Å; I1047-L1071 VanDerWaalsContact CD1-CD1 3.41Å; I1047-L1071 HydrophobicContact CG2-CD1 4.49Å; I1065-L1071 HydrophobicContact CD1-CB 3.9Å; I1065-L1071 HydrophobicContact CD1-CD1 4.46Å; F1068-L1071 HydrophobicContact CE2-CD2 4.06Å; F1068-L1071 HydrophobicContact CZ-CD2 4Å; F1068-L1071 WeakPolarHBondContact O-CB 3.31Å; F1068-L1071 PolarHBondContact O-N 3.47Å; K1069-L1071 PolarHBondContact O-N 2.92Å; L1071-L1074 PolarHBondContact O-N 3.14Å; L1071-L1075 HydrophobicContact CD1-CD1 3.82Å; L1071-L1075 HydrophobicContact CD1-CG 4.04Å; L1071-L1075 HydrophobicContact CG-CD1 3.99Å; L1071-L1075 HydrophobicContact CG-CG 4.48Å; L1071-L1075 PolarHBondContact O-N 3.44Å
1072	Q	93.7	Very high	92.5	Very high	25 Å²	25	9.5 Å²	9.5	12%	0.117	4%	0.042	C	C	.	.	H	α-helix	trans	-58.9	-53.4	177.9	178.9	176.7	-30.3	0	0	110.7	N819 K1069 H1070 L1075 L1076	N819-Q1072 HydrophobicContact CB-CG 4.41Å; N819-Q1072 PolarHBondContact ND2-NE2 2.96Å; N819-Q1072 PolarHBondContact ND2-OE1 3.36Å; K1069-Q1072 PolarHBondContact O-N 3.07Å; H1070-Q1072 PolarHBondContact O-N 2.68Å; Q1072-L1075 PolarHBondContact O-N 3.01Å; Q1072-L1076 HydrophobicContact CG-CD1 3.58Å; Q1072-L1076 HydrophobicContact CG-CG 4.26Å; Q1072-L1076 VanDerWaalsContact O-CB 3.24Å; Q1072-L1076 WeakPolarHBondContact O-CB 3.3Å; Q1072-L1076 VanDerWaalsContact O-CG 3.31Å; Q1072-L1076 WeakPolarHBondContact O-CG 3.43Å; Q1072-L1076 PolarHBondContact O-N 2.76Å
1073	R	94.2	Very high	92.7	Very high	31 Å²	31	9.2 Å²	9.2	12%	0.117	4%	0.041	C	C	.	.	H	α-helix	trans	-67.5	-38.4	-179.1	-174.7	171.1	179.9	105	3.9	111.9	D405 N407 L408 H1070 L1075 V1077 H1078 D1148	D405-R1073 IonicContact OD1-CZ 2.63Å; D405-R1073 IonicContact OD1-NE 2.64Å; D405-R1073 IonicContact OD1-NH2 2.7Å; D405-R1073 IonicContact OD2-CZ 2.92Å; D405-R1073 IonicContact OD2-NE 2.79Å; D405-R1073 PolarHBondContact OD2-NE 3.24Å; D405-R1073 IonicContact OD2-NH2 3.14Å; D405-R1073 PolarHBondContact OD2-NH2 2.92Å; N407-R1073 VanDerWaalsContact CB-CD 3.43Å; N407-R1073 VanDerWaalsContact CB-NE 3.28Å; N407-R1073 PolarHBondContact ND2-NH1 2.9Å; N407-R1073 PolarHBondContact ND2-NH2 3.5Å; N407-R1073 VanDerWaalsContact ND2-NH2 3.16Å; L408-R1073 HydrophobicContact CD2-CB 4.02Å; L408-R1073 HydrophobicContact CD2-CG 4.27Å; H1070-R1073 PolarHBondContact O-N 3.09Å; R1073-L1075 PolarHBondContact O-N 3.28Å; R1073-V1077 HydrophobicContact CG-CB 4.27Å; R1073-V1077 HydrophobicContact CG-CG2 4.15Å; R1073-V1077 WeakPolarHBondContact O-CB 3.35Å; R1073-V1077 PolarHBondContact O-N 3.27Å; R1073-V1077 VanDerWaalsContact O-N 3.12Å; R1073-H1078 PolarHBondContact O-N 2.79Å; R1073-D1148 IonicContact NH2-OD2 3.17Å; R1073-D1148 PolarHBondContact NH2-OD2 3.23Å; R1073-D1148 VanDerWaalsContact NH2-OD2 3.16Å
1074	L	95.2	Very high	92.7	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.047	C	C	.	.	I	π-helix	trans	-59.3	-45.3	176.8	-178.9	64.3	0	0	0	112.2	I402 L428 I1047 I1065 H1070 L1071 H1078 G1079	I402-L1074 HydrophobicContact CD1-CD1 4.27Å; I402-L1074 HydrophobicContact CG2-CD1 3.75Å; L428-L1074 HydrophobicContact CD1-CD1 3.94Å; L428-L1074 HydrophobicContact CD1-CG 4.24Å; I1047-L1074 HydrophobicContact CD1-CD2 4.32Å; I1065-L1074 HydrophobicContact CG2-CD2 3.84Å; H1070-L1074 WeakPolarHBondContact O-CB 3.49Å; H1070-L1074 PolarHBondContact O-N 3.36Å; L1071-L1074 PolarHBondContact O-N 3.14Å; L1074-H1078 WeakPolarHBondContact O-CB 3.39Å; L1074-G1079 PolarHBondContact O-N 3.3Å
1075	L	94.3	Very high	92.8	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	5%	0.05	C	C	.	.	I	π-helix	trans	-82.2	-52.1	-179	-66.9	176.5	0	0	0	112.5	L428 V431 L820 I825 L1071 Q1072 R1073 G1079 H1080 Y1158	L428-L1075 HydrophobicContact CB-CD2 4.22Å; L428-L1075 HydrophobicContact CD2-CD2 3.83Å; L428-L1075 WeakPolarHBondContact O-CD2 3.36Å; V431-L1075 HydrophobicContact CG2-CD2 3.98Å; L820-L1075 HydrophobicContact CD2-CD1 3.85Å; I825-L1075 HydrophobicContact CD1-CD1 4.21Å; L1071-L1075 HydrophobicContact CD1-CD1 3.82Å; L1071-L1075 HydrophobicContact CD1-CG 4.04Å; L1071-L1075 HydrophobicContact CG-CD1 3.99Å; L1071-L1075 HydrophobicContact CG-CG 4.48Å; L1071-L1075 PolarHBondContact O-N 3.44Å; Q1072-L1075 PolarHBondContact O-N 3.01Å; R1073-L1075 PolarHBondContact O-N 3.28Å; L1075-G1079 WeakPolarHBondContact O-CA 3.32Å; L1075-G1079 PolarHBondContact O-N 3.44Å; L1075-H1080 PolarHBondContact O-N 3.43Å; L1075-Y1158 VanDerWaalsContact O-CE2 3.31Å; L1075-Y1158 WeakPolarHBondContact O-CE2 3.31Å
1076	L	93	Very high	92.8	Very high	2 Å²	2	11.5 Å²	11.5	1%	0.01	5%	0.05	C	C	.	.	I	π-helix	trans	-74.2	-33.6	-170.4	-59.6	-175.4	0	0	0	113.3	N819 A823 Q1072 H1080 P1155 Y1158	N819-L1076 HydrophobicContact CB-CD1 4.38Å; A823-L1076 HydrophobicContact CB-CD2 3.58Å; Q1072-L1076 HydrophobicContact CG-CD1 3.58Å; Q1072-L1076 HydrophobicContact CG-CG 4.26Å; Q1072-L1076 VanDerWaalsContact O-CB 3.24Å; Q1072-L1076 WeakPolarHBondContact O-CB 3.3Å; Q1072-L1076 VanDerWaalsContact O-CG 3.31Å; Q1072-L1076 WeakPolarHBondContact O-CG 3.43Å; Q1072-L1076 PolarHBondContact O-N 2.76Å; L1076-H1080 WeakPolarHBondContact O-CB 3.19Å; L1076-P1155 HydrophobicContact CD1-CB 3.8Å; L1076-P1155 HydrophobicContact CD1-CG 4.06Å; L1076-P1155 HydrophobicContact CD2-CB 4.47Å; L1076-Y1158 HydrophobicContact CD2-CD2 4.04Å; L1076-Y1158 HydrophobicContact CD2-CG 4.02Å
1077	V	93.5	Very high	92.9	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	5%	0.05	C	C	.	.	I	π-helix	trans	-97.2	-68.6	179.6	-176.9	0	0	0	0	109.9	R1073 G1079 H1080 Q1081 D1148 L1151 N1152	R1073-V1077 HydrophobicContact CG-CB 4.27Å; R1073-V1077 HydrophobicContact CG-CG2 4.15Å; R1073-V1077 WeakPolarHBondContact O-CB 3.35Å; R1073-V1077 PolarHBondContact O-N 3.27Å; R1073-V1077 VanDerWaalsContact O-N 3.12Å; V1077-G1079 PolarHBondContact O-N 2.72Å; V1077-H1080 PolarHBondContact O-N 2.79Å; V1077-Q1081 WeakPolarHBondContact O-CB 3.45Å; V1077-Q1081 WeakPolarHBondContact O-CG 3.47Å; V1077-Q1081 PolarHBondContact O-N 3.03Å; V1077-D1148 HydrophobicContact CG1-CB 3.92Å; V1077-L1151 HydrophobicContact CG1-CD1 4.44Å; V1077-L1151 HydrophobicContact CG2-CB 4.17Å; V1077-N1152 WeakPolarHBondContact CG2-OD1 3.42Å
1078	H	94.5	Very high	93	Very high	17 Å²	17	11.1 Å²	11.1	8%	0.079	5%	0.048	C	C	.	.	I	π-helix	trans	-65	-46.3	-173.4	-73.4	-75	0	0	0	112.3	I402 D405 R1073 L1074 H1080 Q1081 A1082	I402-H1078 HydrophobicContact CD1-CB 4.11Å; I402-H1078 HydrophobicContact CG1-CB 3.87Å; D405-H1078 IonicContact OD2-CD2 3.67Å; D405-H1078 IonicContact OD2-CE1 3.49Å; D405-H1078 IonicContact OD2-NE2 3.99Å; D405-H1078 PolarHBondContact OD2-NE2 2.67Å; R1073-H1078 PolarHBondContact O-N 2.79Å; L1074-H1078 WeakPolarHBondContact O-CB 3.39Å; H1078-H1080 PolarHBondContact O-N 3.19Å; H1078-Q1081 PolarHBondContact O-N 3.47Å; H1078-A1082 WeakPolarHBondContact O-CB 3.42Å; H1078-A1082 PolarHBondContact O-N 2.81Å
1079	G	92.9	Very high	93	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	5%	0.048	C	C	.	.	I	π-helix	trans	-60.5	-45.3	176.8	0	0	0	0	0	112.7	G429 L1074 L1075 V1077 N1083	G429-G1079 WeakPolarHBondContact CA-O 3.05Å; G429-G1079 PolarHBondContact N-O 3.01Å; L1074-G1079 PolarHBondContact O-N 3.3Å; L1075-G1079 WeakPolarHBondContact O-CA 3.32Å; L1075-G1079 PolarHBondContact O-N 3.44Å; V1077-G1079 PolarHBondContact O-N 2.72Å; G1079-N1083 WeakPolarHBondContact O-CB 3.43Å; G1079-N1083 PolarHBondContact O-N 3.11Å; G1079-N1083 VanDerWaalsContact O-N 3.08Å
1080	H	92.4	Very high	93.1	Very high	1 Å²	1	7.5 Å²	7.5	1%	0.005	3%	0.033	C	C	.	.	H	α-helix	trans	-62.1	-50.5	177.6	-178.2	97.4	0	0	0	112	L1075 L1076 V1077 H1078 Y1084 H1145 L1151 Y1158 L1161	L1075-H1080 PolarHBondContact O-N 3.43Å; L1076-H1080 WeakPolarHBondContact O-CB 3.19Å; V1077-H1080 PolarHBondContact O-N 2.79Å; H1078-H1080 PolarHBondContact O-N 3.19Å; H1080-Y1084 WeakPolarHBondContact O-CB 3.35Å; H1080-Y1084 PolarHBondContact O-N 3.46Å; H1080-Y1084 VanDerWaalsContact O-N 3.12Å; H1080-H1145 AromaticContact CD2-CE1 3.39Å; H1080-H1145 PolarHBondContact CD2-CE1 3.09Å; H1080-H1145 AromaticContact CD2-NE2 3.57Å; H1080-H1145 AromaticContact CE1-NE2 3.98Å; H1080-H1145 AromaticContact NE2-CE1 3.2Å; H1080-H1145 PolarHBondContact NE2-CE1 3.48Å; H1080-H1145 AromaticContact NE2-NE2 2.87Å; H1080-H1145 PolarHBondContact NE2-NE2 3.24Å; H1080-L1151 VanDerWaalsContact CD2-CD2 3.46Å; H1080-L1151 WeakPolarHBondContact CD2-CD2 2.91Å; H1080-Y1158 HydrophobicContact CB-CD2 4.47Å; H1080-L1161 HydrophobicContact CB-CD1 3.97Å; H1080-L1161 VanDerWaalsContact CG-CD1 3.48Å; H1080-L1161 WeakPolarHBondContact ND1-CD1 3.34Å; H1080-L1161 WeakPolarHBondContact O-CD1 3.27Å
1081	Q	91.9	Very high	93.1	Very high	7 Å²	7	7 Å²	7	3%	0.033	3%	0.031	C	C	.	.	H	α-helix	trans	-63.4	-46.6	179.4	-72	-179.6	-2.9	0	0	111.7	V1077 H1078 N1083 Y1084 R1085 D1148 L1151	V1077-Q1081 WeakPolarHBondContact O-CB 3.45Å; V1077-Q1081 WeakPolarHBondContact O-CG 3.47Å; V1077-Q1081 PolarHBondContact O-N 3.03Å; H1078-Q1081 PolarHBondContact O-N 3.47Å; Q1081-N1083 PolarHBondContact O-N 2.83Å; Q1081-Y1084 PolarHBondContact O-N 3.07Å; Q1081-R1085 VanDerWaalsContact O-CB 3.3Å; Q1081-R1085 WeakPolarHBondContact O-CB 3.43Å; Q1081-R1085 WeakPolarHBondContact O-CG 3.31Å; Q1081-R1085 PolarHBondContact O-N 3.11Å; Q1081-R1085 VanDerWaalsContact OE1-NH2 3.13Å; Q1081-D1148 PolarHBondContact NE2-OD1 3.21Å; Q1081-L1151 HydrophobicContact CG-CD1 3.88Å
1082	A	92.8	Very high	93	Very high	2 Å²	2	7 Å²	7	2%	0.017	3%	0.031	C	C	.	.	H	α-helix	trans	-59.9	-47.1	-179.8	0	0	0	0	0	112.7	L398 V425 H1078 Y1084 R1085 I1086	L398-A1082 HydrophobicContact CD1-CB 4Å; V425-A1082 HydrophobicContact CG1-CB 3.52Å; H1078-A1082 WeakPolarHBondContact O-CB 3.42Å; H1078-A1082 PolarHBondContact O-N 2.81Å; A1082-Y1084 VanDerWaalsContact C-N 3.34Å; A1082-Y1084 PolarHBondContact O-N 2.92Å; A1082-R1085 PolarHBondContact O-N 2.9Å; A1082-I1086 WeakPolarHBondContact O-CG1 3.39Å; A1082-I1086 PolarHBondContact O-N 3.1Å
1083	N	92	Very high	93	Very high	4 Å²	4	5.9 Å²	5.9	2%	0.021	3%	0.025	C	C	.	.	H	α-helix	trans	-61.7	-45.6	178.7	-171.3	-81.5	0	0	0	111.3	D426 Q430 G1079 Q1081 C1087 L1161	D426-N1083 PolarHBondContact O-ND2 2.99Å; Q430-N1083 WeakPolarHBondContact CG-ND2 3.22Å; Q430-N1083 VanDerWaalsContact NE2-CG 3.29Å; Q430-N1083 PolarHBondContact NE2-ND2 3.32Å; Q430-N1083 PolarHBondContact NE2-OD1 3.4Å; Q430-N1083 VanDerWaalsContact NE2-OD1 3.13Å; G1079-N1083 WeakPolarHBondContact O-CB 3.43Å; G1079-N1083 PolarHBondContact O-N 3.11Å; G1079-N1083 VanDerWaalsContact O-N 3.08Å; Q1081-N1083 PolarHBondContact O-N 2.83Å; N1083-C1087 VanDerWaalsContact O-CB 3.28Å; N1083-C1087 WeakPolarHBondContact O-CB 3.45Å; N1083-C1087 PolarHBondContact O-N 2.94Å; N1083-C1087 PolarHBondContact O-SG 2.64Å; N1083-L1161 HydrophobicContact CB-CD1 4.33Å
1084	Y	91.5	Very high	93	Very high	31 Å²	31	4.4 Å²	4.4	12%	0.122	2%	0.019	C	C	.	.	H	α-helix	trans	-60.4	-52.9	177.3	-177.8	-89.4	0	0	0	111.7	H1080 Q1081 A1082 I1086 C1087 I1088 H1145	H1080-Y1084 WeakPolarHBondContact O-CB 3.35Å; H1080-Y1084 PolarHBondContact O-N 3.46Å; H1080-Y1084 VanDerWaalsContact O-N 3.12Å; Q1081-Y1084 PolarHBondContact O-N 3.07Å; A1082-Y1084 VanDerWaalsContact C-N 3.34Å; A1082-Y1084 PolarHBondContact O-N 2.92Å; Y1084-I1086 PolarHBondContact O-N 3.23Å; Y1084-C1087 PolarHBondContact O-N 3.08Å; Y1084-I1088 HydrophobicContact CD1-CG1 4.21Å; Y1084-I1088 HydrophobicContact CD2-CG1 4.35Å; Y1084-I1088 HydrophobicContact CE1-CG1 3.89Å; Y1084-I1088 HydrophobicContact CE2-CD1 4.37Å; Y1084-I1088 HydrophobicContact CE2-CG1 4.02Å; Y1084-I1088 HydrophobicContact CG-CG1 4.44Å; Y1084-I1088 WeakPolarHBondContact O-CG1 3.49Å; Y1084-I1088 PolarHBondContact O-N 2.78Å; Y1084-H1145 HydrophobicContact CD1-CB 4.15Å; Y1084-H1145 AromaticContact CD1-CE1 3.81Å; Y1084-H1145 AromaticContact CD1-CG 3.75Å; Y1084-H1145 AromaticContact CD1-ND1 3.22Å; Y1084-H1145 WeakPolarHBondContact CD1-ND1 3.39Å; Y1084-H1145 AromaticContact CD2-CE1 3.86Å; Y1084-H1145 AromaticContact CD2-ND1 3.96Å; Y1084-H1145 HydrophobicContact CE1-CB 3.56Å; Y1084-H1145 AromaticContact CE1-CG 3.62Å; Y1084-H1145 AromaticContact CE1-ND1 3.6Å; Y1084-H1145 HydrophobicContact CE2-CB 4.49Å; Y1084-H1145 AromaticContact CG-CE1 3.49Å; Y1084-H1145 VanDerWaalsContact CG-CE1 3.49Å; Y1084-H1145 AromaticContact CG-ND1 3.42Å; Y1084-H1145 AromaticContact CZ-CG 3.78Å
1085	R	93.1	Very high	92.9	Very high	17 Å²	17	4.4 Å²	4.4	6%	0.064	2%	0.019	C	C	.	.	H	α-helix	trans	-53.1	-50.9	-179.4	-79.5	173.5	-174.4	166.6	10.6	112.4	Q1081 A1082 T1089 G1140 I1141 E1143 R1144	Q1081-R1085 VanDerWaalsContact O-CB 3.3Å; Q1081-R1085 WeakPolarHBondContact O-CB 3.43Å; Q1081-R1085 WeakPolarHBondContact O-CG 3.31Å; Q1081-R1085 PolarHBondContact O-N 3.11Å; Q1081-R1085 VanDerWaalsContact OE1-NH2 3.13Å; A1082-R1085 PolarHBondContact O-N 2.9Å; R1085-T1089 WeakPolarHBondContact O-CB 3.38Å; R1085-T1089 PolarHBondContact O-N 2.98Å; R1085-T1089 PolarHBondContact O-OG1 3.06Å; R1085-G1140 WeakPolarHBondContact CB-O 3.48Å; R1085-G1140 WeakPolarHBondContact CD-O 3.42Å; R1085-I1141 PolarHBondContact NH1-O 3.44Å; R1085-E1143 HydrophobicContact CG-CB 4.44Å; R1085-E1143 PolarHBondContact NE-O 3.25Å; R1085-E1143 PolarHBondContact NH2-O 3.44Å; R1085-R1144 VanDerWaalsContact NH2-CG 3.28Å
1086	I	92.7	Very high	92.9	Very high	0 Å²	0	4.4 Å²	4.4	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-70	-45.3	-176.9	-68	165.2	0	0	0	110.1	R318 T391 Q395 L398 D426 A1082 Y1084 I1088 T1089 M1090	R318-I1086 VanDerWaalsContact CD-CG2 3.41Å; T391-I1086 HydrophobicContact CG2-CG2 4.28Å; Q395-I1086 HydrophobicContact CG-CD1 3.67Å; L398-I1086 HydrophobicContact CD1-CD1 3.83Å; L398-I1086 HydrophobicContact CD1-CG1 4.14Å; D426-I1086 HydrophobicContact CB-CD1 3.78Å; A1082-I1086 WeakPolarHBondContact O-CG1 3.39Å; A1082-I1086 PolarHBondContact O-N 3.1Å; Y1084-I1086 PolarHBondContact O-N 3.23Å; I1086-I1088 PolarHBondContact O-N 3.32Å; I1086-T1089 WeakPolarHBondContact O-CB 3.26Å; I1086-T1089 PolarHBondContact O-N 3.48Å; I1086-M1090 WeakPolarHBondContact O-CG 3.24Å; I1086-M1090 PolarHBondContact O-N 3.25Å
1087	C	92.4	Very high	92.9	Very high	1 Å²	1	4.3 Å²	4.3	1%	0.007	2%	0.019	C	C	.	.	H	α-helix	trans	-60.8	-44	180	-69.5	0	0	0	0	112.8	N1083 Y1084 M1090 N1091 N1166 L1167	N1083-C1087 VanDerWaalsContact O-CB 3.28Å; N1083-C1087 WeakPolarHBondContact O-CB 3.45Å; N1083-C1087 PolarHBondContact O-N 2.94Å; N1083-C1087 PolarHBondContact O-SG 2.64Å; Y1084-C1087 PolarHBondContact O-N 3.08Å; C1087-M1090 PolarHBondContact O-N 3.47Å; C1087-N1091 PolarHBondContact O-N 3.08Å; C1087-N1091 VanDerWaalsContact O-N 3.13Å; C1087-N1091 PolarHBondContact O-ND2 2.89Å; C1087-N1166 HydrophobicContact CB-CB 3.68Å; C1087-L1167 HydrophobicContact CB-CD1 4.39Å; C1087-L1167 HydrophobicContact CB-CG 4.08Å
1088	I	91.9	Very high	92.9	Very high	6 Å²	6	4.7 Å²	4.7	3%	0.031	2%	0.021	C	C	.	.	H	α-helix	trans	-68.5	-38.9	178.1	-61.4	-59.5	0	0	0	110.9	Y1084 I1086 M1090 N1091 L1092 F1139 W1175	Y1084-I1088 HydrophobicContact CD1-CG1 4.21Å; Y1084-I1088 HydrophobicContact CD2-CG1 4.35Å; Y1084-I1088 HydrophobicContact CE1-CG1 3.89Å; Y1084-I1088 HydrophobicContact CE2-CD1 4.37Å; Y1084-I1088 HydrophobicContact CE2-CG1 4.02Å; Y1084-I1088 HydrophobicContact CG-CG1 4.44Å; Y1084-I1088 WeakPolarHBondContact O-CG1 3.49Å; Y1084-I1088 PolarHBondContact O-N 2.78Å; I1086-I1088 PolarHBondContact O-N 3.32Å; I1088-M1090 VanDerWaalsContact C-N 3.32Å; I1088-M1090 PolarHBondContact O-N 3.01Å; I1088-N1091 PolarHBondContact O-N 3.41Å; I1088-L1092 HydrophobicContact CG2-CD1 4.24Å; I1088-L1092 HydrophobicContact CG2-CG 4.41Å; I1088-L1092 WeakPolarHBondContact O-CG 3.48Å; I1088-L1092 PolarHBondContact O-N 3.31Å; I1088-F1139 HydrophobicContact CB-CE1 4.23Å; I1088-F1139 HydrophobicContact CG2-CE1 3.64Å; I1088-F1139 HydrophobicContact CG2-CZ 3.81Å; I1088-W1175 HydrophobicContact CD1-CZ2 4.48Å
1089	T	93.2	Very high	92.9	Very high	0 Å²	0	3.9 Å²	3.9	0%	0	2%	0.017	C	C	.	.	H	α-helix	trans	-56.3	-46.8	172.6	-59.9	0	0	0	0	111	Q394 R1085 I1086 N1091 L1092 F1093 G1140	Q394-T1089 PolarHBondContact NE2-OG1 3.02Å; R1085-T1089 WeakPolarHBondContact O-CB 3.38Å; R1085-T1089 PolarHBondContact O-N 2.98Å; R1085-T1089 PolarHBondContact O-OG1 3.06Å; I1086-T1089 WeakPolarHBondContact O-CB 3.26Å; I1086-T1089 PolarHBondContact O-N 3.48Å; T1089-N1091 VanDerWaalsContact C-N 3.32Å; T1089-N1091 PolarHBondContact O-N 2.97Å; T1089-L1092 WeakPolarHBondContact O-CB 3.49Å; T1089-L1092 PolarHBondContact O-N 3.1Å; T1089-L1092 VanDerWaalsContact O-N 3.16Å; T1089-F1093 HydrophobicContact CG2-CD2 3.84Å; T1089-F1093 HydrophobicContact CG2-CE2 3.8Å; T1089-F1093 WeakPolarHBondContact O-CD2 3.45Å; T1089-F1093 PolarHBondContact O-N 3.33Å; T1089-G1140 VanDerWaalsContact OG1-CA 3.31Å; T1089-G1140 WeakPolarHBondContact OG1-CA 3.47Å
1090	M	92.9	Very high	92.9	Very high	4 Å²	4	4 Å²	4	2%	0.02	2%	0.018	C	C	.	.	H	α-helix	trans	-58.7	-43.9	177.3	-63.2	-169.2	119.4	0	0	112.2	R318 A322 L387 T391 I1086 C1087 I1088 L1092 F1093 Y1094 L1167	R318-M1090 HydrophobicContact CG-SD 3.84Å; A322-M1090 HydrophobicContact CB-CE 3.64Å; A322-M1090 HydrophobicContact CB-SD 4.31Å; L387-M1090 HydrophobicContact CD1-CB 4.33Å; L387-M1090 HydrophobicContact CD1-CE 4.29Å; L387-M1090 HydrophobicContact CD1-CG 4.07Å; L387-M1090 HydrophobicContact CD2-CE 4.25Å; L387-M1090 HydrophobicContact CG-CE 4.32Å; T391-M1090 HydrophobicContact CG2-CE 4.15Å; T391-M1090 HydrophobicContact CG2-CG 4.13Å; I1086-M1090 WeakPolarHBondContact O-CG 3.24Å; I1086-M1090 PolarHBondContact O-N 3.25Å; C1087-M1090 PolarHBondContact O-N 3.47Å; I1088-M1090 VanDerWaalsContact C-N 3.32Å; I1088-M1090 PolarHBondContact O-N 3.01Å; M1090-L1092 VanDerWaalsContact C-N 3.34Å; M1090-L1092 PolarHBondContact O-N 3.3Å; M1090-F1093 WeakPolarHBondContact O-CB 3.36Å; M1090-F1093 PolarHBondContact O-N 3.42Å; M1090-Y1094 HydrophobicContact CB-CE2 4.29Å; M1090-Y1094 VanDerWaalsContact O-CD2 3.3Å; M1090-Y1094 WeakPolarHBondContact O-CD2 3.45Å; M1090-Y1094 PolarHBondContact O-N 3.25Å; M1090-L1167 HydrophobicContact CB-CD2 4.32Å; M1090-L1167 HydrophobicContact SD-CD1 4.22Å
1091	N	93.3	Very high	92.9	Very high	0 Å²	0	4.4 Å²	4.4	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-63.2	-38.9	176.8	-70.9	-29	0	0	0	112.3	C1087 I1088 T1089 F1093 Y1094 Y1095 N1166 W1175	C1087-N1091 PolarHBondContact O-N 3.08Å; C1087-N1091 VanDerWaalsContact O-N 3.13Å; C1087-N1091 PolarHBondContact O-ND2 2.89Å; I1088-N1091 PolarHBondContact O-N 3.41Å; T1089-N1091 VanDerWaalsContact C-N 3.32Å; T1089-N1091 PolarHBondContact O-N 2.97Å; N1091-F1093 VanDerWaalsContact C-N 3.32Å; N1091-F1093 PolarHBondContact O-N 3.48Å; N1091-Y1094 PolarHBondContact O-N 3.46Å; N1091-Y1095 VanDerWaalsContact O-CB 3.32Å; N1091-Y1095 WeakPolarHBondContact O-CB 3.46Å; N1091-Y1095 PolarHBondContact O-N 2.97Å; N1091-N1166 PolarHBondContact ND2-O 3.02Å; N1091-W1175 HydrophobicContact CB-CD2 3.78Å; N1091-W1175 HydrophobicContact CB-CE3 4.39Å; N1091-W1175 HydrophobicContact CB-CG 3.83Å; N1091-W1175 HydrophobicContact CB-CZ2 4.37Å
1092	L	92.9	Very high	93	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-62.6	-37.8	173.7	-72.4	169.3	0	0	0	112.2	I1088 T1089 M1090 K1096 F1139 W1175 I1237	I1088-L1092 HydrophobicContact CG2-CD1 4.24Å; I1088-L1092 HydrophobicContact CG2-CG 4.41Å; I1088-L1092 WeakPolarHBondContact O-CG 3.48Å; I1088-L1092 PolarHBondContact O-N 3.31Å; T1089-L1092 WeakPolarHBondContact O-CB 3.49Å; T1089-L1092 PolarHBondContact O-N 3.1Å; T1089-L1092 VanDerWaalsContact O-N 3.16Å; M1090-L1092 VanDerWaalsContact C-N 3.34Å; M1090-L1092 PolarHBondContact O-N 3.3Å; L1092-K1096 WeakPolarHBondContact O-CB 3.23Å; L1092-K1096 WeakPolarHBondContact O-CG 3.42Å; L1092-K1096 PolarHBondContact O-N 3.05Å; L1092-F1139 HydrophobicContact CD1-CD1 3.6Å; L1092-F1139 HydrophobicContact CD1-CE1 3.56Å; L1092-F1139 HydrophobicContact CD1-CG 4.25Å; L1092-F1139 HydrophobicContact CD1-CZ 4.16Å; L1092-W1175 HydrophobicContact CD2-CH2 4.06Å; L1092-W1175 HydrophobicContact CD2-CZ3 3.66Å; L1092-W1175 HydrophobicContact CG-CH2 4.48Å; L1092-W1175 HydrophobicContact CG-CZ3 4.32Å; L1092-I1237 HydrophobicContact CD1-CG1 4.17Å; L1092-I1237 HydrophobicContact CD2-CG1 3.88Å
1093	F	93	Very high	93	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-66.1	-41.1	174	-92.6	-91.7	0	0	0	112.8	P384 S386 L387 T390 T1089 M1090 N1091 K1096 C1097 C1136	P384-F1093 HydrophobicContact CB-CB 4.4Å; P384-F1093 HydrophobicContact CB-CD1 3.91Å; S386-F1093 WeakPolarHBondContact OG-CE1 3.4Å; L387-F1093 HydrophobicContact CB-CD1 4.29Å; L387-F1093 HydrophobicContact CD1-CB 3.75Å; L387-F1093 HydrophobicContact CD1-CD1 4.34Å; L387-F1093 HydrophobicContact CD1-CD2 3.97Å; L387-F1093 HydrophobicContact CD1-CG 3.78Å; T390-F1093 HydrophobicContact CG2-CE2 4.4Å; T390-F1093 HydrophobicContact CG2-CZ 3.77Å; T390-F1093 WeakPolarHBondContact OG1-CE2 3.37Å; T390-F1093 VanDerWaalsContact OG1-CZ 3.25Å; T390-F1093 WeakPolarHBondContact OG1-CZ 3.32Å; T1089-F1093 HydrophobicContact CG2-CD2 3.84Å; T1089-F1093 HydrophobicContact CG2-CE2 3.8Å; T1089-F1093 WeakPolarHBondContact O-CD2 3.45Å; T1089-F1093 PolarHBondContact O-N 3.33Å; M1090-F1093 WeakPolarHBondContact O-CB 3.36Å; M1090-F1093 PolarHBondContact O-N 3.42Å; N1091-F1093 VanDerWaalsContact C-N 3.32Å; N1091-F1093 PolarHBondContact O-N 3.48Å; F1093-K1096 HydrophobicContact CD1-CD 4.41Å; F1093-K1096 WeakPolarHBondContact O-CG 3.34Å; F1093-C1097 WeakPolarHBondContact O-CB 3.39Å; F1093-C1097 PolarHBondContact O-N 3.4Å; F1093-C1136 HydrophobicContact CD2-CB 4.09Å; F1093-C1136 HydrophobicContact CE2-CB 3.43Å; F1093-C1136 VanDerWaalsContact CE2-CB 3.43Å; F1093-C1136 HydrophobicContact CZ-CB 3.97Å
1094	Y	93.4	Very high	92.8	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-65.3	-47.8	174.9	-60.1	-37.7	0	0	0	111.2	I325 L326 F329 P384 L387 M1090 N1091 K1096 C1097 V1098 V1172	I325-Y1094 HydrophobicContact CD1-CE2 4.32Å; I325-Y1094 HydrophobicContact CG2-CD2 4.46Å; I325-Y1094 HydrophobicContact CG2-CE1 4.42Å; I325-Y1094 HydrophobicContact CG2-CE2 3.95Å; L326-Y1094 HydrophobicContact CD2-CE1 3.86Å; L326-Y1094 HydrophobicContact CG-CE1 4.48Å; F329-Y1094 AromaticContact CE2-CD1 3.75Å; F329-Y1094 HydrophobicContact CE2-CD1 3.75Å; F329-Y1094 HydrophobicContact CE2-CE1 4.47Å; F329-Y1094 HydrophobicContact CE2-CG 4.06Å; F329-Y1094 HydrophobicContact CZ-CD1 4.41Å; F329-Y1094 HydrophobicContact CZ-CG 4.31Å; P384-Y1094 HydrophobicContact CG-CD1 4.3Å; P384-Y1094 HydrophobicContact CG-CE1 4.33Å; L387-Y1094 HydrophobicContact CD2-CE1 3.8Å; M1090-Y1094 HydrophobicContact CB-CE2 4.29Å; M1090-Y1094 VanDerWaalsContact O-CD2 3.3Å; M1090-Y1094 WeakPolarHBondContact O-CD2 3.45Å; M1090-Y1094 PolarHBondContact O-N 3.25Å; N1091-Y1094 PolarHBondContact O-N 3.46Å; Y1094-K1096 PolarHBondContact O-N 3.28Å; Y1094-C1097 PolarHBondContact O-N 2.92Å; Y1094-V1098 WeakPolarHBondContact O-CB 3.48Å; Y1094-V1098 VanDerWaalsContact O-CG2 3.23Å; Y1094-V1098 WeakPolarHBondContact O-CG2 2.97Å; Y1094-V1098 PolarHBondContact O-N 3.08Å; Y1094-V1172 HydrophobicContact CD2-CG1 4.11Å
1095	Y	94.1	Very high	92.9	Very high	0 Å²	0	4.5 Å²	4.5	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-53.8	-54.2	176.7	159.7	-96.3	0	0	0	111.7	N1091 C1097 V1098 T1099 W1175 D1178 G1179 H1182 V1233 R1236	N1091-Y1095 VanDerWaalsContact O-CB 3.32Å; N1091-Y1095 WeakPolarHBondContact O-CB 3.46Å; N1091-Y1095 PolarHBondContact O-N 2.97Å; Y1095-C1097 VanDerWaalsContact C-N 3.33Å; Y1095-C1097 PolarHBondContact O-N 2.96Å; Y1095-V1098 PolarHBondContact O-N 3.43Å; Y1095-T1099 PolarHBondContact O-N 3.48Å; Y1095-T1099 PolarHBondContact O-OG1 2.9Å; Y1095-W1175 HydrophobicContact CG-CE3 4.4Å; Y1095-D1178 HydrophobicContact CD2-CB 4.08Å; Y1095-D1178 HydrophobicContact CE2-CB 4.23Å; Y1095-G1179 VanDerWaalsContact CD2-CA 3.44Å; Y1095-G1179 VanDerWaalsContact CD2-N 3.34Å; Y1095-H1182 HydrophobicContact CE2-CB 4.27Å; Y1095-H1182 AromaticContact CE2-CD2 3.66Å; Y1095-H1182 AromaticContact CE2-CG 3.98Å; Y1095-H1182 AromaticContact CZ-CD2 3.88Å; Y1095-H1182 AromaticContact CZ-CG 3.9Å; Y1095-H1182 PolarHBondContact OH-CD2 3.21Å; Y1095-H1182 PolarHBondContact OH-CE1 3.44Å; Y1095-H1182 PolarHBondContact OH-ND1 2.71Å; Y1095-H1182 PolarHBondContact OH-NE2 2.94Å; Y1095-V1233 HydrophobicContact CE1-CG2 4.07Å; Y1095-R1236 HydrophobicContact CE1-CB 4.2Å; Y1095-R1236 HydrophobicContact CE1-CG 3.73Å
1096	K	93.1	Very high	92.8	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-62.4	-38.9	-176	74.9	178.2	-167.7	167.5	0	112.7	L1092 F1093 Y1094 T1099 F1100 Y1127 T1132 V1233	L1092-K1096 WeakPolarHBondContact O-CB 3.23Å; L1092-K1096 WeakPolarHBondContact O-CG 3.42Å; L1092-K1096 PolarHBondContact O-N 3.05Å; F1093-K1096 HydrophobicContact CD1-CD 4.41Å; F1093-K1096 WeakPolarHBondContact O-CG 3.34Å; Y1094-K1096 PolarHBondContact O-N 3.28Å; K1096-T1099 PolarHBondContact O-N 3.28Å; K1096-F1100 WeakPolarHBondContact O-CB 3.42Å; K1096-F1100 PolarHBondContact O-N 3.29Å; K1096-Y1127 PolarHBondContact O-OH 3.44Å; K1096-T1132 PolarHBondContact NZ-OG1 3.3Å; K1096-V1233 HydrophobicContact CB-CG1 3.75Å; K1096-V1233 HydrophobicContact CB-CG2 4.17Å
1097	C	92.6	Very high	92.7	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-67.4	-41.4	177.8	-79.5	0	0	0	0	111.1	F1093 Y1094 Y1095 F1100 V1101	F1093-C1097 WeakPolarHBondContact O-CB 3.39Å; F1093-C1097 PolarHBondContact O-N 3.4Å; Y1094-C1097 PolarHBondContact O-N 2.92Å; Y1095-C1097 VanDerWaalsContact C-N 3.33Å; Y1095-C1097 PolarHBondContact O-N 2.96Å; C1097-F1100 PolarHBondContact O-N 3.46Å; C1097-V1101 WeakPolarHBondContact O-CB 3.27Å; C1097-V1101 WeakPolarHBondContact O-CG2 3.48Å; C1097-V1101 PolarHBondContact O-N 3.49Å
1098	V	94.5	Very high	92.6	Very high	8 Å²	8	5.6 Å²	5.6	5%	0.048	3%	0.031	C	C	.	.	H	α-helix	trans	-63.5	-44.8	174.7	172.9	0	0	0	0	110.9	L382 Y1094 Y1095 F1100 V1101 T1102 I1176 I1180	L382-V1098 HydrophobicContact CD1-CG2 3.8Å; Y1094-V1098 WeakPolarHBondContact O-CB 3.48Å; Y1094-V1098 VanDerWaalsContact O-CG2 3.23Å; Y1094-V1098 WeakPolarHBondContact O-CG2 2.97Å; Y1094-V1098 PolarHBondContact O-N 3.08Å; Y1095-V1098 PolarHBondContact O-N 3.43Å; V1098-F1100 VanDerWaalsContact C-N 3.33Å; V1098-F1100 PolarHBondContact O-N 2.9Å; V1098-V1101 PolarHBondContact O-N 3.2Å; V1098-T1102 VanDerWaalsContact O-CB 3.26Å; V1098-T1102 WeakPolarHBondContact O-CB 3.47Å; V1098-T1102 PolarHBondContact O-N 3.05Å; V1098-T1102 PolarHBondContact O-OG1 2.99Å; V1098-I1176 HydrophobicContact CG1-CG2 4.21Å; V1098-I1176 HydrophobicContact CG2-CG1 4.48Å; V1098-I1176 HydrophobicContact CG2-CG2 4.31Å; V1098-I1180 HydrophobicContact CG1-CG1 3.77Å
1099	T	94.2	Very high	92.4	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-55.6	-49.3	175.5	-54.6	0	0	0	0	111.3	Y1095 K1096 T1102 T1103 G1179 H1182 I1186 V1229 V1233	Y1095-T1099 PolarHBondContact O-N 3.48Å; Y1095-T1099 PolarHBondContact O-OG1 2.9Å; K1096-T1099 PolarHBondContact O-N 3.28Å; T1099-T1102 PolarHBondContact O-N 3.43Å; T1099-T1103 PolarHBondContact O-N 3.24Å; T1099-G1179 WeakPolarHBondContact CA-O 3.26Å; T1099-G1179 WeakPolarHBondContact OG1-CA 3.3Å; T1099-G1179 PolarHBondContact OG1-O 3.41Å; T1099-H1182 HydrophobicContact CG2-CB 3.74Å; T1099-I1186 HydrophobicContact CG2-CD1 4.3Å; T1099-V1229 HydrophobicContact CG2-CG1 4.18Å; T1099-V1233 HydrophobicContact CG2-CG2 4.46Å
1100	F	92.9	Very high	92.1	Very high	2 Å²	2	17.1 Å²	17.1	1%	0.009	8%	0.078	C	C	.	.	H	α-helix	trans	-62.8	-48.8	-179.2	-175.7	-100.9	0	0	0	112	Y381 K1096 C1097 V1098 T1102 T1103 F1119 F1124 Y1127 Y1226 V1229	Y381-F1100 HydrophobicContact CG-CE1 4.2Å; K1096-F1100 WeakPolarHBondContact O-CB 3.42Å; K1096-F1100 PolarHBondContact O-N 3.29Å; C1097-F1100 PolarHBondContact O-N 3.46Å; V1098-F1100 VanDerWaalsContact C-N 3.33Å; V1098-F1100 PolarHBondContact O-N 2.9Å; F1100-T1102 PolarHBondContact O-N 3.26Å; F1100-T1103 PolarHBondContact O-N 3.1Å; F1100-T1103 PolarHBondContact O-OG1 3.49Å; F1100-F1119 HydrophobicContact CD2-CD2 4.36Å; F1100-F1119 AromaticContact CD2-CE2 3.77Å; F1100-F1119 HydrophobicContact CD2-CE2 3.77Å; F1100-F1119 HydrophobicContact CD2-CZ 4.47Å; F1100-F1119 HydrophobicContact CE1-CD2 4.23Å; F1100-F1119 HydrophobicContact CE1-CE2 4.28Å; F1100-F1119 AromaticContact CE2-CD2 3.38Å; F1100-F1119 HydrophobicContact CE2-CD2 3.38Å; F1100-F1119 AromaticContact CE2-CE2 3.22Å; F1100-F1119 HydrophobicContact CE2-CE2 3.22Å; F1100-F1119 HydrophobicContact CE2-CG 4.4Å; F1100-F1119 HydrophobicContact CE2-CZ 4.12Å; F1100-F1119 HydrophobicContact CG-CE2 4.49Å; F1100-F1119 AromaticContact CZ-CD2 3.31Å; F1100-F1119 HydrophobicContact CZ-CD2 3.31Å; F1100-F1119 AromaticContact CZ-CE2 3.53Å; F1100-F1119 HydrophobicContact CZ-CE2 3.53Å; F1100-F1119 HydrophobicContact CZ-CG 4.42Å; F1100-F1124 AromaticContact CE1-CD1 3.43Å; F1100-F1124 HydrophobicContact CE1-CD1 3.43Å; F1100-F1124 VanDerWaalsContact CE1-CD1 3.43Å; F1100-F1124 AromaticContact CE1-CE1 3.51Å; F1100-F1124 HydrophobicContact CE1-CE1 3.51Å; F1100-F1124 AromaticContact CZ-CD1 3.52Å; F1100-F1124 HydrophobicContact CZ-CD1 3.52Å; F1100-F1124 AromaticContact CZ-CE1 3.71Å; F1100-F1124 HydrophobicContact CZ-CE1 3.71Å; F1100-F1124 HydrophobicContact CZ-CG 4.24Å; F1100-Y1127 HydrophobicContact CB-CD1 4.39Å; F1100-Y1127 HydrophobicContact CB-CE1 3.76Å; F1100-Y1127 HydrophobicContact CD1-CD1 4.41Å; F1100-Y1127 AromaticContact CD2-CD1 3.95Å; F1100-Y1127 HydrophobicContact CD2-CD1 3.95Å; F1100-Y1127 HydrophobicContact CD2-CD2 4.05Å; F1100-Y1127 AromaticContact CD2-CE1 3.98Å; F1100-Y1127 HydrophobicContact CD2-CE1 3.98Å; F1100-Y1127 HydrophobicContact CD2-CE2 4.08Å; F1100-Y1127 AromaticContact CD2-CG 3.99Å; F1100-Y1127 HydrophobicContact CD2-CG 3.99Å; F1100-Y1127 HydrophobicContact CE2-CD1 4.29Å; F1100-Y1127 HydrophobicContact CE2-CD2 4.23Å; F1100-Y1127 HydrophobicContact CE2-CG 4.02Å; F1100-Y1127 HydrophobicContact CG-CD1 4Å; F1100-Y1127 AromaticContact CG-CE1 3.86Å; F1100-Y1127 HydrophobicContact CG-CE1 3.86Å; F1100-Y1127 HydrophobicContact CG-CG 4.5Å; F1100-Y1226 HydrophobicContact CE2-CD2 4.06Å; F1100-Y1226 HydrophobicContact CE2-CE2 4.13Å; F1100-V1229 HydrophobicContact CB-CG1 4.47Å; F1100-V1229 HydrophobicContact CD2-CG1 4.28Å
1101	V	92.6	Very high	91.7	Very high	10 Å²	10	18.2 Å²	18.2	6%	0.061	9%	0.086	C	C	.	.	H	α-helix	trans	-67.8	-34.5	179.3	172.2	0	0	0	0	112.5	L379 L382 C1097 V1098 T1103 Q1104 V1105	L379-V1101 HydrophobicContact CD2-CG1 3.62Å; L382-V1101 HydrophobicContact CB-CG2 4.12Å; C1097-V1101 WeakPolarHBondContact O-CB 3.27Å; C1097-V1101 WeakPolarHBondContact O-CG2 3.48Å; C1097-V1101 PolarHBondContact O-N 3.49Å; V1098-V1101 PolarHBondContact O-N 3.2Å; V1101-T1103 VanDerWaalsContact C-N 3.26Å; V1101-T1103 PolarHBondContact O-N 3.36Å; V1101-Q1104 WeakPolarHBondContact O-CB 3.28Å; V1101-Q1104 PolarHBondContact O-N 3.12Å; V1101-V1105 HydrophobicContact CG1-CG2 3.99Å; V1101-V1105 WeakPolarHBondContact O-CG2 3.18Å; V1101-V1105 PolarHBondContact O-N 3.22Å
1102	T	93.6	Very high	91.1	Very high	17 Å²	17	18.8 Å²	18.8	10%	0.104	9%	0.092	C	C	.	.	H	α-helix	trans	-60	-38.5	178.6	-60.2	0	0	0	0	111.3	V1098 T1099 F1100 Q1104 V1105 L1106 I1180 T1184	V1098-T1102 VanDerWaalsContact O-CB 3.26Å; V1098-T1102 WeakPolarHBondContact O-CB 3.47Å; V1098-T1102 PolarHBondContact O-N 3.05Å; V1098-T1102 PolarHBondContact O-OG1 2.99Å; T1099-T1102 PolarHBondContact O-N 3.43Å; F1100-T1102 PolarHBondContact O-N 3.26Å; T1102-Q1104 VanDerWaalsContact C-N 3.29Å; T1102-Q1104 PolarHBondContact O-N 3.23Å; T1102-V1105 PolarHBondContact O-N 3.33Å; T1102-L1106 HydrophobicContact CG2-CD1 3.98Å; T1102-L1106 HydrophobicContact CG2-CG 4.32Å; T1102-L1106 WeakPolarHBondContact O-CB 3.26Å; T1102-L1106 VanDerWaalsContact O-CG 3.3Å; T1102-L1106 WeakPolarHBondContact O-CG 3.4Å; T1102-L1106 PolarHBondContact O-N 3.48Å; T1102-I1180 HydrophobicContact CG2-CG2 4.34Å; T1102-T1184 HydrophobicContact CG2-CG2 4.28Å
1103	T	92.4	Very high	90.8	Very high	3 Å²	3	19.7 Å²	19.7	2%	0.018	10%	0.096	C	C	.	.	H	α-helix	trans	-62.2	-36.4	175.6	64	0	0	0	0	112.8	T1099 F1100 V1101 Y1107 F1119 I1186 V1229	T1099-T1103 PolarHBondContact O-N 3.24Å; F1100-T1103 PolarHBondContact O-N 3.1Å; F1100-T1103 PolarHBondContact O-OG1 3.49Å; V1101-T1103 VanDerWaalsContact C-N 3.26Å; V1101-T1103 PolarHBondContact O-N 3.36Å; T1103-Y1107 WeakPolarHBondContact O-CB 3.31Å; T1103-Y1107 PolarHBondContact O-N 3.17Å; T1103-Y1107 VanDerWaalsContact O-N 3.09Å; T1103-F1119 WeakPolarHBondContact OG1-CZ 3.2Å; T1103-I1186 HydrophobicContact CG2-CG2 4.41Å; T1103-V1229 HydrophobicContact CG2-CG2 3.77Å
1104	Q	89.7	Confident	90.3	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-71.3	-43.7	175.5	-66.1	-65	-16.3	0	0	112.7	I378 V1101 T1102 L1106 Y1107 T1108 T1118 F1119	I378-Q1104 HydrophobicContact CG2-CB 4.01Å; I378-Q1104 HydrophobicContact CG2-CG 4.32Å; V1101-Q1104 WeakPolarHBondContact O-CB 3.28Å; V1101-Q1104 PolarHBondContact O-N 3.12Å; T1102-Q1104 VanDerWaalsContact C-N 3.29Å; T1102-Q1104 PolarHBondContact O-N 3.23Å; Q1104-L1106 VanDerWaalsContact C-N 3.32Å; Q1104-L1106 PolarHBondContact O-N 2.82Å; Q1104-Y1107 PolarHBondContact O-N 3.17Å; Q1104-T1108 PolarHBondContact O-N 3.48Å; Q1104-T1108 PolarHBondContact O-OG1 3.48Å; Q1104-T1118 VanDerWaalsContact CD-OG1 3.29Å; Q1104-T1118 PolarHBondContact NE2-OG1 3.24Å; Q1104-T1118 PolarHBondContact OE1-OG1 2.96Å; Q1104-F1119 HydrophobicContact CG-CE2 4.25Å
1105	V	91.7	Very high	89.8	Confident	27 Å²	27	21.5 Å²	21.5	16%	0.164	11%	0.109	C	C	.	.	H	α-helix	trans	-59.1	-47.3	176.8	165.2	0	0	0	0	109.9	F340 L379 V1101 T1102 Y1107 T1108 F1109	F340-V1105 HydrophobicContact CE2-CG1 4.5Å; F340-V1105 HydrophobicContact CE2-CG2 4.21Å; F340-V1105 HydrophobicContact CZ-CG1 3.81Å; F340-V1105 HydrophobicContact CZ-CG2 4.28Å; L379-V1105 HydrophobicContact CD2-CG2 3.55Å; V1101-V1105 HydrophobicContact CG1-CG2 3.99Å; V1101-V1105 WeakPolarHBondContact O-CG2 3.18Å; V1101-V1105 PolarHBondContact O-N 3.22Å; T1102-V1105 PolarHBondContact O-N 3.33Å; V1105-Y1107 PolarHBondContact O-N 3Å; V1105-T1108 WeakPolarHBondContact O-CB 3.34Å; V1105-T1108 PolarHBondContact O-N 3.29Å; V1105-F1109 HydrophobicContact CG1-CD2 4.41Å; V1105-F1109 HydrophobicContact CG1-CE2 3.71Å; V1105-F1109 WeakPolarHBondContact O-CD2 3.01Å; V1105-F1109 PolarHBondContact O-N 2.89Å
1106	L	92.1	Very high	89.4	Confident	20 Å²	20	24.7 Å²	24.7	11%	0.105	13%	0.128	C	C	.	.	H	α-helix	trans	-60.3	-46.9	176.9	-70.5	172.5	0	0	0	111.6	T1102 Q1104 T1108 F1109 Y1110 T1184 F1187	T1102-L1106 HydrophobicContact CG2-CD1 3.98Å; T1102-L1106 HydrophobicContact CG2-CG 4.32Å; T1102-L1106 WeakPolarHBondContact O-CB 3.26Å; T1102-L1106 VanDerWaalsContact O-CG 3.3Å; T1102-L1106 WeakPolarHBondContact O-CG 3.4Å; T1102-L1106 PolarHBondContact O-N 3.48Å; Q1104-L1106 VanDerWaalsContact C-N 3.32Å; Q1104-L1106 PolarHBondContact O-N 2.82Å; L1106-T1108 VanDerWaalsContact C-N 3.26Å; L1106-T1108 PolarHBondContact O-N 3.29Å; L1106-F1109 WeakPolarHBondContact O-CB 3.49Å; L1106-F1109 PolarHBondContact O-N 3.3Å; L1106-F1109 VanDerWaalsContact O-N 3.14Å; L1106-Y1110 VanDerWaalsContact O-CD2 3.28Å; L1106-Y1110 WeakPolarHBondContact O-CD2 3.49Å; L1106-T1184 HydrophobicContact CD1-CG2 3.82Å; L1106-F1187 HydrophobicContact CB-CB 4.23Å; L1106-F1187 HydrophobicContact CB-CD1 3.76Å; L1106-F1187 HydrophobicContact CB-CD2 3.73Å; L1106-F1187 HydrophobicContact CB-CE1 4.09Å; L1106-F1187 HydrophobicContact CB-CE2 4.05Å; L1106-F1187 HydrophobicContact CB-CG 3.59Å; L1106-F1187 HydrophobicContact CB-CZ 4.24Å; L1106-F1187 HydrophobicContact CD1-CB 3.66Å; L1106-F1187 HydrophobicContact CD1-CD1 4.02Å; L1106-F1187 HydrophobicContact CD1-CG 3.87Å; L1106-F1187 HydrophobicContact CG-CD1 4.44Å; L1106-F1187 HydrophobicContact CG-CG 4.39Å
1107	Y	90.3	Very high	89	Confident	19 Å²	19	26 Å²	26	8%	0.075	14%	0.137	C	C	.	.	H	α-helix	trans	-59.3	-36.8	175.7	-178.7	-105.1	0	0	0	113.5	T1103 Q1104 V1105 F1109 Y1110 S1111 V1116 T1118 F1187 M1218 Y1221	T1103-Y1107 WeakPolarHBondContact O-CB 3.31Å; T1103-Y1107 PolarHBondContact O-N 3.17Å; T1103-Y1107 VanDerWaalsContact O-N 3.09Å; Q1104-Y1107 PolarHBondContact O-N 3.17Å; V1105-Y1107 PolarHBondContact O-N 3Å; Y1107-F1109 PolarHBondContact O-N 3.26Å; Y1107-Y1110 PolarHBondContact O-N 2.89Å; Y1107-S1111 PolarHBondContact O-N 2.86Å; Y1107-S1111 PolarHBondContact O-OG 3.23Å; Y1107-V1116 HydrophobicContact CE1-CB 4.49Å; Y1107-T1118 HydrophobicContact CD1-CG2 3.22Å; Y1107-T1118 HydrophobicContact CD2-CG2 3.51Å; Y1107-T1118 HydrophobicContact CE1-CG2 3.77Å; Y1107-T1118 HydrophobicContact CE2-CG2 4.03Å; Y1107-T1118 HydrophobicContact CG-CG2 3.05Å; Y1107-F1187 HydrophobicContact CD2-CE2 4.4Å; Y1107-M1218 HydrophobicContact CE2-CE 4.09Å; Y1107-M1218 HydrophobicContact CE2-SD 3.83Å; Y1107-M1218 WeakPolarHBondContact OH-CE 3.25Å; Y1107-M1218 PolarHBondContact OH-SD 3.39Å; Y1107-Y1221 AromaticContact CD2-CE1 3.99Å; Y1107-Y1221 HydrophobicContact CD2-CE1 3.99Å; Y1107-Y1221 HydrophobicContact CE2-CD1 4.42Å; Y1107-Y1221 HydrophobicContact CE2-CE1 4.31Å
1108	T	89.5	Confident	88.6	Confident	2 Å²	2	26.6 Å²	26.6	1%	0.012	14%	0.141	C	C	.	.	H	α-helix	trans	-59.7	-33.2	178.5	-57.9	0	0	0	0	112.2	F375 Q1104 V1105 L1106 Y1110 S1111 F1113	F375-T1108 HydrophobicContact CE1-CG2 3.69Å; F375-T1108 HydrophobicContact CZ-CG2 4.47Å; Q1104-T1108 PolarHBondContact O-N 3.48Å; Q1104-T1108 PolarHBondContact O-OG1 3.48Å; V1105-T1108 WeakPolarHBondContact O-CB 3.34Å; V1105-T1108 PolarHBondContact O-N 3.29Å; L1106-T1108 VanDerWaalsContact C-N 3.26Å; L1106-T1108 PolarHBondContact O-N 3.29Å; T1108-Y1110 VanDerWaalsContact C-N 3.33Å; T1108-S1111 WeakPolarHBondContact CA-OG 3.38Å; T1108-S1111 PolarHBondContact O-OG 2.97Å; T1108-F1113 HydrophobicContact CG2-CB 4.44Å; T1108-F1113 HydrophobicContact CG2-CD1 3.79Å; T1108-F1113 HydrophobicContact CG2-CE1 4.43Å; T1108-F1113 HydrophobicContact CG2-CG 4.34Å; T1108-F1113 WeakPolarHBondContact O-CA 3.37Å; T1108-F1113 PolarHBondContact O-N 3.48Å
1109	F	89.3	Confident	88.2	Confident	104 Å²	104	26.5 Å²	26.5	46%	0.456	14%	0.139	S	C	.	.	H	α-helix	trans	-65.2	-35.7	173.8	-70.6	-76	0	0	0	112.6	F340 V1105 L1106 Y1107 F1113	F340-F1109 HydrophobicContact CE1-CZ 4.14Å; V1105-F1109 HydrophobicContact CG1-CD2 4.41Å; V1105-F1109 HydrophobicContact CG1-CE2 3.71Å; V1105-F1109 WeakPolarHBondContact O-CD2 3.01Å; V1105-F1109 PolarHBondContact O-N 2.89Å; L1106-F1109 WeakPolarHBondContact O-CB 3.49Å; L1106-F1109 PolarHBondContact O-N 3.3Å; L1106-F1109 VanDerWaalsContact O-N 3.14Å; Y1107-F1109 PolarHBondContact O-N 3.26Å; F1109-F1113 AromaticContact CD1-CE1 3.97Å; F1109-F1113 HydrophobicContact CD1-CE1 3.97Å; F1109-F1113 HydrophobicContact CD1-CE2 4.22Å; F1109-F1113 AromaticContact CD1-CZ 3.36Å; F1109-F1113 HydrophobicContact CD1-CZ 3.36Å; F1109-F1113 HydrophobicContact CE1-CE1 4.07Å; F1109-F1113 AromaticContact CE1-CZ 3.72Å; F1109-F1113 HydrophobicContact CE1-CZ 3.72Å; F1109-F1113 HydrophobicContact CG-CZ 4.26Å
1110	Y	86.9	Confident	87.6	Confident	144 Å²	144	29.3 Å²	29.3	57%	0.565	15%	0.153	S	C	*	.	H	α-helix	trans	-88.9	-19.9	-178.2	-68.1	-86.6	0	0	0	113.6	L1106 Y1107 T1108 G1112 F1187 Y1188	L1106-Y1110 VanDerWaalsContact O-CD2 3.28Å; L1106-Y1110 WeakPolarHBondContact O-CD2 3.49Å; Y1107-Y1110 PolarHBondContact O-N 2.89Å; T1108-Y1110 VanDerWaalsContact C-N 3.33Å; Y1110-G1112 VanDerWaalsContact C-N 3.29Å; Y1110-G1112 PolarHBondContact O-N 3.49Å; Y1110-F1187 AromaticContact CD2-CE1 3.67Å; Y1110-F1187 HydrophobicContact CD2-CE1 3.67Å; Y1110-F1187 HydrophobicContact CD2-CE2 4.46Å; Y1110-F1187 AromaticContact CD2-CZ 3.33Å; Y1110-F1187 HydrophobicContact CD2-CZ 3.33Å; Y1110-F1187 AromaticContact CE2-CE1 3.38Å; Y1110-F1187 HydrophobicContact CE2-CE1 3.38Å; Y1110-F1187 AromaticContact CE2-CZ 3.61Å; Y1110-F1187 HydrophobicContact CE2-CZ 3.61Å; Y1110-F1187 HydrophobicContact CG-CZ 4.19Å; Y1110-Y1188 HydrophobicContact CE2-CE1 4.47Å; Y1110-Y1188 WeakPolarHBondContact OH-CE1 3.4Å; Y1110-Y1188 PolarHBondContact OH-OH 3.13Å
1111	S	84.2	Confident	87.1	Confident	26 Å²	26	31 Å²	31	18%	0.182	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	15.2	179	67.1	0	0	0	0	114.2	Y1107 T1108 F1113 S1114	Y1107-S1111 PolarHBondContact O-N 2.86Å; Y1107-S1111 PolarHBondContact O-OG 3.23Å; T1108-S1111 WeakPolarHBondContact CA-OG 3.38Å; T1108-S1111 PolarHBondContact O-OG 2.97Å; S1111-F1113 VanDerWaalsContact C-N 3.3Å; S1111-F1113 PolarHBondContact O-N 3.49Å; S1111-S1114 WeakPolarHBondContact O-CB 3.34Å; S1111-S1114 PolarHBondContact O-N 2.9Å; S1111-S1114 PolarHBondContact O-OG 3.37Å
1112	G	81.2	Confident	86.6	Confident	12 Å²	12	33.1 Å²	33.1	12%	0.124	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.6	28.7	-178.4	0	0	0	0	0	113.5	Y1110 S1114	Y1110-G1112 VanDerWaalsContact C-N 3.29Å; Y1110-G1112 PolarHBondContact O-N 3.49Å; G1112-S1114 PolarHBondContact O-N 3.32Å
1113	F	85.4	Confident	86.2	Confident	20 Å²	20	32.8 Å²	32.8	9%	0.088	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	36.5	-176.2	-60.2	-97	0	0	0	113.5	F340 V343 T344 F375 T1108 F1109 S1111 A1115	F340-F1113 HydrophobicContact CB-CD1 4.28Å; F340-F1113 HydrophobicContact CD1-CD1 4.08Å; F340-F1113 AromaticContact CD1-CE1 3.71Å; F340-F1113 HydrophobicContact CD1-CE1 3.71Å; F340-F1113 HydrophobicContact CE1-CE1 4.19Å; F340-F1113 HydrophobicContact CG-CD1 4.34Å; F340-F1113 HydrophobicContact CG-CE1 4.42Å; V343-F1113 HydrophobicContact CB-CD1 4.22Å; V343-F1113 HydrophobicContact CB-CD2 4.48Å; V343-F1113 HydrophobicContact CB-CE1 4.11Å; V343-F1113 HydrophobicContact CB-CE2 4.38Å; V343-F1113 HydrophobicContact CB-CG 4.4Å; V343-F1113 HydrophobicContact CB-CZ 4.17Å; V343-F1113 HydrophobicContact CG1-CD1 4.11Å; V343-F1113 HydrophobicContact CG1-CD2 3.59Å; V343-F1113 HydrophobicContact CG1-CE1 3.88Å; V343-F1113 HydrophobicContact CG1-CE2 3.32Å; V343-F1113 HydrophobicContact CG1-CG 3.97Å; V343-F1113 HydrophobicContact CG1-CZ 3.46Å; V343-F1113 VanDerWaalsContact CG1-CZ 3.46Å; T344-F1113 WeakPolarHBondContact CG2-O 3.28Å; T344-F1113 VanDerWaalsContact OG1-CB 3.23Å; T344-F1113 WeakPolarHBondContact OG1-CB 3.48Å; T344-F1113 PolarHBondContact OG1-O 3.36Å; F375-F1113 HydrophobicContact CZ-CB 4.27Å; F375-F1113 WeakPolarHBondContact CZ-O 3.44Å; T1108-F1113 HydrophobicContact CG2-CB 4.44Å; T1108-F1113 HydrophobicContact CG2-CD1 3.79Å; T1108-F1113 HydrophobicContact CG2-CE1 4.43Å; T1108-F1113 HydrophobicContact CG2-CG 4.34Å; T1108-F1113 WeakPolarHBondContact O-CA 3.37Å; T1108-F1113 PolarHBondContact O-N 3.48Å; F1109-F1113 AromaticContact CD1-CE1 3.97Å; F1109-F1113 HydrophobicContact CD1-CE1 3.97Å; F1109-F1113 HydrophobicContact CD1-CE2 4.22Å; F1109-F1113 AromaticContact CD1-CZ 3.36Å; F1109-F1113 HydrophobicContact CD1-CZ 3.36Å; F1109-F1113 HydrophobicContact CE1-CE1 4.07Å; F1109-F1113 AromaticContact CE1-CZ 3.72Å; F1109-F1113 HydrophobicContact CE1-CZ 3.72Å; F1109-F1113 HydrophobicContact CG-CZ 4.26Å; S1111-F1113 VanDerWaalsContact C-N 3.3Å; S1111-F1113 PolarHBondContact O-N 3.49Å; F1113-A1115 PolarHBondContact O-N 3.47Å
1114	S	82.4	Confident	85.8	Confident	35 Å²	35	32.7 Å²	32.7	25%	0.245	17%	0.173	C	C	.	.			trans	-77.7	-1.3	-179.4	54.3	0	0	0	0	114.3	R374 S1111 G1112 V1116	R374-S1114 PolarHBondContact NH2-O 3.24Å; S1111-S1114 WeakPolarHBondContact O-CB 3.34Å; S1111-S1114 PolarHBondContact O-N 2.9Å; S1111-S1114 PolarHBondContact O-OG 3.37Å; G1112-S1114 PolarHBondContact O-N 3.32Å; S1114-V1116 VanDerWaalsContact C-N 3.3Å; S1114-V1116 PolarHBondContact O-N 2.97Å; S1114-V1116 WeakPolarHBondContact OG-CG2 3.38Å
1115	A	82.8	Confident	85.4	Confident	3 Å²	3	33.3 Å²	33.3	3%	0.025	18%	0.177	C	C	.	.			trans	52.8	44.7	-175.6	0	0	0	0	0	112.8	R374 F375 I378 F1113	R374-A1115 HydrophobicContact CB-CB 4.1Å; F375-A1115 HydrophobicContact CD1-CB 3.9Å; F375-A1115 HydrophobicContact CE1-CB 3.6Å; F375-A1115 HydrophobicContact CZ-CB 3.98Å; I378-A1115 HydrophobicContact CD1-CB 3.96Å; I378-A1115 WeakPolarHBondContact CD1-O 3.29Å; F1113-A1115 PolarHBondContact O-N 3.47Å
1116	V	85.4	Confident	85	Confident	67 Å²	67	33.1 Å²	33.1	41%	0.406	18%	0.175	S	C	.	.			trans	-94.5	132.1	172.1	177.3	0	0	0	0	109	Y1107 S1114	Y1107-V1116 HydrophobicContact CE1-CB 4.49Å; S1114-V1116 VanDerWaalsContact C-N 3.3Å; S1114-V1116 PolarHBondContact O-N 2.97Å; S1114-V1116 WeakPolarHBondContact OG-CG2 3.38Å
1117	S	85.4	Confident	84.7	Confident	27 Å²	27	32.2 Å²	32.2	19%	0.189	17%	0.17	C	C	.	.			trans	-77.9	136.2	176.9	57.1	0	0	0	0	111.6	F1119	S1117-F1119 PolarHBondContact OG-O 3.11Å
1118	T	84.8	Confident	84.2	Confident	13 Å²	13	31.5 Å²	31.5	8%	0.08	17%	0.168	C	C	.	.	S	Bend	trans	-71.4	-31.8	174.3	64.7	0	0	0	0	113.1	Q1104 Y1107 G1222	Q1104-T1118 VanDerWaalsContact CD-OG1 3.29Å; Q1104-T1118 PolarHBondContact NE2-OG1 3.24Å; Q1104-T1118 PolarHBondContact OE1-OG1 2.96Å; Y1107-T1118 HydrophobicContact CD1-CG2 3.22Å; Y1107-T1118 HydrophobicContact CD2-CG2 3.51Å; Y1107-T1118 HydrophobicContact CE1-CG2 3.77Å; Y1107-T1118 HydrophobicContact CE2-CG2 4.03Å; Y1107-T1118 HydrophobicContact CG-CG2 3.05Å; T1118-G1222 WeakPolarHBondContact O-CA 3.37Å
1119	F	85.7	Confident	83.8	Confident	5 Å²	5	34.1 Å²	34.1	2%	0.022	18%	0.181	C	C	.	.	S	Bend	trans	-98.3	152.3	-174.9	-50.1	-50.5	0	0	0	110.6	F1100 T1103 Q1104 S1117 L1123 F1124 G1222 T1225 Y1226	F1100-F1119 HydrophobicContact CD2-CD2 4.36Å; F1100-F1119 AromaticContact CD2-CE2 3.77Å; F1100-F1119 HydrophobicContact CD2-CE2 3.77Å; F1100-F1119 HydrophobicContact CD2-CZ 4.47Å; F1100-F1119 HydrophobicContact CE1-CD2 4.23Å; F1100-F1119 HydrophobicContact CE1-CE2 4.28Å; F1100-F1119 AromaticContact CE2-CD2 3.38Å; F1100-F1119 HydrophobicContact CE2-CD2 3.38Å; F1100-F1119 AromaticContact CE2-CE2 3.22Å; F1100-F1119 HydrophobicContact CE2-CE2 3.22Å; F1100-F1119 HydrophobicContact CE2-CG 4.4Å; F1100-F1119 HydrophobicContact CE2-CZ 4.12Å; F1100-F1119 HydrophobicContact CG-CE2 4.49Å; F1100-F1119 AromaticContact CZ-CD2 3.31Å; F1100-F1119 HydrophobicContact CZ-CD2 3.31Å; F1100-F1119 AromaticContact CZ-CE2 3.53Å; F1100-F1119 HydrophobicContact CZ-CE2 3.53Å; F1100-F1119 HydrophobicContact CZ-CG 4.42Å; T1103-F1119 WeakPolarHBondContact OG1-CZ 3.2Å; Q1104-F1119 HydrophobicContact CG-CE2 4.25Å; S1117-F1119 PolarHBondContact OG-O 3.11Å; F1119-L1123 HydrophobicContact CB-CB 4.43Å; F1119-F1124 HydrophobicContact CB-CD2 4.06Å; F1119-F1124 HydrophobicContact CB-CE2 3.71Å; F1119-F1124 HydrophobicContact CB-CZ 4.17Å; F1119-F1124 HydrophobicContact CD2-CE1 4.2Å; F1119-F1124 HydrophobicContact CD2-CE2 4.38Å; F1119-F1124 HydrophobicContact CD2-CZ 4Å; F1119-F1124 WeakPolarHBondContact O-CE2 3.42Å; F1119-G1222 VanDerWaalsContact CD1-O 3.24Å; F1119-G1222 WeakPolarHBondContact CD1-O 3.38Å; F1119-G1222 WeakPolarHBondContact CE1-O 3.23Å; F1119-T1225 WeakPolarHBondContact CE1-OG1 3.49Å; F1119-Y1226 HydrophobicContact CD1-CD2 4.25Å; F1119-Y1226 HydrophobicContact CD1-CG 4.5Å; F1119-Y1226 HydrophobicContact CE1-CD2 4.48Å; F1119-Y1226 HydrophobicContact CG-CD2 4.32Å
1120	E	81.4	Confident	83.3	Confident	59 Å²	59	31.1 Å²	31.1	28%	0.276	17%	0.172	S	C	.	.			trans	-63.9	141.4	167.7	-177.7	176.7	-144.6	0	0	110.5	V1122 L1123 F1124 N1276	E1120-V1122 PolarHBondContact O-N 2.97Å; E1120-L1123 HydrophobicContact CB-CD1 4.15Å; E1120-L1123 HydrophobicContact CB-CG 4.24Å; E1120-L1123 WeakPolarHBondContact O-CB 3.32Å; E1120-L1123 PolarHBondContact O-N 2.96Å; E1120-F1124 PolarHBondContact O-N 3.18Å; E1120-N1276 VanDerWaalsContact CD-ND2 3.32Å; E1120-N1276 PolarHBondContact OE1-ND2 3.27Å
1121	T	82.7	Confident	83.1	Confident	37 Å²	37	24.3 Å²	24.3	23%	0.227	15%	0.145	C	C	.	.	H	α-helix	trans	-48.1	-37.2	-179.6	-60.3	0	0	0	0	114.5	S98 A101 S1125	S98-T1121 VanDerWaalsContact N-CG2 3.26Å; S98-T1121 WeakPolarHBondContact OG-CG2 3.5Å; A101-T1121 HydrophobicContact CB-CG2 3.79Å; T1121-S1125 PolarHBondContact O-OG 2.88Å
1122	V	81.9	Confident	83.2	Confident	55 Å²	55	23.1 Å²	23.1	33%	0.333	14%	0.137	S	C	.	.	H	α-helix	trans	-70.2	-37.3	179.9	-178.8	0	0	0	0	111.3	E1120 F1124 S1125 I1126 L1266	E1120-V1122 PolarHBondContact O-N 2.97Å; V1122-F1124 VanDerWaalsContact C-N 3.3Å; V1122-F1124 PolarHBondContact O-N 3.37Å; V1122-S1125 WeakPolarHBondContact O-CB 3.45Å; V1122-S1125 PolarHBondContact O-N 3.11Å; V1122-I1126 HydrophobicContact CG1-CD1 3.61Å; V1122-I1126 HydrophobicContact CG1-CG1 4.23Å; V1122-I1126 WeakPolarHBondContact O-CG1 3.25Å; V1122-I1126 PolarHBondContact O-N 3.01Å; V1122-L1266 HydrophobicContact CG1-CD1 3.79Å; V1122-L1266 HydrophobicContact CG1-CD2 3.77Å; V1122-L1266 HydrophobicContact CG1-CG 4.46Å
1123	L	84.6	Confident	83.4	Confident	10 Å²	10	23.1 Å²	23.1	5%	0.052	14%	0.135	C	C	.	.	H	α-helix	trans	-63.4	-35.7	179.4	-63.5	176.8	0	0	0	112.2	F1119 E1120 S1125 I1126 Y1127 Y1226 L1263	F1119-L1123 HydrophobicContact CB-CB 4.43Å; E1120-L1123 HydrophobicContact CB-CD1 4.15Å; E1120-L1123 HydrophobicContact CB-CG 4.24Å; E1120-L1123 WeakPolarHBondContact O-CB 3.32Å; E1120-L1123 PolarHBondContact O-N 2.96Å; L1123-S1125 VanDerWaalsContact C-N 3.26Å; L1123-S1125 PolarHBondContact O-N 3.16Å; L1123-I1126 PolarHBondContact O-N 3.38Å; L1123-Y1127 WeakPolarHBondContact O-CB 3.45Å; L1123-Y1127 PolarHBondContact O-N 3.48Å; L1123-Y1226 HydrophobicContact CB-CD2 4.05Å; L1123-Y1226 HydrophobicContact CB-CE2 3.8Å; L1123-Y1226 HydrophobicContact CD1-CD1 4.41Å; L1123-Y1226 HydrophobicContact CD1-CD2 4.44Å; L1123-Y1226 HydrophobicContact CD1-CG 4.22Å; L1123-Y1226 HydrophobicContact CD2-CD1 4.35Å; L1123-Y1226 HydrophobicContact CD2-CE1 4.02Å; L1123-L1263 HydrophobicContact CD2-CD1 3.92Å
1124	F	84	Confident	83.4	Confident	1 Å²	1	25 Å²	25	0%	0.004	15%	0.146	C	C	.	.	H	α-helix	trans	-56.4	-40.2	172.3	-81.8	-80.6	0	0	0	113	T97 Y381 F1100 F1119 E1120 V1122	T97-F1124 HydrophobicContact CG2-CD2 4.1Å; T97-F1124 HydrophobicContact CG2-CE2 4.08Å; Y381-F1124 HydrophobicContact CD1-CD1 4.07Å; Y381-F1124 AromaticContact CD2-CD1 3.4Å; Y381-F1124 HydrophobicContact CD2-CD1 3.4Å; Y381-F1124 AromaticContact CD2-CE1 3.69Å; Y381-F1124 HydrophobicContact CD2-CE1 3.69Å; Y381-F1124 HydrophobicContact CD2-CG 4.42Å; Y381-F1124 HydrophobicContact CE1-CB 3.78Å; Y381-F1124 AromaticContact CE1-CD1 3.95Å; Y381-F1124 HydrophobicContact CE1-CD1 3.95Å; Y381-F1124 HydrophobicContact CE1-CG 4.31Å; Y381-F1124 HydrophobicContact CE2-CB 4.12Å; Y381-F1124 AromaticContact CE2-CD1 3.25Å; Y381-F1124 HydrophobicContact CE2-CD1 3.25Å; Y381-F1124 AromaticContact CE2-CE1 3.78Å; Y381-F1124 HydrophobicContact CE2-CE1 3.78Å; Y381-F1124 AromaticContact CE2-CG 3.86Å; Y381-F1124 HydrophobicContact CE2-CG 3.86Å; Y381-F1124 AromaticContact CG-CD1 3.83Å; Y381-F1124 HydrophobicContact CG-CD1 3.83Å; Y381-F1124 HydrophobicContact CG-CE1 4.34Å; Y381-F1124 AromaticContact CZ-CD1 3.56Å; Y381-F1124 AromaticContact CZ-CG 3.81Å; Y381-F1124 WeakPolarHBondContact OH-CB 3.19Å; F1100-F1124 AromaticContact CE1-CD1 3.43Å; F1100-F1124 HydrophobicContact CE1-CD1 3.43Å; F1100-F1124 VanDerWaalsContact CE1-CD1 3.43Å; F1100-F1124 AromaticContact CE1-CE1 3.51Å; F1100-F1124 HydrophobicContact CE1-CE1 3.51Å; F1100-F1124 AromaticContact CZ-CD1 3.52Å; F1100-F1124 HydrophobicContact CZ-CD1 3.52Å; F1100-F1124 AromaticContact CZ-CE1 3.71Å; F1100-F1124 HydrophobicContact CZ-CE1 3.71Å; F1100-F1124 HydrophobicContact CZ-CG 4.24Å; F1119-F1124 HydrophobicContact CB-CD2 4.06Å; F1119-F1124 HydrophobicContact CB-CE2 3.71Å; F1119-F1124 HydrophobicContact CB-CZ 4.17Å; F1119-F1124 HydrophobicContact CD2-CE1 4.2Å; F1119-F1124 HydrophobicContact CD2-CE2 4.38Å; F1119-F1124 HydrophobicContact CD2-CZ 4Å; F1119-F1124 WeakPolarHBondContact O-CE2 3.42Å; E1120-F1124 PolarHBondContact O-N 3.18Å; V1122-F1124 VanDerWaalsContact C-N 3.3Å; V1122-F1124 PolarHBondContact O-N 3.37Å
1125	S	80.8	Confident	83.7	Confident	14 Å²	14	23.4 Å²	23.4	10%	0.098	13%	0.134	C	C	.	.	H	α-helix	trans	-71.4	-44.8	-178.6	-48.9	0	0	0	0	111.5	A101 T1121 V1122 L1123 L1129	A101-S1125 WeakPolarHBondContact CA-OG 3.4Å; A101-S1125 VanDerWaalsContact CB-OG 3.28Å; A101-S1125 WeakPolarHBondContact CB-OG 3.46Å; T1121-S1125 PolarHBondContact O-OG 2.88Å; V1122-S1125 WeakPolarHBondContact O-CB 3.45Å; V1122-S1125 PolarHBondContact O-N 3.11Å; L1123-S1125 VanDerWaalsContact C-N 3.26Å; L1123-S1125 PolarHBondContact O-N 3.16Å; S1125-L1129 WeakPolarHBondContact O-CB 3.35Å; S1125-L1129 PolarHBondContact O-N 3.15Å
1126	I	83.8	Confident	84	Confident	23 Å²	23	23.2 Å²	23.2	12%	0.118	13%	0.133	C	C	.	.	H	α-helix	trans	-69.7	-36.2	-174.8	-64.6	174.1	0	0	0	110.7	V1122 L1123 N1128 L1129 T1130 V1131 N1259 I1262 L1266	V1122-I1126 HydrophobicContact CG1-CD1 3.61Å; V1122-I1126 HydrophobicContact CG1-CG1 4.23Å; V1122-I1126 WeakPolarHBondContact O-CG1 3.25Å; V1122-I1126 PolarHBondContact O-N 3.01Å; L1123-I1126 PolarHBondContact O-N 3.38Å; I1126-N1128 PolarHBondContact O-N 3.34Å; I1126-L1129 PolarHBondContact O-N 3.04Å; I1126-T1130 WeakPolarHBondContact CG2-OG1 3.42Å; I1126-T1130 PolarHBondContact O-N 3.24Å; I1126-T1130 PolarHBondContact O-OG1 3.04Å; I1126-V1131 HydrophobicContact CG2-CG2 3.56Å; I1126-V1131 PolarHBondContact O-N 3.21Å; I1126-V1131 VanDerWaalsContact O-N 3.15Å; I1126-N1259 WeakPolarHBondContact CG2-OD1 3.25Å; I1126-I1262 HydrophobicContact CD1-CG2 3.62Å; I1126-L1266 HydrophobicContact CD1-CD1 3.7Å
1127	Y	87	Confident	84.2	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.122	C	C	.	.	I	π-helix	trans	-52.1	-50	-177.6	-176.6	-103.4	0	0	0	113.7	K1096 F1100 L1123 T1132 Y1226 V1229	K1096-Y1127 PolarHBondContact O-OH 3.44Å; F1100-Y1127 HydrophobicContact CB-CD1 4.39Å; F1100-Y1127 HydrophobicContact CB-CE1 3.76Å; F1100-Y1127 HydrophobicContact CD1-CD1 4.41Å; F1100-Y1127 AromaticContact CD2-CD1 3.95Å; F1100-Y1127 HydrophobicContact CD2-CD1 3.95Å; F1100-Y1127 HydrophobicContact CD2-CD2 4.05Å; F1100-Y1127 AromaticContact CD2-CE1 3.98Å; F1100-Y1127 HydrophobicContact CD2-CE1 3.98Å; F1100-Y1127 HydrophobicContact CD2-CE2 4.08Å; F1100-Y1127 AromaticContact CD2-CG 3.99Å; F1100-Y1127 HydrophobicContact CD2-CG 3.99Å; F1100-Y1127 HydrophobicContact CE2-CD1 4.29Å; F1100-Y1127 HydrophobicContact CE2-CD2 4.23Å; F1100-Y1127 HydrophobicContact CE2-CG 4.02Å; F1100-Y1127 HydrophobicContact CG-CD1 4Å; F1100-Y1127 AromaticContact CG-CE1 3.86Å; F1100-Y1127 HydrophobicContact CG-CE1 3.86Å; F1100-Y1127 HydrophobicContact CG-CG 4.5Å; L1123-Y1127 WeakPolarHBondContact O-CB 3.45Å; L1123-Y1127 PolarHBondContact O-N 3.48Å; Y1127-T1132 HydrophobicContact CD2-CG2 4.31Å; Y1127-T1132 HydrophobicContact CE2-CG2 3.77Å; Y1127-T1132 PolarHBondContact O-N 3.26Å; Y1127-T1132 PolarHBondContact O-OG1 2.88Å; Y1127-Y1226 HydrophobicContact CD2-CE2 4.02Å; Y1127-Y1226 HydrophobicContact CG-CE2 4.42Å; Y1127-V1229 HydrophobicContact CE2-CG1 3.89Å
1128	N	79.9	Confident	84.5	Confident	4 Å²	4	21.5 Å²	21.5	2%	0.021	12%	0.119	C	C	.	.	I	π-helix	trans	-84.2	-22.2	-177.4	-79.4	-28.6	0	0	0	113.5	S386 I1126	S386-N1128 WeakPolarHBondContact CB-O 3.03Å; S386-N1128 PolarHBondContact OG-O 2.88Å; I1126-N1128 PolarHBondContact O-N 3.34Å
1129	L	79.6	Confident	84.7	Confident	57 Å²	57	21 Å²	21	30%	0.298	12%	0.115	S	C	.	.	I	π-helix	trans	-92	-46.8	-174.8	-171.7	77.7	0	0	0	113.5	F108 S1125 I1126 S1133	F108-L1129 HydrophobicContact CD1-CD1 3.46Å; F108-L1129 VanDerWaalsContact CD1-CD1 3.46Å; F108-L1129 HydrophobicContact CE1-CD1 3.8Å; F108-L1129 HydrophobicContact CG-CD1 4.22Å; S1125-L1129 WeakPolarHBondContact O-CB 3.35Å; S1125-L1129 PolarHBondContact O-N 3.15Å; I1126-L1129 PolarHBondContact O-N 3.04Å; L1129-S1133 VanDerWaalsContact C-OG 3.23Å; L1129-S1133 WeakPolarHBondContact O-CB 3.49Å; L1129-S1133 PolarHBondContact O-OG 3.13Å
1130	T	80.3	Confident	84.9	Confident	42 Å²	42	20.7 Å²	20.7	26%	0.258	11%	0.114	S	C	.	.	I	π-helix	trans	-125	-34.2	-169.3	57.2	0	0	0	0	113.7	I1126 N1259	I1126-T1130 WeakPolarHBondContact CG2-OG1 3.42Å; I1126-T1130 PolarHBondContact O-N 3.24Å; I1126-T1130 PolarHBondContact O-OG1 3.04Å; T1130-N1259 WeakPolarHBondContact CB-OD1 3.25Å; T1130-N1259 PolarHBondContact O-ND2 3.1Å; T1130-N1259 VanDerWaalsContact O-ND2 3.13Å; T1130-N1259 PolarHBondContact OG1-OD1 2.78Å
1131	V	82.7	Confident	85.4	Confident	1 Å²	1	18.3 Å²	18.3	1%	0.006	10%	0.103	C	C	.	.	I	π-helix	trans	-68.5	-49.9	-172.8	177.8	0	0	0	0	112.1	I1126 Y1226 W1230 N1259	I1126-V1131 HydrophobicContact CG2-CG2 3.56Å; I1126-V1131 PolarHBondContact O-N 3.21Å; I1126-V1131 VanDerWaalsContact O-N 3.15Å; V1131-Y1226 WeakPolarHBondContact CG2-OH 3.3Å; V1131-W1230 HydrophobicContact CG1-CB 4.06Å; V1131-W1230 HydrophobicContact CG1-CD2 3.62Å; V1131-W1230 HydrophobicContact CG1-CE3 4.48Å; V1131-W1230 HydrophobicContact CG1-CG 3.36Å; V1131-W1230 HydrophobicContact CG1-CZ2 4.33Å; V1131-W1230 VanDerWaalsContact CG1-NE1 3.29Å; V1131-N1259 WeakPolarHBondContact CA-ND2 3.34Å; V1131-N1259 HydrophobicContact CG2-CB 4.35Å
1132	T	85.2	Confident	85.8	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.105	C	C	.	.	S	Bend	trans	-115.3	-18.6	-169.7	58.9	0	0	0	0	113.8	K1096 Y1127 C1136 V1233	K1096-T1132 PolarHBondContact NZ-OG1 3.3Å; Y1127-T1132 HydrophobicContact CD2-CG2 4.31Å; Y1127-T1132 HydrophobicContact CE2-CG2 3.77Å; Y1127-T1132 PolarHBondContact O-N 3.26Å; Y1127-T1132 PolarHBondContact O-OG1 2.88Å; T1132-C1136 PolarHBondContact O-N 3.47Å; T1132-C1136 PolarHBondContact O-SG 3.06Å; T1132-V1233 HydrophobicContact CG2-CG1 4.08Å
1133	S	85	Confident	86.2	Confident	13 Å²	13	16.9 Å²	16.9	9%	0.091	9%	0.089	C	C	.	.	H	α-helix	trans	-66.7	-48.9	-172.1	57.7	0	0	0	0	113.1	L1129 M1135 C1136 M1137	L1129-S1133 VanDerWaalsContact C-OG 3.23Å; L1129-S1133 WeakPolarHBondContact O-CB 3.49Å; L1129-S1133 PolarHBondContact O-OG 3.13Å; S1133-M1135 PolarHBondContact O-N 3.28Å; S1133-C1136 PolarHBondContact O-N 3.21Å; S1133-M1137 WeakPolarHBondContact O-CB 3.39Å; S1133-M1137 PolarHBondContact O-N 3.42Å
1134	L	87	Confident	86.2	Confident	59 Å²	59	21.6 Å²	21.6	31%	0.309	11%	0.106	S	C	.	.	H	α-helix	trans	-65.3	-41.2	-176.1	174.8	59.3	0	0	0	111.1	M1137 L1138 T1255	L1134-M1137 HydrophobicContact CD1-CE 3.4Å; L1134-M1137 WeakPolarHBondContact O-CB 3.26Å; L1134-M1137 PolarHBondContact O-N 3.32Å; L1134-L1138 HydrophobicContact CD1-CD1 3.95Å; L1134-L1138 HydrophobicContact CD1-CG 4.01Å; L1134-L1138 HydrophobicContact CG-CD1 4.05Å; L1134-L1138 HydrophobicContact CG-CG 4.5Å; L1134-L1138 WeakPolarHBondContact O-CB 3.44Å; L1134-L1138 VanDerWaalsContact O-CG 3.32Å; L1134-L1138 WeakPolarHBondContact O-CG 3.48Å; L1134-L1138 PolarHBondContact O-N 3.27Å; L1134-T1255 HydrophobicContact CB-CG2 3.63Å; L1134-T1255 HydrophobicContact CD2-CG2 3.69Å; L1134-T1255 HydrophobicContact CG-CG2 3.86Å
1135	M	87.6	Confident	86.2	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-64.4	-47.2	175.9	176.8	-171	50.8	0	0	111.8	S1133 M1137 L1138 F1139 I1237 I1252	S1133-M1135 PolarHBondContact O-N 3.28Å; M1135-M1137 PolarHBondContact O-N 3.49Å; M1135-L1138 PolarHBondContact O-N 3.41Å; M1135-F1139 WeakPolarHBondContact O-CB 3.44Å; M1135-F1139 PolarHBondContact O-N 3.17Å; M1135-I1237 HydrophobicContact CE-CB 4.05Å; M1135-I1237 HydrophobicContact CE-CD1 3.25Å; M1135-I1237 HydrophobicContact CE-CG1 4.14Å; M1135-I1237 HydrophobicContact CE-CG2 4.41Å; M1135-I1237 HydrophobicContact CG-CB 4.39Å; M1135-I1237 HydrophobicContact CG-CD1 4.49Å; M1135-I1237 HydrophobicContact CG-CG2 3.78Å; M1135-I1237 HydrophobicContact SD-CB 3.85Å; M1135-I1237 HydrophobicContact SD-CD1 4.18Å; M1135-I1237 HydrophobicContact SD-CG2 3.88Å; M1135-I1252 HydrophobicContact CG-CG1 3.81Å; M1135-I1252 HydrophobicContact SD-CD1 4.38Å; M1135-I1252 HydrophobicContact SD-CG1 3.88Å
1136	C	89.2	Confident	86.4	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-58.9	-39	173.8	-67.1	0	0	0	0	111.8	Q394 F1093 T1132 S1133 G1140 I1237	Q394-C1136 PolarHBondContact NE2-O 3.09Å; F1093-C1136 HydrophobicContact CD2-CB 4.09Å; F1093-C1136 HydrophobicContact CE2-CB 3.43Å; F1093-C1136 VanDerWaalsContact CE2-CB 3.43Å; F1093-C1136 HydrophobicContact CZ-CB 3.97Å; T1132-C1136 PolarHBondContact O-N 3.47Å; T1132-C1136 PolarHBondContact O-SG 3.06Å; S1133-C1136 PolarHBondContact O-N 3.21Å; C1136-G1140 PolarHBondContact O-N 2.92Å; C1136-I1237 WeakPolarHBondContact SG-CD1 3.35Å
1137	M	90.1	Very high	86.5	Confident	34 Å²	34	24.6 Å²	24.6	17%	0.167	12%	0.124	C	C	.	.	H	α-helix	trans	-64	-51.3	179.3	-175.9	178.7	65.9	0	0	110.9	T390 I393 Q394 S1133 L1134 M1135 F1139 G1140 I1141	T390-M1137 HydrophobicContact CG2-CB 4.25Å; I393-M1137 HydrophobicContact CB-SD 4.17Å; I393-M1137 HydrophobicContact CD1-SD 4.18Å; I393-M1137 HydrophobicContact CG2-SD 3.69Å; Q394-M1137 HydrophobicContact CG-CG 4.41Å; Q394-M1137 PolarHBondContact NE2-O 2.99Å; S1133-M1137 WeakPolarHBondContact O-CB 3.39Å; S1133-M1137 PolarHBondContact O-N 3.42Å; L1134-M1137 HydrophobicContact CD1-CE 3.4Å; L1134-M1137 WeakPolarHBondContact O-CB 3.26Å; L1134-M1137 PolarHBondContact O-N 3.32Å; M1135-M1137 PolarHBondContact O-N 3.49Å; M1137-F1139 PolarHBondContact O-N 2.95Å; M1137-G1140 PolarHBondContact O-N 2.91Å; M1137-I1141 HydrophobicContact CG-CD1 3.97Å; M1137-I1141 WeakPolarHBondContact O-CG1 3.43Å; M1137-I1141 PolarHBondContact O-N 3.49Å; M1137-I1141 VanDerWaalsContact O-N 3.11Å
1138	L	90.7	Very high	86.6	Confident	24 Å²	24	26.2 Å²	26.2	13%	0.126	13%	0.133	C	C	.	.	H	α-helix	trans	-63.5	-39.5	-179.6	-69.9	172.5	0	0	0	112.4	L1134 M1135 G1140 I1141 F1142 V1247	L1134-L1138 HydrophobicContact CD1-CD1 3.95Å; L1134-L1138 HydrophobicContact CD1-CG 4.01Å; L1134-L1138 HydrophobicContact CG-CD1 4.05Å; L1134-L1138 HydrophobicContact CG-CG 4.5Å; L1134-L1138 WeakPolarHBondContact O-CB 3.44Å; L1134-L1138 VanDerWaalsContact O-CG 3.32Å; L1134-L1138 WeakPolarHBondContact O-CG 3.48Å; L1134-L1138 PolarHBondContact O-N 3.27Å; M1135-L1138 PolarHBondContact O-N 3.41Å; L1138-G1140 PolarHBondContact O-N 2.97Å; L1138-I1141 PolarHBondContact O-N 3.45Å; L1138-I1141 VanDerWaalsContact O-N 3.16Å; L1138-F1142 HydrophobicContact CD2-CD2 4.41Å; L1138-F1142 HydrophobicContact CD2-CE2 4.02Å; L1138-F1142 WeakPolarHBondContact O-CD2 3.28Å; L1138-F1142 PolarHBondContact O-N 3.22Å; L1138-F1142 VanDerWaalsContact O-N 3.09Å; L1138-V1247 HydrophobicContact CD2-CG1 4.22Å
1139	F	90.4	Very high	86.9	Confident	1 Å²	1	31.9 Å²	31.9	0%	0.004	16%	0.163	C	C	.	.	H	α-helix	trans	-52.3	-56	170.6	170.4	-92.6	0	0	0	110.6	I1088 L1092 M1135 M1137 I1141 F1142 E1143 I1237 A1240	I1088-F1139 HydrophobicContact CB-CE1 4.23Å; I1088-F1139 HydrophobicContact CG2-CE1 3.64Å; I1088-F1139 HydrophobicContact CG2-CZ 3.81Å; L1092-F1139 HydrophobicContact CD1-CD1 3.6Å; L1092-F1139 HydrophobicContact CD1-CE1 3.56Å; L1092-F1139 HydrophobicContact CD1-CG 4.25Å; L1092-F1139 HydrophobicContact CD1-CZ 4.16Å; M1135-F1139 WeakPolarHBondContact O-CB 3.44Å; M1135-F1139 PolarHBondContact O-N 3.17Å; M1137-F1139 PolarHBondContact O-N 2.95Å; F1139-I1141 PolarHBondContact O-N 2.85Å; F1139-I1141 VanDerWaalsContact O-N 3.15Å; F1139-F1142 PolarHBondContact O-N 3.26Å; F1139-E1143 HydrophobicContact CD2-CB 4.31Å; F1139-E1143 HydrophobicContact CD2-CG 4.4Å; F1139-E1143 HydrophobicContact CE1-CG 4.46Å; F1139-E1143 HydrophobicContact CE2-CB 4.15Å; F1139-E1143 HydrophobicContact CE2-CG 3.77Å; F1139-E1143 WeakPolarHBondContact CE2-OE2 3.39Å; F1139-E1143 HydrophobicContact CZ-CB 4.29Å; F1139-E1143 HydrophobicContact CZ-CG 3.8Å; F1139-E1143 WeakPolarHBondContact O-CB 3.5Å; F1139-E1143 PolarHBondContact O-N 3.06Å; F1139-I1237 HydrophobicContact CB-CG2 4.19Å; F1139-I1237 HydrophobicContact CD2-CG2 4.35Å; F1139-I1237 HydrophobicContact CG-CG2 4.37Å; F1139-A1240 HydrophobicContact CE2-CB 4.25Å; F1139-A1240 HydrophobicContact CZ-CB 4.43Å
1140	G	89.1	Confident	87.2	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-71.4	-8.2	-179.1	0	0	0	0	0	115.6	Q394 R1085 T1089 C1136 M1137 L1138	Q394-G1140 VanDerWaalsContact NE2-CA 3.27Å; R1085-G1140 WeakPolarHBondContact CB-O 3.48Å; R1085-G1140 WeakPolarHBondContact CD-O 3.42Å; T1089-G1140 VanDerWaalsContact OG1-CA 3.31Å; T1089-G1140 WeakPolarHBondContact OG1-CA 3.47Å; C1136-G1140 PolarHBondContact O-N 2.92Å; M1137-G1140 PolarHBondContact O-N 2.91Å; L1138-G1140 PolarHBondContact O-N 2.97Å
1141	I	92.1	Very high	87.6	Confident	9 Å²	9	30.1 Å²	30.1	5%	0.046	15%	0.152	C	C	.	.	H	α-helix	trans	-84.8	-47.8	172.1	-67.4	169	0	0	0	110.4	Q394 M397 F401 R1085 M1137 L1138 F1139	Q394-I1141 HydrophobicContact CG-CG1 3.92Å; M397-I1141 HydrophobicContact CB-CD1 4.3Å; M397-I1141 HydrophobicContact CB-CG1 4.26Å; M397-I1141 HydrophobicContact CB-CG2 4.22Å; M397-I1141 HydrophobicContact CG-CD1 4.08Å; F401-I1141 HydrophobicContact CE2-CG2 3.55Å; F401-I1141 HydrophobicContact CZ-CG2 3.75Å; R1085-I1141 PolarHBondContact NH1-O 3.44Å; M1137-I1141 HydrophobicContact CG-CD1 3.97Å; M1137-I1141 WeakPolarHBondContact O-CG1 3.43Å; M1137-I1141 PolarHBondContact O-N 3.49Å; M1137-I1141 VanDerWaalsContact O-N 3.11Å; L1138-I1141 PolarHBondContact O-N 3.45Å; L1138-I1141 VanDerWaalsContact O-N 3.16Å; F1139-I1141 PolarHBondContact O-N 2.85Å; F1139-I1141 VanDerWaalsContact O-N 3.15Å
1142	F	91.1	Very high	87.7	Confident	61 Å²	61	31.7 Å²	31.7	27%	0.268	16%	0.16	S	C	.	.	H	α-helix	trans	-103.7	-14.7	-166.6	-67.1	-74.1	0	0	0	115.2	F401 L1138 F1139 R1144 T1245 V1247 V1248	F401-F1142 HydrophobicContact CE2-CE1 4.45Å; F401-F1142 HydrophobicContact CZ-CD1 4.34Å; F401-F1142 AromaticContact CZ-CE1 3.76Å; F401-F1142 HydrophobicContact CZ-CE1 3.76Å; F401-F1142 HydrophobicContact CZ-CZ 4.23Å; L1138-F1142 HydrophobicContact CD2-CD2 4.41Å; L1138-F1142 HydrophobicContact CD2-CE2 4.02Å; L1138-F1142 WeakPolarHBondContact O-CD2 3.28Å; L1138-F1142 PolarHBondContact O-N 3.22Å; L1138-F1142 VanDerWaalsContact O-N 3.09Å; F1139-F1142 PolarHBondContact O-N 3.26Å; F1142-R1144 PolarHBondContact O-N 3.4Å; F1142-T1245 HydrophobicContact CB-CG2 4.49Å; F1142-V1247 HydrophobicContact CD2-CB 4.25Å; F1142-V1247 HydrophobicContact CD2-CG1 3.9Å; F1142-V1247 HydrophobicContact CE2-CB 4.09Å; F1142-V1247 HydrophobicContact CE2-CG1 3.39Å; F1142-V1247 HydrophobicContact CZ-CB 4.36Å; F1142-V1247 HydrophobicContact CZ-CG1 3.85Å; F1142-V1247 HydrophobicContact CZ-CG2 4.43Å; F1142-V1248 HydrophobicContact CB-CG2 4.18Å
1143	E	89.3	Confident	87.7	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	19%	0.189	C	C	.	.			trans	-60.8	124.2	-175	179.8	68	-168.8	0	0	112.7	R1085 F1139 S1241 H1242	R1085-E1143 HydrophobicContact CG-CB 4.44Å; R1085-E1143 PolarHBondContact NE-O 3.25Å; R1085-E1143 PolarHBondContact NH2-O 3.44Å; F1139-E1143 HydrophobicContact CD2-CB 4.31Å; F1139-E1143 HydrophobicContact CD2-CG 4.4Å; F1139-E1143 HydrophobicContact CE1-CG 4.46Å; F1139-E1143 HydrophobicContact CE2-CB 4.15Å; F1139-E1143 HydrophobicContact CE2-CG 3.77Å; F1139-E1143 WeakPolarHBondContact CE2-OE2 3.39Å; F1139-E1143 HydrophobicContact CZ-CB 4.29Å; F1139-E1143 HydrophobicContact CZ-CG 3.8Å; F1139-E1143 WeakPolarHBondContact O-CB 3.5Å; F1139-E1143 PolarHBondContact O-N 3.06Å; E1143-S1241 VanDerWaalsContact OE2-CA 3.31Å; E1143-S1241 WeakPolarHBondContact OE2-CA 3.31Å; E1143-S1241 WeakPolarHBondContact OE2-CB 3.32Å; E1143-S1241 PolarHBondContact OE2-OG 3.35Å; E1143-H1242 WeakPolarHBondContact OE1-CB 3.48Å; E1143-H1242 IonicContact OE1-CE1 3.78Å; E1143-H1242 IonicContact OE1-CG 2.78Å; E1143-H1242 PolarHBondContact OE1-N 3.29Å; E1143-H1242 IonicContact OE1-ND1 3.71Å; E1143-H1242 PolarHBondContact OE1-ND1 3.5Å; E1143-H1242 PolarHBondContact OE2-N 2.91Å
1144	R	86.2	Confident	87.8	Confident	109 Å²	109	36.3 Å²	36.3	41%	0.411	19%	0.194	S	C	.	.			trans	-118.2	111.5	166.4	-60.4	173.8	-63.8	178	6.3	108.3	R1085 F1142 L1146 D1243	R1085-R1144 VanDerWaalsContact NH2-CG 3.28Å; F1142-R1144 PolarHBondContact O-N 3.4Å; R1144-L1146 VanDerWaalsContact C-N 3.34Å; R1144-D1243 WeakPolarHBondContact CB-OD2 3.26Å; R1144-D1243 IonicContact CZ-OD2 3.65Å; R1144-D1243 IonicContact NE-OD2 3.48Å; R1144-D1243 PolarHBondContact NE-OD2 2.86Å; R1144-D1243 IonicContact NH2-OD2 3.47Å; R1144-D1243 PolarHBondContact NH2-OD2 2.9Å
1145	H	83.4	Confident	87.7	Confident	23 Å²	23	34 Å²	34	11%	0.106	18%	0.183	C	C	.	.	S	Bend	trans	-79.8	-21.3	175	68.4	-75.8	0	0	0	112.4	H1080 Y1084	H1080-H1145 AromaticContact CD2-CE1 3.39Å; H1080-H1145 PolarHBondContact CD2-CE1 3.09Å; H1080-H1145 AromaticContact CD2-NE2 3.57Å; H1080-H1145 AromaticContact CE1-NE2 3.98Å; H1080-H1145 AromaticContact NE2-CE1 3.2Å; H1080-H1145 PolarHBondContact NE2-CE1 3.48Å; H1080-H1145 AromaticContact NE2-NE2 2.87Å; H1080-H1145 PolarHBondContact NE2-NE2 3.24Å; Y1084-H1145 HydrophobicContact CD1-CB 4.15Å; Y1084-H1145 AromaticContact CD1-CE1 3.81Å; Y1084-H1145 AromaticContact CD1-CG 3.75Å; Y1084-H1145 AromaticContact CD1-ND1 3.22Å; Y1084-H1145 WeakPolarHBondContact CD1-ND1 3.39Å; Y1084-H1145 AromaticContact CD2-CE1 3.86Å; Y1084-H1145 AromaticContact CD2-ND1 3.96Å; Y1084-H1145 HydrophobicContact CE1-CB 3.56Å; Y1084-H1145 AromaticContact CE1-CG 3.62Å; Y1084-H1145 AromaticContact CE1-ND1 3.6Å; Y1084-H1145 HydrophobicContact CE2-CB 4.49Å; Y1084-H1145 AromaticContact CG-CE1 3.49Å; Y1084-H1145 VanDerWaalsContact CG-CE1 3.49Å; Y1084-H1145 AromaticContact CG-ND1 3.42Å; Y1084-H1145 AromaticContact CZ-CG 3.78Å
1146	L	84.5	Confident	87.5	Confident	13 Å²	13	37.5 Å²	37.5	7%	0.068	20%	0.196	C	C	.	.	S	Bend	trans	-141.6	137	175.8	-69.7	169.2	0	0	0	108.5	R1144 L1151 L1157 W1315 I1319	R1144-L1146 VanDerWaalsContact C-N 3.34Å; L1146-L1151 HydrophobicContact CB-CD1 4.38Å; L1146-L1151 HydrophobicContact CB-CD2 4.13Å; L1146-L1151 HydrophobicContact CB-CG 4.08Å; L1146-L1151 HydrophobicContact CD1-CD2 3.85Å; L1146-L1157 HydrophobicContact CD1-CD1 4.18Å; L1146-W1315 HydrophobicContact CD1-CZ3 4.4Å; L1146-I1319 HydrophobicContact CD2-CD1 3.77Å
1147	P	86	Confident	87.4	Confident	64 Å²	64	37.6 Å²	37.6	42%	0.416	20%	0.197	S	C	.	.			trans	-67.7	153.6	175.7	29.5	-35.2	0	0	0	111.3	D1149 I1150 L1151	P1147-D1149 VanDerWaalsContact C-N 3.27Å; P1147-D1149 PolarHBondContact O-N 2.88Å; P1147-I1150 HydrophobicContact CG-CB 4.11Å; P1147-I1150 HydrophobicContact CG-CD1 3.46Å; P1147-I1150 VanDerWaalsContact CG-CD1 3.46Å; P1147-I1150 HydrophobicContact CG-CG1 3.72Å; P1147-I1150 PolarHBondContact O-N 3Å; P1147-L1151 PolarHBondContact O-N 3.43Å
1148	D	88.8	Confident	87.2	Confident	35 Å²	35	36.2 Å²	36.2	19%	0.187	19%	0.19	C	C	.	.	H	α-helix	trans	-58.7	-37	-173.5	-62.7	6	0	0	0	112.6	R1073 V1077 Q1081 L1151 N1152	R1073-D1148 IonicContact NH2-OD2 3.17Å; R1073-D1148 PolarHBondContact NH2-OD2 3.23Å; R1073-D1148 VanDerWaalsContact NH2-OD2 3.16Å; V1077-D1148 HydrophobicContact CG1-CB 3.92Å; Q1081-D1148 PolarHBondContact NE2-OD1 3.21Å; D1148-L1151 PolarHBondContact O-N 3.14Å; D1148-N1152 PolarHBondContact O-N 3.28Å; D1148-N1152 PolarHBondContact O-ND2 3.35Å
1149	D	86.2	Confident	86.9	Confident	123 Å²	123	39.7 Å²	39.7	66%	0.658	20%	0.201	S	C	*	.	H	α-helix	trans	-67.9	-40.1	-176.6	-55.2	-40.5	0	0	0	111.8	P1147 L1151 N1152 A1153	P1147-D1149 VanDerWaalsContact C-N 3.27Å; P1147-D1149 PolarHBondContact O-N 2.88Å; D1149-L1151 VanDerWaalsContact C-N 3.33Å; D1149-L1151 PolarHBondContact O-N 2.98Å; D1149-N1152 PolarHBondContact O-N 3.21Å; D1149-A1153 VanDerWaalsContact O-CB 3.3Å; D1149-A1153 WeakPolarHBondContact O-CB 3.34Å; D1149-A1153 PolarHBondContact O-N 3.02Å
1150	I	86	Confident	86.4	Confident	59 Å²	59	43.9 Å²	43.9	30%	0.303	22%	0.217	S	C	.	.	H	α-helix	trans	-65.9	-38	176.1	-64.9	-179.4	0	0	0	110.7	P1147 N1154 L1157	P1147-I1150 HydrophobicContact CG-CB 4.11Å; P1147-I1150 HydrophobicContact CG-CD1 3.46Å; P1147-I1150 VanDerWaalsContact CG-CD1 3.46Å; P1147-I1150 HydrophobicContact CG-CG1 3.72Å; P1147-I1150 PolarHBondContact O-N 3Å; I1150-N1154 WeakPolarHBondContact O-CB 3.42Å; I1150-N1154 PolarHBondContact O-N 3.41Å; I1150-N1154 PolarHBondContact O-ND2 3.2Å; I1150-L1157 HydrophobicContact CG2-CD1 4.23Å
1151	L	88.1	Confident	85.9	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.016	22%	0.219	C	C	.	.	H	α-helix	trans	-67.7	-38.5	177.9	-71	174	0	0	0	112.1	V1077 H1080 Q1081 L1146 P1147 D1148 D1149 L1157	V1077-L1151 HydrophobicContact CG1-CD1 4.44Å; V1077-L1151 HydrophobicContact CG2-CB 4.17Å; H1080-L1151 VanDerWaalsContact CD2-CD2 3.46Å; H1080-L1151 WeakPolarHBondContact CD2-CD2 2.91Å; Q1081-L1151 HydrophobicContact CG-CD1 3.88Å; L1146-L1151 HydrophobicContact CB-CD1 4.38Å; L1146-L1151 HydrophobicContact CB-CD2 4.13Å; L1146-L1151 HydrophobicContact CB-CG 4.08Å; L1146-L1151 HydrophobicContact CD1-CD2 3.85Å; P1147-L1151 PolarHBondContact O-N 3.43Å; D1148-L1151 PolarHBondContact O-N 3.14Å; D1149-L1151 VanDerWaalsContact C-N 3.33Å; D1149-L1151 PolarHBondContact O-N 2.98Å; L1151-L1157 HydrophobicContact CD2-CD1 4.22Å
1152	N	86.7	Confident	85.1	Confident	34 Å²	34	44.9 Å²	44.9	18%	0.182	22%	0.221	C	C	.	.	H	α-helix	trans	-70.6	-42.6	175.3	-77.9	-38.5	0	0	0	112.4	V1077 D1148 D1149 N1154	V1077-N1152 WeakPolarHBondContact CG2-OD1 3.42Å; D1148-N1152 PolarHBondContact O-N 3.28Å; D1148-N1152 PolarHBondContact O-ND2 3.35Å; D1149-N1152 PolarHBondContact O-N 3.21Å; N1152-N1154 VanDerWaalsContact C-N 3.32Å; N1152-N1154 PolarHBondContact O-N 2.94Å
1153	A	85.3	Confident	84.1	Confident	73 Å²	73	45.2 Å²	45.2	60%	0.603	22%	0.224	S	C	*	.	H	α-helix	trans	-69	-28.9	179.8	0	0	0	0	0	113	D1149 P1155	D1149-A1153 VanDerWaalsContact O-CB 3.3Å; D1149-A1153 WeakPolarHBondContact O-CB 3.34Å; D1149-A1153 PolarHBondContact O-N 3.02Å; A1153-P1155 VanDerWaalsContact C-CD 3.45Å; A1153-P1155 VanDerWaalsContact O-CD 3.27Å; A1153-P1155 WeakPolarHBondContact O-CD 3.46Å
1154	N	85.2	Confident	83.6	Confident	37 Å²	37	45.5 Å²	45.5	20%	0.198	23%	0.225	C	C	.	.			trans	-119.6	72.5	-177.7	-65.6	-64.8	0	0	0	113	I1150 N1152 Y1156 L1157	I1150-N1154 WeakPolarHBondContact O-CB 3.42Å; I1150-N1154 PolarHBondContact O-N 3.41Å; I1150-N1154 PolarHBondContact O-ND2 3.2Å; N1152-N1154 VanDerWaalsContact C-N 3.32Å; N1152-N1154 PolarHBondContact O-N 2.94Å; N1154-Y1156 HydrophobicContact CB-CD1 4.11Å; N1154-Y1156 HydrophobicContact CB-CE1 3.59Å; N1154-Y1156 PolarHBondContact O-N 3Å; N1154-L1157 HydrophobicContact CB-CD1 3.7Å; N1154-L1157 HydrophobicContact CB-CG 3.96Å; N1154-L1157 WeakPolarHBondContact O-CB 3.31Å; N1154-L1157 WeakPolarHBondContact O-CG 3.48Å; N1154-L1157 PolarHBondContact O-N 3.43Å; N1154-L1157 VanDerWaalsContact O-N 3.07Å
1155	P	85.7	Confident	83.2	Confident	10 Å²	10	41.5 Å²	41.5	7%	0.065	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-56.3	-29.1	-177.1	-25.7	32.7	0	0	0	114.6	N819 D822 A823 L1076 A1153 L1157 Y1158	N819-P1155 HydrophobicContact CB-CB 4.26Å; N819-P1155 HydrophobicContact CB-CG 3.73Å; N819-P1155 WeakPolarHBondContact O-CB 3.42Å; D822-P1155 HydrophobicContact CB-CB 4.21Å; A823-P1155 VanDerWaalsContact CA-O 3.22Å; A823-P1155 WeakPolarHBondContact CA-O 3.49Å; A823-P1155 HydrophobicContact CB-CB 4.17Å; A823-P1155 VanDerWaalsContact CB-O 3.28Å; A823-P1155 WeakPolarHBondContact CB-O 3.29Å; L1076-P1155 HydrophobicContact CD1-CB 3.8Å; L1076-P1155 HydrophobicContact CD1-CG 4.06Å; L1076-P1155 HydrophobicContact CD2-CB 4.47Å; A1153-P1155 VanDerWaalsContact C-CD 3.45Å; A1153-P1155 VanDerWaalsContact O-CD 3.27Å; A1153-P1155 WeakPolarHBondContact O-CD 3.46Å; P1155-L1157 PolarHBondContact O-N 2.98Å; P1155-Y1158 WeakPolarHBondContact O-CB 3.3Å; P1155-Y1158 PolarHBondContact O-N 3.38Å
1156	Y	84.4	Confident	83.3	Confident	75 Å²	75	41.7 Å²	41.7	29%	0.294	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-60.6	-19.2	-179.8	76.9	-95.2	0	0	0	113.3	N1154 Y1158 R1159 S1322	N1154-Y1156 HydrophobicContact CB-CD1 4.11Å; N1154-Y1156 HydrophobicContact CB-CE1 3.59Å; N1154-Y1156 PolarHBondContact O-N 3Å; Y1156-Y1158 VanDerWaalsContact C-N 3.29Å; Y1156-Y1158 PolarHBondContact O-N 3.44Å; Y1156-R1159 WeakPolarHBondContact O-CB 3.4Å; Y1156-R1159 PolarHBondContact O-N 3.47Å; Y1156-S1322 WeakPolarHBondContact CE1-OG 3.38Å; Y1156-S1322 VanDerWaalsContact CZ-OG 3.3Å; Y1156-S1322 WeakPolarHBondContact OH-CB 2.99Å; Y1156-S1322 PolarHBondContact OH-OG 3.13Å
1157	L	85.3	Confident	83.4	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.01	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-62.7	-35.7	178	-68.9	174.3	0	0	0	112.3	L1146 I1150 L1151 N1154 P1155 R1159 R1160 W1315	L1146-L1157 HydrophobicContact CD1-CD1 4.18Å; I1150-L1157 HydrophobicContact CG2-CD1 4.23Å; L1151-L1157 HydrophobicContact CD2-CD1 4.22Å; N1154-L1157 HydrophobicContact CB-CD1 3.7Å; N1154-L1157 HydrophobicContact CB-CG 3.96Å; N1154-L1157 WeakPolarHBondContact O-CB 3.31Å; N1154-L1157 WeakPolarHBondContact O-CG 3.48Å; N1154-L1157 PolarHBondContact O-N 3.43Å; N1154-L1157 VanDerWaalsContact O-N 3.07Å; P1155-L1157 PolarHBondContact O-N 2.98Å; L1157-R1159 PolarHBondContact O-N 3.38Å; L1157-R1159 VanDerWaalsContact O-N 3.1Å; L1157-R1160 WeakPolarHBondContact O-CB 3.34Å; L1157-R1160 PolarHBondContact O-N 3.1Å; L1157-W1315 HydrophobicContact CD2-CZ3 4.14Å
1158	Y	87.5	Confident	83.4	Confident	4 Å²	4	44.4 Å²	44.4	2%	0.016	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-52.3	-35.8	175.1	-175.6	-90.9	0	0	0	112	L428 G429 Q430 V431 A823 I825 L1075 L1076 H1080 P1155 Y1156 R1160 L1161	L428-Y1158 PolarHBondContact O-OH 3.12Å; G429-Y1158 VanDerWaalsContact C-OH 3.22Å; Q430-Y1158 PolarHBondContact N-OH 2.98Å; V431-Y1158 WeakPolarHBondContact CB-OH 3.48Å; V431-Y1158 PolarHBondContact N-OH 3.45Å; A823-Y1158 HydrophobicContact CB-CD1 4.16Å; A823-Y1158 HydrophobicContact CB-CG 4.26Å; I825-Y1158 HydrophobicContact CD1-CD1 4.17Å; I825-Y1158 HydrophobicContact CD1-CE1 3.77Å; I825-Y1158 HydrophobicContact CG1-CD1 4.24Å; I825-Y1158 HydrophobicContact CG1-CE1 3.9Å; L1075-Y1158 VanDerWaalsContact O-CE2 3.31Å; L1075-Y1158 WeakPolarHBondContact O-CE2 3.31Å; L1076-Y1158 HydrophobicContact CD2-CD2 4.04Å; L1076-Y1158 HydrophobicContact CD2-CG 4.02Å; H1080-Y1158 HydrophobicContact CB-CD2 4.47Å; P1155-Y1158 WeakPolarHBondContact O-CB 3.3Å; P1155-Y1158 PolarHBondContact O-N 3.38Å; Y1156-Y1158 VanDerWaalsContact C-N 3.29Å; Y1156-Y1158 PolarHBondContact O-N 3.44Å; Y1158-R1160 PolarHBondContact O-N 3.29Å; Y1158-R1160 VanDerWaalsContact O-N 3.12Å; Y1158-L1161 PolarHBondContact O-N 3.38Å
1159	R	82.7	Confident	83.3	Confident	98 Å²	98	46.5 Å²	46.5	37%	0.37	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-60.6	-26.7	-179.7	-167.1	176.3	168	-169.3	-10.4	113.7	K957 Y1156 L1157 L1161 K1162	K957-R1159 PolarHBondContact O-NH1 2.89Å; K957-R1159 PolarHBondContact O-NH2 3.01Å; Y1156-R1159 WeakPolarHBondContact O-CB 3.4Å; Y1156-R1159 PolarHBondContact O-N 3.47Å; L1157-R1159 PolarHBondContact O-N 3.38Å; L1157-R1159 VanDerWaalsContact O-N 3.1Å; R1159-L1161 VanDerWaalsContact C-N 3.28Å; R1159-L1161 PolarHBondContact O-N 2.87Å; R1159-K1162 HydrophobicContact CG-CD 4.26Å; R1159-K1162 WeakPolarHBondContact O-CB 3.26Å; R1159-K1162 PolarHBondContact O-N 2.87Å
1160	R	80.6	Confident	83.5	Confident	88 Å²	88	47.6 Å²	47.6	33%	0.332	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-71.4	-24.3	-177.7	-62.6	-171.1	56.4	-169	-26.1	112.7	L1157 Y1158 A1165 W1314 W1315	L1157-R1160 WeakPolarHBondContact O-CB 3.34Å; L1157-R1160 PolarHBondContact O-N 3.1Å; Y1158-R1160 PolarHBondContact O-N 3.29Å; Y1158-R1160 VanDerWaalsContact O-N 3.12Å; R1160-A1165 WeakPolarHBondContact O-CB 3.46Å; R1160-W1314 VanDerWaalsContact CZ-CZ3 3.45Å; R1160-W1315 VanDerWaalsContact CZ-CZ2 3.49Å
1161	L	79.9	Confident	83.7	Confident	7 Å²	7	46.9 Å²	46.9	4%	0.037	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-80	-19	177.7	-67.8	177.5	0	0	0	113.3	Q430 H1080 N1083 Y1158 R1159 Q1164 A1165 N1166	Q430-L1161 PolarHBondContact NE2-O 3.37Å; Q430-L1161 PolarHBondContact OE1-O 3.13Å; H1080-L1161 HydrophobicContact CB-CD1 3.97Å; H1080-L1161 VanDerWaalsContact CG-CD1 3.48Å; H1080-L1161 WeakPolarHBondContact ND1-CD1 3.34Å; H1080-L1161 WeakPolarHBondContact O-CD1 3.27Å; N1083-L1161 HydrophobicContact CB-CD1 4.33Å; Y1158-L1161 PolarHBondContact O-N 3.38Å; R1159-L1161 VanDerWaalsContact C-N 3.28Å; R1159-L1161 PolarHBondContact O-N 2.87Å; L1161-Q1164 PolarHBondContact O-N 3.03Å; L1161-A1165 PolarHBondContact O-N 3.46Å; L1161-N1166 WeakPolarHBondContact CD2-ND2 3.45Å
1162	K	73.4	Confident	83.9	Confident	24 Å²	24	46.9 Å²	46.9	10%	0.104	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	145.3	-172.5	-71.1	-169.8	175.6	-165.7	0	113.8	G824 R1159 Q1164	G824-K1162 PolarHBondContact O-NZ 3.1Å; R1159-K1162 HydrophobicContact CG-CD 4.26Å; R1159-K1162 WeakPolarHBondContact O-CB 3.26Å; R1159-K1162 PolarHBondContact O-N 2.87Å; K1162-Q1164 PolarHBondContact O-N 3.08Å
1163	H	71.9	Confident	84.2	Confident	68 Å²	68	48.1 Å²	48.1	32%	0.315	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	28.7	-175.9	-53.1	-75.1	0	0	0	113.4	K321 Q430 H955	K321-H1163 PolarHBondContact NZ-O 2.98Å; Q430-H1163 VanDerWaalsContact OE1-N 3.08Å; H955-H1163 AromaticContact CD2-NE2 3.71Å; H955-H1163 AromaticContact CE1-CE1 3.79Å; H955-H1163 AromaticContact CE1-NE2 3.52Å; H955-H1163 AromaticContact NE2-CE1 3.28Å; H955-H1163 PolarHBondContact NE2-CE1 2.86Å; H955-H1163 VanDerWaalsContact NE2-CE1 3.28Å; H955-H1163 AromaticContact NE2-NE2 3.13Å; H955-H1163 PolarHBondContact NE2-NE2 3.49Å; H955-H1163 VanDerWaalsContact NE2-NE2 3.13Å
1164	Q	77.7	Confident	84.6	Confident	7 Å²	7	48.2 Å²	48.2	3%	0.033	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	60.5	-177.5	-51.1	168.6	-9.6	0	0	111.5	T317 R318 Q430 L1161 K1162 N1166 L1167 R1168	T317-Q1164 VanDerWaalsContact CB-NE2 3.3Å; T317-Q1164 PolarHBondContact O-NE2 3.46Å; T317-Q1164 PolarHBondContact OG1-NE2 3.47Å; R318-Q1164 VanDerWaalsContact N-NE2 3.1Å; Q430-Q1164 HydrophobicContact CG-CG 4.45Å; L1161-Q1164 PolarHBondContact O-N 3.03Å; K1162-Q1164 PolarHBondContact O-N 3.08Å; Q1164-N1166 PolarHBondContact O-N 2.95Å; Q1164-N1166 VanDerWaalsContact O-N 3.14Å; Q1164-L1167 HydrophobicContact CB-CB 4.38Å; Q1164-L1167 PolarHBondContact O-N 3.34Å; Q1164-R1168 PolarHBondContact O-N 3.31Å
1165	A	77.5	Confident	85	Confident	25 Å²	25	47.2 Å²	47.2	21%	0.207	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-53	-36	-178.6	0	0	0	0	0	112.6	R1160 L1161 L1167 R1168	R1160-A1165 WeakPolarHBondContact O-CB 3.46Å; L1161-A1165 PolarHBondContact O-N 3.46Å; A1165-L1167 VanDerWaalsContact C-N 3.3Å; A1165-L1167 PolarHBondContact O-N 3.47Å; A1165-R1168 WeakPolarHBondContact O-CB 3.24Å; A1165-R1168 PolarHBondContact O-N 3.46Å
1166	N	85.5	Confident	85.4	Confident	26 Å²	26	48.6 Å²	48.6	14%	0.139	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-75.7	-11.1	-177.7	-61.5	-16	0	0	0	114.6	C1087 N1091 L1161 Q1164 Y1171	C1087-N1166 HydrophobicContact CB-CB 3.68Å; N1091-N1166 PolarHBondContact ND2-O 3.02Å; L1161-N1166 WeakPolarHBondContact CD2-ND2 3.45Å; Q1164-N1166 PolarHBondContact O-N 2.95Å; Q1164-N1166 VanDerWaalsContact O-N 3.14Å; N1166-Y1171 VanDerWaalsContact O-CD1 3.31Å; N1166-Y1171 WeakPolarHBondContact O-CD1 3.19Å
1167	L	86.7	Confident	85.9	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.016	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-117.6	19.4	175.5	-70.5	172.7	0	0	0	111.8	R318 C1087 M1090 Q1164 A1165	R318-L1167 HydrophobicContact CG-CD1 3.77Å; C1087-L1167 HydrophobicContact CB-CD1 4.39Å; C1087-L1167 HydrophobicContact CB-CG 4.08Å; M1090-L1167 HydrophobicContact CB-CD2 4.32Å; M1090-L1167 HydrophobicContact SD-CD1 4.22Å; Q1164-L1167 HydrophobicContact CB-CB 4.38Å; Q1164-L1167 PolarHBondContact O-N 3.34Å; A1165-L1167 VanDerWaalsContact C-N 3.3Å; A1165-L1167 PolarHBondContact O-N 3.47Å
1168	R	86.3	Confident	86.4	Confident	131 Å²	131	50.6 Å²	50.6	49%	0.494	24%	0.24	S	C	.	.			trans	-69.8	137.5	174.1	-161.2	178.1	-64.4	169.2	-0.1	109.3	Q1164 A1165 W1170 Y1171 V1172	Q1164-R1168 PolarHBondContact O-N 3.31Å; A1165-R1168 WeakPolarHBondContact O-CB 3.24Å; A1165-R1168 PolarHBondContact O-N 3.46Å; R1168-W1170 VanDerWaalsContact C-N 3.27Å; R1168-W1170 PolarHBondContact O-N 3.45Å; R1168-W1170 VanDerWaalsContact O-N 3.1Å; R1168-Y1171 WeakPolarHBondContact O-CA 3.32Å; R1168-Y1171 WeakPolarHBondContact O-CB 2.96Å; R1168-Y1171 PolarHBondContact O-N 3.46Å; R1168-V1172 PolarHBondContact O-N 3.21Å
1169	S	85.9	Confident	86.7	Confident	79 Å²	79	50.4 Å²	50.4	55%	0.552	24%	0.239	S	C	*	.	H	α-helix	trans	-53.6	-37.5	-172.4	-47.2	0	0	0	0	114.5	Y1171 V1172 C1173	S1169-Y1171 VanDerWaalsContact C-N 3.31Å; S1169-Y1171 PolarHBondContact O-N 2.94Å; S1169-V1172 PolarHBondContact O-N 2.68Å; S1169-C1173 WeakPolarHBondContact O-CB 3.41Å; S1169-C1173 PolarHBondContact O-N 2.98Å
1170	W	90.2	Very high	87.4	Confident	147 Å²	147	49 Å²	49	56%	0.557	24%	0.238	S	C	*	.	H	α-helix	trans	-64.7	-35.8	176.4	82	-84.1	0	0	0	112.5	R1168 C1173 L1174	R1168-W1170 VanDerWaalsContact C-N 3.27Å; R1168-W1170 PolarHBondContact O-N 3.45Å; R1168-W1170 VanDerWaalsContact O-N 3.1Å; W1170-C1173 WeakPolarHBondContact O-CB 3.37Å; W1170-C1173 PolarHBondContact O-N 2.95Å; W1170-L1174 HydrophobicContact CE3-CD1 4.03Å; W1170-L1174 HydrophobicContact CE3-CG 4.4Å; W1170-L1174 HydrophobicContact CH2-CD1 4.31Å; W1170-L1174 HydrophobicContact CZ3-CD1 3.5Å; W1170-L1174 VanDerWaalsContact CZ3-CD1 3.5Å; W1170-L1174 HydrophobicContact CZ3-CG 4.33Å; W1170-L1174 PolarHBondContact O-N 2.94Å
1171	Y	90.6	Very high	88.1	Confident	43 Å²	43	49.9 Å²	49.9	17%	0.169	24%	0.242	C	C	.	.	H	α-helix	trans	-75.3	-41.5	-179.9	-173.2	-108.6	0	0	0	110.3	N1166 R1168 S1169 C1173 L1174 W1175	N1166-Y1171 VanDerWaalsContact O-CD1 3.31Å; N1166-Y1171 WeakPolarHBondContact O-CD1 3.19Å; R1168-Y1171 WeakPolarHBondContact O-CA 3.32Å; R1168-Y1171 WeakPolarHBondContact O-CB 2.96Å; R1168-Y1171 PolarHBondContact O-N 3.46Å; S1169-Y1171 VanDerWaalsContact C-N 3.31Å; S1169-Y1171 PolarHBondContact O-N 2.94Å; Y1171-C1173 PolarHBondContact O-N 3.23Å; Y1171-L1174 HydrophobicContact CD2-CD1 4.33Å; Y1171-L1174 WeakPolarHBondContact O-CB 3.36Å; Y1171-L1174 PolarHBondContact O-N 3.42Å; Y1171-L1174 VanDerWaalsContact O-N 3.07Å; Y1171-W1175 AromaticContact CD1-NE1 3.85Å; Y1171-W1175 AromaticContact CE1-CD1 3.89Å; Y1171-W1175 AromaticContact CE1-NE1 3.21Å; Y1171-W1175 AromaticContact CZ-NE1 3.45Å; Y1171-W1175 VanDerWaalsContact O-CD1 3.32Å; Y1171-W1175 PolarHBondContact O-N 3.22Å
1172	V	92.2	Very high	88.9	Confident	4 Å²	4	49.6 Å²	49.6	2%	0.024	24%	0.24	C	C	.	.	H	α-helix	trans	-58.9	-38.3	171.2	-178.9	0	0	0	0	110.9	I325 Y1094 R1168 S1169 L1174 W1175 I1176	I325-V1172 HydrophobicContact CD1-CG2 4.06Å; I325-V1172 HydrophobicContact CG2-CG1 4.32Å; Y1094-V1172 HydrophobicContact CD2-CG1 4.11Å; R1168-V1172 PolarHBondContact O-N 3.21Å; S1169-V1172 PolarHBondContact O-N 2.68Å; V1172-L1174 VanDerWaalsContact C-N 3.29Å; V1172-L1174 PolarHBondContact O-N 3.05Å; V1172-W1175 WeakPolarHBondContact O-CB 3.45Å; V1172-W1175 PolarHBondContact O-N 3.43Å; V1172-W1175 VanDerWaalsContact O-N 3.09Å; V1172-I1176 HydrophobicContact CG1-CD1 4.13Å; V1172-I1176 HydrophobicContact CG1-CG1 4.48Å; V1172-I1176 WeakPolarHBondContact O-CG1 3.46Å; V1172-I1176 PolarHBondContact O-N 3.41Å
1173	C	93.4	Very high	89.9	Confident	60 Å²	60	48.4 Å²	48.4	41%	0.405	24%	0.235	S	C	.	.	H	α-helix	trans	-58.2	-38.4	174.6	-168.8	0	0	0	0	112.5	S1169 W1170 Y1171 W1175 I1176 L1177	S1169-C1173 WeakPolarHBondContact O-CB 3.41Å; S1169-C1173 PolarHBondContact O-N 2.98Å; W1170-C1173 WeakPolarHBondContact O-CB 3.37Å; W1170-C1173 PolarHBondContact O-N 2.95Å; Y1171-C1173 PolarHBondContact O-N 3.23Å; C1173-W1175 VanDerWaalsContact C-N 3.33Å; C1173-W1175 PolarHBondContact O-N 3.09Å; C1173-I1176 PolarHBondContact O-N 2.92Å; C1173-L1177 WeakPolarHBondContact O-CG 3.5Å; C1173-L1177 PolarHBondContact O-N 3.38Å
1174	L	93.4	Very high	91.1	Very high	74 Å²	74	46.8 Å²	46.8	39%	0.387	23%	0.23	S	C	.	.	H	α-helix	trans	-61.9	-40.4	174.3	-66.2	179.7	0	0	0	112.3	W1170 Y1171 V1172 I1176 L1177 D1178	W1170-L1174 HydrophobicContact CE3-CD1 4.03Å; W1170-L1174 HydrophobicContact CE3-CG 4.4Å; W1170-L1174 HydrophobicContact CH2-CD1 4.31Å; W1170-L1174 HydrophobicContact CZ3-CD1 3.5Å; W1170-L1174 VanDerWaalsContact CZ3-CD1 3.5Å; W1170-L1174 HydrophobicContact CZ3-CG 4.33Å; W1170-L1174 PolarHBondContact O-N 2.94Å; Y1171-L1174 HydrophobicContact CD2-CD1 4.33Å; Y1171-L1174 WeakPolarHBondContact O-CB 3.36Å; Y1171-L1174 PolarHBondContact O-N 3.42Å; Y1171-L1174 VanDerWaalsContact O-N 3.07Å; V1172-L1174 VanDerWaalsContact C-N 3.29Å; V1172-L1174 PolarHBondContact O-N 3.05Å; L1174-I1176 VanDerWaalsContact C-N 3.34Å; L1174-L1177 PolarHBondContact O-N 3.45Å; L1174-D1178 WeakPolarHBondContact O-CB 3.13Å; L1174-D1178 PolarHBondContact O-N 3.05Å
1175	W	94.4	Very high	91.9	Very high	17 Å²	17	47.5 Å²	47.5	6%	0.064	23%	0.234	C	C	.	.	H	α-helix	trans	-67.3	-33.6	175.2	-72.9	93.9	0	0	0	112.8	I1088 N1091 L1092 Y1095 Y1171 V1172 C1173 G1179	I1088-W1175 HydrophobicContact CD1-CZ2 4.48Å; N1091-W1175 HydrophobicContact CB-CD2 3.78Å; N1091-W1175 HydrophobicContact CB-CE3 4.39Å; N1091-W1175 HydrophobicContact CB-CG 3.83Å; N1091-W1175 HydrophobicContact CB-CZ2 4.37Å; L1092-W1175 HydrophobicContact CD2-CH2 4.06Å; L1092-W1175 HydrophobicContact CD2-CZ3 3.66Å; L1092-W1175 HydrophobicContact CG-CH2 4.48Å; L1092-W1175 HydrophobicContact CG-CZ3 4.32Å; Y1095-W1175 HydrophobicContact CG-CE3 4.4Å; Y1171-W1175 AromaticContact CD1-NE1 3.85Å; Y1171-W1175 AromaticContact CE1-CD1 3.89Å; Y1171-W1175 AromaticContact CE1-NE1 3.21Å; Y1171-W1175 AromaticContact CZ-NE1 3.45Å; Y1171-W1175 VanDerWaalsContact O-CD1 3.32Å; Y1171-W1175 PolarHBondContact O-N 3.22Å; V1172-W1175 WeakPolarHBondContact O-CB 3.45Å; V1172-W1175 PolarHBondContact O-N 3.43Å; V1172-W1175 VanDerWaalsContact O-N 3.09Å; C1173-W1175 VanDerWaalsContact C-N 3.33Å; C1173-W1175 PolarHBondContact O-N 3.09Å; W1175-G1179 PolarHBondContact O-N 2.67Å
1176	I	94.3	Very high	92.8	Very high	39 Å²	39	46.3 Å²	46.3	20%	0.2	22%	0.224	C	C	.	.	H	α-helix	trans	-67	-45	173.6	-64.7	165.2	0	0	0	110.1	F329 V1098 V1172 C1173 L1174 D1178 G1179 I1180	F329-I1176 HydrophobicContact CE1-CD1 3.46Å; F329-I1176 VanDerWaalsContact CE1-CD1 3.46Å; F329-I1176 HydrophobicContact CE1-CG1 4.21Å; F329-I1176 HydrophobicContact CZ-CD1 3.66Å; F329-I1176 HydrophobicContact CZ-CG1 3.93Å; V1098-I1176 HydrophobicContact CG1-CG2 4.21Å; V1098-I1176 HydrophobicContact CG2-CG1 4.48Å; V1098-I1176 HydrophobicContact CG2-CG2 4.31Å; V1172-I1176 HydrophobicContact CG1-CD1 4.13Å; V1172-I1176 HydrophobicContact CG1-CG1 4.48Å; V1172-I1176 WeakPolarHBondContact O-CG1 3.46Å; V1172-I1176 PolarHBondContact O-N 3.41Å; C1173-I1176 PolarHBondContact O-N 2.92Å; L1174-I1176 VanDerWaalsContact C-N 3.34Å; I1176-D1178 VanDerWaalsContact C-N 3.33Å; I1176-D1178 PolarHBondContact O-N 3.32Å; I1176-G1179 WeakPolarHBondContact O-CA 3.45Å; I1176-G1179 PolarHBondContact O-N 3.03Å; I1176-G1179 VanDerWaalsContact O-N 3.11Å; I1176-I1180 HydrophobicContact CG2-CD1 4.07Å; I1176-I1180 WeakPolarHBondContact O-CG1 3.45Å; I1176-I1180 PolarHBondContact O-N 3.32Å
1177	L	95.2	Very high	93.1	Very high	96 Å²	96	45.3 Å²	45.3	50%	0.503	22%	0.218	S	C	.	.	H	α-helix	trans	-62.5	-40.1	176.5	-70.3	172.4	0	0	0	111.8	C1173 L1174 G1179 I1180 W1181	C1173-L1177 WeakPolarHBondContact O-CG 3.5Å; C1173-L1177 PolarHBondContact O-N 3.38Å; L1174-L1177 PolarHBondContact O-N 3.45Å; L1177-G1179 VanDerWaalsContact C-N 3.31Å; L1177-G1179 PolarHBondContact O-N 2.85Å; L1177-I1180 PolarHBondContact O-N 3.47Å; L1177-W1181 WeakPolarHBondContact O-CB 3.4Å; L1177-W1181 PolarHBondContact O-N 3.19Å
1178	D	94.6	Very high	93.4	Very high	22 Å²	22	49.2 Å²	49.2	12%	0.118	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-42.9	171.8	-164.2	29	0	0	0	110.6	Y1095 L1174 I1176 I1180 W1181 H1182 R1236 S1304	Y1095-D1178 HydrophobicContact CD2-CB 4.08Å; Y1095-D1178 HydrophobicContact CE2-CB 4.23Å; L1174-D1178 WeakPolarHBondContact O-CB 3.13Å; L1174-D1178 PolarHBondContact O-N 3.05Å; I1176-D1178 VanDerWaalsContact C-N 3.33Å; I1176-D1178 PolarHBondContact O-N 3.32Å; D1178-I1180 PolarHBondContact O-N 3.17Å; D1178-W1181 WeakPolarHBondContact O-CB 3.46Å; D1178-W1181 PolarHBondContact O-N 3.44Å; D1178-H1182 PolarHBondContact O-CD2 2.96Å; D1178-H1182 VanDerWaalsContact O-CD2 3.24Å; D1178-H1182 PolarHBondContact O-N 3.41Å; D1178-H1182 IonicContact OD1-CD2 2.73Å; D1178-H1182 PolarHBondContact OD1-CD2 3.37Å; D1178-H1182 IonicContact OD1-NE2 3.48Å; D1178-R1236 IonicContact OD2-CZ 2.69Å; D1178-R1236 IonicContact OD2-NE 2.71Å; D1178-R1236 PolarHBondContact OD2-NE 3.42Å; D1178-R1236 VanDerWaalsContact OD2-NE 3.14Å; D1178-R1236 IonicContact OD2-NH2 2.62Å; D1178-R1236 PolarHBondContact OD2-NH2 2.96Å; D1178-S1304 PolarHBondContact OD1-OG 2.98Å; D1178-S1304 VanDerWaalsContact OD1-OG 3.1Å; D1178-S1304 PolarHBondContact OD2-OG 3.41Å; D1178-S1304 VanDerWaalsContact OD2-OG 3.07Å
1179	G	95.3	Very high	93.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62.6	-43.8	176.2	0	0	0	0	0	113	Y1095 T1099 W1175 I1176 L1177 H1182 G1183	Y1095-G1179 VanDerWaalsContact CD2-CA 3.44Å; Y1095-G1179 VanDerWaalsContact CD2-N 3.34Å; T1099-G1179 WeakPolarHBondContact CA-O 3.26Å; T1099-G1179 WeakPolarHBondContact OG1-CA 3.3Å; T1099-G1179 PolarHBondContact OG1-O 3.41Å; W1175-G1179 PolarHBondContact O-N 2.67Å; I1176-G1179 WeakPolarHBondContact O-CA 3.45Å; I1176-G1179 PolarHBondContact O-N 3.03Å; I1176-G1179 VanDerWaalsContact O-N 3.11Å; L1177-G1179 VanDerWaalsContact C-N 3.31Å; L1177-G1179 PolarHBondContact O-N 2.85Å; G1179-H1182 PolarHBondContact O-N 2.87Å; G1179-G1183 PolarHBondContact O-N 3.44Å
1180	I	96.1	Very high	93.8	Very high	68 Å²	68	39.8 Å²	39.8	35%	0.349	19%	0.19	S	C	.	.	H	α-helix	trans	-62.2	-45.7	175.7	-66.7	167.1	0	0	0	110	V1098 T1102 I1176 L1177 D1178 H1182 G1183 T1184	V1098-I1180 HydrophobicContact CG1-CG1 3.77Å; T1102-I1180 HydrophobicContact CG2-CG2 4.34Å; I1176-I1180 HydrophobicContact CG2-CD1 4.07Å; I1176-I1180 WeakPolarHBondContact O-CG1 3.45Å; I1176-I1180 PolarHBondContact O-N 3.32Å; L1177-I1180 PolarHBondContact O-N 3.47Å; D1178-I1180 PolarHBondContact O-N 3.17Å; I1180-H1182 PolarHBondContact O-N 2.86Å; I1180-G1183 PolarHBondContact O-N 2.71Å; I1180-T1184 HydrophobicContact CG2-CG2 4.16Å; I1180-T1184 VanDerWaalsContact O-CG2 3.25Å; I1180-T1184 WeakPolarHBondContact O-CG2 3.44Å; I1180-T1184 PolarHBondContact O-N 3.4Å; I1180-T1184 PolarHBondContact O-OG1 2.7Å
1181	W	96.5	Very high	93.7	Very high	108 Å²	108	34.3 Å²	34.3	41%	0.409	17%	0.172	S	C	.	.	H	α-helix	trans	-55.9	-52.8	177.1	170.5	-104.4	0	0	0	111.8	L1177 D1178 G1183 T1184 I1185 A1300 P1303	L1177-W1181 WeakPolarHBondContact O-CB 3.4Å; L1177-W1181 PolarHBondContact O-N 3.19Å; D1178-W1181 WeakPolarHBondContact O-CB 3.46Å; D1178-W1181 PolarHBondContact O-N 3.44Å; W1181-G1183 VanDerWaalsContact C-N 3.33Å; W1181-G1183 PolarHBondContact O-N 3.46Å; W1181-T1184 WeakPolarHBondContact CA-OG1 3.45Å; W1181-T1184 PolarHBondContact O-N 2.83Å; W1181-T1184 PolarHBondContact O-OG1 3Å; W1181-I1185 HydrophobicContact CD2-CD1 3.61Å; W1181-I1185 HydrophobicContact CD2-CG1 4.4Å; W1181-I1185 HydrophobicContact CE3-CD1 4.18Å; W1181-I1185 HydrophobicContact CG-CD1 4.15Å; W1181-I1185 HydrophobicContact CH2-CD1 3.9Å; W1181-I1185 HydrophobicContact CZ2-CD1 3.3Å; W1181-I1185 HydrophobicContact CZ2-CG1 4.37Å; W1181-I1185 HydrophobicContact CZ3-CD1 4.3Å; W1181-I1185 PolarHBondContact O-N 2.97Å; W1181-A1300 PolarHBondContact NE1-O 3.07Å; W1181-P1303 HydrophobicContact CZ2-CG 3.88Å
1182	H	95.7	Very high	93.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.6	-44.4	176.9	-85	-103.8	0	0	0	112	Y1095 T1099 D1178 G1179 I1180 T1184 I1186 S1232 A1300 N1301	Y1095-H1182 HydrophobicContact CE2-CB 4.27Å; Y1095-H1182 AromaticContact CE2-CD2 3.66Å; Y1095-H1182 AromaticContact CE2-CG 3.98Å; Y1095-H1182 AromaticContact CZ-CD2 3.88Å; Y1095-H1182 AromaticContact CZ-CG 3.9Å; Y1095-H1182 PolarHBondContact OH-CD2 3.21Å; Y1095-H1182 PolarHBondContact OH-CE1 3.44Å; Y1095-H1182 PolarHBondContact OH-ND1 2.71Å; Y1095-H1182 PolarHBondContact OH-NE2 2.94Å; T1099-H1182 HydrophobicContact CG2-CB 3.74Å; D1178-H1182 PolarHBondContact O-CD2 2.96Å; D1178-H1182 VanDerWaalsContact O-CD2 3.24Å; D1178-H1182 PolarHBondContact O-N 3.41Å; D1178-H1182 IonicContact OD1-CD2 2.73Å; D1178-H1182 PolarHBondContact OD1-CD2 3.37Å; D1178-H1182 IonicContact OD1-NE2 3.48Å; G1179-H1182 PolarHBondContact O-N 2.87Å; I1180-H1182 PolarHBondContact O-N 2.86Å; H1182-T1184 VanDerWaalsContact C-N 3.34Å; H1182-T1184 PolarHBondContact O-N 3.08Å; H1182-I1186 WeakPolarHBondContact O-CB 3.5Å; H1182-I1186 WeakPolarHBondContact O-CD1 3.47Å; H1182-I1186 WeakPolarHBondContact O-CG1 3.24Å; H1182-I1186 PolarHBondContact O-N 3.38Å; H1182-I1186 VanDerWaalsContact O-N 3.08Å; H1182-S1232 PolarHBondContact CE1-OG 3.49Å; H1182-S1232 PolarHBondContact ND1-OG 3.18Å; H1182-A1300 PolarHBondContact CE1-O 3.02Å; H1182-A1300 PolarHBondContact NE2-O 3.34Å; H1182-A1300 VanDerWaalsContact NE2-O 3.13Å; H1182-N1301 PolarHBondContact CE1-OD1 3.46Å
1183	G	95	Very high	93.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.7	-40.3	177.1	0	0	0	0	0	113	G1179 I1180 W1181 F1187	G1179-G1183 PolarHBondContact O-N 3.44Å; I1180-G1183 PolarHBondContact O-N 2.71Å; W1181-G1183 VanDerWaalsContact C-N 3.33Å; W1181-G1183 PolarHBondContact O-N 3.46Å; G1183-F1187 WeakPolarHBondContact O-CB 3.35Å; G1183-F1187 PolarHBondContact O-N 3.44Å
1184	T	95.8	Very high	92.7	Very high	34 Å²	34	38.7 Å²	38.7	21%	0.209	18%	0.182	C	C	.	.	H	α-helix	trans	-66.5	-46.6	178.4	58.2	0	0	0	0	112.8	T1102 L1106 I1180 W1181 H1182 I1186 F1187 Y1188	T1102-T1184 HydrophobicContact CG2-CG2 4.28Å; L1106-T1184 HydrophobicContact CD1-CG2 3.82Å; I1180-T1184 HydrophobicContact CG2-CG2 4.16Å; I1180-T1184 VanDerWaalsContact O-CG2 3.25Å; I1180-T1184 WeakPolarHBondContact O-CG2 3.44Å; I1180-T1184 PolarHBondContact O-N 3.4Å; I1180-T1184 PolarHBondContact O-OG1 2.7Å; W1181-T1184 WeakPolarHBondContact CA-OG1 3.45Å; W1181-T1184 PolarHBondContact O-N 2.83Å; W1181-T1184 PolarHBondContact O-OG1 3Å; H1182-T1184 VanDerWaalsContact C-N 3.34Å; H1182-T1184 PolarHBondContact O-N 3.08Å; T1184-I1186 VanDerWaalsContact C-N 3.33Å; T1184-I1186 PolarHBondContact O-N 2.98Å; T1184-F1187 PolarHBondContact O-N 3.36Å; T1184-Y1188 WeakPolarHBondContact O-CB 3.29Å; T1184-Y1188 VanDerWaalsContact O-CD2 3.24Å; T1184-Y1188 WeakPolarHBondContact O-CD2 3.5Å; T1184-Y1188 PolarHBondContact O-N 3.26Å
1185	I	96	Very high	92	Very high	21 Å²	21	37.3 Å²	37.3	11%	0.108	18%	0.177	C	C	.	.	H	α-helix	trans	-64.1	-42	179.1	-73.3	166.1	0	0	0	111.2	W1181 G1189 I1296 I1299 A1300	W1181-I1185 HydrophobicContact CD2-CD1 3.61Å; W1181-I1185 HydrophobicContact CD2-CG1 4.4Å; W1181-I1185 HydrophobicContact CE3-CD1 4.18Å; W1181-I1185 HydrophobicContact CG-CD1 4.15Å; W1181-I1185 HydrophobicContact CH2-CD1 3.9Å; W1181-I1185 HydrophobicContact CZ2-CD1 3.3Å; W1181-I1185 HydrophobicContact CZ2-CG1 4.37Å; W1181-I1185 HydrophobicContact CZ3-CD1 4.3Å; W1181-I1185 PolarHBondContact O-N 2.97Å; I1185-G1189 VanDerWaalsContact O-CA 3.3Å; I1185-G1189 WeakPolarHBondContact O-CA 3.47Å; I1185-G1189 PolarHBondContact O-N 3.47Å; I1185-I1296 HydrophobicContact CG2-CG2 4.2Å; I1185-I1299 HydrophobicContact CD1-CG2 3.85Å; I1185-I1299 HydrophobicContact CG1-CG2 4.39Å; I1185-I1299 HydrophobicContact CG2-CB 4.37Å; I1185-I1299 HydrophobicContact CG2-CG2 4.22Å; I1185-A1300 HydrophobicContact CB-CB 4.45Å; I1185-A1300 HydrophobicContact CD1-CB 4.45Å; I1185-A1300 HydrophobicContact CG2-CB 4.08Å
1186	I	94.9	Very high	91	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.7	-44	-179	-67.8	165.9	0	0	0	110.4	T1099 T1103 H1182 T1184 A1190 F1228 V1229 I1296	T1099-I1186 HydrophobicContact CG2-CD1 4.3Å; T1103-I1186 HydrophobicContact CG2-CG2 4.41Å; H1182-I1186 WeakPolarHBondContact O-CB 3.5Å; H1182-I1186 WeakPolarHBondContact O-CD1 3.47Å; H1182-I1186 WeakPolarHBondContact O-CG1 3.24Å; H1182-I1186 PolarHBondContact O-N 3.38Å; H1182-I1186 VanDerWaalsContact O-N 3.08Å; T1184-I1186 VanDerWaalsContact C-N 3.33Å; T1184-I1186 PolarHBondContact O-N 2.98Å; I1186-A1190 WeakPolarHBondContact O-CB 3.37Å; I1186-A1190 PolarHBondContact O-N 3.42Å; I1186-F1228 HydrophobicContact CG1-CB 4.44Å; I1186-F1228 HydrophobicContact CG2-CB 3.6Å; I1186-F1228 HydrophobicContact CG2-CD2 4.38Å; I1186-V1229 HydrophobicContact CD1-CB 4.46Å; I1186-V1229 HydrophobicContact CD1-CG2 3.94Å; I1186-V1229 HydrophobicContact CG2-CG2 4Å; I1186-I1296 HydrophobicContact CG1-CG2 3.98Å
1187	F	93.6	Very high	89.7	Confident	5 Å²	5	35.1 Å²	35.1	2%	0.022	17%	0.169	C	C	.	.	H	α-helix	trans	-62.6	-54.6	177.7	177	-90.8	0	0	0	112.1	L1106 Y1107 Y1110 G1183 T1184 A1190 T1191 Y1221	L1106-F1187 HydrophobicContact CB-CB 4.23Å; L1106-F1187 HydrophobicContact CB-CD1 3.76Å; L1106-F1187 HydrophobicContact CB-CD2 3.73Å; L1106-F1187 HydrophobicContact CB-CE1 4.09Å; L1106-F1187 HydrophobicContact CB-CE2 4.05Å; L1106-F1187 HydrophobicContact CB-CG 3.59Å; L1106-F1187 HydrophobicContact CB-CZ 4.24Å; L1106-F1187 HydrophobicContact CD1-CB 3.66Å; L1106-F1187 HydrophobicContact CD1-CD1 4.02Å; L1106-F1187 HydrophobicContact CD1-CG 3.87Å; L1106-F1187 HydrophobicContact CG-CD1 4.44Å; L1106-F1187 HydrophobicContact CG-CG 4.39Å; Y1107-F1187 HydrophobicContact CD2-CE2 4.4Å; Y1110-F1187 AromaticContact CD2-CE1 3.67Å; Y1110-F1187 HydrophobicContact CD2-CE1 3.67Å; Y1110-F1187 HydrophobicContact CD2-CE2 4.46Å; Y1110-F1187 AromaticContact CD2-CZ 3.33Å; Y1110-F1187 HydrophobicContact CD2-CZ 3.33Å; Y1110-F1187 AromaticContact CE2-CE1 3.38Å; Y1110-F1187 HydrophobicContact CE2-CE1 3.38Å; Y1110-F1187 AromaticContact CE2-CZ 3.61Å; Y1110-F1187 HydrophobicContact CE2-CZ 3.61Å; Y1110-F1187 HydrophobicContact CG-CZ 4.19Å; G1183-F1187 WeakPolarHBondContact O-CB 3.35Å; G1183-F1187 PolarHBondContact O-N 3.44Å; T1184-F1187 PolarHBondContact O-N 3.36Å; F1187-A1190 PolarHBondContact O-N 3.5Å; F1187-T1191 WeakPolarHBondContact O-CB 3.33Å; F1187-T1191 PolarHBondContact O-N 3.08Å; F1187-T1191 PolarHBondContact O-OG1 3.38Å; F1187-Y1221 WeakPolarHBondContact CD2-OH 3.46Å; F1187-Y1221 HydrophobicContact CE2-CE1 4.45Å; F1187-Y1221 WeakPolarHBondContact CE2-OH 3.32Å; F1187-Y1221 PolarHBondContact O-OH 2.94Å
1188	Y	92.4	Very high	88.3	Confident	86 Å²	86	41.6 Å²	41.6	34%	0.337	19%	0.189	S	C	.	.	H	α-helix	trans	-67.7	-41.8	-178.4	-77	-61.6	0	0	0	111.5	Y1110 T1184 T1191 Y1192	Y1110-Y1188 HydrophobicContact CE2-CE1 4.47Å; Y1110-Y1188 WeakPolarHBondContact OH-CE1 3.4Å; Y1110-Y1188 PolarHBondContact OH-OH 3.13Å; T1184-Y1188 WeakPolarHBondContact O-CB 3.29Å; T1184-Y1188 VanDerWaalsContact O-CD2 3.24Å; T1184-Y1188 WeakPolarHBondContact O-CD2 3.5Å; T1184-Y1188 PolarHBondContact O-N 3.26Å; Y1188-T1191 PolarHBondContact O-N 3.47Å; Y1188-Y1192 HydrophobicContact CD1-CE2 4.3Å; Y1188-Y1192 WeakPolarHBondContact O-CD2 3.2Å; Y1188-Y1192 PolarHBondContact O-N 3.5Å
1189	G	91.3	Very high	87.1	Confident	12 Å²	12	50.4 Å²	50.4	12%	0.124	22%	0.222	C	C	.	.	H	α-helix	trans	-56.4	-52.4	175.2	0	0	0	0	0	111.5	I1185 T1191 Y1192 F1193	I1185-G1189 VanDerWaalsContact O-CA 3.3Å; I1185-G1189 WeakPolarHBondContact O-CA 3.47Å; I1185-G1189 PolarHBondContact O-N 3.47Å; G1189-T1191 VanDerWaalsContact C-N 3.3Å; G1189-T1191 PolarHBondContact O-N 2.82Å; G1189-Y1192 PolarHBondContact O-N 3.12Å; G1189-F1193 WeakPolarHBondContact O-CD2 3.32Å; G1189-F1193 PolarHBondContact O-N 3Å
1190	A	89.2	Confident	85.9	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59.8	-41.1	176.9	0	0	0	0	0	112.1	I1186 F1187 F1194 Y1221 T1225 F1228	I1186-A1190 WeakPolarHBondContact O-CB 3.37Å; I1186-A1190 PolarHBondContact O-N 3.42Å; F1187-A1190 PolarHBondContact O-N 3.5Å; A1190-F1194 HydrophobicContact CB-CD2 4.26Å; A1190-F1194 WeakPolarHBondContact O-CB 3.18Å; A1190-F1194 WeakPolarHBondContact O-CD2 3.43Å; A1190-F1194 PolarHBondContact O-N 3.45Å; A1190-Y1221 HydrophobicContact CB-CD2 4.39Å; A1190-Y1221 HydrophobicContact CB-CE2 3.7Å; A1190-T1225 HydrophobicContact CB-CG2 3.47Å; A1190-T1225 VanDerWaalsContact CB-CG2 3.47Å; A1190-F1228 HydrophobicContact CB-CD2 4.13Å; A1190-F1228 HydrophobicContact CB-CE2 4.01Å
1191	T	87.6	Confident	84.6	Confident	31 Å²	31	59.7 Å²	59.7	19%	0.19	27%	0.274	C	S	.	.	H	α-helix	trans	-61.9	-52.6	177.4	-55.6	0	0	0	0	111	F1187 Y1188 G1189 F1193 F1194 T1195 Y1221	F1187-T1191 WeakPolarHBondContact O-CB 3.33Å; F1187-T1191 PolarHBondContact O-N 3.08Å; F1187-T1191 PolarHBondContact O-OG1 3.38Å; Y1188-T1191 PolarHBondContact O-N 3.47Å; G1189-T1191 VanDerWaalsContact C-N 3.3Å; G1189-T1191 PolarHBondContact O-N 2.82Å; T1191-F1193 VanDerWaalsContact C-N 3.35Å; T1191-F1193 PolarHBondContact O-N 3.39Å; T1191-F1194 PolarHBondContact O-N 3.45Å; T1191-T1195 WeakPolarHBondContact CG2-OG1 3.1Å; T1191-T1195 PolarHBondContact O-N 3.12Å; T1191-T1195 PolarHBondContact O-OG1 3.47Å; T1191-Y1221 PolarHBondContact OG1-OH 3.23Å
1192	Y	87.4	Confident	83.5	Confident	134 Å²	134	59.8 Å²	59.8	53%	0.525	28%	0.279	S	S	.	.	H	α-helix	trans	-59.4	-41.4	-179.8	-76.5	-63.8	0	0	0	113.2	Y1188 G1189 G1196	Y1188-Y1192 HydrophobicContact CD1-CE2 4.3Å; Y1188-Y1192 WeakPolarHBondContact O-CD2 3.2Å; Y1188-Y1192 PolarHBondContact O-N 3.5Å; G1189-Y1192 PolarHBondContact O-N 3.12Å; Y1192-G1196 CarbonylContact O-C 3.43Å; Y1192-G1196 WeakPolarHBondContact O-CA 3.35Å; Y1192-G1196 PolarHBondContact O-N 3.14Å
1193	F	85.9	Confident	82.5	Confident	64 Å²	64	60 Å²	60	28%	0.281	28%	0.281	S	S	.	.	H	α-helix	trans	-75.3	-41.1	-179	-81	-70.6	0	0	0	113.6	G1189 T1191 T1288 A1292 L1295 I1296	G1189-F1193 WeakPolarHBondContact O-CD2 3.32Å; G1189-F1193 PolarHBondContact O-N 3Å; T1191-F1193 VanDerWaalsContact C-N 3.35Å; T1191-F1193 PolarHBondContact O-N 3.39Å; F1193-T1288 HydrophobicContact CB-CG2 4.12Å; F1193-T1288 HydrophobicContact CD1-CG2 4.39Å; F1193-T1288 WeakPolarHBondContact O-CG2 3.4Å; F1193-A1292 HydrophobicContact CB-CB 3.94Å; F1193-A1292 HydrophobicContact CD1-CB 4.01Å; F1193-A1292 HydrophobicContact CD2-CB 3.56Å; F1193-A1292 HydrophobicContact CE1-CB 4.44Å; F1193-A1292 HydrophobicContact CE2-CB 4.07Å; F1193-A1292 HydrophobicContact CG-CB 3.56Å; F1193-A1292 HydrophobicContact CZ-CB 4.48Å; F1193-L1295 HydrophobicContact CE2-CD2 3.83Å; F1193-L1295 HydrophobicContact CZ-CD1 4.25Å; F1193-L1295 HydrophobicContact CZ-CD2 3.84Å; F1193-L1295 HydrophobicContact CZ-CG 4.46Å; F1193-I1296 HydrophobicContact CD2-CD1 4.05Å; F1193-I1296 HydrophobicContact CD2-CG1 4.31Å; F1193-I1296 HydrophobicContact CE2-CD1 4.41Å; F1193-I1296 HydrophobicContact CE2-CG1 4.18Å
1194	F	82.4	Confident	81.4	Confident	1 Å²	1	63 Å²	63	0%	0.004	30%	0.299	C	S	.	.	H	α-helix	trans	-89.3	-41.2	-174	-71.1	-65.3	0	0	0	113.5	A1190 T1191 E1202 G1203 F1205 F1216 A1224 F1228 L1283 F1289	A1190-F1194 HydrophobicContact CB-CD2 4.26Å; A1190-F1194 WeakPolarHBondContact O-CB 3.18Å; A1190-F1194 WeakPolarHBondContact O-CD2 3.43Å; A1190-F1194 PolarHBondContact O-N 3.45Å; T1191-F1194 PolarHBondContact O-N 3.45Å; F1194-E1202 WeakPolarHBondContact O-CA 3.44Å; F1194-G1203 PolarHBondContact O-N 2.82Å; F1194-F1205 HydrophobicContact CD1-CE1 4.43Å; F1194-F1205 AromaticContact CD1-CZ 3.81Å; F1194-F1205 HydrophobicContact CD1-CZ 3.81Å; F1194-F1205 HydrophobicContact CE1-CE1 4.35Å; F1194-F1205 HydrophobicContact CE1-CZ 4.18Å; F1194-F1216 HydrophobicContact CB-CD2 4.08Å; F1194-F1216 HydrophobicContact CB-CE1 4.44Å; F1194-F1216 HydrophobicContact CB-CE2 3.39Å; F1194-F1216 HydrophobicContact CB-CZ 3.55Å; F1194-F1216 HydrophobicContact CD1-CE2 4.19Å; F1194-F1216 AromaticContact CG-CE2 3.82Å; F1194-F1216 HydrophobicContact CG-CE2 3.82Å; F1194-F1216 HydrophobicContact CG-CZ 4.3Å; F1194-A1224 HydrophobicContact CD2-CB 4.35Å; F1194-A1224 HydrophobicContact CE2-CB 3.48Å; F1194-A1224 VanDerWaalsContact CE2-CB 3.48Å; F1194-A1224 HydrophobicContact CZ-CB 3.77Å; F1194-F1228 AromaticContact CE2-CE2 3.88Å; F1194-F1228 HydrophobicContact CE2-CE2 3.88Å; F1194-F1228 HydrophobicContact CE2-CZ 4.06Å; F1194-F1228 HydrophobicContact CZ-CZ 4.38Å; F1194-L1283 HydrophobicContact CE1-CD1 4.16Å; F1194-L1283 HydrophobicContact CZ-CD1 3.91Å; F1194-F1289 HydrophobicContact CE1-CB 4.28Å; F1194-F1289 HydrophobicContact CZ-CB 4Å; F1194-F1289 HydrophobicContact CZ-CD2 4.09Å
1195	T	78.1	Confident	80.3	Confident	46 Å²	46	61.6 Å²	61.6	28%	0.282	29%	0.29	S	S	.	.	S	Bend	trans	-94.6	3.2	179.3	76.5	0	0	0	0	112.6	T1191 G1197 F1216	T1191-T1195 WeakPolarHBondContact CG2-OG1 3.1Å; T1191-T1195 PolarHBondContact O-N 3.12Å; T1191-T1195 PolarHBondContact O-OG1 3.47Å; T1195-G1197 PolarHBondContact O-N 2.79Å; T1195-F1216 HydrophobicContact CG2-CD1 3.94Å; T1195-F1216 HydrophobicContact CG2-CE1 3.4Å; T1195-F1216 HydrophobicContact CG2-CZ 4.06Å
1196	G	73.4	Confident	79	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.01	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	67.2	4	-178.3	0	0	0	0	0	114.9	Y1192 Y1198 Y1199 F1200	Y1192-G1196 CarbonylContact O-C 3.43Å; Y1192-G1196 WeakPolarHBondContact O-CA 3.35Å; Y1192-G1196 PolarHBondContact O-N 3.14Å; G1196-Y1198 PolarHBondContact O-N 2.91Å; G1196-Y1198 VanDerWaalsContact O-N 3.13Å; G1196-Y1199 PolarHBondContact O-N 3.43Å; G1196-F1200 WeakPolarHBondContact CA-O 3.2Å; G1196-F1200 WeakPolarHBondContact O-CD2 3.44Å; G1196-F1200 PolarHBondContact O-N 3.42Å
1197	G	68.5	Low	77.7	Confident	8 Å²	8	66.4 Å²	66.4	8%	0.082	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	52.4	33.1	-178.4	0	0	0	0	0	114.8	T1195 Y1199	T1195-G1197 PolarHBondContact O-N 2.79Å; G1197-Y1199 VanDerWaalsContact O-CD2 3.27Å; G1197-Y1199 WeakPolarHBondContact O-CD2 3.42Å; G1197-Y1199 PolarHBondContact O-N 2.87Å
1198	Y	64.7	Low	76.2	Confident	232 Å²	232	69 Å²	69	91%	0.91	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	70.5	-14.2	-172.7	-63.4	-86.9	0	0	0	117.1	G1196	G1196-Y1198 PolarHBondContact O-N 2.91Å; G1196-Y1198 VanDerWaalsContact O-N 3.13Å
1199	Y	69.4	Low	74.9	Confident	207 Å²	207	75.1 Å²	75.1	81%	0.812	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	-27.7	-174.8	-67.1	-77.7	0	0	0	114.3	G1196 G1197	G1196-Y1199 PolarHBondContact O-N 3.43Å; G1197-Y1199 VanDerWaalsContact O-CD2 3.27Å; G1197-Y1199 WeakPolarHBondContact O-CD2 3.42Å; G1197-Y1199 PolarHBondContact O-N 2.87Å
1200	F	71	Confident	73.7	Confident	156 Å²	156	76.8 Å²	76.8	68%	0.684	37%	0.367	S	S	*	.	S	Bend	trans	-109.7	162.5	-175.9	-56.7	-73.9	0	0	0	111	G1196	G1196-F1200 WeakPolarHBondContact CA-O 3.2Å; G1196-F1200 WeakPolarHBondContact O-CD2 3.44Å; G1196-F1200 PolarHBondContact O-N 3.42Å
1201	S	68.6	Low	72.6	Confident	108 Å²	108	81.6 Å²	81.6	76%	0.755	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-64	140.5	174.7	57.9	0	0	0	0	110.9
1202	E	73.8	Confident	71.4	Confident	110 Å²	110	85.4 Å²	85.4	51%	0.514	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-56.9	152.1	171.5	-62.7	-179.6	173.3	0	0	111.5	F1194 T1204	F1194-E1202 WeakPolarHBondContact O-CA 3.44Å; E1202-T1204 PolarHBondContact O-N 3.11Å
1203	G	73.1	Confident	70	Confident	5 Å²	5	82.4 Å²	82.4	5%	0.052	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-60.1	136.3	177.9	0	0	0	0	0	111.8	F1194 F1205	F1194-G1203 PolarHBondContact O-N 2.82Å; G1203-F1205 WeakPolarHBondContact O-CD2 3.37Å; G1203-F1205 WeakPolarHBondContact O-CE2 3.29Å
1204	T	72.6	Confident	68.5	Low	62 Å²	62	87 Å²	87	38%	0.38	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-83.4	127.7	177.9	51.1	0	0	0	0	111	E1202 C1286	E1202-T1204 PolarHBondContact O-N 3.11Å; T1204-C1286 PolarHBondContact O-SG 2.98Å
1205	F	72.2	Confident	67.5	Low	4 Å²	4	93.6 Å²	93.6	2%	0.018	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	131.1	177.3	-60.7	-85	0	0	0	110.8	F1194 G1203 Q1213 F1216 L1220 C1286	F1194-F1205 HydrophobicContact CD1-CE1 4.43Å; F1194-F1205 AromaticContact CD1-CZ 3.81Å; F1194-F1205 HydrophobicContact CD1-CZ 3.81Å; F1194-F1205 HydrophobicContact CE1-CE1 4.35Å; F1194-F1205 HydrophobicContact CE1-CZ 4.18Å; G1203-F1205 WeakPolarHBondContact O-CD2 3.37Å; G1203-F1205 WeakPolarHBondContact O-CE2 3.29Å; F1205-Q1213 PolarHBondContact O-N 2.87Å; F1205-F1216 HydrophobicContact CE2-CB 4Å; F1205-F1216 AromaticContact CE2-CD2 3.67Å; F1205-F1216 HydrophobicContact CE2-CD2 3.67Å; F1205-F1216 HydrophobicContact CE2-CG 4.32Å; F1205-F1216 AromaticContact CZ-CD2 3.57Å; F1205-F1216 HydrophobicContact CZ-CD2 3.57Å; F1205-F1216 HydrophobicContact CZ-CE2 4.19Å; F1205-L1220 HydrophobicContact CD1-CD1 4.28Å; F1205-L1220 HydrophobicContact CE1-CD1 4.31Å; F1205-C1286 HydrophobicContact CD1-CB 4.16Å; F1205-C1286 HydrophobicContact CE1-CB 4.24Å
1206	Y	68.7	Low	66.9	Low	90 Å²	90	93.4 Å²	93.4	35%	0.353	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	120.4	175.9	-62.6	-81.6	0	0	0	109.8	I1212 P1287	Y1206-I1212 HydrophobicContact CE1-CG1 4.17Å; Y1206-P1287 HydrophobicContact CE2-CG 4.22Å
1207	D	67	Low	67	Low	32 Å²	32	95.3 Å²	95.3	17%	0.171	46%	0.464	C	S	.	.			trans	-68.3	159.1	169.3	-156.2	34.3	0	0	0	109.6	R1209 G1210 N1211 Q1213	D1207-R1209 PolarHBondContact O-N 3.01Å; D1207-G1210 PolarHBondContact O-N 3.22Å; D1207-N1211 PolarHBondContact N-O 3.28Å; D1207-Q1213 HydrophobicContact CB-CG 4.3Å; D1207-Q1213 VanDerWaalsContact CG-NE2 3.31Å; D1207-Q1213 PolarHBondContact OD2-NE2 3.5Å
1208	P	62.9	Low	67.5	Low	60 Å²	60	100 Å²	100	39%	0.39	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-15.9	177.7	-25.7	35.7	0	0	0	114.4
1209	R	64.8	Low	68.2	Low	214 Å²	214	89.9 Å²	89.9	81%	0.808	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	2.2	174.3	-64.9	-178.1	176.9	169.2	-0.2	114	D1207 N1211	D1207-R1209 PolarHBondContact O-N 3.01Å; R1209-N1211 VanDerWaalsContact C-N 3.26Å; R1209-N1211 PolarHBondContact O-N 3.23Å
1210	G	66.2	Low	68.9	Low	48 Å²	48	80.5 Å²	80.5	50%	0.495	41%	0.412	S	S	.	.	S	Bend	trans	80.3	-1.4	-178.3	0	0	0	0	0	114.9	D1207	D1207-G1210 PolarHBondContact O-N 3.22Å
1211	N	65.9	Low	69.6	Low	101 Å²	101	73.6 Å²	73.6	54%	0.54	38%	0.381	S	S	.	.			trans	-70.4	133.4	177.4	-68.9	-18.2	0	0	0	110.6	D1207 R1209 Q1213	D1207-N1211 PolarHBondContact N-O 3.28Å; R1209-N1211 VanDerWaalsContact C-N 3.26Å; R1209-N1211 PolarHBondContact O-N 3.23Å; N1211-Q1213 PolarHBondContact O-N 3.24Å; N1211-Q1213 VanDerWaalsContact O-N 3.14Å
1212	I	63.2	Low	70.5	Confident	111 Å²	111	68.5 Å²	68.5	57%	0.569	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	106	172.7	-57	168.8	0	0	0	107	Y1206 Q1214	Y1206-I1212 HydrophobicContact CE1-CG1 4.17Å; I1212-Q1214 HydrophobicContact CG2-CG 4.43Å
1213	Q	58.5	Low	71.1	Confident	71 Å²	71	63.7 Å²	63.7	33%	0.332	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	116.3	166.4	-75.3	-177.8	-1.3	0	0	107.3	F1205 D1207 N1211 L1215	F1205-Q1213 PolarHBondContact O-N 2.87Å; D1207-Q1213 HydrophobicContact CB-CG 4.3Å; D1207-Q1213 VanDerWaalsContact CG-NE2 3.31Å; D1207-Q1213 PolarHBondContact OD2-NE2 3.5Å; N1211-Q1213 PolarHBondContact O-N 3.24Å; N1211-Q1213 VanDerWaalsContact O-N 3.14Å; Q1213-L1215 PolarHBondContact O-N 3.07Å
1214	Q	54.6	Low	71.8	Confident	159 Å²	159	63.5 Å²	63.5	74%	0.743	32%	0.322	S	S	*	.			trans	-78.7	-3.5	173.1	-70.6	179.7	-17.5	0	0	112.5	I1212 F1216	I1212-Q1214 HydrophobicContact CG2-CG 4.43Å; Q1214-F1216 PolarHBondContact O-N 3.36Å; Q1214-F1216 VanDerWaalsContact O-N 3.12Å
1215	L	60.2	Low	72.7	Confident	140 Å²	140	60.7 Å²	60.7	73%	0.733	31%	0.305	S	S	*	.			trans	-86.8	93	-174.2	-145.4	80.6	0	0	0	110.9	Q1213	Q1213-L1215 PolarHBondContact O-N 3.07Å
1216	F	66.4	Low	73.6	Confident	42 Å²	42	60.7 Å²	60.7	18%	0.184	31%	0.305	C	S	.	.			trans	-67.4	125.3	162.2	177.5	-111.4	0	0	0	109.6	F1194 T1195 F1205 Q1214 Y1221	F1194-F1216 HydrophobicContact CB-CD2 4.08Å; F1194-F1216 HydrophobicContact CB-CE1 4.44Å; F1194-F1216 HydrophobicContact CB-CE2 3.39Å; F1194-F1216 HydrophobicContact CB-CZ 3.55Å; F1194-F1216 HydrophobicContact CD1-CE2 4.19Å; F1194-F1216 AromaticContact CG-CE2 3.82Å; F1194-F1216 HydrophobicContact CG-CE2 3.82Å; F1194-F1216 HydrophobicContact CG-CZ 4.3Å; T1195-F1216 HydrophobicContact CG2-CD1 3.94Å; T1195-F1216 HydrophobicContact CG2-CE1 3.4Å; T1195-F1216 HydrophobicContact CG2-CZ 4.06Å; F1205-F1216 HydrophobicContact CE2-CB 4Å; F1205-F1216 AromaticContact CE2-CD2 3.67Å; F1205-F1216 HydrophobicContact CE2-CD2 3.67Å; F1205-F1216 HydrophobicContact CE2-CG 4.32Å; F1205-F1216 AromaticContact CZ-CD2 3.57Å; F1205-F1216 HydrophobicContact CZ-CD2 3.57Å; F1205-F1216 HydrophobicContact CZ-CE2 4.19Å; Q1214-F1216 PolarHBondContact O-N 3.36Å; Q1214-F1216 VanDerWaalsContact O-N 3.12Å; F1216-Y1221 HydrophobicContact CE1-CD2 4.47Å; F1216-Y1221 VanDerWaalsContact CZ-CB 3.43Å; F1216-Y1221 AromaticContact CZ-CD2 3.66Å; F1216-Y1221 HydrophobicContact CZ-CD2 3.66Å; F1216-Y1221 AromaticContact CZ-CG 3.88Å; F1216-Y1221 HydrophobicContact CZ-CG 3.88Å
1217	D	74.5	Confident	74.6	Confident	42 Å²	42	56.5 Å²	56.5	23%	0.225	29%	0.289	C	S	.	.			trans	-118.6	152.8	-176.2	-175.1	31.3	0	0	0	111.5	S1219 L1220 Y1221 I1275	D1217-S1219 PolarHBondContact O-N 3.2Å; D1217-S1219 PolarHBondContact OD2-OG 3.25Å; D1217-L1220 HydrophobicContact CB-CD1 4.4Å; D1217-L1220 WeakPolarHBondContact O-CB 3.3Å; D1217-L1220 PolarHBondContact O-N 3.17Å; D1217-L1220 VanDerWaalsContact O-N 3.07Å; D1217-Y1221 PolarHBondContact O-N 3.08Å; D1217-I1275 WeakPolarHBondContact OD2-CG1 3.43Å
1218	M	79.7	Confident	75.9	Confident	106 Å²	106	55 Å²	55	52%	0.522	28%	0.28	S	S	.	.	H	α-helix	trans	-60.2	-31.6	-179.3	-70.9	-65.5	-160.9	0	0	112.1	Y1107 Y1221 G1222	Y1107-M1218 HydrophobicContact CE2-CE 4.09Å; Y1107-M1218 HydrophobicContact CE2-SD 3.83Å; Y1107-M1218 WeakPolarHBondContact OH-CE 3.25Å; Y1107-M1218 PolarHBondContact OH-SD 3.39Å; M1218-Y1221 PolarHBondContact O-N 3.06Å; M1218-G1222 PolarHBondContact O-N 3.39Å
1219	S	79.6	Confident	77.3	Confident	19 Å²	19	52.1 Å²	52.1	13%	0.133	26%	0.262	C	S	.	.	H	α-helix	trans	-64.6	-41.4	175.5	66.2	0	0	0	0	112.4	D1217 G1222 C1223 N1276	D1217-S1219 PolarHBondContact O-N 3.2Å; D1217-S1219 PolarHBondContact OD2-OG 3.25Å; S1219-G1222 PolarHBondContact O-N 3.45Å; S1219-C1223 WeakPolarHBondContact O-CB 3.23Å; S1219-C1223 PolarHBondContact O-N 3.11Å; S1219-N1276 VanDerWaalsContact CB-OD1 3.32Å; S1219-N1276 WeakPolarHBondContact CB-OD1 3.12Å
1220	L	82.5	Confident	78.6	Confident	10 Å²	10	42.1 Å²	42.1	5%	0.052	22%	0.224	C	C	.	.	H	α-helix	trans	-68.2	-43.2	176.3	-71.9	166.5	0	0	0	110.8	F1205 D1217 C1223 A1224 S1279 K1282	F1205-L1220 HydrophobicContact CD1-CD1 4.28Å; F1205-L1220 HydrophobicContact CE1-CD1 4.31Å; D1217-L1220 HydrophobicContact CB-CD1 4.4Å; D1217-L1220 WeakPolarHBondContact O-CB 3.3Å; D1217-L1220 PolarHBondContact O-N 3.17Å; D1217-L1220 VanDerWaalsContact O-N 3.07Å; L1220-C1223 PolarHBondContact O-N 3.34Å; L1220-A1224 WeakPolarHBondContact O-CB 3.34Å; L1220-A1224 PolarHBondContact O-N 3.18Å; L1220-S1279 WeakPolarHBondContact CD2-O 3.33Å; L1220-K1282 HydrophobicContact CD2-CB 3.96Å; L1220-K1282 HydrophobicContact CD2-CD 4.47Å
1221	Y	85.8	Confident	79.8	Confident	11 Å²	11	42 Å²	42	4%	0.043	21%	0.21	C	C	.	.	H	α-helix	trans	-57	-49.1	173.4	-179.4	-114.1	0	0	0	112.2	Y1107 F1187 A1190 T1191 F1216 D1217 M1218 C1223 A1224 T1225	Y1107-Y1221 AromaticContact CD2-CE1 3.99Å; Y1107-Y1221 HydrophobicContact CD2-CE1 3.99Å; Y1107-Y1221 HydrophobicContact CE2-CD1 4.42Å; Y1107-Y1221 HydrophobicContact CE2-CE1 4.31Å; F1187-Y1221 WeakPolarHBondContact CD2-OH 3.46Å; F1187-Y1221 HydrophobicContact CE2-CE1 4.45Å; F1187-Y1221 WeakPolarHBondContact CE2-OH 3.32Å; F1187-Y1221 PolarHBondContact O-OH 2.94Å; A1190-Y1221 HydrophobicContact CB-CD2 4.39Å; A1190-Y1221 HydrophobicContact CB-CE2 3.7Å; T1191-Y1221 PolarHBondContact OG1-OH 3.23Å; F1216-Y1221 HydrophobicContact CE1-CD2 4.47Å; F1216-Y1221 VanDerWaalsContact CZ-CB 3.43Å; F1216-Y1221 AromaticContact CZ-CD2 3.66Å; F1216-Y1221 HydrophobicContact CZ-CD2 3.66Å; F1216-Y1221 AromaticContact CZ-CG 3.88Å; F1216-Y1221 HydrophobicContact CZ-CG 3.88Å; D1217-Y1221 PolarHBondContact O-N 3.08Å; M1218-Y1221 PolarHBondContact O-N 3.06Å; Y1221-C1223 PolarHBondContact O-N 2.92Å; Y1221-A1224 PolarHBondContact O-N 3.41Å; Y1221-T1225 HydrophobicContact CD1-CG2 4.48Å; Y1221-T1225 HydrophobicContact CD2-CG2 4.06Å; Y1221-T1225 HydrophobicContact CE1-CG2 4.05Å; Y1221-T1225 HydrophobicContact CE2-CG2 3.62Å; Y1221-T1225 WeakPolarHBondContact O-CB 3.16Å; Y1221-T1225 WeakPolarHBondContact O-CG2 3.22Å; Y1221-T1225 PolarHBondContact O-N 3.23Å; Y1221-T1225 PolarHBondContact O-OG1 2.9Å
1222	G	87.7	Confident	81.2	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-58.6	-46.1	177.1	0	0	0	0	0	112.4	T1118 F1119 M1218 S1219 A1224 T1225 Y1226	T1118-G1222 WeakPolarHBondContact O-CA 3.37Å; F1119-G1222 VanDerWaalsContact CD1-O 3.24Å; F1119-G1222 WeakPolarHBondContact CD1-O 3.38Å; F1119-G1222 WeakPolarHBondContact CE1-O 3.23Å; M1218-G1222 PolarHBondContact O-N 3.39Å; S1219-G1222 PolarHBondContact O-N 3.45Å; G1222-A1224 PolarHBondContact O-N 3.49Å; G1222-T1225 WeakPolarHBondContact CA-OG1 3.19Å; G1222-T1225 PolarHBondContact O-OG1 3.19Å; G1222-Y1226 VanDerWaalsContact O-CB 3.28Å; G1222-Y1226 WeakPolarHBondContact O-CB 3.4Å; G1222-Y1226 PolarHBondContact O-N 2.79Å
1223	C	86.4	Confident	82.6	Confident	10 Å²	10	31.9 Å²	31.9	7%	0.068	16%	0.157	C	C	.	.	H	α-helix	trans	-63.3	-42.6	177.2	-167.2	0	0	0	0	111.9	S1219 L1220 Y1221 Y1226 L1227	S1219-C1223 WeakPolarHBondContact O-CB 3.23Å; S1219-C1223 PolarHBondContact O-N 3.11Å; L1220-C1223 PolarHBondContact O-N 3.34Å; Y1221-C1223 PolarHBondContact O-N 2.92Å; C1223-Y1226 PolarHBondContact O-N 3.48Å; C1223-L1227 WeakPolarHBondContact O-CG 3.32Å; C1223-L1227 PolarHBondContact O-N 3.21Å; C1223-L1227 VanDerWaalsContact O-N 3.11Å
1224	A	88.9	Confident	84.1	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.6	-48.7	179.1	0	0	0	0	0	112.6	F1194 L1220 Y1221 G1222 Y1226 L1227 F1228 L1283 F1289	F1194-A1224 HydrophobicContact CD2-CB 4.35Å; F1194-A1224 HydrophobicContact CE2-CB 3.48Å; F1194-A1224 VanDerWaalsContact CE2-CB 3.48Å; F1194-A1224 HydrophobicContact CZ-CB 3.77Å; L1220-A1224 WeakPolarHBondContact O-CB 3.34Å; L1220-A1224 PolarHBondContact O-N 3.18Å; Y1221-A1224 PolarHBondContact O-N 3.41Å; G1222-A1224 PolarHBondContact O-N 3.49Å; A1224-Y1226 VanDerWaalsContact C-N 3.29Å; A1224-Y1226 PolarHBondContact O-N 3.11Å; A1224-L1227 PolarHBondContact O-N 3.05Å; A1224-F1228 HydrophobicContact CB-CE2 4.46Å; A1224-F1228 WeakPolarHBondContact O-CD2 3.14Å; A1224-F1228 VanDerWaalsContact O-CG 3.29Å; A1224-F1228 WeakPolarHBondContact O-CG 3.04Å; A1224-F1228 PolarHBondContact O-N 3.14Å; A1224-L1283 HydrophobicContact CB-CD1 3.73Å; A1224-L1283 HydrophobicContact CB-CD2 3.89Å; A1224-L1283 HydrophobicContact CB-CG 4.47Å; A1224-F1289 HydrophobicContact CB-CD2 4.44Å
1225	T	91.3	Very high	85.8	Confident	3 Å²	3	24.7 Å²	24.7	2%	0.018	13%	0.127	C	C	.	.	H	α-helix	trans	-60.7	-38.6	176.7	47.4	0	0	0	0	111.7	F1119 A1190 Y1221 G1222 F1228 V1229	F1119-T1225 WeakPolarHBondContact CE1-OG1 3.49Å; A1190-T1225 HydrophobicContact CB-CG2 3.47Å; A1190-T1225 VanDerWaalsContact CB-CG2 3.47Å; Y1221-T1225 HydrophobicContact CD1-CG2 4.48Å; Y1221-T1225 HydrophobicContact CD2-CG2 4.06Å; Y1221-T1225 HydrophobicContact CE1-CG2 4.05Å; Y1221-T1225 HydrophobicContact CE2-CG2 3.62Å; Y1221-T1225 WeakPolarHBondContact O-CB 3.16Å; Y1221-T1225 WeakPolarHBondContact O-CG2 3.22Å; Y1221-T1225 PolarHBondContact O-N 3.23Å; Y1221-T1225 PolarHBondContact O-OG1 2.9Å; G1222-T1225 WeakPolarHBondContact CA-OG1 3.19Å; G1222-T1225 PolarHBondContact O-OG1 3.19Å; T1225-F1228 PolarHBondContact O-N 3.28Å; T1225-V1229 WeakPolarHBondContact O-CG2 3.03Å; T1225-V1229 PolarHBondContact O-N 2.84Å
1226	Y	90.8	Very high	87.3	Confident	5 Å²	5	18.9 Å²	18.9	2%	0.02	10%	0.095	C	C	.	.	H	α-helix	trans	-60.2	-48.1	174.7	-179.5	-93.4	0	0	0	112.4	F1100 F1119 L1123 Y1127 V1131 G1222 C1223 A1224 F1228 V1229 W1230	F1100-Y1226 HydrophobicContact CE2-CD2 4.06Å; F1100-Y1226 HydrophobicContact CE2-CE2 4.13Å; F1119-Y1226 HydrophobicContact CD1-CD2 4.25Å; F1119-Y1226 HydrophobicContact CD1-CG 4.5Å; F1119-Y1226 HydrophobicContact CE1-CD2 4.48Å; F1119-Y1226 HydrophobicContact CG-CD2 4.32Å; L1123-Y1226 HydrophobicContact CB-CD2 4.05Å; L1123-Y1226 HydrophobicContact CB-CE2 3.8Å; L1123-Y1226 HydrophobicContact CD1-CD1 4.41Å; L1123-Y1226 HydrophobicContact CD1-CD2 4.44Å; L1123-Y1226 HydrophobicContact CD1-CG 4.22Å; L1123-Y1226 HydrophobicContact CD2-CD1 4.35Å; L1123-Y1226 HydrophobicContact CD2-CE1 4.02Å; Y1127-Y1226 HydrophobicContact CD2-CE2 4.02Å; Y1127-Y1226 HydrophobicContact CG-CE2 4.42Å; V1131-Y1226 WeakPolarHBondContact CG2-OH 3.3Å; G1222-Y1226 VanDerWaalsContact O-CB 3.28Å; G1222-Y1226 WeakPolarHBondContact O-CB 3.4Å; G1222-Y1226 PolarHBondContact O-N 2.79Å; C1223-Y1226 PolarHBondContact O-N 3.48Å; A1224-Y1226 VanDerWaalsContact C-N 3.29Å; A1224-Y1226 PolarHBondContact O-N 3.11Å; Y1226-F1228 VanDerWaalsContact C-N 3.33Å; Y1226-F1228 PolarHBondContact O-N 3.39Å; Y1226-V1229 PolarHBondContact O-N 3.36Å; Y1226-W1230 PolarHBondContact O-N 3.07Å
1227	L	90.4	Very high	88.4	Confident	1 Å²	1	17 Å²	17	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-63.3	-39.4	177.8	-68.1	179.1	0	0	0	111.8	C1223 A1224 W1230 F1231 L1263 Y1280 L1283 F1289	C1223-L1227 WeakPolarHBondContact O-CG 3.32Å; C1223-L1227 PolarHBondContact O-N 3.21Å; C1223-L1227 VanDerWaalsContact O-N 3.11Å; A1224-L1227 PolarHBondContact O-N 3.05Å; L1227-W1230 HydrophobicContact CD2-CE3 3.77Å; L1227-W1230 HydrophobicContact CD2-CZ3 4.06Å; L1227-W1230 PolarHBondContact O-N 3.4Å; L1227-F1231 HydrophobicContact CB-CD2 4.37Å; L1227-F1231 HydrophobicContact CB-CE2 4.17Å; L1227-F1231 WeakPolarHBondContact O-CD2 3.33Å; L1227-F1231 WeakPolarHBondContact O-CG 3.14Å; L1227-F1231 PolarHBondContact O-N 2.86Å; L1227-L1263 HydrophobicContact CD2-CD2 4.17Å; L1227-Y1280 HydrophobicContact CD1-CD2 3.82Å; L1227-Y1280 HydrophobicContact CD1-CE2 3.72Å; L1227-Y1280 HydrophobicContact CD2-CE2 4.33Å; L1227-L1283 HydrophobicContact CD1-CD2 3.62Å; L1227-F1289 HydrophobicContact CB-CE2 4.4Å; L1227-F1289 HydrophobicContact CB-CZ 4.38Å; L1227-F1289 HydrophobicContact CD1-CE2 4.06Å; L1227-F1289 HydrophobicContact CD1-CZ 3.67Å
1228	F	93.4	Very high	89	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-63.5	-42.6	175.1	-63.3	-26.2	0	0	0	112.2	I1186 A1190 F1194 A1224 T1225 Y1226 S1232 F1289 A1292 L1293 I1296	I1186-F1228 HydrophobicContact CG1-CB 4.44Å; I1186-F1228 HydrophobicContact CG2-CB 3.6Å; I1186-F1228 HydrophobicContact CG2-CD2 4.38Å; A1190-F1228 HydrophobicContact CB-CD2 4.13Å; A1190-F1228 HydrophobicContact CB-CE2 4.01Å; F1194-F1228 AromaticContact CE2-CE2 3.88Å; F1194-F1228 HydrophobicContact CE2-CE2 3.88Å; F1194-F1228 HydrophobicContact CE2-CZ 4.06Å; F1194-F1228 HydrophobicContact CZ-CZ 4.38Å; A1224-F1228 HydrophobicContact CB-CE2 4.46Å; A1224-F1228 WeakPolarHBondContact O-CD2 3.14Å; A1224-F1228 VanDerWaalsContact O-CG 3.29Å; A1224-F1228 WeakPolarHBondContact O-CG 3.04Å; A1224-F1228 PolarHBondContact O-N 3.14Å; T1225-F1228 PolarHBondContact O-N 3.28Å; Y1226-F1228 VanDerWaalsContact C-N 3.33Å; Y1226-F1228 PolarHBondContact O-N 3.39Å; F1228-S1232 WeakPolarHBondContact O-CB 3.49Å; F1228-S1232 PolarHBondContact O-N 2.87Å; F1228-F1289 HydrophobicContact CD1-CE2 4.15Å; F1228-F1289 AromaticContact CE1-CD2 3.68Å; F1228-F1289 HydrophobicContact CE1-CD2 3.68Å; F1228-F1289 AromaticContact CE1-CE2 3.43Å; F1228-F1289 HydrophobicContact CE1-CE2 3.43Å; F1228-F1289 VanDerWaalsContact CE1-CE2 3.43Å; F1228-F1289 HydrophobicContact CE1-CZ 4.36Å; F1228-F1289 AromaticContact CZ-CD2 3.73Å; F1228-F1289 HydrophobicContact CZ-CD2 3.73Å; F1228-F1289 AromaticContact CZ-CE2 3.91Å; F1228-F1289 HydrophobicContact CZ-CE2 3.91Å; F1228-A1292 HydrophobicContact CZ-CB 4.07Å; F1228-L1293 HydrophobicContact CD1-CB 4.48Å; F1228-L1293 HydrophobicContact CD1-CG 4.48Å; F1228-L1293 HydrophobicContact CE1-CB 3.89Å; F1228-L1293 HydrophobicContact CE1-CD1 4.39Å; F1228-L1293 HydrophobicContact CE1-CG 4.32Å; F1228-I1296 HydrophobicContact CD2-CD1 3.87Å; F1228-I1296 HydrophobicContact CE2-CD1 3.59Å; F1228-I1296 HydrophobicContact CZ-CD1 4.05Å
1229	V	93.3	Very high	89.5	Confident	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-60.6	-46.2	173.2	173.4	0	0	0	0	110.9	T1099 F1100 T1103 Y1127 I1186 T1225 Y1226 S1232 V1233	T1099-V1229 HydrophobicContact CG2-CG1 4.18Å; F1100-V1229 HydrophobicContact CB-CG1 4.47Å; F1100-V1229 HydrophobicContact CD2-CG1 4.28Å; T1103-V1229 HydrophobicContact CG2-CG2 3.77Å; Y1127-V1229 HydrophobicContact CE2-CG1 3.89Å; I1186-V1229 HydrophobicContact CD1-CB 4.46Å; I1186-V1229 HydrophobicContact CD1-CG2 3.94Å; I1186-V1229 HydrophobicContact CG2-CG2 4Å; T1225-V1229 WeakPolarHBondContact O-CG2 3.03Å; T1225-V1229 PolarHBondContact O-N 2.84Å; Y1226-V1229 PolarHBondContact O-N 3.36Å; V1229-S1232 PolarHBondContact O-N 2.95Å; V1229-V1233 HydrophobicContact CG1-CG2 4.35Å; V1229-V1233 WeakPolarHBondContact O-CB 3.4Å; V1229-V1233 VanDerWaalsContact O-CG2 3.29Å; V1229-V1233 WeakPolarHBondContact O-CG2 3.46Å; V1229-V1233 PolarHBondContact O-N 3.45Å
1230	W	91.8	Very high	89.8	Confident	4 Å²	4	14 Å²	14	2%	0.015	7%	0.07	C	C	.	.	H	α-helix	trans	-58.3	-58.1	177.9	174.1	16.6	0	0	0	111.7	V1131 Y1226 L1227 S1232 V1233 S1234 N1259 I1260	V1131-W1230 HydrophobicContact CG1-CB 4.06Å; V1131-W1230 HydrophobicContact CG1-CD2 3.62Å; V1131-W1230 HydrophobicContact CG1-CE3 4.48Å; V1131-W1230 HydrophobicContact CG1-CG 3.36Å; V1131-W1230 HydrophobicContact CG1-CZ2 4.33Å; V1131-W1230 VanDerWaalsContact CG1-NE1 3.29Å; Y1226-W1230 PolarHBondContact O-N 3.07Å; L1227-W1230 HydrophobicContact CD2-CE3 3.77Å; L1227-W1230 HydrophobicContact CD2-CZ3 4.06Å; L1227-W1230 PolarHBondContact O-N 3.4Å; W1230-S1232 VanDerWaalsContact C-N 3.28Å; W1230-S1232 PolarHBondContact O-N 3.38Å; W1230-V1233 PolarHBondContact O-N 3.26Å; W1230-S1234 PolarHBondContact O-N 3.41Å; W1230-S1234 PolarHBondContact O-OG 3.35Å; W1230-S1234 VanDerWaalsContact O-OG 3.08Å; W1230-N1259 HydrophobicContact CH2-CB 3.43Å; W1230-N1259 VanDerWaalsContact CH2-CB 3.43Å; W1230-N1259 HydrophobicContact CZ2-CB 3.68Å; W1230-N1259 HydrophobicContact CZ3-CB 4.28Å; W1230-I1260 HydrophobicContact CH2-CG1 4.03Å; W1230-I1260 HydrophobicContact CZ3-CG1 4.39Å
1231	F	91.7	Very high	90	Very high	46 Å²	46	13.7 Å²	13.7	20%	0.202	7%	0.069	C	C	.	.	H	α-helix	trans	-63.3	-35.3	-178	-66.6	-50.2	0	0	0	112.2	L1227 S1234 L1235 L1256 L1293 L1297	L1227-F1231 HydrophobicContact CB-CD2 4.37Å; L1227-F1231 HydrophobicContact CB-CE2 4.17Å; L1227-F1231 WeakPolarHBondContact O-CD2 3.33Å; L1227-F1231 WeakPolarHBondContact O-CG 3.14Å; L1227-F1231 PolarHBondContact O-N 2.86Å; F1231-S1234 PolarHBondContact O-N 3.11Å; F1231-L1235 WeakPolarHBondContact O-CB 3.18Å; F1231-L1235 PolarHBondContact O-N 2.83Å; F1231-L1256 HydrophobicContact CE1-CD1 3.86Å; F1231-L1293 HydrophobicContact CD2-CD1 3.75Å; F1231-L1293 HydrophobicContact CE2-CD1 3.9Å; F1231-L1297 HydrophobicContact CB-CD1 3.98Å; F1231-L1297 HydrophobicContact CB-CD2 3.89Å
1232	S	93.6	Very high	89.8	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-65.7	-42.6	177.4	-175.7	0	0	0	0	112.3	H1182 F1228 V1229 W1230 R1236	H1182-S1232 PolarHBondContact CE1-OG 3.49Å; H1182-S1232 PolarHBondContact ND1-OG 3.18Å; F1228-S1232 WeakPolarHBondContact O-CB 3.49Å; F1228-S1232 PolarHBondContact O-N 2.87Å; V1229-S1232 PolarHBondContact O-N 2.95Å; W1230-S1232 VanDerWaalsContact C-N 3.28Å; W1230-S1232 PolarHBondContact O-N 3.38Å; S1232-R1236 VanDerWaalsContact O-CB 3.28Å; S1232-R1236 WeakPolarHBondContact O-CB 3.34Å; S1232-R1236 PolarHBondContact O-N 3.1Å
1233	V	92.7	Very high	89.5	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-69.7	-38.2	178	171.3	0	0	0	0	110.7	Y1095 K1096 T1099 T1132 V1229 W1230 R1236 I1237	Y1095-V1233 HydrophobicContact CE1-CG2 4.07Å; K1096-V1233 HydrophobicContact CB-CG1 3.75Å; K1096-V1233 HydrophobicContact CB-CG2 4.17Å; T1099-V1233 HydrophobicContact CG2-CG2 4.46Å; T1132-V1233 HydrophobicContact CG2-CG1 4.08Å; V1229-V1233 HydrophobicContact CG1-CG2 4.35Å; V1229-V1233 WeakPolarHBondContact O-CB 3.4Å; V1229-V1233 VanDerWaalsContact O-CG2 3.29Å; V1229-V1233 WeakPolarHBondContact O-CG2 3.46Å; V1229-V1233 PolarHBondContact O-N 3.45Å; W1230-V1233 PolarHBondContact O-N 3.26Å; V1233-R1236 PolarHBondContact O-N 2.99Å; V1233-I1237 HydrophobicContact CG1-CD1 4.08Å; V1233-I1237 WeakPolarHBondContact O-CG1 3.25Å; V1233-I1237 PolarHBondContact O-N 2.79Å
1234	S	90.2	Very high	89.3	Confident	13 Å²	13	23.6 Å²	23.6	9%	0.091	11%	0.111	C	C	.	.	H	α-helix	trans	-61.8	-47.4	174.4	-60.7	0	0	0	0	112.9	W1230 F1231 R1236 I1237 F1238	W1230-S1234 PolarHBondContact O-N 3.41Å; W1230-S1234 PolarHBondContact O-OG 3.35Å; W1230-S1234 VanDerWaalsContact O-OG 3.08Å; F1231-S1234 PolarHBondContact O-N 3.11Å; S1234-R1236 VanDerWaalsContact C-N 3.32Å; S1234-R1236 PolarHBondContact O-N 3.17Å; S1234-I1237 PolarHBondContact O-N 3.45Å; S1234-F1238 PolarHBondContact O-N 3.44Å
1235	L	90.5	Very high	89.1	Confident	66 Å²	66	25.2 Å²	25.2	35%	0.346	12%	0.121	S	C	.	.	H	α-helix	trans	-64.2	-38.6	176.6	-173.7	61.4	0	0	0	111.5	F1231 I1237 F1238 I1239 L1297 N1301	F1231-L1235 WeakPolarHBondContact O-CB 3.18Å; F1231-L1235 PolarHBondContact O-N 2.83Å; L1235-I1237 VanDerWaalsContact C-N 3.33Å; L1235-I1237 PolarHBondContact O-N 2.97Å; L1235-F1238 WeakPolarHBondContact O-CB 3.49Å; L1235-F1238 PolarHBondContact O-N 3.47Å; L1235-I1239 HydrophobicContact CG-CD1 4.11Å; L1235-I1239 VanDerWaalsContact O-CG1 3.32Å; L1235-I1239 WeakPolarHBondContact O-CG1 3.47Å; L1235-I1239 PolarHBondContact O-N 3.43Å; L1235-L1297 HydrophobicContact CD2-CB 4.31Å; L1235-N1301 HydrophobicContact CD2-CB 4.49Å
1236	R	92	Very high	88.9	Confident	18 Å²	18	32.4 Å²	32.4	7%	0.068	16%	0.158	C	C	.	.	H	α-helix	trans	-62.6	-38.1	177.4	180	59.6	175.1	85.9	-1.1	113	Y1095 D1178 S1232 V1233 S1234 I1239 A1240 N1301 S1304	Y1095-R1236 HydrophobicContact CE1-CB 4.2Å; Y1095-R1236 HydrophobicContact CE1-CG 3.73Å; D1178-R1236 IonicContact OD2-CZ 2.69Å; D1178-R1236 IonicContact OD2-NE 2.71Å; D1178-R1236 PolarHBondContact OD2-NE 3.42Å; D1178-R1236 VanDerWaalsContact OD2-NE 3.14Å; D1178-R1236 IonicContact OD2-NH2 2.62Å; D1178-R1236 PolarHBondContact OD2-NH2 2.96Å; S1232-R1236 VanDerWaalsContact O-CB 3.28Å; S1232-R1236 WeakPolarHBondContact O-CB 3.34Å; S1232-R1236 PolarHBondContact O-N 3.1Å; V1233-R1236 PolarHBondContact O-N 2.99Å; S1234-R1236 VanDerWaalsContact C-N 3.32Å; S1234-R1236 PolarHBondContact O-N 3.17Å; R1236-I1239 PolarHBondContact O-N 3.4Å; R1236-A1240 WeakPolarHBondContact O-CB 3.35Å; R1236-A1240 PolarHBondContact O-N 3.41Å; R1236-N1301 WeakPolarHBondContact CA-OD1 3.47Å; R1236-N1301 WeakPolarHBondContact CB-OD1 3.46Å; R1236-N1301 PolarHBondContact N-OD1 2.82Å; R1236-S1304 WeakPolarHBondContact CD-OG 3.44Å; R1236-S1304 VanDerWaalsContact NE-CB 3.3Å; R1236-S1304 PolarHBondContact NE-OG 3.03Å
1237	I	89.7	Confident	88.7	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-70.9	-39.5	176.6	-73.3	167.3	0	0	0	110.7	L1092 M1135 C1136 F1139 V1233 S1234 L1235 I1239 A1240 S1241	L1092-I1237 HydrophobicContact CD1-CG1 4.17Å; L1092-I1237 HydrophobicContact CD2-CG1 3.88Å; M1135-I1237 HydrophobicContact CE-CB 4.05Å; M1135-I1237 HydrophobicContact CE-CD1 3.25Å; M1135-I1237 HydrophobicContact CE-CG1 4.14Å; M1135-I1237 HydrophobicContact CE-CG2 4.41Å; M1135-I1237 HydrophobicContact CG-CB 4.39Å; M1135-I1237 HydrophobicContact CG-CD1 4.49Å; M1135-I1237 HydrophobicContact CG-CG2 3.78Å; M1135-I1237 HydrophobicContact SD-CB 3.85Å; M1135-I1237 HydrophobicContact SD-CD1 4.18Å; M1135-I1237 HydrophobicContact SD-CG2 3.88Å; C1136-I1237 WeakPolarHBondContact SG-CD1 3.35Å; F1139-I1237 HydrophobicContact CB-CG2 4.19Å; F1139-I1237 HydrophobicContact CD2-CG2 4.35Å; F1139-I1237 HydrophobicContact CG-CG2 4.37Å; V1233-I1237 HydrophobicContact CG1-CD1 4.08Å; V1233-I1237 WeakPolarHBondContact O-CG1 3.25Å; V1233-I1237 PolarHBondContact O-N 2.79Å; S1234-I1237 PolarHBondContact O-N 3.45Å; L1235-I1237 VanDerWaalsContact C-N 3.33Å; L1235-I1237 PolarHBondContact O-N 2.97Å; I1237-I1239 VanDerWaalsContact C-N 3.34Å; I1237-I1239 PolarHBondContact O-N 2.96Å; I1237-A1240 PolarHBondContact O-N 3.26Å; I1237-A1240 VanDerWaalsContact O-N 3.17Å; I1237-S1241 PolarHBondContact O-N 3.22Å
1238	F	87.6	Confident	88.3	Confident	75 Å²	75	35.9 Å²	35.9	33%	0.329	18%	0.179	S	C	.	.	H	α-helix	trans	-60.3	-43.9	171.8	-173.9	-98.8	0	0	0	111.7	S1234 L1235 A1240 S1241 Y1244 I1252	S1234-F1238 PolarHBondContact O-N 3.44Å; L1235-F1238 WeakPolarHBondContact O-CB 3.49Å; L1235-F1238 PolarHBondContact O-N 3.47Å; F1238-A1240 VanDerWaalsContact C-N 3.3Å; F1238-A1240 PolarHBondContact O-N 3.14Å; F1238-S1241 PolarHBondContact O-N 3.17Å; F1238-Y1244 HydrophobicContact CD1-CE1 4.06Å; F1238-Y1244 HydrophobicContact CD2-CD1 4.14Å; F1238-Y1244 AromaticContact CD2-CE1 3.91Å; F1238-Y1244 HydrophobicContact CD2-CE1 3.91Å; F1238-Y1244 HydrophobicContact CE1-CD1 4.36Å; F1238-Y1244 AromaticContact CE1-CE1 3.59Å; F1238-Y1244 HydrophobicContact CE1-CE1 3.59Å; F1238-Y1244 AromaticContact CE2-CD1 3.44Å; F1238-Y1244 HydrophobicContact CE2-CD1 3.44Å; F1238-Y1244 VanDerWaalsContact CE2-CD1 3.44Å; F1238-Y1244 AromaticContact CE2-CE1 3.44Å; F1238-Y1244 HydrophobicContact CE2-CE1 3.44Å; F1238-Y1244 VanDerWaalsContact CE2-CE1 3.44Å; F1238-Y1244 HydrophobicContact CG-CE1 4.21Å; F1238-Y1244 AromaticContact CZ-CD1 3.57Å; F1238-Y1244 HydrophobicContact CZ-CD1 3.57Å; F1238-Y1244 AromaticContact CZ-CE1 3.26Å; F1238-Y1244 HydrophobicContact CZ-CE1 3.26Å; F1238-I1252 HydrophobicContact CD2-CD1 4.1Å
1239	I	89.3	Confident	88	Confident	15 Å²	15	42.2 Å²	42.2	8%	0.077	21%	0.207	C	C	.	.	H	α-helix	trans	-62.3	-38.4	174.9	-69	166.6	0	0	0	110.9	L1235 R1236 I1237 S1241 N1301 L1305 R1308	L1235-I1239 HydrophobicContact CG-CD1 4.11Å; L1235-I1239 VanDerWaalsContact O-CG1 3.32Å; L1235-I1239 WeakPolarHBondContact O-CG1 3.47Å; L1235-I1239 PolarHBondContact O-N 3.43Å; R1236-I1239 PolarHBondContact O-N 3.4Å; I1237-I1239 VanDerWaalsContact C-N 3.34Å; I1237-I1239 PolarHBondContact O-N 2.96Å; I1239-S1241 PolarHBondContact O-N 3.43Å; I1239-N1301 HydrophobicContact CD1-CB 3.72Å; I1239-L1305 HydrophobicContact CG2-CD1 4.3Å; I1239-R1308 WeakPolarHBondContact O-CD 3.32Å; I1239-R1308 PolarHBondContact O-NH1 3.01Å
1240	A	86.7	Confident	87.6	Confident	15 Å²	15	43.5 Å²	43.5	12%	0.124	22%	0.221	C	C	.	.	H	α-helix	trans	-68.3	-17.2	179.9	0	0	0	0	0	114.3	F1139 R1236 I1237 F1238 H1242	F1139-A1240 HydrophobicContact CE2-CB 4.25Å; F1139-A1240 HydrophobicContact CZ-CB 4.43Å; R1236-A1240 WeakPolarHBondContact O-CB 3.35Å; R1236-A1240 PolarHBondContact O-N 3.41Å; I1237-A1240 PolarHBondContact O-N 3.26Å; I1237-A1240 VanDerWaalsContact O-N 3.17Å; F1238-A1240 VanDerWaalsContact C-N 3.3Å; F1238-A1240 PolarHBondContact O-N 3.14Å; A1240-H1242 PolarHBondContact O-ND1 3.44Å
1241	S	86.4	Confident	87.3	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.021	22%	0.222	C	C	.	.			trans	-82.8	129.9	-177.6	-164.6	0	0	0	0	111.5	E1143 I1237 F1238 I1239 D1243	E1143-S1241 VanDerWaalsContact OE2-CA 3.31Å; E1143-S1241 WeakPolarHBondContact OE2-CA 3.31Å; E1143-S1241 WeakPolarHBondContact OE2-CB 3.32Å; E1143-S1241 PolarHBondContact OE2-OG 3.35Å; I1237-S1241 PolarHBondContact O-N 3.22Å; F1238-S1241 PolarHBondContact O-N 3.17Å; I1239-S1241 PolarHBondContact O-N 3.43Å; S1241-D1243 PolarHBondContact OG-O 3.18Å
1242	H	82.3	Confident	86.9	Confident	62 Å²	62	42.7 Å²	42.7	29%	0.287	22%	0.219	S	C	.	.	S	Bend	trans	-89.6	-36.5	174.3	-57.3	70.3	0	0	0	110.2	E1143 A1240 D1312	E1143-H1242 WeakPolarHBondContact OE1-CB 3.48Å; E1143-H1242 IonicContact OE1-CE1 3.78Å; E1143-H1242 IonicContact OE1-CG 2.78Å; E1143-H1242 PolarHBondContact OE1-N 3.29Å; E1143-H1242 IonicContact OE1-ND1 3.71Å; E1143-H1242 PolarHBondContact OE1-ND1 3.5Å; E1143-H1242 PolarHBondContact OE2-N 2.91Å; A1240-H1242 PolarHBondContact O-ND1 3.44Å; H1242-D1312 IonicContact CD2-OD1 3.42Å; H1242-D1312 IonicContact NE2-OD1 2.67Å; H1242-D1312 PolarHBondContact NE2-OD1 2.8Å
1243	D	81.2	Confident	86.6	Confident	44 Å²	44	47 Å²	47	24%	0.235	24%	0.242	C	C	.	.	S	Bend	trans	-106.4	98.7	-176.3	-97.5	19.7	0	0	0	111.3	R1144 S1241 T1245	R1144-D1243 WeakPolarHBondContact CB-OD2 3.26Å; R1144-D1243 IonicContact CZ-OD2 3.65Å; R1144-D1243 IonicContact NE-OD2 3.48Å; R1144-D1243 PolarHBondContact NE-OD2 2.86Å; R1144-D1243 IonicContact NH2-OD2 3.47Å; R1144-D1243 PolarHBondContact NH2-OD2 2.9Å; S1241-D1243 PolarHBondContact OG-O 3.18Å; D1243-T1245 VanDerWaalsContact C-N 3.28Å; D1243-T1245 PolarHBondContact O-N 3.34Å
1244	Y	82	Confident	86.3	Confident	125 Å²	125	50.2 Å²	50.2	49%	0.49	26%	0.261	S	S	.	.			trans	-74.7	78.9	177	-60.6	-73.1	0	0	0	111.6	F1238 R1308	F1238-Y1244 HydrophobicContact CD1-CE1 4.06Å; F1238-Y1244 HydrophobicContact CD2-CD1 4.14Å; F1238-Y1244 AromaticContact CD2-CE1 3.91Å; F1238-Y1244 HydrophobicContact CD2-CE1 3.91Å; F1238-Y1244 HydrophobicContact CE1-CD1 4.36Å; F1238-Y1244 AromaticContact CE1-CE1 3.59Å; F1238-Y1244 HydrophobicContact CE1-CE1 3.59Å; F1238-Y1244 AromaticContact CE2-CD1 3.44Å; F1238-Y1244 HydrophobicContact CE2-CD1 3.44Å; F1238-Y1244 VanDerWaalsContact CE2-CD1 3.44Å; F1238-Y1244 AromaticContact CE2-CE1 3.44Å; F1238-Y1244 HydrophobicContact CE2-CE1 3.44Å; F1238-Y1244 VanDerWaalsContact CE2-CE1 3.44Å; F1238-Y1244 HydrophobicContact CG-CE1 4.21Å; F1238-Y1244 AromaticContact CZ-CD1 3.57Å; F1238-Y1244 HydrophobicContact CZ-CD1 3.57Å; F1238-Y1244 AromaticContact CZ-CE1 3.26Å; F1238-Y1244 HydrophobicContact CZ-CE1 3.26Å; Y1244-R1308 PolarHBondContact OH-NH1 3.49Å; Y1244-R1308 VanDerWaalsContact OH-NH1 3.09Å
1245	T	83.8	Confident	86	Confident	34 Å²	34	49.8 Å²	49.8	21%	0.209	26%	0.258	C	S	.	.			trans	-78.6	144.9	174.6	62.2	0	0	0	0	111.7	F1142 D1243 V1247 V1248 F1249	F1142-T1245 HydrophobicContact CB-CG2 4.49Å; D1243-T1245 VanDerWaalsContact C-N 3.28Å; D1243-T1245 PolarHBondContact O-N 3.34Å; T1245-V1247 PolarHBondContact O-N 3.49Å; T1245-V1247 VanDerWaalsContact O-N 3.14Å; T1245-V1248 PolarHBondContact O-N 3.39Å; T1245-V1248 VanDerWaalsContact O-N 3.12Å; T1245-V1248 VanDerWaalsContact OG1-CG2 3.26Å; T1245-V1248 WeakPolarHBondContact OG1-CG2 3.36Å; T1245-V1248 PolarHBondContact OG1-N 3.31Å; T1245-F1249 PolarHBondContact O-N 3.29Å; T1245-F1249 VanDerWaalsContact O-N 3.12Å
1246	I	87.3	Confident	85.8	Confident	153 Å²	153	49.3 Å²	49.3	79%	0.785	26%	0.256	S	S	*	.	H	α-helix	trans	-54.5	-34.1	175.2	-63.2	169.7	0	0	0	110.9	F1249 G1250	I1246-F1249 PolarHBondContact O-N 2.88Å; I1246-G1250 PolarHBondContact O-N 3.46Å
1247	V	86.3	Confident	85.6	Confident	70 Å²	70	51.9 Å²	51.9	42%	0.424	27%	0.273	S	S	.	.	H	α-helix	trans	-67.6	-42.7	-179.8	-175.1	0	0	0	0	112	L1138 F1142 T1245 G1251	L1138-V1247 HydrophobicContact CD2-CG1 4.22Å; F1142-V1247 HydrophobicContact CD2-CB 4.25Å; F1142-V1247 HydrophobicContact CD2-CG1 3.9Å; F1142-V1247 HydrophobicContact CE2-CB 4.09Å; F1142-V1247 HydrophobicContact CE2-CG1 3.39Å; F1142-V1247 HydrophobicContact CZ-CB 4.36Å; F1142-V1247 HydrophobicContact CZ-CG1 3.85Å; F1142-V1247 HydrophobicContact CZ-CG2 4.43Å; T1245-V1247 PolarHBondContact O-N 3.49Å; T1245-V1247 VanDerWaalsContact O-N 3.14Å; V1247-G1251 PolarHBondContact O-N 3.09Å
1248	V	83.5	Confident	85.4	Confident	9 Å²	9	55.5 Å²	55.5	6%	0.055	30%	0.296	C	S	.	.	H	α-helix	trans	-66.4	-43.9	176.5	172.2	0	0	0	0	110.1	F1142 T1245 G1251 I1252	F1142-V1248 HydrophobicContact CB-CG2 4.18Å; T1245-V1248 PolarHBondContact O-N 3.39Å; T1245-V1248 VanDerWaalsContact O-N 3.12Å; T1245-V1248 VanDerWaalsContact OG1-CG2 3.26Å; T1245-V1248 WeakPolarHBondContact OG1-CG2 3.36Å; T1245-V1248 PolarHBondContact OG1-N 3.31Å; V1248-G1251 PolarHBondContact O-N 2.69Å; V1248-I1252 HydrophobicContact CG1-CD1 4.16Å; V1248-I1252 WeakPolarHBondContact O-CG1 3.39Å; V1248-I1252 PolarHBondContact O-N 3.03Å
1249	F	85.5	Confident	85.2	Confident	133 Å²	133	52.3 Å²	52.3	58%	0.583	28%	0.282	S	S	*	.	H	α-helix	trans	-62	-47.3	176.6	-176	-100.4	0	0	0	112.3	T1245 I1246 G1251 I1252 L1253	T1245-F1249 PolarHBondContact O-N 3.29Å; T1245-F1249 VanDerWaalsContact O-N 3.12Å; I1246-F1249 PolarHBondContact O-N 2.88Å; F1249-G1251 VanDerWaalsContact C-N 3.28Å; F1249-G1251 PolarHBondContact O-N 3.41Å; F1249-I1252 PolarHBondContact O-N 2.56Å; F1249-L1253 PolarHBondContact O-N 3.15Å
1250	G	85.9	Confident	85.1	Confident	28 Å²	28	53.4 Å²	53.4	29%	0.289	29%	0.288	S	S	.	.	H	α-helix	trans	-61.7	-36.4	174.3	0	0	0	0	0	112.4	I1246 L1253 T1254	I1246-G1250 PolarHBondContact O-N 3.46Å; G1250-L1253 PolarHBondContact O-N 3.41Å; G1250-T1254 WeakPolarHBondContact O-CB 3.42Å; G1250-T1254 VanDerWaalsContact O-CG2 3.22Å; G1250-T1254 WeakPolarHBondContact O-CG2 3.15Å; G1250-T1254 PolarHBondContact O-N 3.48Å; G1250-T1254 PolarHBondContact O-OG1 2.99Å
1251	G	85.1	Confident	85	Confident	4 Å²	4	55.3 Å²	55.3	4%	0.041	30%	0.303	C	S	.	.	H	α-helix	trans	-59.9	-46.1	171.3	0	0	0	0	0	113.4	V1247 V1248 F1249 T1254 T1255	V1247-G1251 PolarHBondContact O-N 3.09Å; V1248-G1251 PolarHBondContact O-N 2.69Å; F1249-G1251 VanDerWaalsContact C-N 3.28Å; F1249-G1251 PolarHBondContact O-N 3.41Å; G1251-T1254 WeakPolarHBondContact CA-OG1 3.28Å; G1251-T1254 PolarHBondContact O-N 2.8Å; G1251-T1254 PolarHBondContact O-OG1 3.4Å; G1251-T1255 WeakPolarHBondContact O-CG2 3.48Å; G1251-T1255 PolarHBondContact O-N 2.91Å; G1251-T1255 PolarHBondContact O-OG1 3.32Å
1252	I	82.9	Confident	84.9	Confident	28 Å²	28	57.7 Å²	57.7	14%	0.144	32%	0.315	C	S	.	.	H	α-helix	trans	-62.1	-48.2	175.6	-66.6	165	0	0	0	109.8	M1135 F1238 V1248 F1249 T1254 T1255 L1256	M1135-I1252 HydrophobicContact CG-CG1 3.81Å; M1135-I1252 HydrophobicContact SD-CD1 4.38Å; M1135-I1252 HydrophobicContact SD-CG1 3.88Å; F1238-I1252 HydrophobicContact CD2-CD1 4.1Å; V1248-I1252 HydrophobicContact CG1-CD1 4.16Å; V1248-I1252 WeakPolarHBondContact O-CG1 3.39Å; V1248-I1252 PolarHBondContact O-N 3.03Å; F1249-I1252 PolarHBondContact O-N 2.56Å; I1252-T1254 PolarHBondContact O-N 2.91Å; I1252-T1255 PolarHBondContact O-N 3.21Å; I1252-T1255 PolarHBondContact O-OG1 3.13Å; I1252-L1256 WeakPolarHBondContact O-CB 3.46Å; I1252-L1256 PolarHBondContact O-N 3.19Å
1253	L	87	Confident	84.9	Confident	92 Å²	92	55.2 Å²	55.2	48%	0.482	30%	0.304	S	S	.	.	H	α-helix	trans	-61.8	-43.5	-179.7	-174.1	63.5	0	0	0	112.1	F1249 G1250 L1256 T1257	F1249-L1253 PolarHBondContact O-N 3.15Å; G1250-L1253 PolarHBondContact O-N 3.41Å; L1253-L1256 PolarHBondContact O-N 2.75Å; L1253-T1257 HydrophobicContact CD1-CG2 4.34Å; L1253-T1257 HydrophobicContact CG-CG2 4.46Å; L1253-T1257 WeakPolarHBondContact O-CG2 3.39Å; L1253-T1257 PolarHBondContact O-N 2.95Å; L1253-T1257 PolarHBondContact O-OG1 3.46Å
1254	T	86.4	Confident	85	Confident	66 Å²	66	57.6 Å²	57.6	41%	0.405	32%	0.316	S	S	.	.	H	α-helix	trans	-64.8	-42.3	177.4	51.1	0	0	0	0	112.1	G1250 G1251 I1252 L1256 T1257 V1258	G1250-T1254 WeakPolarHBondContact O-CB 3.42Å; G1250-T1254 VanDerWaalsContact O-CG2 3.22Å; G1250-T1254 WeakPolarHBondContact O-CG2 3.15Å; G1250-T1254 PolarHBondContact O-N 3.48Å; G1250-T1254 PolarHBondContact O-OG1 2.99Å; G1251-T1254 WeakPolarHBondContact CA-OG1 3.28Å; G1251-T1254 PolarHBondContact O-N 2.8Å; G1251-T1254 PolarHBondContact O-OG1 3.4Å; I1252-T1254 PolarHBondContact O-N 2.91Å; T1254-L1256 VanDerWaalsContact C-N 3.3Å; T1254-L1256 PolarHBondContact O-N 2.83Å; T1254-T1257 PolarHBondContact O-OG1 2.88Å; T1254-V1258 VanDerWaalsContact O-CB 3.28Å; T1254-V1258 WeakPolarHBondContact O-CB 3.14Å; T1254-V1258 WeakPolarHBondContact O-CG2 3.39Å; T1254-V1258 PolarHBondContact O-N 3.33Å
1255	T	85.7	Confident	85.2	Confident	4 Å²	4	54 Å²	54	3%	0.025	31%	0.312	C	S	.	.	H	α-helix	trans	-62.2	-39.8	172.9	57	0	0	0	0	111.7	L1134 G1251 I1252 N1259	L1134-T1255 HydrophobicContact CB-CG2 3.63Å; L1134-T1255 HydrophobicContact CD2-CG2 3.69Å; L1134-T1255 HydrophobicContact CG-CG2 3.86Å; G1251-T1255 WeakPolarHBondContact O-CG2 3.48Å; G1251-T1255 PolarHBondContact O-N 2.91Å; G1251-T1255 PolarHBondContact O-OG1 3.32Å; I1252-T1255 PolarHBondContact O-N 3.21Å; I1252-T1255 PolarHBondContact O-OG1 3.13Å; T1255-N1259 VanDerWaalsContact O-CB 3.28Å; T1255-N1259 WeakPolarHBondContact O-CB 3.35Å; T1255-N1259 PolarHBondContact O-N 2.89Å; T1255-N1259 PolarHBondContact O-ND2 3.08Å
1256	L	85.4	Confident	85	Confident	56 Å²	56	54.2 Å²	54.2	29%	0.293	31%	0.312	S	S	.	.	H	α-helix	trans	-64.2	-50.3	178.8	-171.5	136.2	0	0	0	111.7	F1231 I1252 L1253 T1254 I1260	F1231-L1256 HydrophobicContact CE1-CD1 3.86Å; I1252-L1256 WeakPolarHBondContact O-CB 3.46Å; I1252-L1256 PolarHBondContact O-N 3.19Å; L1253-L1256 PolarHBondContact O-N 2.75Å; T1254-L1256 VanDerWaalsContact C-N 3.3Å; T1254-L1256 PolarHBondContact O-N 2.83Å; L1256-I1260 HydrophobicContact CD2-CD1 3.57Å; L1256-I1260 HydrophobicContact CG-CD1 3.91Å; L1256-I1260 WeakPolarHBondContact O-CB 3.46Å; L1256-I1260 WeakPolarHBondContact O-CD1 3.37Å; L1256-I1260 WeakPolarHBondContact O-CG1 3.47Å; L1256-I1260 PolarHBondContact O-N 3.21Å
1257	T	86.8	Confident	84.7	Confident	72 Å²	72	47.8 Å²	47.8	44%	0.442	28%	0.278	S	S	.	.	H	α-helix	trans	-65.9	-46.1	-178.8	55.9	0	0	0	0	112.3	L1253 T1254 I1260 A1261	L1253-T1257 HydrophobicContact CD1-CG2 4.34Å; L1253-T1257 HydrophobicContact CG-CG2 4.46Å; L1253-T1257 WeakPolarHBondContact O-CG2 3.39Å; L1253-T1257 PolarHBondContact O-N 2.95Å; L1253-T1257 PolarHBondContact O-OG1 3.46Å; T1254-T1257 PolarHBondContact O-OG1 2.88Å; T1257-I1260 PolarHBondContact O-N 2.76Å; T1257-A1261 WeakPolarHBondContact O-CB 3.01Å; T1257-A1261 PolarHBondContact O-N 2.91Å
1258	V	86.3	Confident	84.3	Confident	78 Å²	78	49 Å²	49	47%	0.473	29%	0.29	S	S	.	.	H	α-helix	trans	-63.6	-44.9	-179.6	172.2	0	0	0	0	110.9	T1254 A1261 I1262	T1254-V1258 VanDerWaalsContact O-CB 3.28Å; T1254-V1258 WeakPolarHBondContact O-CB 3.14Å; T1254-V1258 WeakPolarHBondContact O-CG2 3.39Å; T1254-V1258 PolarHBondContact O-N 3.33Å; V1258-A1261 WeakPolarHBondContact O-CB 3.45Å; V1258-A1261 PolarHBondContact O-N 2.89Å; V1258-I1262 HydrophobicContact CG1-CD1 3.9Å; V1258-I1262 VanDerWaalsContact O-CG1 3.28Å; V1258-I1262 WeakPolarHBondContact O-CG1 3.3Å; V1258-I1262 PolarHBondContact O-N 3.3Å
1259	N	84.2	Confident	84	Confident	7 Å²	7	53.6 Å²	53.6	4%	0.037	32%	0.318	C	S	.	.	H	α-helix	trans	-74.9	-30.6	-178	-71.3	-73.3	0	0	0	112.9	I1126 T1130 V1131 W1230 T1255 I1262 L1263	I1126-N1259 WeakPolarHBondContact CG2-OD1 3.25Å; T1130-N1259 WeakPolarHBondContact CB-OD1 3.25Å; T1130-N1259 PolarHBondContact O-ND2 3.1Å; T1130-N1259 VanDerWaalsContact O-ND2 3.13Å; T1130-N1259 PolarHBondContact OG1-OD1 2.78Å; V1131-N1259 WeakPolarHBondContact CA-ND2 3.34Å; V1131-N1259 HydrophobicContact CG2-CB 4.35Å; W1230-N1259 HydrophobicContact CH2-CB 3.43Å; W1230-N1259 VanDerWaalsContact CH2-CB 3.43Å; W1230-N1259 HydrophobicContact CZ2-CB 3.68Å; W1230-N1259 HydrophobicContact CZ3-CB 4.28Å; T1255-N1259 VanDerWaalsContact O-CB 3.28Å; T1255-N1259 WeakPolarHBondContact O-CB 3.35Å; T1255-N1259 PolarHBondContact O-N 2.89Å; T1255-N1259 PolarHBondContact O-ND2 3.08Å; N1259-I1262 PolarHBondContact O-N 3.43Å; N1259-L1263 WeakPolarHBondContact O-CB 3.21Å; N1259-L1263 PolarHBondContact O-N 2.88Å
1260	I	85.5	Confident	83.6	Confident	39 Å²	39	48 Å²	48	20%	0.2	30%	0.295	C	S	.	.	H	α-helix	trans	-63.7	-43.4	168.8	-71	169.3	0	0	0	110.2	W1230 L1256 T1257 I1262 L1263 I1264	W1230-I1260 HydrophobicContact CH2-CG1 4.03Å; W1230-I1260 HydrophobicContact CZ3-CG1 4.39Å; L1256-I1260 HydrophobicContact CD2-CD1 3.57Å; L1256-I1260 HydrophobicContact CG-CD1 3.91Å; L1256-I1260 WeakPolarHBondContact O-CB 3.46Å; L1256-I1260 WeakPolarHBondContact O-CD1 3.37Å; L1256-I1260 WeakPolarHBondContact O-CG1 3.47Å; L1256-I1260 PolarHBondContact O-N 3.21Å; T1257-I1260 PolarHBondContact O-N 2.76Å; I1260-I1262 VanDerWaalsContact C-N 3.33Å; I1260-I1262 PolarHBondContact O-N 2.96Å; I1260-L1263 PolarHBondContact O-N 2.88Å; I1260-I1264 HydrophobicContact CG2-CD1 3.81Å; I1260-I1264 HydrophobicContact CG2-CG1 4.41Å; I1260-I1264 WeakPolarHBondContact O-CG1 3.5Å; I1260-I1264 PolarHBondContact O-N 3.21Å
1261	A	86.2	Confident	83.1	Confident	55 Å²	55	51.3 Å²	51.3	46%	0.455	31%	0.31	S	S	.	.	H	α-helix	trans	-61.2	-41.7	176.2	0	0	0	0	0	111.8	T1257 V1258 I1264 A1265	T1257-A1261 WeakPolarHBondContact O-CB 3.01Å; T1257-A1261 PolarHBondContact O-N 2.91Å; V1258-A1261 WeakPolarHBondContact O-CB 3.45Å; V1258-A1261 PolarHBondContact O-N 2.89Å; A1261-I1264 PolarHBondContact O-N 3.48Å; A1261-A1265 WeakPolarHBondContact O-CB 3.34Å; A1261-A1265 PolarHBondContact O-N 3.19Å
1262	I	84.1	Confident	82.4	Confident	52 Å²	52	57.5 Å²	57.5	27%	0.267	34%	0.341	S	S	.	.	H	α-helix	trans	-61.7	-43.5	174.1	-67.1	164.3	0	0	0	110.7	I1126 V1258 N1259 I1260 I1264 A1265 L1266	I1126-I1262 HydrophobicContact CD1-CG2 3.62Å; V1258-I1262 HydrophobicContact CG1-CD1 3.9Å; V1258-I1262 VanDerWaalsContact O-CG1 3.28Å; V1258-I1262 WeakPolarHBondContact O-CG1 3.3Å; V1258-I1262 PolarHBondContact O-N 3.3Å; N1259-I1262 PolarHBondContact O-N 3.43Å; I1260-I1262 VanDerWaalsContact C-N 3.33Å; I1260-I1262 PolarHBondContact O-N 2.96Å; I1262-I1264 PolarHBondContact O-N 2.85Å; I1262-A1265 PolarHBondContact O-N 2.93Å; I1262-L1266 HydrophobicContact CG2-CD1 3.88Å; I1262-L1266 HydrophobicContact CG2-CG 4.26Å; I1262-L1266 WeakPolarHBondContact O-CB 3.35Å; I1262-L1266 VanDerWaalsContact O-CG 3.26Å; I1262-L1266 WeakPolarHBondContact O-CG 3.4Å; I1262-L1266 PolarHBondContact O-N 3.04Å
1263	L	82.4	Confident	81.7	Confident	11 Å²	11	63.6 Å²	63.6	6%	0.058	37%	0.374	C	S	.	.	H	α-helix	trans	-64.6	-39.4	179.3	-169.2	65	0	0	0	112.3	L1123 L1227 N1259 I1260 Q1267 Y1280	L1123-L1263 HydrophobicContact CD2-CD1 3.92Å; L1227-L1263 HydrophobicContact CD2-CD2 4.17Å; N1259-L1263 WeakPolarHBondContact O-CB 3.21Å; N1259-L1263 PolarHBondContact O-N 2.88Å; I1260-L1263 PolarHBondContact O-N 2.88Å; L1263-Q1267 WeakPolarHBondContact O-CG 3.22Å; L1263-Q1267 PolarHBondContact O-N 3.46Å; L1263-Y1280 HydrophobicContact CD2-CD1 4.17Å; L1263-Y1280 HydrophobicContact CD2-CD2 3.27Å; L1263-Y1280 HydrophobicContact CD2-CE1 4.37Å; L1263-Y1280 HydrophobicContact CD2-CE2 3.51Å; L1263-Y1280 HydrophobicContact CD2-CG 3.62Å; L1263-Y1280 HydrophobicContact CG-CD2 4.28Å; L1263-Y1280 HydrophobicContact CG-CG 4.16Å
1264	I	83.9	Confident	81.1	Confident	94 Å²	94	62.1 Å²	62.1	48%	0.482	37%	0.367	S	S	.	.	H	α-helix	trans	-65.1	-44.6	173.8	-67.1	167.3	0	0	0	110.4	I1260 A1261 I1262 L1266 Q1267 S1268 Y1280	I1260-I1264 HydrophobicContact CG2-CD1 3.81Å; I1260-I1264 HydrophobicContact CG2-CG1 4.41Å; I1260-I1264 WeakPolarHBondContact O-CG1 3.5Å; I1260-I1264 PolarHBondContact O-N 3.21Å; A1261-I1264 PolarHBondContact O-N 3.48Å; I1262-I1264 PolarHBondContact O-N 2.85Å; I1264-L1266 PolarHBondContact O-N 3.38Å; I1264-Q1267 PolarHBondContact O-N 2.84Å; I1264-S1268 PolarHBondContact O-N 3Å; I1264-S1268 VanDerWaalsContact O-N 3.14Å; I1264-Y1280 HydrophobicContact CG1-CE1 4.35Å
1265	A	84.6	Confident	80.5	Confident	50 Å²	50	64.4 Å²	64.4	41%	0.413	38%	0.375	S	S	.	.	H	α-helix	trans	-62.2	-43	178.2	0	0	0	0	0	111.7	A1261 I1262 Q1267 S1268 T1269	A1261-A1265 WeakPolarHBondContact O-CB 3.34Å; A1261-A1265 PolarHBondContact O-N 3.19Å; I1262-A1265 PolarHBondContact O-N 2.93Å; A1265-Q1267 PolarHBondContact O-N 3.49Å; A1265-S1268 WeakPolarHBondContact O-CB 3.37Å; A1265-S1268 PolarHBondContact O-N 2.86Å; A1265-S1268 VanDerWaalsContact O-N 3.08Å; A1265-S1268 PolarHBondContact O-OG 2.92Å; A1265-T1269 PolarHBondContact O-N 3.48Å
1266	L	80.2	Confident	79.9	Confident	37 Å²	37	65.8 Å²	65.8	19%	0.194	38%	0.382	C	S	.	.	H	α-helix	trans	-59.5	-33.3	175.7	-73.8	169	0	0	0	112.4	V1122 I1126 I1262 I1264 T1269 T1270	V1122-L1266 HydrophobicContact CG1-CD1 3.79Å; V1122-L1266 HydrophobicContact CG1-CD2 3.77Å; V1122-L1266 HydrophobicContact CG1-CG 4.46Å; I1126-L1266 HydrophobicContact CD1-CD1 3.7Å; I1262-L1266 HydrophobicContact CG2-CD1 3.88Å; I1262-L1266 HydrophobicContact CG2-CG 4.26Å; I1262-L1266 WeakPolarHBondContact O-CB 3.35Å; I1262-L1266 VanDerWaalsContact O-CG 3.26Å; I1262-L1266 WeakPolarHBondContact O-CG 3.4Å; I1262-L1266 PolarHBondContact O-N 3.04Å; I1264-L1266 PolarHBondContact O-N 3.38Å; L1266-T1269 PolarHBondContact O-N 3.38Å; L1266-T1269 PolarHBondContact O-OG1 2.96Å; L1266-T1270 PolarHBondContact O-N 3.4Å
1267	Q	80	Confident	79.5	Confident	19 Å²	19	65.3 Å²	65.3	9%	0.089	38%	0.378	C	S	.	.	H	α-helix	trans	-80.2	-21.1	177.8	-71.8	-179.2	8.1	0	0	114.1	L1263 I1264 A1265 T1269 T1270 Y1280	L1263-Q1267 WeakPolarHBondContact O-CG 3.22Å; L1263-Q1267 PolarHBondContact O-N 3.46Å; I1264-Q1267 PolarHBondContact O-N 2.84Å; A1265-Q1267 PolarHBondContact O-N 3.49Å; Q1267-T1269 VanDerWaalsContact C-N 3.29Å; Q1267-T1270 PolarHBondContact O-OG1 3Å; Q1267-Y1280 VanDerWaalsContact CD-CB 3.44Å; Q1267-Y1280 VanDerWaalsContact OE1-CB 3.29Å
1268	S	79.1	Confident	79.1	Confident	94 Å²	94	67.3 Å²	67.3	66%	0.657	38%	0.377	S	S	*	.	H	α-helix	trans	-72.2	-26.9	172.1	75.4	0	0	0	0	112.1	I1264 A1265	I1264-S1268 PolarHBondContact O-N 3Å; I1264-S1268 VanDerWaalsContact O-N 3.14Å; A1265-S1268 WeakPolarHBondContact O-CB 3.37Å; A1265-S1268 PolarHBondContact O-N 2.86Å; A1265-S1268 VanDerWaalsContact O-N 3.08Å; A1265-S1268 PolarHBondContact O-OG 2.92Å
1269	T	77.8	Confident	78.8	Confident	106 Å²	106	63.9 Å²	63.9	65%	0.65	36%	0.357	S	S	*	.	H	α-helix	trans	-88	-19.4	-179.9	59.4	0	0	0	0	113.3	A1265 L1266 Q1267 T1271	A1265-T1269 PolarHBondContact O-N 3.48Å; L1266-T1269 PolarHBondContact O-N 3.38Å; L1266-T1269 PolarHBondContact O-OG1 2.96Å; Q1267-T1269 VanDerWaalsContact C-N 3.29Å; T1269-T1271 PolarHBondContact O-N 3.22Å
1270	T	75.5	Confident	78.6	Confident	16 Å²	16	65 Å²	65	10%	0.098	36%	0.361	C	S	.	.	S	Bend	trans	-68.7	128	175.2	52.4	0	0	0	0	111.4	L1266 Q1267 N1276 F1277	L1266-T1270 PolarHBondContact O-N 3.4Å; Q1267-T1270 PolarHBondContact O-OG1 3Å; T1270-N1276 HydrophobicContact CG2-CB 4.44Å; T1270-F1277 WeakPolarHBondContact O-CD2 3.25Å
1271	T	75.6	Confident	78.4	Confident	98 Å²	98	65.2 Å²	65.2	60%	0.601	36%	0.364	S	S	*	.			trans	-73.9	158	175.7	55.8	0	0	0	0	111.4	T1269 N1273 N1274	T1269-T1271 PolarHBondContact O-N 3.22Å; T1271-N1273 PolarHBondContact O-N 3.27Å; T1271-N1273 VanDerWaalsContact O-N 3.11Å; T1271-N1274 WeakPolarHBondContact O-CB 3.36Å; T1271-N1274 PolarHBondContact O-N 3.22Å
1272	L	71	Confident	78.1	Confident	133 Å²	133	64.6 Å²	64.6	70%	0.696	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-28.2	-179.1	-160.2	82.1	0	0	0	113.2	N1274 F1277	L1272-N1274 VanDerWaalsContact C-N 3.32Å; L1272-F1277 HydrophobicContact CD1-CD1 4.05Å; L1272-F1277 HydrophobicContact CD1-CE1 3.56Å; L1272-F1277 HydrophobicContact CD1-CE2 4.24Å; L1272-F1277 HydrophobicContact CD1-CZ 3.66Å
1273	N	69	Low	78.1	Confident	156 Å²	156	62.1 Å²	62.1	83%	0.834	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-13.3	-179.1	-65.8	-0.7	0	0	0	113.2	T1271	T1271-N1273 PolarHBondContact O-N 3.27Å; T1271-N1273 VanDerWaalsContact O-N 3.11Å
1274	N	74.3	Confident	78.1	Confident	62 Å²	62	63.3 Å²	63.3	33%	0.332	35%	0.347	S	S	.	.	S	Bend	trans	-81	134	-180	-165.3	-19.1	0	0	0	109.5	T1271 L1272 N1276 F1277	T1271-N1274 WeakPolarHBondContact O-CB 3.36Å; T1271-N1274 PolarHBondContact O-N 3.22Å; L1272-N1274 VanDerWaalsContact C-N 3.32Å; N1274-N1276 PolarHBondContact O-N 3.06Å; N1274-N1276 VanDerWaalsContact O-N 3.11Å; N1274-N1276 PolarHBondContact OD1-N 3.14Å; N1274-F1277 WeakPolarHBondContact O-CB 3.31Å; N1274-F1277 PolarHBondContact O-N 3.22Å
1275	I	72.5	Confident	78.1	Confident	113 Å²	113	65 Å²	65	58%	0.579	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-27	179	-153.5	162.3	0	0	0	112.1	D1217 F1277	D1217-I1275 WeakPolarHBondContact OD2-CG1 3.43Å; I1275-F1277 PolarHBondContact O-N 3.44Å
1276	N	73	Confident	78	Confident	33 Å²	33	62.7 Å²	62.7	18%	0.176	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	3.3	177.4	-63.5	-17.1	0	0	0	114	E1120 S1219 T1270 N1274 R1278 S1279	E1120-N1276 VanDerWaalsContact CD-ND2 3.32Å; E1120-N1276 PolarHBondContact OE1-ND2 3.27Å; S1219-N1276 VanDerWaalsContact CB-OD1 3.32Å; S1219-N1276 WeakPolarHBondContact CB-OD1 3.12Å; T1270-N1276 HydrophobicContact CG2-CB 4.44Å; N1274-N1276 PolarHBondContact O-N 3.06Å; N1274-N1276 VanDerWaalsContact O-N 3.11Å; N1274-N1276 PolarHBondContact OD1-N 3.14Å; N1276-R1278 PolarHBondContact O-N 2.95Å; N1276-S1279 WeakPolarHBondContact CA-OG 3.34Å; N1276-S1279 PolarHBondContact O-N 3.17Å; N1276-S1279 PolarHBondContact O-OG 3.19Å
1277	F	78.1	Confident	78.2	Confident	46 Å²	46	63.5 Å²	63.5	20%	0.202	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	114.4	-175.6	-178.2	-104.1	0	0	0	111	T1270 L1272 N1274 I1275 S1279	T1270-F1277 WeakPolarHBondContact O-CD2 3.25Å; L1272-F1277 HydrophobicContact CD1-CD1 4.05Å; L1272-F1277 HydrophobicContact CD1-CE1 3.56Å; L1272-F1277 HydrophobicContact CD1-CE2 4.24Å; L1272-F1277 HydrophobicContact CD1-CZ 3.66Å; N1274-F1277 WeakPolarHBondContact O-CB 3.31Å; N1274-F1277 PolarHBondContact O-N 3.22Å; I1275-F1277 PolarHBondContact O-N 3.44Å; F1277-S1279 PolarHBondContact O-N 3.19Å
1278	R	78.6	Confident	78.4	Confident	114 Å²	114	64 Å²	64	43%	0.43	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	23.8	174.3	-74	-171	179.2	-176.6	-2	115.2	N1276 Y1280 T1281 K1282	N1276-R1278 PolarHBondContact O-N 2.95Å; R1278-Y1280 VanDerWaalsContact C-N 3.32Å; R1278-Y1280 PolarHBondContact O-N 3.4Å; R1278-T1281 WeakPolarHBondContact CB-OG1 3.41Å; R1278-T1281 PolarHBondContact O-N 3.42Å; R1278-T1281 PolarHBondContact O-OG1 3.16Å; R1278-K1282 PolarHBondContact O-N 3.44Å
1279	S	79.2	Confident	78.9	Confident	7 Å²	7	59.8 Å²	59.8	5%	0.049	31%	0.31	C	S	.	.	H	α-helix	trans	-55	-38.9	-175.1	-57.7	0	0	0	0	114.5	L1220 N1276 F1277 K1282 L1283	L1220-S1279 WeakPolarHBondContact CD2-O 3.33Å; N1276-S1279 WeakPolarHBondContact CA-OG 3.34Å; N1276-S1279 PolarHBondContact O-N 3.17Å; N1276-S1279 PolarHBondContact O-OG 3.19Å; F1277-S1279 PolarHBondContact O-N 3.19Å; S1279-K1282 PolarHBondContact O-N 3.33Å; S1279-L1283 WeakPolarHBondContact O-CB 3.37Å; S1279-L1283 PolarHBondContact O-N 2.74Å
1280	Y	80.9	Confident	79.4	Confident	31 Å²	31	61.3 Å²	61.3	12%	0.122	30%	0.304	C	S	.	.	H	α-helix	trans	-69.7	-41.1	176.9	175.4	-108.2	0	0	0	111.5	L1227 L1263 I1264 Q1267 R1278 K1282 L1283 C1284	L1227-Y1280 HydrophobicContact CD1-CD2 3.82Å; L1227-Y1280 HydrophobicContact CD1-CE2 3.72Å; L1227-Y1280 HydrophobicContact CD2-CE2 4.33Å; L1263-Y1280 HydrophobicContact CD2-CD1 4.17Å; L1263-Y1280 HydrophobicContact CD2-CD2 3.27Å; L1263-Y1280 HydrophobicContact CD2-CE1 4.37Å; L1263-Y1280 HydrophobicContact CD2-CE2 3.51Å; L1263-Y1280 HydrophobicContact CD2-CG 3.62Å; L1263-Y1280 HydrophobicContact CG-CD2 4.28Å; L1263-Y1280 HydrophobicContact CG-CG 4.16Å; I1264-Y1280 HydrophobicContact CG1-CE1 4.35Å; Q1267-Y1280 VanDerWaalsContact CD-CB 3.44Å; Q1267-Y1280 VanDerWaalsContact OE1-CB 3.29Å; R1278-Y1280 VanDerWaalsContact C-N 3.32Å; R1278-Y1280 PolarHBondContact O-N 3.4Å; Y1280-K1282 PolarHBondContact O-N 3.43Å; Y1280-L1283 PolarHBondContact O-N 2.99Å; Y1280-L1283 VanDerWaalsContact O-N 3.16Å; Y1280-C1284 WeakPolarHBondContact O-CB 3.5Å; Y1280-C1284 PolarHBondContact O-N 3.43Å; Y1280-C1284 PolarHBondContact O-SG 3.26Å; Y1280-C1284 VanDerWaalsContact O-SG 3.36Å
1281	T	81.5	Confident	80.1	Confident	43 Å²	43	68 Å²	68	26%	0.264	33%	0.332	S	S	.	.	H	α-helix	trans	-65.3	-29.4	176.9	71.9	0	0	0	0	112.8	R1278 R1285	R1278-T1281 WeakPolarHBondContact CB-OG1 3.41Å; R1278-T1281 PolarHBondContact O-N 3.42Å; R1278-T1281 PolarHBondContact O-OG1 3.16Å; T1281-R1285 WeakPolarHBondContact O-CG 3.39Å; T1281-R1285 PolarHBondContact O-NH1 3.42Å
1282	K	79.6	Confident	80.8	Confident	42 Å²	42	63.4 Å²	63.4	18%	0.183	30%	0.304	C	S	.	.	H	α-helix	trans	-71	-44.5	171.5	-67.6	-179.8	179.2	-175.5	0	110.6	L1220 R1278 S1279 Y1280 R1285 C1286	L1220-K1282 HydrophobicContact CD2-CB 3.96Å; L1220-K1282 HydrophobicContact CD2-CD 4.47Å; R1278-K1282 PolarHBondContact O-N 3.44Å; S1279-K1282 PolarHBondContact O-N 3.33Å; Y1280-K1282 PolarHBondContact O-N 3.43Å; K1282-R1285 PolarHBondContact O-N 3.06Å; K1282-C1286 PolarHBondContact O-N 3.2Å
1283	L	83	Confident	81.7	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63	-44	178.6	-171.4	69.4	0	0	0	112.7	F1194 A1224 L1227 S1279 Y1280 R1285 C1286 F1289	F1194-L1283 HydrophobicContact CE1-CD1 4.16Å; F1194-L1283 HydrophobicContact CZ-CD1 3.91Å; A1224-L1283 HydrophobicContact CB-CD1 3.73Å; A1224-L1283 HydrophobicContact CB-CD2 3.89Å; A1224-L1283 HydrophobicContact CB-CG 4.47Å; L1227-L1283 HydrophobicContact CD1-CD2 3.62Å; S1279-L1283 WeakPolarHBondContact O-CB 3.37Å; S1279-L1283 PolarHBondContact O-N 2.74Å; Y1280-L1283 PolarHBondContact O-N 2.99Å; Y1280-L1283 VanDerWaalsContact O-N 3.16Å; L1283-R1285 PolarHBondContact O-N 2.87Å; L1283-C1286 VanDerWaalsContact O-CB 3.26Å; L1283-C1286 WeakPolarHBondContact O-CB 3.35Å; L1283-C1286 PolarHBondContact O-N 2.92Å; L1283-F1289 HydrophobicContact CD1-CB 3.96Å; L1283-F1289 HydrophobicContact CD1-CD2 3.7Å; L1283-F1289 HydrophobicContact CD1-CE2 4.4Å; L1283-F1289 HydrophobicContact CD1-CG 3.89Å; L1283-F1289 HydrophobicContact CD2-CD2 3.84Å; L1283-F1289 HydrophobicContact CD2-CE2 3.68Å; L1283-F1289 HydrophobicContact CD2-CG 4.38Å; L1283-F1289 HydrophobicContact CD2-CZ 4.1Å; L1283-F1289 HydrophobicContact CG-CB 4.27Å; L1283-F1289 HydrophobicContact CG-CD1 4.18Å; L1283-F1289 HydrophobicContact CG-CD2 3.68Å; L1283-F1289 HydrophobicContact CG-CE1 4.48Å; L1283-F1289 HydrophobicContact CG-CE2 4.01Å; L1283-F1289 HydrophobicContact CG-CG 3.77Å; L1283-F1289 HydrophobicContact CG-CZ 4.4Å
1284	C	83.3	Confident	82.9	Confident	36 Å²	36	54.1 Å²	54.1	24%	0.243	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-20	177	-71.3	0	0	0	0	113.6	Y1280 W1290	Y1280-C1284 WeakPolarHBondContact O-CB 3.5Å; Y1280-C1284 PolarHBondContact O-N 3.43Å; Y1280-C1284 PolarHBondContact O-SG 3.26Å; Y1280-C1284 VanDerWaalsContact O-SG 3.36Å; C1284-W1290 PolarHBondContact O-NE1 3.34Å
1285	R	83.6	Confident	83.7	Confident	130 Å²	130	55 Å²	55	49%	0.491	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-8	173.9	-74.2	-175	171.5	91	-1.3	113.1	T1281 K1282 L1283 P1287	T1281-R1285 WeakPolarHBondContact O-CG 3.39Å; T1281-R1285 PolarHBondContact O-NH1 3.42Å; K1282-R1285 PolarHBondContact O-N 3.06Å; L1283-R1285 PolarHBondContact O-N 2.87Å; R1285-P1287 WeakPolarHBondContact O-CD 3.46Å
1286	C	82	Confident	84.8	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.235	C	C	.	.			trans	-82.9	117.6	-178.9	-175.7	0	0	0	0	110.4	T1204 F1205 K1282 L1283 T1288 F1289 W1290	T1204-C1286 PolarHBondContact O-SG 2.98Å; F1205-C1286 HydrophobicContact CD1-CB 4.16Å; F1205-C1286 HydrophobicContact CE1-CB 4.24Å; K1282-C1286 PolarHBondContact O-N 3.2Å; L1283-C1286 VanDerWaalsContact O-CB 3.26Å; L1283-C1286 WeakPolarHBondContact O-CB 3.35Å; L1283-C1286 PolarHBondContact O-N 2.92Å; C1286-T1288 VanDerWaalsContact C-N 3.28Å; C1286-T1288 PolarHBondContact O-N 3.36Å; C1286-F1289 HydrophobicContact CB-CB 4.13Å; C1286-F1289 PolarHBondContact O-N 3.44Å; C1286-W1290 VanDerWaalsContact O-CD1 3.31Å
1287	P	84.4	Confident	85.8	Confident	54 Å²	54	49 Å²	49	35%	0.351	23%	0.231	S	C	.	.	H	α-helix	trans	-61.7	-37.4	176.1	-22.6	34.6	0	0	0	112.3	Y1206 R1285 F1289 W1290 F1291	Y1206-P1287 HydrophobicContact CE2-CG 4.22Å; R1285-P1287 WeakPolarHBondContact O-CD 3.46Å; P1287-F1289 VanDerWaalsContact C-N 3.26Å; P1287-F1289 PolarHBondContact O-N 3.37Å; P1287-W1290 PolarHBondContact O-N 3.07Å; P1287-W1290 VanDerWaalsContact O-N 3.1Å; P1287-F1291 VanDerWaalsContact O-CD2 3.3Å; P1287-F1291 WeakPolarHBondContact O-CD2 3.39Å; P1287-F1291 PolarHBondContact O-N 3.17Å
1288	T	85.6	Confident	86.5	Confident	31 Å²	31	51 Å²	51	19%	0.19	25%	0.247	C	C	.	.	H	α-helix	trans	-58.3	-38	179.1	-49.9	0	0	0	0	112	F1193 C1286 F1291 A1292	F1193-T1288 HydrophobicContact CB-CG2 4.12Å; F1193-T1288 HydrophobicContact CD1-CG2 4.39Å; F1193-T1288 WeakPolarHBondContact O-CG2 3.4Å; C1286-T1288 VanDerWaalsContact C-N 3.28Å; C1286-T1288 PolarHBondContact O-N 3.36Å; T1288-F1291 PolarHBondContact O-N 3.38Å; T1288-A1292 WeakPolarHBondContact O-CB 3.28Å; T1288-A1292 PolarHBondContact O-N 2.68Å
1289	F	87.7	Confident	87.3	Confident	4 Å²	4	49.3 Å²	49.3	2%	0.018	25%	0.246	C	C	.	.	H	α-helix	trans	-61.2	-46.3	175.6	170.7	-104.6	0	0	0	111.9	F1194 A1224 L1227 F1228 L1283 C1286 P1287 F1291 A1292 L1293	F1194-F1289 HydrophobicContact CE1-CB 4.28Å; F1194-F1289 HydrophobicContact CZ-CB 4Å; F1194-F1289 HydrophobicContact CZ-CD2 4.09Å; A1224-F1289 HydrophobicContact CB-CD2 4.44Å; L1227-F1289 HydrophobicContact CB-CE2 4.4Å; L1227-F1289 HydrophobicContact CB-CZ 4.38Å; L1227-F1289 HydrophobicContact CD1-CE2 4.06Å; L1227-F1289 HydrophobicContact CD1-CZ 3.67Å; F1228-F1289 HydrophobicContact CD1-CE2 4.15Å; F1228-F1289 AromaticContact CE1-CD2 3.68Å; F1228-F1289 HydrophobicContact CE1-CD2 3.68Å; F1228-F1289 AromaticContact CE1-CE2 3.43Å; F1228-F1289 HydrophobicContact CE1-CE2 3.43Å; F1228-F1289 VanDerWaalsContact CE1-CE2 3.43Å; F1228-F1289 HydrophobicContact CE1-CZ 4.36Å; F1228-F1289 AromaticContact CZ-CD2 3.73Å; F1228-F1289 HydrophobicContact CZ-CD2 3.73Å; F1228-F1289 AromaticContact CZ-CE2 3.91Å; F1228-F1289 HydrophobicContact CZ-CE2 3.91Å; L1283-F1289 HydrophobicContact CD1-CB 3.96Å; L1283-F1289 HydrophobicContact CD1-CD2 3.7Å; L1283-F1289 HydrophobicContact CD1-CE2 4.4Å; L1283-F1289 HydrophobicContact CD1-CG 3.89Å; L1283-F1289 HydrophobicContact CD2-CD2 3.84Å; L1283-F1289 HydrophobicContact CD2-CE2 3.68Å; L1283-F1289 HydrophobicContact CD2-CG 4.38Å; L1283-F1289 HydrophobicContact CD2-CZ 4.1Å; L1283-F1289 HydrophobicContact CG-CB 4.27Å; L1283-F1289 HydrophobicContact CG-CD1 4.18Å; L1283-F1289 HydrophobicContact CG-CD2 3.68Å; L1283-F1289 HydrophobicContact CG-CE1 4.48Å; L1283-F1289 HydrophobicContact CG-CE2 4.01Å; L1283-F1289 HydrophobicContact CG-CG 3.77Å; L1283-F1289 HydrophobicContact CG-CZ 4.4Å; C1286-F1289 HydrophobicContact CB-CB 4.13Å; C1286-F1289 PolarHBondContact O-N 3.44Å; P1287-F1289 VanDerWaalsContact C-N 3.26Å; P1287-F1289 PolarHBondContact O-N 3.37Å; F1289-F1291 PolarHBondContact O-N 3.47Å; F1289-A1292 PolarHBondContact O-N 3.38Å; F1289-L1293 HydrophobicContact CE1-CD1 4.24Å; F1289-L1293 HydrophobicContact CE2-CD1 4.45Å; F1289-L1293 HydrophobicContact CZ-CD1 3.88Å; F1289-L1293 WeakPolarHBondContact O-CB 3.14Å; F1289-L1293 PolarHBondContact O-N 3.21Å
1290	W	89	Confident	88	Confident	139 Å²	139	49 Å²	49	53%	0.527	24%	0.244	S	C	.	.	H	α-helix	trans	-69.6	-30.3	-179.4	-68	109.7	0	0	0	113.6	C1284 C1286 P1287 P1294	C1284-W1290 PolarHBondContact O-NE1 3.34Å; C1286-W1290 VanDerWaalsContact O-CD1 3.31Å; P1287-W1290 PolarHBondContact O-N 3.07Å; P1287-W1290 VanDerWaalsContact O-N 3.1Å; W1290-P1294 WeakPolarHBondContact O-CD 3.38Å
1291	F	89.5	Confident	88.6	Confident	157 Å²	157	47.8 Å²	47.8	69%	0.689	24%	0.239	S	C	*	.	H	α-helix	trans	-75.6	-40.5	172	-80	-68.9	0	0	0	112.7	P1287 T1288 F1289 P1294	P1287-F1291 VanDerWaalsContact O-CD2 3.3Å; P1287-F1291 WeakPolarHBondContact O-CD2 3.39Å; P1287-F1291 PolarHBondContact O-N 3.17Å; T1288-F1291 PolarHBondContact O-N 3.38Å; F1289-F1291 PolarHBondContact O-N 3.47Å; F1291-P1294 WeakPolarHBondContact O-CD 3.43Å
1292	A	90.1	Very high	89.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.4	-38.1	179.6	0	0	0	0	0	112	F1193 F1228 T1288 F1289 L1295 I1296	F1193-A1292 HydrophobicContact CB-CB 3.94Å; F1193-A1292 HydrophobicContact CD1-CB 4.01Å; F1193-A1292 HydrophobicContact CD2-CB 3.56Å; F1193-A1292 HydrophobicContact CE1-CB 4.44Å; F1193-A1292 HydrophobicContact CE2-CB 4.07Å; F1193-A1292 HydrophobicContact CG-CB 3.56Å; F1193-A1292 HydrophobicContact CZ-CB 4.48Å; F1228-A1292 HydrophobicContact CZ-CB 4.07Å; T1288-A1292 WeakPolarHBondContact O-CB 3.28Å; T1288-A1292 PolarHBondContact O-N 2.68Å; F1289-A1292 PolarHBondContact O-N 3.38Å; A1292-L1295 PolarHBondContact O-N 2.69Å; A1292-I1296 HydrophobicContact CB-CD1 4.01Å; A1292-I1296 WeakPolarHBondContact O-CB 3.4Å; A1292-I1296 VanDerWaalsContact O-CG1 3.25Å; A1292-I1296 WeakPolarHBondContact O-CG1 3.37Å; A1292-I1296 PolarHBondContact O-N 3.02Å
1293	L	91	Very high	89.8	Confident	29 Å²	29	50.8 Å²	50.8	15%	0.152	26%	0.258	C	S	.	.	H	α-helix	trans	-52.6	-60.2	-176.3	-174.5	146.4	0	0	0	113.8	F1228 F1231 F1289 L1295 L1297	F1228-L1293 HydrophobicContact CD1-CB 4.48Å; F1228-L1293 HydrophobicContact CD1-CG 4.48Å; F1228-L1293 HydrophobicContact CE1-CB 3.89Å; F1228-L1293 HydrophobicContact CE1-CD1 4.39Å; F1228-L1293 HydrophobicContact CE1-CG 4.32Å; F1231-L1293 HydrophobicContact CD2-CD1 3.75Å; F1231-L1293 HydrophobicContact CE2-CD1 3.9Å; F1289-L1293 HydrophobicContact CE1-CD1 4.24Å; F1289-L1293 HydrophobicContact CE2-CD1 4.45Å; F1289-L1293 HydrophobicContact CZ-CD1 3.88Å; F1289-L1293 WeakPolarHBondContact O-CB 3.14Å; F1289-L1293 PolarHBondContact O-N 3.21Å; L1293-L1295 VanDerWaalsContact C-N 3.32Å; L1293-L1295 PolarHBondContact O-N 2.98Å; L1293-L1297 HydrophobicContact CD2-CD1 3.55Å; L1293-L1297 HydrophobicContact CG-CD1 3.93Å; L1293-L1297 WeakPolarHBondContact O-CB 3.36Å; L1293-L1297 WeakPolarHBondContact O-CG 3.31Å; L1293-L1297 PolarHBondContact O-N 2.8Å
1294	P	93.1	Very high	90.1	Very high	66 Å²	66	51.1 Å²	51.1	43%	0.429	26%	0.26	S	S	.	.	H	α-helix	trans	-65.6	-34.2	-178.2	25.6	-34.5	0	0	0	112.6	W1290 F1291 T1298	W1290-P1294 WeakPolarHBondContact O-CD 3.38Å; F1291-P1294 WeakPolarHBondContact O-CD 3.43Å; P1294-T1298 WeakPolarHBondContact O-CB 3.18Å; P1294-T1298 WeakPolarHBondContact O-CG2 3.04Å; P1294-T1298 PolarHBondContact O-N 2.95Å; P1294-T1298 PolarHBondContact O-OG1 3.11Å
1295	L	92.8	Very high	90.4	Very high	79 Å²	79	52.3 Å²	52.3	41%	0.414	26%	0.264	S	S	.	.	H	α-helix	trans	-70.1	-46.4	-179.8	-171.6	147.2	0	0	0	111.6	F1193 A1292 L1293 L1297 T1298 I1299	F1193-L1295 HydrophobicContact CE2-CD2 3.83Å; F1193-L1295 HydrophobicContact CZ-CD1 4.25Å; F1193-L1295 HydrophobicContact CZ-CD2 3.84Å; F1193-L1295 HydrophobicContact CZ-CG 4.46Å; A1292-L1295 PolarHBondContact O-N 2.69Å; L1293-L1295 VanDerWaalsContact C-N 3.32Å; L1293-L1295 PolarHBondContact O-N 2.98Å; L1295-L1297 VanDerWaalsContact C-N 3.35Å; L1295-L1297 PolarHBondContact O-N 3.39Å; L1295-T1298 PolarHBondContact O-N 2.91Å; L1295-T1298 PolarHBondContact O-OG1 3.44Å; L1295-I1299 HydrophobicContact CD2-CD1 3.5Å; L1295-I1299 VanDerWaalsContact CD2-CD1 3.5Å; L1295-I1299 HydrophobicContact CD2-CG1 4.48Å; L1295-I1299 HydrophobicContact CG-CD1 4.19Å; L1295-I1299 VanDerWaalsContact O-CG1 3.31Å; L1295-I1299 WeakPolarHBondContact O-CG1 3.39Å; L1295-I1299 PolarHBondContact O-N 3.24Å; L1295-I1299 VanDerWaalsContact O-N 3.13Å
1296	I	93.9	Very high	90.7	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-63.3	-44.4	177.1	-67.8	171.3	0	0	0	109.9	I1185 I1186 F1193 F1228 A1292 T1298 I1299 A1300	I1185-I1296 HydrophobicContact CG2-CG2 4.2Å; I1186-I1296 HydrophobicContact CG1-CG2 3.98Å; F1193-I1296 HydrophobicContact CD2-CD1 4.05Å; F1193-I1296 HydrophobicContact CD2-CG1 4.31Å; F1193-I1296 HydrophobicContact CE2-CD1 4.41Å; F1193-I1296 HydrophobicContact CE2-CG1 4.18Å; F1228-I1296 HydrophobicContact CD2-CD1 3.87Å; F1228-I1296 HydrophobicContact CE2-CD1 3.59Å; F1228-I1296 HydrophobicContact CZ-CD1 4.05Å; A1292-I1296 HydrophobicContact CB-CD1 4.01Å; A1292-I1296 WeakPolarHBondContact O-CB 3.4Å; A1292-I1296 VanDerWaalsContact O-CG1 3.25Å; A1292-I1296 WeakPolarHBondContact O-CG1 3.37Å; A1292-I1296 PolarHBondContact O-N 3.02Å; I1296-T1298 PolarHBondContact O-N 3.5Å; I1296-I1299 PolarHBondContact O-N 3.46Å; I1296-A1300 WeakPolarHBondContact O-CB 3.35Å; I1296-A1300 PolarHBondContact O-N 2.74Å
1297	L	94.1	Very high	91.1	Very high	18 Å²	18	57.4 Å²	57.4	9%	0.094	29%	0.29	C	S	.	.	H	α-helix	trans	-63.6	-40	-179.5	-69.8	175.3	0	0	0	112.9	F1231 L1235 L1293 L1295 N1301	F1231-L1297 HydrophobicContact CB-CD1 3.98Å; F1231-L1297 HydrophobicContact CB-CD2 3.89Å; L1235-L1297 HydrophobicContact CD2-CB 4.31Å; L1293-L1297 HydrophobicContact CD2-CD1 3.55Å; L1293-L1297 HydrophobicContact CG-CD1 3.93Å; L1293-L1297 WeakPolarHBondContact O-CB 3.36Å; L1293-L1297 WeakPolarHBondContact O-CG 3.31Å; L1293-L1297 PolarHBondContact O-N 2.8Å; L1295-L1297 VanDerWaalsContact C-N 3.35Å; L1295-L1297 PolarHBondContact O-N 3.39Å; L1297-N1301 WeakPolarHBondContact O-CB 3.24Å; L1297-N1301 PolarHBondContact O-N 3.22Å; L1297-N1301 VanDerWaalsContact O-N 3.08Å; L1297-N1301 PolarHBondContact O-ND2 3.34Å
1298	T	93.4	Very high	91.2	Very high	88 Å²	88	57.8 Å²	57.8	54%	0.54	28%	0.284	S	S	.	.	H	α-helix	trans	-68	-47	178.6	48.7	0	0	0	0	111.4	P1294 L1295 I1296 A1300 N1301 L1302	P1294-T1298 WeakPolarHBondContact O-CB 3.18Å; P1294-T1298 WeakPolarHBondContact O-CG2 3.04Å; P1294-T1298 PolarHBondContact O-N 2.95Å; P1294-T1298 PolarHBondContact O-OG1 3.11Å; L1295-T1298 PolarHBondContact O-N 2.91Å; L1295-T1298 PolarHBondContact O-OG1 3.44Å; I1296-T1298 PolarHBondContact O-N 3.5Å; T1298-A1300 PolarHBondContact O-N 3.07Å; T1298-N1301 PolarHBondContact O-N 3.04Å; T1298-L1302 WeakPolarHBondContact O-CB 3.49Å; T1298-L1302 PolarHBondContact O-N 2.91Å
1299	I	95	Very high	91.3	Very high	80 Å²	80	59.9 Å²	59.9	41%	0.41	29%	0.293	S	S	.	.	H	α-helix	trans	-63.6	-42.6	178.5	-61.2	173.7	0	0	0	110.8	I1185 L1295 I1296 N1301	I1185-I1299 HydrophobicContact CD1-CG2 3.85Å; I1185-I1299 HydrophobicContact CG1-CG2 4.39Å; I1185-I1299 HydrophobicContact CG2-CB 4.37Å; I1185-I1299 HydrophobicContact CG2-CG2 4.22Å; L1295-I1299 HydrophobicContact CD2-CD1 3.5Å; L1295-I1299 VanDerWaalsContact CD2-CD1 3.5Å; L1295-I1299 HydrophobicContact CD2-CG1 4.48Å; L1295-I1299 HydrophobicContact CG-CD1 4.19Å; L1295-I1299 VanDerWaalsContact O-CG1 3.31Å; L1295-I1299 WeakPolarHBondContact O-CG1 3.39Å; L1295-I1299 PolarHBondContact O-N 3.24Å; L1295-I1299 VanDerWaalsContact O-N 3.13Å; I1296-I1299 PolarHBondContact O-N 3.46Å; I1299-N1301 PolarHBondContact O-N 3.28Å
1300	A	94.8	Very high	91.2	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.2	-48	178.1	0	0	0	0	0	111.7	W1181 H1182 I1185 I1296 T1298	W1181-A1300 PolarHBondContact NE1-O 3.07Å; H1182-A1300 PolarHBondContact CE1-O 3.02Å; H1182-A1300 PolarHBondContact NE2-O 3.34Å; H1182-A1300 VanDerWaalsContact NE2-O 3.13Å; I1185-A1300 HydrophobicContact CB-CB 4.45Å; I1185-A1300 HydrophobicContact CD1-CB 4.45Å; I1185-A1300 HydrophobicContact CG2-CB 4.08Å; I1296-A1300 WeakPolarHBondContact O-CB 3.35Å; I1296-A1300 PolarHBondContact O-N 2.74Å; T1298-A1300 PolarHBondContact O-N 3.07Å
1301	N	93.7	Very high	91	Very high	5 Å²	5	58.4 Å²	58.4	3%	0.027	30%	0.298	C	S	.	.	H	α-helix	trans	-84.5	-8.9	-175.5	-72	-83.8	0	0	0	114.8	H1182 L1235 R1236 I1239 L1297 T1298 I1299 S1304 L1305	H1182-N1301 PolarHBondContact CE1-OD1 3.46Å; L1235-N1301 HydrophobicContact CD2-CB 4.49Å; R1236-N1301 WeakPolarHBondContact CA-OD1 3.47Å; R1236-N1301 WeakPolarHBondContact CB-OD1 3.46Å; R1236-N1301 PolarHBondContact N-OD1 2.82Å; I1239-N1301 HydrophobicContact CD1-CB 3.72Å; L1297-N1301 WeakPolarHBondContact O-CB 3.24Å; L1297-N1301 PolarHBondContact O-N 3.22Å; L1297-N1301 VanDerWaalsContact O-N 3.08Å; L1297-N1301 PolarHBondContact O-ND2 3.34Å; T1298-N1301 PolarHBondContact O-N 3.04Å; I1299-N1301 PolarHBondContact O-N 3.28Å; N1301-S1304 WeakPolarHBondContact O-CB 3.47Å; N1301-S1304 PolarHBondContact O-N 3.34Å; N1301-L1305 PolarHBondContact O-N 3.35Å
1302	L	92.9	Very high	90.6	Very high	99 Å²	99	52.9 Å²	52.9	52%	0.518	28%	0.275	S	S	.	.	H	α-helix	trans	-55.5	-49.6	-175.7	-172.7	91.2	0	0	0	113.1	T1298 S1304 L1305 L1306	T1298-L1302 WeakPolarHBondContact O-CB 3.49Å; T1298-L1302 PolarHBondContact O-N 2.91Å; L1302-S1304 VanDerWaalsContact C-N 3.28Å; L1302-S1304 PolarHBondContact O-N 3.36Å; L1302-L1305 PolarHBondContact O-N 2.99Å; L1302-L1306 HydrophobicContact CD2-CD1 4.46Å; L1302-L1306 HydrophobicContact CG-CD1 4.28Å; L1302-L1306 WeakPolarHBondContact O-CG 3.48Å; L1302-L1306 PolarHBondContact O-N 2.89Å
1303	P	92.5	Very high	90.1	Very high	50 Å²	50	53 Å²	53	33%	0.325	28%	0.276	S	S	.	.	H	α-helix	trans	-65.2	-35.9	-178.8	-22.8	37.4	0	0	0	112.3	W1181 L1306 W1307	W1181-P1303 HydrophobicContact CZ2-CG 3.88Å; P1303-L1306 PolarHBondContact O-N 3.47Å; P1303-W1307 WeakPolarHBondContact O-CB 3.28Å; P1303-W1307 PolarHBondContact O-N 3.23Å
1304	S	89.7	Confident	89.7	Confident	6 Å²	6	54.8 Å²	54.8	4%	0.042	28%	0.281	C	S	.	.	H	α-helix	trans	-66.5	-39.9	177.2	-79.4	0	0	0	0	112.4	D1178 R1236 N1301 L1302 R1308	D1178-S1304 PolarHBondContact OD1-OG 2.98Å; D1178-S1304 VanDerWaalsContact OD1-OG 3.1Å; D1178-S1304 PolarHBondContact OD2-OG 3.41Å; D1178-S1304 VanDerWaalsContact OD2-OG 3.07Å; R1236-S1304 WeakPolarHBondContact CD-OG 3.44Å; R1236-S1304 VanDerWaalsContact NE-CB 3.3Å; R1236-S1304 PolarHBondContact NE-OG 3.03Å; N1301-S1304 WeakPolarHBondContact O-CB 3.47Å; N1301-S1304 PolarHBondContact O-N 3.34Å; L1302-S1304 VanDerWaalsContact C-N 3.28Å; L1302-S1304 PolarHBondContact O-N 3.36Å; S1304-R1308 PolarHBondContact O-N 2.89Å
1305	L	89.7	Confident	88.7	Confident	61 Å²	61	53.8 Å²	53.8	32%	0.319	27%	0.269	S	S	.	.	H	α-helix	trans	-64.9	-45.8	174.4	-177.1	69	0	0	0	111.6	I1239 N1301 L1302 W1307 R1308 I1309	I1239-L1305 HydrophobicContact CG2-CD1 4.3Å; N1301-L1305 PolarHBondContact O-N 3.35Å; L1302-L1305 PolarHBondContact O-N 2.99Å; L1305-W1307 PolarHBondContact O-N 2.99Å; L1305-R1308 WeakPolarHBondContact O-CB 3.28Å; L1305-R1308 PolarHBondContact O-N 3.4Å; L1305-I1309 HydrophobicContact CG-CD1 4.27Å; L1305-I1309 WeakPolarHBondContact O-CG1 3.28Å; L1305-I1309 PolarHBondContact O-N 3.26Å; L1305-I1309 VanDerWaalsContact O-N 3.11Å
1306	L	90.9	Very high	87.9	Confident	93 Å²	93	52.6 Å²	52.6	49%	0.487	26%	0.263	S	S	.	.	H	α-helix	trans	-61.3	-44.6	176.6	-72.1	172	0	0	0	111.5	L1302 P1303 R1308 I1309 I1310	L1302-L1306 HydrophobicContact CD2-CD1 4.46Å; L1302-L1306 HydrophobicContact CG-CD1 4.28Å; L1302-L1306 WeakPolarHBondContact O-CG 3.48Å; L1302-L1306 PolarHBondContact O-N 2.89Å; P1303-L1306 PolarHBondContact O-N 3.47Å; L1306-R1308 VanDerWaalsContact C-N 3.32Å; L1306-R1308 PolarHBondContact O-N 2.99Å; L1306-I1309 PolarHBondContact O-N 3Å; L1306-I1310 VanDerWaalsContact O-CG1 3.3Å; L1306-I1310 WeakPolarHBondContact O-CG1 3.27Å; L1306-I1310 PolarHBondContact O-N 3.44Å; L1306-I1310 VanDerWaalsContact O-N 3.08Å
1307	W	89.3	Confident	87.1	Confident	145 Å²	145	52.5 Å²	52.5	55%	0.549	26%	0.262	S	S	.	.	H	α-helix	trans	-60.7	-41.5	176.8	-179.1	-96.9	0	0	0	112.1	P1303 L1305 I1310 S1311	P1303-W1307 WeakPolarHBondContact O-CB 3.28Å; P1303-W1307 PolarHBondContact O-N 3.23Å; L1305-W1307 PolarHBondContact O-N 2.99Å; W1307-I1310 PolarHBondContact O-N 3.14Å; W1307-S1311 VanDerWaalsContact O-CB 3.25Å; W1307-S1311 WeakPolarHBondContact O-CB 3.21Å; W1307-S1311 PolarHBondContact O-N 3.15Å
1308	R	86.8	Confident	86.3	Confident	62 Å²	62	53.6 Å²	53.6	23%	0.234	27%	0.267	C	S	.	.	H	α-helix	trans	-57.6	-53.4	175.2	-179.8	177.9	78.3	167.1	4.4	111.5	I1239 Y1244 S1304 L1305 L1306 I1310 S1311 D1312	I1239-R1308 WeakPolarHBondContact O-CD 3.32Å; I1239-R1308 PolarHBondContact O-NH1 3.01Å; Y1244-R1308 PolarHBondContact OH-NH1 3.49Å; Y1244-R1308 VanDerWaalsContact OH-NH1 3.09Å; S1304-R1308 PolarHBondContact O-N 2.89Å; L1305-R1308 WeakPolarHBondContact O-CB 3.28Å; L1305-R1308 PolarHBondContact O-N 3.4Å; L1306-R1308 VanDerWaalsContact C-N 3.32Å; L1306-R1308 PolarHBondContact O-N 2.99Å; R1308-I1310 VanDerWaalsContact C-N 3.28Å; R1308-I1310 PolarHBondContact O-N 2.95Å; R1308-S1311 WeakPolarHBondContact O-CB 3.37Å; R1308-S1311 PolarHBondContact O-N 3.04Å; R1308-D1312 WeakPolarHBondContact CG-OD2 3.18Å; R1308-D1312 VanDerWaalsContact O-CG 3.28Å; R1308-D1312 PolarHBondContact O-N 3.33Å
1309	I	86.9	Confident	85.2	Confident	74 Å²	74	50.8 Å²	50.8	38%	0.379	25%	0.248	S	C	.	.	H	α-helix	trans	-56.6	-44.6	-179.1	-65.3	165	0	0	0	110.8	L1305 L1306 A1313 L1344	L1305-I1309 HydrophobicContact CG-CD1 4.27Å; L1305-I1309 WeakPolarHBondContact O-CG1 3.28Å; L1305-I1309 PolarHBondContact O-N 3.26Å; L1305-I1309 VanDerWaalsContact O-N 3.11Å; L1306-I1309 PolarHBondContact O-N 3Å; I1309-A1313 WeakPolarHBondContact O-CB 3.2Å; I1309-A1313 PolarHBondContact O-N 3.47Å; I1309-A1313 VanDerWaalsContact O-N 3.08Å; I1309-L1344 HydrophobicContact CG2-CD2 3.93Å
1310	I	87.2	Confident	84.2	Confident	82 Å²	82	49.1 Å²	49.1	42%	0.421	24%	0.239	S	C	.	.	H	α-helix	trans	-66	-41.1	178.3	-66	165.8	0	0	0	111.5	L1306 W1307 R1308 W1314	L1306-I1310 VanDerWaalsContact O-CG1 3.3Å; L1306-I1310 WeakPolarHBondContact O-CG1 3.27Å; L1306-I1310 PolarHBondContact O-N 3.44Å; L1306-I1310 VanDerWaalsContact O-N 3.08Å; W1307-I1310 PolarHBondContact O-N 3.14Å; R1308-I1310 VanDerWaalsContact C-N 3.28Å; R1308-I1310 PolarHBondContact O-N 2.95Å; I1310-W1314 VanDerWaalsContact O-CB 3.22Å; I1310-W1314 WeakPolarHBondContact O-CB 3.41Å; I1310-W1314 PolarHBondContact O-N 3.24Å
1311	S	83.8	Confident	83.2	Confident	31 Å²	31	49.5 Å²	49.5	22%	0.217	24%	0.241	C	C	.	.	H	α-helix	trans	-62.9	-46.9	179	175	0	0	0	0	111.4	W1307 R1308 W1314 W1315	W1307-S1311 VanDerWaalsContact O-CB 3.25Å; W1307-S1311 WeakPolarHBondContact O-CB 3.21Å; W1307-S1311 PolarHBondContact O-N 3.15Å; R1308-S1311 WeakPolarHBondContact O-CB 3.37Å; R1308-S1311 PolarHBondContact O-N 3.04Å; S1311-W1314 WeakPolarHBondContact O-CB 3.29Å; S1311-W1314 PolarHBondContact O-N 2.92Å; S1311-W1315 PolarHBondContact O-N 3.46Å
1312	D	80.9	Confident	82	Confident	40 Å²	40	50.8 Å²	50.8	21%	0.214	25%	0.25	C	C	.	.	H	α-helix	trans	-66.6	-47.1	-177.7	-63.3	-13	0	0	0	110.9	H1242 R1308 W1314 W1315 N1316	H1242-D1312 IonicContact CD2-OD1 3.42Å; H1242-D1312 IonicContact NE2-OD1 2.67Å; H1242-D1312 PolarHBondContact NE2-OD1 2.8Å; R1308-D1312 WeakPolarHBondContact CG-OD2 3.18Å; R1308-D1312 VanDerWaalsContact O-CG 3.28Å; R1308-D1312 PolarHBondContact O-N 3.33Å; D1312-W1314 PolarHBondContact O-N 3.06Å; D1312-W1315 PolarHBondContact O-N 2.9Å; D1312-W1315 VanDerWaalsContact O-N 3.09Å; D1312-N1316 PolarHBondContact O-N 3.29Å
1313	A	79.6	Confident	80.8	Confident	2 Å²	2	49.9 Å²	49.9	2%	0.017	25%	0.252	C	S	.	.	H	α-helix	trans	-55.8	-41.3	172.7	0	0	0	0	0	111.6	I1309 L1317 A1343 L1344	I1309-A1313 WeakPolarHBondContact O-CB 3.2Å; I1309-A1313 PolarHBondContact O-N 3.47Å; I1309-A1313 VanDerWaalsContact O-N 3.08Å; A1313-L1317 VanDerWaalsContact O-CB 3.23Å; A1313-L1317 WeakPolarHBondContact O-CB 3.49Å; A1313-L1317 PolarHBondContact O-N 3.34Å; A1313-A1343 HydrophobicContact CB-CB 4.39Å; A1313-A1343 VanDerWaalsContact CB-O 3.26Å; A1313-A1343 WeakPolarHBondContact CB-O 3.46Å; A1313-L1344 HydrophobicContact CB-CD2 3.81Å; A1313-L1344 HydrophobicContact CB-CG 4.13Å
1314	W	82.3	Confident	79.6	Confident	68 Å²	68	48.8 Å²	48.8	26%	0.258	24%	0.243	S	C	.	.	H	α-helix	trans	-68.3	-38.6	177.7	179.3	81.5	0	0	0	112.7	R1160 I1310 S1311 D1312 Q1318 W1340	R1160-W1314 VanDerWaalsContact CZ-CZ3 3.45Å; I1310-W1314 VanDerWaalsContact O-CB 3.22Å; I1310-W1314 WeakPolarHBondContact O-CB 3.41Å; I1310-W1314 PolarHBondContact O-N 3.24Å; S1311-W1314 WeakPolarHBondContact O-CB 3.29Å; S1311-W1314 PolarHBondContact O-N 2.92Å; D1312-W1314 PolarHBondContact O-N 3.06Å; W1314-Q1318 HydrophobicContact CD2-CG 3.9Å; W1314-Q1318 VanDerWaalsContact CE2-CG 3.48Å; W1314-Q1318 HydrophobicContact CE3-CG 4.22Å; W1314-Q1318 HydrophobicContact CH2-CG 3.9Å; W1314-Q1318 HydrophobicContact CZ2-CG 3.5Å; W1314-Q1318 HydrophobicContact CZ3-CG 4.22Å; W1314-Q1318 WeakPolarHBondContact O-CG 3.39Å; W1314-Q1318 PolarHBondContact O-N 2.98Å; W1314-W1340 HydrophobicContact CB-CH2 3.9Å; W1314-W1340 HydrophobicContact CB-CZ3 4.22Å; W1314-W1340 AromaticContact CD1-CH2 3.53Å; W1314-W1340 AromaticContact CD1-CZ2 3.93Å; W1314-W1340 HydrophobicContact CG-CH2 4.1Å
1315	W	73.4	Confident	78.4	Confident	45 Å²	45	52.3 Å²	52.3	17%	0.17	27%	0.266	C	S	.	.	H	α-helix	trans	-65	-48.7	175.7	-85.4	108.5	0	0	0	112	L1146 L1157 R1160 S1311 D1312 L1317 Q1318 I1319	L1146-W1315 HydrophobicContact CD1-CZ3 4.4Å; L1157-W1315 HydrophobicContact CD2-CZ3 4.14Å; R1160-W1315 VanDerWaalsContact CZ-CZ2 3.49Å; S1311-W1315 PolarHBondContact O-N 3.46Å; D1312-W1315 PolarHBondContact O-N 2.9Å; D1312-W1315 VanDerWaalsContact O-N 3.09Å; W1315-L1317 VanDerWaalsContact C-N 3.27Å; W1315-L1317 PolarHBondContact O-N 3.05Å; W1315-Q1318 PolarHBondContact O-N 3.5Å; W1315-I1319 WeakPolarHBondContact O-CG1 3.12Å; W1315-I1319 PolarHBondContact O-N 2.93Å
1316	N	75.4	Confident	77.5	Confident	53 Å²	53	52.7 Å²	52.7	28%	0.283	27%	0.268	S	S	.	.	H	α-helix	trans	-56.3	-45.6	176.1	-72	-16.6	0	0	0	110.7	D1312 Q1318 I1319 H1320 N1347 L1349	D1312-N1316 PolarHBondContact O-N 3.29Å; N1316-Q1318 PolarHBondContact O-N 3.18Å; N1316-I1319 PolarHBondContact O-N 3.45Å; N1316-H1320 WeakPolarHBondContact O-CB 3.2Å; N1316-H1320 PolarHBondContact O-N 2.92Å; N1316-N1347 PolarHBondContact ND2-O 3.49Å; N1316-L1349 HydrophobicContact CB-CD1 4.41Å
1317	L	76.4	Confident	76.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-62.6	-42	175	-175.7	64.7	0	0	0	112.4	A1313 W1315 L1321 V1339 W1340	A1313-L1317 VanDerWaalsContact O-CB 3.23Å; A1313-L1317 WeakPolarHBondContact O-CB 3.49Å; A1313-L1317 PolarHBondContact O-N 3.34Å; W1315-L1317 VanDerWaalsContact C-N 3.27Å; W1315-L1317 PolarHBondContact O-N 3.05Å; L1317-L1321 HydrophobicContact CD1-CD1 4.06Å; L1317-L1321 HydrophobicContact CD1-CG 4.07Å; L1317-L1321 HydrophobicContact CD2-CD1 4.38Å; L1317-L1321 HydrophobicContact CG-CD1 3.77Å; L1317-L1321 HydrophobicContact CG-CG 4.21Å; L1317-L1321 WeakPolarHBondContact O-CB 3.18Å; L1317-L1321 WeakPolarHBondContact O-CG 3.41Å; L1317-L1321 PolarHBondContact O-N 3.41Å; L1317-V1339 HydrophobicContact CD1-CG1 3.5Å; L1317-W1340 HydrophobicContact CD2-CD2 4.01Å; L1317-W1340 HydrophobicContact CD2-CE3 4.49Å; L1317-W1340 HydrophobicContact CD2-CG 4.5Å; L1317-W1340 HydrophobicContact CD2-CH2 4.46Å; L1317-W1340 HydrophobicContact CD2-CZ2 3.89Å
1318	Q	77	Confident	75.5	Confident	42 Å²	42	54.1 Å²	54.1	20%	0.196	28%	0.277	C	S	.	.	H	α-helix	trans	-68.2	-40.2	178.8	-74	-48	-71.1	0	0	112.9	W1314 W1315 N1316 S1322	W1314-Q1318 HydrophobicContact CD2-CG 3.9Å; W1314-Q1318 VanDerWaalsContact CE2-CG 3.48Å; W1314-Q1318 HydrophobicContact CE3-CG 4.22Å; W1314-Q1318 HydrophobicContact CH2-CG 3.9Å; W1314-Q1318 HydrophobicContact CZ2-CG 3.5Å; W1314-Q1318 HydrophobicContact CZ3-CG 4.22Å; W1314-Q1318 WeakPolarHBondContact O-CG 3.39Å; W1314-Q1318 PolarHBondContact O-N 2.98Å; W1315-Q1318 PolarHBondContact O-N 3.5Å; N1316-Q1318 PolarHBondContact O-N 3.18Å; Q1318-S1322 WeakPolarHBondContact O-CB 3.49Å; Q1318-S1322 PolarHBondContact O-N 2.93Å
1319	I	72	Confident	74.8	Confident	29 Å²	29	54.3 Å²	54.3	15%	0.149	28%	0.282	C	S	.	.	H	α-helix	trans	-63.7	-47.6	177.6	-67.6	165.8	0	0	0	108.8	L1146 W1315 N1316 S1322	L1146-I1319 HydrophobicContact CD2-CD1 3.77Å; W1315-I1319 WeakPolarHBondContact O-CG1 3.12Å; W1315-I1319 PolarHBondContact O-N 2.93Å; N1316-I1319 PolarHBondContact O-N 3.45Å; I1319-S1322 VanDerWaalsContact O-CB 3.3Å; I1319-S1322 WeakPolarHBondContact O-CB 3.15Å; I1319-S1322 PolarHBondContact O-N 2.93Å; I1319-S1322 PolarHBondContact O-OG 3.26Å
1320	H	73.2	Confident	74.1	Confident	44 Å²	44	54.2 Å²	54.2	20%	0.204	28%	0.277	C	S	.	.	H	α-helix	trans	-67.3	-41.6	178.7	-168.6	54.9	0	0	0	112.6	N1316 S1322 S1323 L1349 Y1353	N1316-H1320 WeakPolarHBondContact O-CB 3.2Å; N1316-H1320 PolarHBondContact O-N 2.92Å; H1320-S1322 PolarHBondContact O-N 3.3Å; H1320-S1322 VanDerWaalsContact O-N 3.1Å; H1320-S1323 PolarHBondContact O-N 3.01Å; H1320-S1323 PolarHBondContact O-OG 2.97Å; H1320-L1349 HydrophobicContact CB-CD1 4.49Å; H1320-Y1353 AromaticContact CD2-CD2 3.85Å; H1320-Y1353 AromaticContact CD2-CE2 3.33Å; H1320-Y1353 WeakPolarHBondContact CD2-CE2 3.33Å; H1320-Y1353 AromaticContact CD2-CZ 3.53Å; H1320-Y1353 AromaticContact NE2-CD1 3.64Å; H1320-Y1353 AromaticContact NE2-CD2 3.24Å; H1320-Y1353 WeakPolarHBondContact NE2-CD2 3.35Å; H1320-Y1353 AromaticContact NE2-CE1 3.57Å; H1320-Y1353 AromaticContact NE2-CE2 3.16Å; H1320-Y1353 WeakPolarHBondContact NE2-CE2 3.49Å; H1320-Y1353 AromaticContact NE2-CG 3.47Å; H1320-Y1353 AromaticContact NE2-CZ 3.3Å; H1320-Y1353 VanDerWaalsContact NE2-CZ 3.3Å
1321	L	73.5	Confident	73.6	Confident	9 Å²	9	59 Å²	59	5%	0.047	29%	0.289	C	S	.	.	H	α-helix	trans	-63.8	-17	172	-72.8	173.7	0	0	0	112.9	L1317 I1324 R1330 Y1333 R1334	L1317-L1321 HydrophobicContact CD1-CD1 4.06Å; L1317-L1321 HydrophobicContact CD1-CG 4.07Å; L1317-L1321 HydrophobicContact CD2-CD1 4.38Å; L1317-L1321 HydrophobicContact CG-CD1 3.77Å; L1317-L1321 HydrophobicContact CG-CG 4.21Å; L1317-L1321 WeakPolarHBondContact O-CB 3.18Å; L1317-L1321 WeakPolarHBondContact O-CG 3.41Å; L1317-L1321 PolarHBondContact O-N 3.41Å; L1321-I1324 HydrophobicContact CD2-CD1 4.31Å; L1321-R1330 HydrophobicContact CD2-CB 4.49Å; L1321-R1330 HydrophobicContact CD2-CG 4.4Å; L1321-R1330 WeakPolarHBondContact O-CD 3.44Å; L1321-R1330 WeakPolarHBondContact O-CG 3.37Å; L1321-Y1333 HydrophobicContact CD2-CD2 4.49Å; L1321-R1334 HydrophobicContact CD1-CB 4.26Å
1322	S	68.2	Low	73.2	Confident	31 Å²	31	63.3 Å²	63.3	22%	0.217	30%	0.304	C	S	.	.	H	α-helix	trans	-77.8	-31.4	179.5	80.6	0	0	0	0	113	Y1156 Q1318 I1319 H1320 I1324	Y1156-S1322 WeakPolarHBondContact CE1-OG 3.38Å; Y1156-S1322 VanDerWaalsContact CZ-OG 3.3Å; Y1156-S1322 WeakPolarHBondContact OH-CB 2.99Å; Y1156-S1322 PolarHBondContact OH-OG 3.13Å; Q1318-S1322 WeakPolarHBondContact O-CB 3.49Å; Q1318-S1322 PolarHBondContact O-N 2.93Å; I1319-S1322 VanDerWaalsContact O-CB 3.3Å; I1319-S1322 WeakPolarHBondContact O-CB 3.15Å; I1319-S1322 PolarHBondContact O-N 2.93Å; I1319-S1322 PolarHBondContact O-OG 3.26Å; H1320-S1322 PolarHBondContact O-N 3.3Å; H1320-S1322 VanDerWaalsContact O-N 3.1Å; S1322-I1324 PolarHBondContact O-N 3.05Å
1323	S	68.7	Low	72.9	Confident	81 Å²	81	62.7 Å²	62.7	57%	0.566	30%	0.299	S	S	*	.	H	α-helix	trans	-67	-29.1	178.2	63.9	0	0	0	0	111.4	H1320 P1325	H1320-S1323 PolarHBondContact O-N 3.01Å; H1320-S1323 PolarHBondContact O-OG 2.97Å; S1323-P1325 VanDerWaalsContact O-CD 3.29Å; S1323-P1325 WeakPolarHBondContact O-CD 3.06Å
1324	I	67.9	Low	72.7	Confident	26 Å²	26	69.2 Å²	69.2	13%	0.133	32%	0.323	C	S	.	.			trans	-70.8	116.9	179.2	-56.1	175.6	0	0	0	110.7	L1321 S1322 N1326 I1329 R1330 Y1333	L1321-I1324 HydrophobicContact CD2-CD1 4.31Å; S1322-I1324 PolarHBondContact O-N 3.05Å; I1324-N1326 PolarHBondContact O-N 3.44Å; I1324-I1329 HydrophobicContact CD1-CG2 4.5Å; I1324-I1329 HydrophobicContact CG2-CB 4.29Å; I1324-I1329 HydrophobicContact CG2-CG2 4.07Å; I1324-R1330 HydrophobicContact CB-CG 3.83Å; I1324-R1330 HydrophobicContact CG2-CG 3.89Å; I1324-R1330 WeakPolarHBondContact O-CD 3.43Å; I1324-R1330 PolarHBondContact O-NE 3.17Å; I1324-R1330 PolarHBondContact O-NH1 3Å; I1324-R1330 PolarHBondContact O-NH2 3.23Å; I1324-Y1333 HydrophobicContact CD1-CD2 3.92Å; I1324-Y1333 HydrophobicContact CD1-CE2 4.07Å
1325	P	63.5	Low	72.5	Confident	81 Å²	81	76.3 Å²	76.3	53%	0.526	35%	0.35	S	S	.	.			trans	-71.8	-32.1	-179.7	27.1	-33.1	0	0	0	112	S1323 K1327 R1330	S1323-P1325 VanDerWaalsContact O-CD 3.29Å; S1323-P1325 WeakPolarHBondContact O-CD 3.06Å; P1325-K1327 PolarHBondContact O-N 3.47Å; P1325-R1330 PolarHBondContact O-NH2 2.86Å
1326	N	70.7	Confident	72.7	Confident	68 Å²	68	75.6 Å²	75.6	36%	0.364	35%	0.352	S	S	.	.			trans	-77	121.9	-174.2	-164.7	-21	0	0	0	112.5	I1324 Q1328 I1329 R1330	I1324-N1326 PolarHBondContact O-N 3.44Å; N1326-Q1328 PolarHBondContact O-N 3.1Å; N1326-Q1328 PolarHBondContact OD1-N 3.49Å; N1326-Q1328 VanDerWaalsContact OD1-N 3.1Å; N1326-I1329 HydrophobicContact CB-CB 4.25Å; N1326-I1329 HydrophobicContact CB-CD1 3.9Å; N1326-I1329 HydrophobicContact CB-CG1 4.09Å; N1326-R1330 VanDerWaalsContact O-CG 3.25Å; N1326-R1330 WeakPolarHBondContact O-CG 3.19Å; N1326-R1330 PolarHBondContact O-N 3.29Å; N1326-R1330 PolarHBondContact O-NE 3.08Å
1327	K	69.3	Low	73	Confident	114 Å²	114	78.1 Å²	78.1	50%	0.496	37%	0.371	S	S	.	.	H	α-helix	trans	-71.8	-26.8	-178.8	-72.4	177.8	-175.8	162.4	0	113.9	P1325 R1331	P1325-K1327 PolarHBondContact O-N 3.47Å; K1327-R1331 WeakPolarHBondContact O-CG 3.37Å; K1327-R1331 PolarHBondContact O-N 3.39Å
1328	Q	69.7	Low	73	Confident	154 Å²	154	83 Å²	83	72%	0.72	40%	0.395	S	S	*	.	H	α-helix	trans	-73.4	-47.5	-178.5	-69	-176.6	-4.4	0	0	110.5	N1326 R1330 R1331 K1332	N1326-Q1328 PolarHBondContact O-N 3.1Å; N1326-Q1328 PolarHBondContact OD1-N 3.49Å; N1326-Q1328 VanDerWaalsContact OD1-N 3.1Å; Q1328-R1330 VanDerWaalsContact C-N 3.34Å; Q1328-R1330 PolarHBondContact O-N 3.05Å; Q1328-R1331 WeakPolarHBondContact O-CA 3.41Å; Q1328-R1331 WeakPolarHBondContact O-CB 3.41Å; Q1328-R1331 PolarHBondContact O-N 2.66Å; Q1328-K1332 PolarHBondContact O-N 3.27Å
1329	I	71.7	Confident	72.9	Confident	67 Å²	67	81.8 Å²	81.8	34%	0.344	39%	0.391	S	S	.	.	H	α-helix	trans	-56.6	-47.7	174.5	-62.4	-179.6	0	0	0	110.7	I1324 N1326 R1331 K1332 Y1333	I1324-I1329 HydrophobicContact CD1-CG2 4.5Å; I1324-I1329 HydrophobicContact CG2-CB 4.29Å; I1324-I1329 HydrophobicContact CG2-CG2 4.07Å; N1326-I1329 HydrophobicContact CB-CB 4.25Å; N1326-I1329 HydrophobicContact CB-CD1 3.9Å; N1326-I1329 HydrophobicContact CB-CG1 4.09Å; I1329-R1331 PolarHBondContact O-N 3.26Å; I1329-R1331 VanDerWaalsContact O-N 3.13Å; I1329-K1332 WeakPolarHBondContact O-CB 3.36Å; I1329-K1332 PolarHBondContact O-N 3.41Å; I1329-Y1333 HydrophobicContact CG2-CD2 3.46Å; I1329-Y1333 VanDerWaalsContact CG2-CD2 3.46Å; I1329-Y1333 HydrophobicContact CG2-CE2 3.11Å; I1329-Y1333 PolarHBondContact O-N 3.3Å
1330	R	72.6	Confident	73.2	Confident	72 Å²	72	83.8 Å²	83.8	27%	0.272	40%	0.397	S	S	.	.	H	α-helix	trans	-55	-34.1	174.5	-73.3	-175.3	-78	-165.5	-14.8	114.1	L1321 I1324 P1325 N1326 Q1328 R1334	L1321-R1330 HydrophobicContact CD2-CB 4.49Å; L1321-R1330 HydrophobicContact CD2-CG 4.4Å; L1321-R1330 WeakPolarHBondContact O-CD 3.44Å; L1321-R1330 WeakPolarHBondContact O-CG 3.37Å; I1324-R1330 HydrophobicContact CB-CG 3.83Å; I1324-R1330 HydrophobicContact CG2-CG 3.89Å; I1324-R1330 WeakPolarHBondContact O-CD 3.43Å; I1324-R1330 PolarHBondContact O-NE 3.17Å; I1324-R1330 PolarHBondContact O-NH1 3Å; I1324-R1330 PolarHBondContact O-NH2 3.23Å; P1325-R1330 PolarHBondContact O-NH2 2.86Å; N1326-R1330 VanDerWaalsContact O-CG 3.25Å; N1326-R1330 WeakPolarHBondContact O-CG 3.19Å; N1326-R1330 PolarHBondContact O-N 3.29Å; N1326-R1330 PolarHBondContact O-NE 3.08Å; Q1328-R1330 VanDerWaalsContact C-N 3.34Å; Q1328-R1330 PolarHBondContact O-N 3.05Å; R1330-R1334 VanDerWaalsContact O-CB 3.24Å; R1330-R1334 WeakPolarHBondContact O-CB 3.33Å; R1330-R1334 PolarHBondContact O-N 3.5Å
1331	R	75.2	Confident	73.5	Confident	181 Å²	181	87.7 Å²	87.7	68%	0.683	41%	0.413	S	S	*	.	H	α-helix	trans	-77.4	-35.6	176.5	-74.4	176	175.3	-178.6	-1.2	112.4	K1327 Q1328 I1329 R1335	K1327-R1331 WeakPolarHBondContact O-CG 3.37Å; K1327-R1331 PolarHBondContact O-N 3.39Å; Q1328-R1331 WeakPolarHBondContact O-CA 3.41Å; Q1328-R1331 WeakPolarHBondContact O-CB 3.41Å; Q1328-R1331 PolarHBondContact O-N 2.66Å; I1329-R1331 PolarHBondContact O-N 3.26Å; I1329-R1331 VanDerWaalsContact O-N 3.13Å; R1331-R1335 WeakPolarHBondContact O-CG 3.44Å; R1331-R1335 PolarHBondContact O-N 3.18Å
1332	K	77.1	Confident	73.5	Confident	122 Å²	122	88.3 Å²	88.3	53%	0.53	42%	0.416	S	S	.	.	H	α-helix	trans	-61.3	-55.1	174.2	-170.8	-173.6	176	-164.2	0	109.4	Q1328 I1329 R1334 R1335 S1336 E1360	Q1328-K1332 PolarHBondContact O-N 3.27Å; I1329-K1332 WeakPolarHBondContact O-CB 3.36Å; I1329-K1332 PolarHBondContact O-N 3.41Å; K1332-R1334 VanDerWaalsContact C-N 3.35Å; K1332-R1334 PolarHBondContact O-N 2.88Å; K1332-R1335 PolarHBondContact O-N 2.64Å; K1332-S1336 PolarHBondContact O-N 3.08Å; K1332-S1336 VanDerWaalsContact O-N 3.09Å; K1332-E1360 IonicContact NZ-OE1 3.19Å; K1332-E1360 PolarHBondContact NZ-OE1 3.45Å
1333	Y	73.6	Confident	73.8	Confident	28 Å²	28	87 Å²	87	11%	0.11	41%	0.407	C	S	.	.	H	α-helix	trans	-64	-34.5	-179.5	-69.3	-48	0	0	0	114.1	L1321 I1324 I1329 R1335 S1336 V1339 Y1353	L1321-Y1333 HydrophobicContact CD2-CD2 4.49Å; I1324-Y1333 HydrophobicContact CD1-CD2 3.92Å; I1324-Y1333 HydrophobicContact CD1-CE2 4.07Å; I1329-Y1333 HydrophobicContact CG2-CD2 3.46Å; I1329-Y1333 VanDerWaalsContact CG2-CD2 3.46Å; I1329-Y1333 HydrophobicContact CG2-CE2 3.11Å; I1329-Y1333 PolarHBondContact O-N 3.3Å; Y1333-R1335 PolarHBondContact O-N 3.33Å; Y1333-S1336 WeakPolarHBondContact CA-OG 3.28Å; Y1333-S1336 PolarHBondContact O-N 3.12Å; Y1333-S1336 PolarHBondContact O-OG 3.49Å; Y1333-V1339 HydrophobicContact CD1-CG2 3.91Å; Y1333-Y1353 HydrophobicContact CE2-CE1 4.21Å
1334	R	74.9	Confident	74.2	Confident	138 Å²	138	86.8 Å²	86.8	52%	0.521	40%	0.399	S	S	.	.	H	α-helix	trans	-65.8	-23.2	175.2	-171.3	172.7	177.5	166.2	3.6	113.3	L1321 R1330 K1332 W1340	L1321-R1334 HydrophobicContact CD1-CB 4.26Å; R1330-R1334 VanDerWaalsContact O-CB 3.24Å; R1330-R1334 WeakPolarHBondContact O-CB 3.33Å; R1330-R1334 PolarHBondContact O-N 3.5Å; K1332-R1334 VanDerWaalsContact C-N 3.35Å; K1332-R1334 PolarHBondContact O-N 2.88Å; R1334-W1340 PolarHBondContact O-NE1 2.85Å
1335	R	78.6	Confident	74.4	Confident	217 Å²	217	89.5 Å²	89.5	82%	0.819	42%	0.417	S	S	*	.	H	α-helix	trans	-97	-19.6	-179.6	-73.8	-180	172.6	-179.1	-4.3	113.5	R1331 K1332 Y1333 P1337	R1331-R1335 WeakPolarHBondContact O-CG 3.44Å; R1331-R1335 PolarHBondContact O-N 3.18Å; K1332-R1335 PolarHBondContact O-N 2.64Å; Y1333-R1335 PolarHBondContact O-N 3.33Å; R1335-P1337 WeakPolarHBondContact O-CD 3.48Å
1336	S	78.4	Confident	74.4	Confident	30 Å²	30	87.8 Å²	87.8	21%	0.21	41%	0.405	C	S	.	.			trans	-72	121.3	-178.8	48.6	0	0	0	0	110.9	K1332 Y1333 M1338 V1339 W1340	K1332-S1336 PolarHBondContact O-N 3.08Å; K1332-S1336 VanDerWaalsContact O-N 3.09Å; Y1333-S1336 WeakPolarHBondContact CA-OG 3.28Å; Y1333-S1336 PolarHBondContact O-N 3.12Å; Y1333-S1336 PolarHBondContact O-OG 3.49Å; S1336-M1338 PolarHBondContact O-N 3.21Å; S1336-V1339 PolarHBondContact O-N 3.21Å; S1336-V1339 WeakPolarHBondContact OG-CB 3.42Å; S1336-V1339 WeakPolarHBondContact OG-CG2 3.37Å; S1336-W1340 PolarHBondContact O-N 3.26Å
1337	P	80	Confident	73.6	Confident	107 Å²	107	90.3 Å²	90.3	70%	0.695	42%	0.419	S	S	*	.	H	α-helix	trans	-65.5	-30.2	177.7	26.4	-33.6	0	0	0	112	R1335 V1339 W1340 F1341	R1335-P1337 WeakPolarHBondContact O-CD 3.48Å; P1337-V1339 PolarHBondContact O-N 3.47Å; P1337-W1340 WeakPolarHBondContact O-CB 3.3Å; P1337-W1340 PolarHBondContact O-N 2.89Å; P1337-F1341 WeakPolarHBondContact O-CB 3.2Å; P1337-F1341 PolarHBondContact O-N 3.07Å
1338	M	78	Confident	72.8	Confident	101 Å²	101	93.1 Å²	93.1	50%	0.498	43%	0.428	S	S	.	.	H	α-helix	trans	-61.3	-41.6	177.6	-172.2	62.2	-179.8	0	0	112.6	S1336 W1340 F1341 L1342 F1356	S1336-M1338 PolarHBondContact O-N 3.21Å; M1338-W1340 VanDerWaalsContact C-N 3.32Å; M1338-W1340 PolarHBondContact O-N 3.16Å; M1338-F1341 WeakPolarHBondContact O-CB 3.49Å; M1338-F1341 PolarHBondContact O-N 3.38Å; M1338-F1341 HydrophobicContact SD-CD1 4.48Å; M1338-L1342 WeakPolarHBondContact O-CB 3.39Å; M1338-L1342 PolarHBondContact O-N 2.94Å; M1338-F1356 HydrophobicContact CE-CZ 3.98Å; M1338-F1356 HydrophobicContact CG-CZ 4.14Å
1339	V	75.1	Confident	71.9	Confident	17 Å²	17	86.3 Å²	86.3	10%	0.103	40%	0.396	C	S	.	.	H	α-helix	trans	-68.1	-35.3	177.7	174.7	0	0	0	0	111.3	L1317 Y1333 S1336 P1337 A1343	L1317-V1339 HydrophobicContact CD1-CG1 3.5Å; Y1333-V1339 HydrophobicContact CD1-CG2 3.91Å; S1336-V1339 PolarHBondContact O-N 3.21Å; S1336-V1339 WeakPolarHBondContact OG-CB 3.42Å; S1336-V1339 WeakPolarHBondContact OG-CG2 3.37Å; P1337-V1339 PolarHBondContact O-N 3.47Å; V1339-A1343 VanDerWaalsContact O-CB 3.27Å; V1339-A1343 WeakPolarHBondContact O-CB 3.26Å; V1339-A1343 PolarHBondContact O-N 3.38Å
1340	W	78.1	Confident	70.8	Confident	72 Å²	72	87.1 Å²	87.1	27%	0.273	40%	0.404	S	S	.	.	H	α-helix	trans	-68.2	-39.9	172.6	-89	101.1	0	0	0	112.4	W1314 L1317 R1334 S1336 P1337 M1338 A1343 L1344	W1314-W1340 HydrophobicContact CB-CH2 3.9Å; W1314-W1340 HydrophobicContact CB-CZ3 4.22Å; W1314-W1340 AromaticContact CD1-CH2 3.53Å; W1314-W1340 AromaticContact CD1-CZ2 3.93Å; W1314-W1340 HydrophobicContact CG-CH2 4.1Å; L1317-W1340 HydrophobicContact CD2-CD2 4.01Å; L1317-W1340 HydrophobicContact CD2-CE3 4.49Å; L1317-W1340 HydrophobicContact CD2-CG 4.5Å; L1317-W1340 HydrophobicContact CD2-CH2 4.46Å; L1317-W1340 HydrophobicContact CD2-CZ2 3.89Å; R1334-W1340 PolarHBondContact O-NE1 2.85Å; S1336-W1340 PolarHBondContact O-N 3.26Å; P1337-W1340 WeakPolarHBondContact O-CB 3.3Å; P1337-W1340 PolarHBondContact O-N 2.89Å; M1338-W1340 VanDerWaalsContact C-N 3.32Å; M1338-W1340 PolarHBondContact O-N 3.16Å; W1340-A1343 PolarHBondContact O-N 3.41Å; W1340-L1344 WeakPolarHBondContact O-CB 3.22Å; W1340-L1344 WeakPolarHBondContact O-CD1 3.48Å; W1340-L1344 VanDerWaalsContact O-CG 3.26Å; W1340-L1344 WeakPolarHBondContact O-CG 3.32Å; W1340-L1344 PolarHBondContact O-N 3.22Å
1341	F	79.3	Confident	69.5	Low	125 Å²	125	89.8 Å²	89.8	55%	0.548	42%	0.424	S	S	.	.	H	α-helix	trans	-61.4	-47.5	174.4	-179.5	-100.6	0	0	0	110.6	P1337 M1338 L1344 T1345	P1337-F1341 WeakPolarHBondContact O-CB 3.2Å; P1337-F1341 PolarHBondContact O-N 3.07Å; M1338-F1341 WeakPolarHBondContact O-CB 3.49Å; M1338-F1341 PolarHBondContact O-N 3.38Å; M1338-F1341 HydrophobicContact SD-CD1 4.48Å; F1341-L1344 PolarHBondContact O-N 3.2Å; F1341-T1345 HydrophobicContact CD1-CG2 4.4Å; F1341-T1345 HydrophobicContact CD2-CG2 4.41Å; F1341-T1345 HydrophobicContact CE1-CG2 4.02Å; F1341-T1345 HydrophobicContact CE2-CG2 4.03Å; F1341-T1345 HydrophobicContact CZ-CG2 3.83Å; F1341-T1345 WeakPolarHBondContact O-CG2 3.45Å; F1341-T1345 PolarHBondContact O-N 3.36Å; F1341-T1345 PolarHBondContact O-OG1 2.83Å; F1341-T1345 VanDerWaalsContact O-OG1 3.08Å
1342	L	73.5	Confident	68.1	Low	23 Å²	23	82 Å²	82	12%	0.12	40%	0.397	C	S	.	.	H	α-helix	trans	-60.6	-47	175.7	-168.4	69.8	0	0	0	111.4	M1338 L1344 T1345 T1346 L1349 F1356	M1338-L1342 WeakPolarHBondContact O-CB 3.39Å; M1338-L1342 PolarHBondContact O-N 2.94Å; L1342-L1344 PolarHBondContact O-N 2.8Å; L1342-T1345 PolarHBondContact O-N 3.33Å; L1342-T1345 VanDerWaalsContact O-N 3.15Å; L1342-T1345 PolarHBondContact O-OG1 3.48Å; L1342-T1346 HydrophobicContact CD1-CG2 4.06Å; L1342-T1346 PolarHBondContact O-N 3.25Å; L1342-T1346 PolarHBondContact O-OG1 2.99Å; L1342-L1349 HydrophobicContact CD2-CD2 3.86Å; L1342-L1349 HydrophobicContact CG-CD2 4.13Å; L1342-F1356 HydrophobicContact CD2-CE2 4.26Å
1343	A	73.1	Confident	66.5	Low	2 Å²	2	77.4 Å²	77.4	2%	0.017	38%	0.377	C	S	.	.	H	α-helix	trans	-63.7	-24	177.3	0	0	0	0	0	114	A1313 V1339 W1340 L1349	A1313-A1343 HydrophobicContact CB-CB 4.39Å; A1313-A1343 VanDerWaalsContact CB-O 3.26Å; A1313-A1343 WeakPolarHBondContact CB-O 3.46Å; V1339-A1343 VanDerWaalsContact O-CB 3.27Å; V1339-A1343 WeakPolarHBondContact O-CB 3.26Å; V1339-A1343 PolarHBondContact O-N 3.38Å; W1340-A1343 PolarHBondContact O-N 3.41Å; A1343-L1349 HydrophobicContact CB-CD1 4.11Å; A1343-L1349 HydrophobicContact CB-CD2 4.45Å
1344	L	77.6	Confident	65.4	Low	77 Å²	77	81.3 Å²	81.3	40%	0.403	40%	0.4	S	S	.	.	H	α-helix	trans	-83.8	-30.6	175.2	-78.1	164.2	0	0	0	112.5	I1309 A1313 W1340 F1341 L1342	I1309-L1344 HydrophobicContact CG2-CD2 3.93Å; A1313-L1344 HydrophobicContact CB-CD2 3.81Å; A1313-L1344 HydrophobicContact CB-CG 4.13Å; W1340-L1344 WeakPolarHBondContact O-CB 3.22Å; W1340-L1344 WeakPolarHBondContact O-CD1 3.48Å; W1340-L1344 VanDerWaalsContact O-CG 3.26Å; W1340-L1344 WeakPolarHBondContact O-CG 3.32Å; W1340-L1344 PolarHBondContact O-N 3.22Å; F1341-L1344 PolarHBondContact O-N 3.2Å; L1342-L1344 PolarHBondContact O-N 2.8Å
1345	T	72.7	Confident	64	Low	84 Å²	84	80.4 Å²	80.4	52%	0.515	40%	0.404	S	S	.	.	H	α-helix	trans	-93.2	-32.4	-177.7	56.6	0	0	0	0	112.9	F1341 L1342	F1341-T1345 HydrophobicContact CD1-CG2 4.4Å; F1341-T1345 HydrophobicContact CD2-CG2 4.41Å; F1341-T1345 HydrophobicContact CE1-CG2 4.02Å; F1341-T1345 HydrophobicContact CE2-CG2 4.03Å; F1341-T1345 HydrophobicContact CZ-CG2 3.83Å; F1341-T1345 WeakPolarHBondContact O-CG2 3.45Å; F1341-T1345 PolarHBondContact O-N 3.36Å; F1341-T1345 PolarHBondContact O-OG1 2.83Å; F1341-T1345 VanDerWaalsContact O-OG1 3.08Å; L1342-T1345 PolarHBondContact O-N 3.33Å; L1342-T1345 VanDerWaalsContact O-N 3.15Å; L1342-T1345 PolarHBondContact O-OG1 3.48Å
1346	T	62.5	Low	62.6	Low	44 Å²	44	74 Å²	74	27%	0.27	38%	0.382	S	S	.	.			trans	-112.3	121.6	178.7	68	0	0	0	0	110.4	L1342 Y1348	L1342-T1346 HydrophobicContact CD1-CG2 4.06Å; L1342-T1346 PolarHBondContact O-N 3.25Å; L1342-T1346 PolarHBondContact O-OG1 2.99Å; T1346-Y1348 WeakPolarHBondContact CB-O 3.33Å; T1346-Y1348 PolarHBondContact O-N 3.44Å; T1346-Y1348 PolarHBondContact OG1-O 3.29Å; T1346-Y1348 VanDerWaalsContact OG1-O 3.06Å
1347	N	55	Low	61.2	Low	121 Å²	121	77.2 Å²	77.2	65%	0.647	39%	0.394	S	S	*	.	S	Bend	trans	-68.1	-13.4	171	-88.8	-11	0	0	0	112.6	N1316	N1316-N1347 PolarHBondContact ND2-O 3.49Å
1348	Y	51.5	Low	59.6	Low	174 Å²	174	81 Å²	81	68%	0.682	39%	0.394	S	S	*	.			trans	-122.7	116	177.4	-73.2	-88.3	0	0	0	109.4	T1346 T1350	T1346-Y1348 WeakPolarHBondContact CB-O 3.33Å; T1346-Y1348 PolarHBondContact O-N 3.44Å; T1346-Y1348 PolarHBondContact OG1-O 3.29Å; T1346-Y1348 VanDerWaalsContact OG1-O 3.06Å; Y1348-T1350 VanDerWaalsContact C-N 3.32Å
1349	L	51.6	Low	58.1	Low	10 Å²	10	78.6 Å²	78.6	5%	0.052	39%	0.387	C	S	.	.			trans	-85.8	-7.2	171.2	-79.5	154.1	0	0	0	111.8	N1316 H1320 L1342 A1343 Y1353	N1316-L1349 HydrophobicContact CB-CD1 4.41Å; H1320-L1349 HydrophobicContact CB-CD1 4.49Å; L1342-L1349 HydrophobicContact CD2-CD2 3.86Å; L1342-L1349 HydrophobicContact CG-CD2 4.13Å; A1343-L1349 HydrophobicContact CB-CD1 4.11Å; A1343-L1349 HydrophobicContact CB-CD2 4.45Å; L1349-Y1353 HydrophobicContact CB-CD2 4.4Å; L1349-Y1353 HydrophobicContact CB-CE2 4.46Å; L1349-Y1353 HydrophobicContact CD2-CD2 4.43Å; L1349-Y1353 HydrophobicContact CD2-CE2 3.99Å; L1349-Y1353 WeakPolarHBondContact O-CD2 3.47Å
1350	T	48.7	Very low	56.8	Low	85 Å²	85	81.1 Å²	81.1	52%	0.521	40%	0.398	S	S	.	.	H	α-helix	trans	-62.7	-50.1	-173.4	45.6	0	0	0	0	111.9	Y1348 S1352	Y1348-T1350 VanDerWaalsContact C-N 3.32Å; T1350-S1352 PolarHBondContact O-N 3.45Å
1351	D	45.3	Very low	55.2	Low	127 Å²	127	82.6 Å²	82.6	68%	0.679	41%	0.41	S	S	*	.	H	α-helix	trans	-82.1	-17.9	-168.2	-56.2	4.4	0	0	0	113.3
1352	S	45.6	Very low	53.5	Low	19 Å²	19	85.8 Å²	85.8	13%	0.133	42%	0.419	C	S	.	.	H	α-helix	trans	-94.6	-15.4	-175.7	27.6	0	0	0	0	113.2	T1350 I1355 F1356	T1350-S1352 PolarHBondContact O-N 3.45Å; S1352-I1355 PolarHBondContact O-N 3.11Å; S1352-F1356 WeakPolarHBondContact O-CD2 3.48Å; S1352-F1356 PolarHBondContact O-N 3.3Å
1353	Y	44.3	Very low	52.2	Low	25 Å²	25	91.4 Å²	91.4	10%	0.098	44%	0.444	C	S	.	.	H	α-helix	trans	-70.2	-34	175.5	-103.8	-97.8	0	0	0	112.8	H1320 Y1333 L1349 I1355 F1356 H1357	H1320-Y1353 AromaticContact CD2-CD2 3.85Å; H1320-Y1353 AromaticContact CD2-CE2 3.33Å; H1320-Y1353 WeakPolarHBondContact CD2-CE2 3.33Å; H1320-Y1353 AromaticContact CD2-CZ 3.53Å; H1320-Y1353 AromaticContact NE2-CD1 3.64Å; H1320-Y1353 AromaticContact NE2-CD2 3.24Å; H1320-Y1353 WeakPolarHBondContact NE2-CD2 3.35Å; H1320-Y1353 AromaticContact NE2-CE1 3.57Å; H1320-Y1353 AromaticContact NE2-CE2 3.16Å; H1320-Y1353 WeakPolarHBondContact NE2-CE2 3.49Å; H1320-Y1353 AromaticContact NE2-CG 3.47Å; H1320-Y1353 AromaticContact NE2-CZ 3.3Å; H1320-Y1353 VanDerWaalsContact NE2-CZ 3.3Å; Y1333-Y1353 HydrophobicContact CE2-CE1 4.21Å; L1349-Y1353 HydrophobicContact CB-CD2 4.4Å; L1349-Y1353 HydrophobicContact CB-CE2 4.46Å; L1349-Y1353 HydrophobicContact CD2-CD2 4.43Å; L1349-Y1353 HydrophobicContact CD2-CE2 3.99Å; L1349-Y1353 WeakPolarHBondContact O-CD2 3.47Å; Y1353-I1355 PolarHBondContact O-N 2.94Å; Y1353-F1356 PolarHBondContact O-N 3Å; Y1353-F1356 VanDerWaalsContact O-N 3.15Å; Y1353-H1357 WeakPolarHBondContact O-CB 3.18Å; Y1353-H1357 PolarHBondContact O-N 3.15Å
1354	D	48.6	Very low	50.7	Low	110 Å²	110	98.5 Å²	98.5	59%	0.588	48%	0.482	S	S	*	.	H	α-helix	trans	-62.6	-29.5	174.4	-84.8	-9.6	0	0	0	112.8	R1358	D1354-R1358 VanDerWaalsContact O-CB 3.24Å; D1354-R1358 WeakPolarHBondContact O-CB 3.21Å; D1354-R1358 VanDerWaalsContact O-CG 3.28Å; D1354-R1358 WeakPolarHBondContact O-CG 3.39Å; D1354-R1358 PolarHBondContact O-N 3.14Å; D1354-R1358 VanDerWaalsContact O-N 3.09Å
1355	I	47.1	Very low	48.9	Very low	118 Å²	118	99.4 Å²	99.4	61%	0.605	49%	0.494	S	S	*	.	H	α-helix	trans	-74.1	-38.2	176.7	-56.2	174.3	0	0	0	110.8	S1352 Y1353 S1359	S1352-I1355 PolarHBondContact O-N 3.11Å; Y1353-I1355 PolarHBondContact O-N 2.94Å; I1355-S1359 WeakPolarHBondContact O-CB 3.47Å; I1355-S1359 PolarHBondContact O-N 3.47Å; I1355-S1359 PolarHBondContact O-OG 3.04Å
1356	F	48.3	Very low	47	Very low	83 Å²	83	102.1 Å²	102.1	36%	0.364	52%	0.517	S	S	.	.	H	α-helix	trans	-76.3	-40.1	177.5	-85.2	-77.4	0	0	0	112.8	M1338 L1342 S1352 Y1353 S1359 E1360	M1338-F1356 HydrophobicContact CE-CZ 3.98Å; M1338-F1356 HydrophobicContact CG-CZ 4.14Å; L1342-F1356 HydrophobicContact CD2-CE2 4.26Å; S1352-F1356 WeakPolarHBondContact O-CD2 3.48Å; S1352-F1356 PolarHBondContact O-N 3.3Å; Y1353-F1356 PolarHBondContact O-N 3Å; Y1353-F1356 VanDerWaalsContact O-N 3.15Å; F1356-S1359 WeakPolarHBondContact CA-OG 3.26Å; F1356-S1359 PolarHBondContact O-N 3.37Å; F1356-S1359 PolarHBondContact O-OG 3.43Å; F1356-E1360 PolarHBondContact O-N 3Å
1357	H	49.3	Very low	46.2	Very low	98 Å²	98	105.1 Å²	105.1	45%	0.454	53%	0.529	S	S	.	.	H	α-helix	trans	-66.2	-38.1	175.6	-121.4	-67.7	0	0	0	111.5	Y1353 S1359 I1361	Y1353-H1357 WeakPolarHBondContact O-CB 3.18Å; Y1353-H1357 PolarHBondContact O-N 3.15Å; H1357-S1359 VanDerWaalsContact C-N 3.3Å; H1357-S1359 PolarHBondContact O-N 2.89Å; H1357-I1361 WeakPolarHBondContact O-CB 3.35Å; H1357-I1361 WeakPolarHBondContact O-CD1 3.18Å; H1357-I1361 WeakPolarHBondContact O-CG1 3.44Å; H1357-I1361 PolarHBondContact O-N 3.14Å
1358	R	46.9	Very low	45.8	Very low	185 Å²	185	104.2 Å²	104.2	70%	0.698	52%	0.523	S	S	*	.	H	α-helix	trans	-69	-22.5	173.7	-79.2	-179	-180	-172.5	2.8	114.1	D1354 R1362	D1354-R1358 VanDerWaalsContact O-CB 3.24Å; D1354-R1358 WeakPolarHBondContact O-CB 3.21Å; D1354-R1358 VanDerWaalsContact O-CG 3.28Å; D1354-R1358 WeakPolarHBondContact O-CG 3.39Å; D1354-R1358 PolarHBondContact O-N 3.14Å; D1354-R1358 VanDerWaalsContact O-N 3.09Å; R1358-R1362 WeakPolarHBondContact O-CB 3.36Å; R1358-R1362 VanDerWaalsContact O-CG 3.29Å; R1358-R1362 WeakPolarHBondContact O-CG 3.37Å
1359	S	46.6	Very low	45.4	Very low	51 Å²	51	100.3 Å²	100.3	36%	0.357	51%	0.514	S	S	.	.	H	α-helix	trans	-91	-37.5	-179.8	48.4	0	0	0	0	113.5	I1355 F1356 H1357 R1362 Q1363	I1355-S1359 WeakPolarHBondContact O-CB 3.47Å; I1355-S1359 PolarHBondContact O-N 3.47Å; I1355-S1359 PolarHBondContact O-OG 3.04Å; F1356-S1359 WeakPolarHBondContact CA-OG 3.26Å; F1356-S1359 PolarHBondContact O-N 3.37Å; F1356-S1359 PolarHBondContact O-OG 3.43Å; H1357-S1359 VanDerWaalsContact C-N 3.3Å; H1357-S1359 PolarHBondContact O-N 2.89Å; S1359-R1362 PolarHBondContact O-N 3.07Å; S1359-Q1363 PolarHBondContact O-N 2.8Å
1360	E	46.4	Very low	45.1	Very low	71 Å²	71	105.6 Å²	105.6	33%	0.332	54%	0.542	S	S	.	.	H	α-helix	trans	-68.9	-39.9	171.6	-88.4	-175	148.2	0	0	111	K1332 F1356 R1362 Q1363 D1364	K1332-E1360 IonicContact NZ-OE1 3.19Å; K1332-E1360 PolarHBondContact NZ-OE1 3.45Å; F1356-E1360 PolarHBondContact O-N 3Å; E1360-R1362 PolarHBondContact O-N 3.11Å; E1360-Q1363 PolarHBondContact O-N 3.44Å; E1360-Q1363 VanDerWaalsContact O-N 3.07Å; E1360-D1364 PolarHBondContact O-N 2.92Å; E1360-D1364 VanDerWaalsContact O-N 3.08Å
1361	I	45.5	Very low	44.9	Very low	103 Å²	103	106.9 Å²	106.9	53%	0.528	54%	0.543	S	S	.	.	H	α-helix	trans	-63.6	-31.1	175.4	-65.9	169.3	0	0	0	111.6	H1357 S1365	H1357-I1361 WeakPolarHBondContact O-CB 3.35Å; H1357-I1361 WeakPolarHBondContact O-CD1 3.18Å; H1357-I1361 WeakPolarHBondContact O-CG1 3.44Å; H1357-I1361 PolarHBondContact O-N 3.14Å; I1361-S1365 WeakPolarHBondContact O-CB 3.49Å; I1361-S1365 PolarHBondContact O-N 2.91Å; I1361-S1365 PolarHBondContact O-OG 3.04Å
1362	R	42.8	Very low	44.8	Very low	192 Å²	192	105.6 Å²	105.6	73%	0.725	53%	0.534	S	S	*	.	H	α-helix	trans	-76.1	-20.1	174.6	-84.9	-179.5	177	178.1	0.1	114.3	R1358 S1359 E1360 S1366	R1358-R1362 WeakPolarHBondContact O-CB 3.36Å; R1358-R1362 VanDerWaalsContact O-CG 3.29Å; R1358-R1362 WeakPolarHBondContact O-CG 3.37Å; S1359-R1362 PolarHBondContact O-N 3.07Å; E1360-R1362 PolarHBondContact O-N 3.11Å; R1362-S1366 PolarHBondContact O-OG 3.4Å
1363	Q	46	Very low	44.8	Very low	140 Å²	140	111.8 Å²	111.8	65%	0.654	56%	0.562	S	S	*	*	H	α-helix	trans	-91.2	-26.9	177.4	-79.5	-174.4	-27.8	0	0	113.1	S1359 E1360 S1366	S1359-Q1363 PolarHBondContact O-N 2.8Å; E1360-Q1363 PolarHBondContact O-N 3.44Å; E1360-Q1363 VanDerWaalsContact O-N 3.07Å; Q1363-S1366 PolarHBondContact O-OG 2.82Å
1364	D	42	Very low	44.8	Very low	151 Å²	151	118.5 Å²	118.5	81%	0.807	60%	0.598	S	S	*	*	H	α-helix	trans	-88.3	-11	174.4	-75.8	-21.3	0	0	0	112.9	E1360	E1360-D1364 PolarHBondContact O-N 2.92Å; E1360-D1364 VanDerWaalsContact O-N 3.08Å
1365	S	40.1	Very low	44.5	Very low	96 Å²	96	119.2 Å²	119.2	67%	0.671	60%	0.599	S	S	*	*			trans	-99.4	-0.2	172.6	56.3	0	0	0	0	114.4	I1361	I1361-S1365 WeakPolarHBondContact O-CB 3.49Å; I1361-S1365 PolarHBondContact O-N 2.91Å; I1361-S1365 PolarHBondContact O-OG 3.04Å
1366	S	33.1	Very low	44.3	Very low	142 Å²	142	119.3 Å²	119.3	99%	0.993	60%	0.598	S	S	*	*			trans	-108.7	0	170.8	65.7	0	0	0	0	110.3	R1362 Q1363	R1362-S1366 PolarHBondContact O-OG 3.4Å; Q1363-S1366 PolarHBondContact O-OG 2.82Å

Retrieved 1,366 of 1,366 residues in 2159.3 ms (Link to these results)

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